NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
371642 | 1cnn | 4500 | cing | 4-filtered-FRED | STAR | entry | full | 373 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1cnn # This FRED archive file contains, for PDB entry <1cnn>: # # - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) 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.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_1cnn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1cnn _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2756.31 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 $OMEGA_CONOTOXIN_MVIIC A . 1 1 stop_ save_ save_OMEGA_CONOTOXIN_MVIIC _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "OMEGA CONOTOXIN MVIIC" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CKGKGAPCRKTMYDCCSGSCGRRGKCX _Entity.Number_of_monomers 27 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 CYS . 1 1 2 LYS . 1 1 3 GLY . 1 1 4 LYS . 1 1 5 GLY . 1 1 6 ALA . 1 1 7 PRO . 1 1 8 CYS . 1 1 9 ARG . 1 1 10 LYS . 1 1 11 THR . 1 1 12 MET . 1 1 13 TYR . 1 1 14 ASP . 1 1 15 CYS . 1 1 16 CYS . 1 1 17 SER . 1 1 18 GLY . 1 1 19 SER . 1 1 20 CYS . 1 1 21 GLY . 1 1 22 ARG . 1 1 23 ARG . 1 1 24 GLY . 1 1 25 LYS . 1 1 26 CYS . 1 1 27 NH2 $NH2 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 CYS 1 1 1 1 LYS 2 2 1 1 GLY 3 3 1 1 LYS 4 4 1 1 GLY 5 5 1 1 ALA 6 6 1 1 PRO 7 7 1 1 CYS 8 8 1 1 ARG 9 9 1 1 LYS 10 10 1 1 THR 11 11 1 1 MET 12 12 1 1 TYR 13 13 1 1 ASP 14 14 1 1 CYS 15 15 1 1 CYS 16 16 1 1 SER 17 17 1 1 GLY 18 18 1 1 SER 19 19 1 1 CYS 20 20 1 1 GLY 21 21 1 1 ARG 22 22 1 1 ARG 23 23 1 1 GLY 24 24 1 1 LYS 25 25 1 1 CYS 26 26 1 1 NH2 27 27 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 CYS HA . 1 . HA 1 1 1 1 2 1 1 16 CYS HA . 16 . HA 1 1 2 1 1 1 1 1 CYS QB . 1 . HB* 1 1 2 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 3 1 1 1 1 1 CYS QB . 1 . HB* 1 1 3 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 4 1 1 1 1 1 CYS HA . 1 . HA 1 1 4 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 5 1 1 1 1 1 CYS HA . 1 . HA 1 1 5 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 6 1 1 1 1 2 LYS H . 2 . HN 1 1 6 1 2 1 1 15 CYS HA . 15 . HA 1 1 7 1 1 1 1 2 LYS H . 2 . HN 1 1 7 1 2 1 1 14 ASP HA . 14 . HA 1 1 8 1 1 1 1 1 CYS HA . 1 . HA 1 1 8 1 2 1 1 2 LYS H . 2 . HN 1 1 9 1 1 1 1 2 LYS H . 2 . HN 1 1 9 1 2 1 1 16 CYS HA . 16 . HA 1 1 10 1 1 1 1 1 CYS HB2 . 1 . HB2 1 1 10 1 2 1 1 2 LYS H . 2 . HN 1 1 11 1 1 1 1 1 CYS HB3 . 1 . HB1 1 1 11 1 2 1 1 2 LYS H . 2 . HN 1 1 12 1 1 1 1 2 LYS H . 2 . HN 1 1 12 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 13 1 1 1 1 2 LYS H . 2 . HN 1 1 13 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 14 1 1 1 1 2 LYS H . 2 . HN 1 1 14 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 15 1 1 1 1 2 LYS H . 2 . HN 1 1 15 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 16 1 1 1 1 2 LYS H . 2 . HN 1 1 16 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 17 1 1 1 1 2 LYS H . 2 . HN 1 1 17 1 2 1 1 2 LYS QE . 2 . HE* 1 1 18 1 1 1 1 2 LYS H . 2 . HN 1 1 18 1 2 1 1 2 LYS QG . 2 . HG* 1 1 19 1 1 1 1 2 LYS H . 2 . HN 1 1 19 1 2 1 1 2 LYS HD3 . 2 . HD1 1 1 20 1 1 1 1 2 LYS H . 2 . HN 1 1 20 1 2 1 1 2 LYS HD2 . 2 . HD2 1 1 21 1 1 1 1 2 LYS H . 2 . HN 1 1 21 1 2 1 1 15 CYS H . 15 . HN 1 1 22 1 1 1 1 2 LYS H . 2 . HN 1 1 22 1 2 1 1 3 GLY H . 3 . HN 1 1 23 1 1 1 1 2 LYS HA . 2 . HA 1 1 23 1 2 1 1 2 LYS HD3 . 2 . HD1 1 1 24 1 1 1 1 2 LYS HA . 2 . HA 1 1 24 1 2 1 1 2 LYS HD2 . 2 . HD2 1 1 25 1 1 1 1 2 LYS HA . 2 . HA 1 1 25 1 2 1 1 6 ALA MB . 6 . HB* 1 1 26 1 1 1 1 2 LYS QB . 2 . HB* 1 1 26 1 2 1 1 14 ASP QB . 14 . HB* 1 1 27 1 1 1 1 2 LYS QD . 2 . HD* 1 1 27 1 2 1 1 14 ASP QB . 14 . HB* 1 1 28 1 1 1 1 2 LYS QG . 2 . HG* 1 1 28 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 29 1 1 1 1 2 LYS HA . 2 . HA 1 1 29 1 2 1 1 3 GLY H . 3 . HN 1 1 30 1 1 1 1 3 GLY H . 3 . HN 1 1 30 1 2 1 1 6 ALA MB . 6 . HB* 1 1 31 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1 31 1 2 1 1 3 GLY H . 3 . HN 1 1 32 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1 32 1 2 1 1 3 GLY H . 3 . HN 1 1 33 1 1 1 1 2 LYS HD3 . 2 . HD1 1 1 33 1 2 1 1 3 GLY H . 3 . HN 1 1 34 1 1 1 1 2 LYS HD2 . 2 . HD2 1 1 34 1 2 1 1 3 GLY H . 3 . HN 1 1 35 1 1 1 1 3 GLY H . 3 . HN 1 1 35 1 2 1 1 6 ALA H . 6 . HN 1 1 36 1 1 1 1 3 GLY H . 3 . HN 1 1 36 1 2 1 1 4 LYS H . 4 . HN 1 1 37 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 37 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 38 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 38 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 39 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 39 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 40 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 40 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 41 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 41 1 2 1 1 4 LYS H . 4 . HN 1 1 42 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 42 1 2 1 1 4 LYS H . 4 . HN 1 1 43 1 1 1 1 4 LYS H . 4 . HN 1 1 43 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 44 1 1 1 1 4 LYS H . 4 . HN 1 1 44 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 45 1 1 1 1 4 LYS H . 4 . HN 1 1 45 1 2 1 1 6 ALA MB . 6 . HB* 1 1 46 1 1 1 1 4 LYS H . 4 . HN 1 1 46 1 2 1 1 4 LYS HB2 . 4 . HB2 1 1 47 1 1 1 1 4 LYS H . 4 . HN 1 1 47 1 2 1 1 4 LYS HB3 . 4 . HB1 1 1 48 1 1 1 1 4 LYS H . 4 . HN 1 1 48 1 2 1 1 4 LYS QD . 4 . HD* 1 1 49 1 1 1 1 4 LYS H . 4 . HN 1 1 49 1 2 1 1 4 LYS QE . 4 . HE* 1 1 50 1 1 1 1 4 LYS H . 4 . HN 1 1 50 1 2 1 1 6 ALA H . 6 . HN 1 1 51 1 1 1 1 4 LYS HA . 4 . HA 1 1 51 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 52 1 1 1 1 4 LYS HA . 4 . HA 1 1 52 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 53 1 1 1 1 4 LYS HA . 4 . HA 1 1 53 1 2 1 1 5 GLY H . 5 . HN 1 1 54 1 1 1 1 5 GLY H . 5 . HN 1 1 54 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 55 1 1 1 1 5 GLY H . 5 . HN 1 1 55 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 56 1 1 1 1 5 GLY H . 5 . HN 1 1 56 1 2 1 1 26 CYS HA . 26 . HA 1 1 57 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 57 1 2 1 1 5 GLY H . 5 . HN 1 1 58 1 1 1 1 4 LYS HB3 . 4 . HB1 1 1 58 1 2 1 1 5 GLY H . 5 . HN 1 1 59 1 1 1 1 4 LYS H . 4 . HN 1 1 59 1 2 1 1 5 GLY H . 5 . HN 1 1 60 1 1 1 1 5 GLY H . 5 . HN 1 1 60 1 2 1 1 6 ALA H . 6 . HN 1 1 61 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 61 1 2 1 1 25 LYS HB3 . 25 . HB1 1 1 62 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 62 1 2 1 1 25 LYS HB3 . 25 . HB1 1 1 63 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 63 1 2 1 1 25 LYS HB2 . 25 . HB2 1 1 64 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 64 1 2 1 1 25 LYS HB2 . 25 . HB2 1 1 65 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 65 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 66 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 66 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 67 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 67 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 68 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 68 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 69 1 1 1 1 4 LYS HB3 . 4 . HB1 1 1 69 1 2 1 1 5 GLY QA . 5 . HA* 1 1 70 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 70 1 2 1 1 5 GLY QA . 5 . HA* 1 1 71 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 71 1 2 1 1 6 ALA H . 6 . HN 1 1 72 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 72 1 2 1 1 6 ALA H . 6 . HN 1 1 73 1 1 1 1 4 LYS HA . 4 . HA 1 1 73 1 2 1 1 6 ALA H . 6 . HN 1 1 74 1 1 1 1 6 ALA H . 6 . HN 1 1 74 1 2 1 1 25 LYS HA . 25 . HA 1 1 75 1 1 1 1 6 ALA H . 6 . HN 1 1 75 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 76 1 1 1 1 6 ALA H . 6 . HN 1 1 76 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 77 1 1 1 1 4 LYS QG . 4 . HG* 1 1 77 1 2 1 1 6 ALA H . 6 . HN 1 1 78 1 1 1 1 6 ALA HA . 6 . HA 1 1 78 1 2 1 1 7 PRO HD3 . 7 . HD1 1 1 79 1 1 1 1 6 ALA HA . 6 . HA 1 1 79 1 2 1 1 7 PRO HD2 . 7 . HD2 1 1 80 1 1 1 1 7 PRO HA . 7 . HA 1 1 80 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 81 1 1 1 1 7 PRO HA . 7 . HA 1 1 81 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 82 1 1 1 1 7 PRO HA . 7 . HA 1 1 82 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 83 1 1 1 1 7 PRO HA . 7 . HA 1 1 83 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 84 1 1 1 1 7 PRO HA . 7 . HA 1 1 84 1 2 1 1 25 LYS HB3 . 25 . HB1 1 1 85 1 1 1 1 7 PRO HA . 7 . HA 1 1 85 1 2 1 1 25 LYS HB2 . 25 . HB2 1 1 86 1 1 1 1 7 PRO HA . 7 . HA 1 1 86 1 2 1 1 25 LYS QG . 25 . HG* 1 1 87 1 1 1 1 6 ALA MB . 6 . HB* 1 1 87 1 2 1 1 7 PRO HD3 . 7 . HD1 1 1 88 1 1 1 1 6 ALA MB . 6 . HB* 1 1 88 1 2 1 1 7 PRO HD2 . 7 . HD2 1 1 89 1 1 1 1 8 CYS H . 8 . HN 1 1 89 1 2 1 1 25 LYS HA . 25 . HA 1 1 90 1 1 1 1 7 PRO HA . 7 . HA 1 1 90 1 2 1 1 8 CYS H . 8 . HN 1 1 91 1 1 1 1 8 CYS H . 8 . HN 1 1 91 1 2 1 1 24 GLY HA3 . 24 . HA1 1 1 92 1 1 1 1 8 CYS H . 8 . HN 1 1 92 1 2 1 1 24 GLY HA2 . 24 . HA2 1 1 93 1 1 1 1 8 CYS H . 8 . HN 1 1 93 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 94 1 1 1 1 8 CYS H . 8 . HN 1 1 94 1 2 1 1 25 LYS HB3 . 25 . HB1 1 1 95 1 1 1 1 8 CYS H . 8 . HN 1 1 95 1 2 1 1 25 LYS HB2 . 25 . HB2 1 1 96 1 1 1 1 8 CYS H . 8 . HN 1 1 96 1 2 1 1 25 LYS QG . 25 . HG* 1 1 97 1 1 1 1 8 CYS H . 8 . HN 1 1 97 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 98 1 1 1 1 8 CYS H . 8 . HN 1 1 98 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 99 1 1 1 1 7 PRO HB3 . 7 . HB1 1 1 99 1 2 1 1 8 CYS H . 8 . HN 1 1 100 1 1 1 1 7 PRO HB2 . 7 . HB2 1 1 100 1 2 1 1 8 CYS H . 8 . HN 1 1 101 1 1 1 1 8 CYS HA . 8 . HA 1 1 101 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 102 1 1 1 1 8 CYS HA . 8 . HA 1 1 102 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 103 1 1 1 1 8 CYS HA . 8 . HA 1 1 103 1 2 1 1 20 CYS QB . 20 . HB* 1 1 104 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 104 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 105 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 105 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 106 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 106 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 107 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 107 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 108 1 1 1 1 8 CYS HA . 8 . HA 1 1 108 1 2 1 1 9 ARG H . 9 . HN 1 1 109 1 1 1 1 9 ARG H . 9 . HN 1 1 109 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 110 1 1 1 1 9 ARG H . 9 . HN 1 1 110 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 111 1 1 1 1 9 ARG H . 9 . HN 1 1 111 1 2 1 1 9 ARG QG . 9 . HG* 1 1 112 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 112 1 2 1 1 9 ARG H . 9 . HN 1 1 113 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 113 1 2 1 1 9 ARG H . 9 . HN 1 1 114 1 1 1 1 9 ARG H . 9 . HN 1 1 114 1 2 1 1 9 ARG QH . 9 . HH** 1 1 115 1 1 1 1 9 ARG QH . 9 . HH** 1 1 115 1 2 1 1 12 MET QG . 12 . HG* 1 1 116 1 1 1 1 9 ARG QD . 9 . HD* 1 1 116 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 117 1 1 1 1 9 ARG QD . 9 . HD* 1 1 117 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 118 1 1 1 1 9 ARG QG . 9 . HG* 1 1 118 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 119 1 1 1 1 9 ARG QG . 9 . HG* 1 1 119 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 120 1 1 1 1 9 ARG QB . 9 . HB* 1 1 120 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 121 1 1 1 1 9 ARG QB . 9 . HB* 1 1 121 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 122 1 1 1 1 9 ARG HA . 9 . HA 1 1 122 1 2 1 1 10 LYS H . 10 . HN 1 1 123 1 1 1 1 8 CYS HA . 8 . HA 1 1 123 1 2 1 1 10 LYS H . 10 . HN 1 1 124 1 1 1 1 10 LYS H . 10 . HN 1 1 124 1 2 1 1 10 LYS QB . 10 . HB* 1 1 125 1 1 1 1 10 LYS H . 10 . HN 1 1 125 1 2 1 1 10 LYS HD3 . 10 . HD1 1 1 126 1 1 1 1 10 LYS H . 10 . HN 1 1 126 1 2 1 1 10 LYS HD2 . 10 . HD2 1 1 127 1 1 1 1 10 LYS H . 10 . HN 1 1 127 1 2 1 1 11 THR MG . 11 . HG2* 1 1 128 1 1 1 1 9 ARG H . 9 . HN 1 1 128 1 2 1 1 10 LYS H . 10 . HN 1 1 129 1 1 1 1 10 LYS H . 10 . HN 1 1 129 1 2 1 1 11 THR H . 11 . HN 1 1 130 1 1 1 1 10 LYS HA . 10 . HA 1 1 130 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 131 1 1 1 1 10 LYS HA . 10 . HA 1 1 131 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 132 1 1 1 1 10 LYS QB . 10 . HB* 1 1 132 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 133 1 1 1 1 10 LYS HA . 10 . HA 1 1 133 1 2 1 1 11 THR MG . 11 . HG2* 1 1 134 1 1 1 1 10 LYS HA . 10 . HA 1 1 134 1 2 1 1 11 THR H . 11 . HN 1 1 135 1 1 1 1 9 ARG HA . 9 . HA 1 1 135 1 2 1 1 11 THR H . 11 . HN 1 1 136 1 1 1 1 10 LYS QB . 10 . HB* 1 1 136 1 2 1 1 11 THR H . 11 . HN 1 1 137 1 1 1 1 10 LYS HD3 . 10 . HD1 1 1 137 1 2 1 1 11 THR H . 11 . HN 1 1 138 1 1 1 1 10 LYS HD2 . 10 . HD2 1 1 138 1 2 1 1 11 THR H . 11 . HN 1 1 139 1 1 1 1 11 THR H . 11 . HN 1 1 139 1 2 1 1 12 MET H . 12 . HN 1 1 140 1 1 1 1 11 THR HB . 11 . HB 1 1 140 1 2 1 1 14 ASP HB3 . 14 . HB1 1 1 141 1 1 1 1 11 THR HB . 11 . HB 1 1 141 1 2 1 1 14 ASP HB2 . 14 . HB2 1 1 142 1 1 1 1 11 THR HA . 11 . HA 1 1 142 1 2 1 1 12 MET H . 12 . HN 1 1 143 1 1 1 1 10 LYS HA . 10 . HA 1 1 143 1 2 1 1 12 MET H . 12 . HN 1 1 144 1 1 1 1 10 LYS QD . 10 . HD* 1 1 144 1 2 1 1 12 MET H . 12 . HN 1 1 145 1 1 1 1 11 THR MG . 11 . HG2* 1 1 145 1 2 1 1 12 MET H . 12 . HN 1 1 146 1 1 1 1 12 MET HA . 12 . HA 1 1 146 1 2 1 1 13 TYR H . 13 . HN 1 1 147 1 1 1 1 12 MET H . 12 . HN 1 1 147 1 2 1 1 13 TYR H . 13 . HN 1 1 148 1 1 1 1 11 THR HA . 11 . HA 1 1 148 1 2 1 1 13 TYR H . 13 . HN 1 1 149 1 1 1 1 12 MET QB . 12 . HB* 1 1 149 1 2 1 1 13 TYR H . 13 . HN 1 1 150 1 1 1 1 12 MET QG . 12 . HG* 1 1 150 1 2 1 1 13 TYR H . 13 . HN 1 1 151 1 1 1 1 13 TYR H . 13 . HN 1 1 151 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 152 1 1 1 1 13 TYR H . 13 . HN 1 1 152 1 2 1 1 14 ASP H . 14 . HN 1 1 153 1 1 1 1 13 TYR H . 13 . HN 1 1 153 1 2 1 1 13 TYR QD . 13 . HD* 1 1 154 1 1 1 1 13 TYR H . 13 . HN 1 1 154 1 2 1 1 13 TYR QE . 13 . HE* 1 1 155 1 1 1 1 12 MET HA . 12 . HA 1 1 155 1 2 1 1 13 TYR QD . 13 . HD* 1 1 156 1 1 1 1 11 THR HA . 11 . HA 1 1 156 1 2 1 1 13 TYR QD . 13 . HD* 1 1 157 1 1 1 1 12 MET HA . 12 . HA 1 1 157 1 2 1 1 13 TYR QE . 13 . HE* 1 1 158 1 1 1 1 11 THR HA . 11 . HA 1 1 158 1 2 1 1 13 TYR QE . 13 . HE* 1 1 159 1 1 1 1 12 MET QB . 12 . HB* 1 1 159 1 2 1 1 13 TYR QD . 13 . HD* 1 1 160 1 1 1 1 12 MET QB . 12 . HB* 1 1 160 1 2 1 1 13 TYR QE . 13 . HE* 1 1 161 1 1 1 1 12 MET HG3 . 12 . HG1 1 1 161 1 2 1 1 13 TYR QD . 13 . HD* 1 1 162 1 1 1 1 12 MET HG2 . 12 . HG2 1 1 162 1 2 1 1 13 TYR QD . 13 . HD* 1 1 163 1 1 1 1 13 TYR HA . 13 . HA 1 1 163 1 2 1 1 14 ASP H . 14 . HN 1 1 164 1 1 1 1 12 MET HB3 . 12 . HB1 1 1 164 1 2 1 1 14 ASP H . 14 . HN 1 1 165 1 1 1 1 12 MET HB2 . 12 . HB2 1 1 165 1 2 1 1 14 ASP H . 14 . HN 1 1 166 1 1 1 1 13 TYR HB3 . 13 . HB1 1 1 166 1 2 1 1 14 ASP H . 14 . HN 1 1 167 1 1 1 1 14 ASP HA . 14 . HA 1 1 167 1 2 1 1 15 CYS H . 15 . HN 1 1 168 1 1 1 1 13 TYR HA . 13 . HA 1 1 168 1 2 1 1 15 CYS H . 15 . HN 1 1 169 1 1 1 1 15 CYS H . 15 . HN 1 1 169 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 170 1 1 1 1 14 ASP HB2 . 14 . HB2 1 1 170 1 2 1 1 15 CYS H . 15 . HN 1 1 171 1 1 1 1 14 ASP HB3 . 14 . HB1 1 1 171 1 2 1 1 15 CYS H . 15 . HN 1 1 172 1 1 1 1 15 CYS H . 15 . HN 1 1 172 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 173 1 1 1 1 14 ASP H . 14 . HN 1 1 173 1 2 1 1 15 CYS H . 15 . HN 1 1 174 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1 174 1 2 1 1 15 CYS HA . 15 . HA 1 1 175 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1 175 1 2 1 1 15 CYS HA . 15 . HA 1 1 176 1 1 1 1 15 CYS HA . 15 . HA 1 1 176 1 2 1 1 17 SER HB3 . 17 . HB1 1 1 177 1 1 1 1 15 CYS HA . 15 . HA 1 1 177 1 2 1 1 17 SER HB2 . 17 . HB2 1 1 178 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 178 1 2 1 1 15 CYS HA . 15 . HA 1 1 179 1 1 1 1 1 CYS HB3 . 1 . HB1 1 1 179 1 2 1 1 15 CYS HA . 15 . HA 1 1 180 1 1 1 1 1 CYS HB2 . 1 . HB2 1 1 180 1 2 1 1 15 CYS HA . 15 . HA 1 1 181 1 1 1 1 15 CYS HA . 15 . HA 1 1 181 1 2 1 1 16 CYS H . 16 . HN 1 1 182 1 1 1 1 1 CYS HA . 1 . HA 1 1 182 1 2 1 1 16 CYS H . 16 . HN 1 1 183 1 1 1 1 2 LYS HA . 2 . HA 1 1 183 1 2 1 1 16 CYS H . 16 . HN 1 1 184 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 184 1 2 1 1 16 CYS H . 16 . HN 1 1 185 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 185 1 2 1 1 16 CYS H . 16 . HN 1 1 186 1 1 1 1 16 CYS H . 16 . HN 1 1 186 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 187 1 1 1 1 16 CYS H . 16 . HN 1 1 187 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 188 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 188 1 2 1 1 16 CYS H . 16 . HN 1 1 189 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 189 1 2 1 1 16 CYS H . 16 . HN 1 1 190 1 1 1 1 1 CYS QB . 1 . HB* 1 1 190 1 2 1 1 16 CYS H . 16 . HN 1 1 191 1 1 1 1 2 LYS QB . 2 . HB* 1 1 191 1 2 1 1 16 CYS H . 16 . HN 1 1 192 1 1 1 1 2 LYS H . 2 . HN 1 1 192 1 2 1 1 16 CYS H . 16 . HN 1 1 193 1 1 1 1 16 CYS H . 16 . HN 1 1 193 1 2 1 1 17 SER H . 17 . HN 1 1 194 1 1 1 1 16 CYS HA . 16 . HA 1 1 194 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 195 1 1 1 1 1 CYS QB . 1 . HB* 1 1 195 1 2 1 1 16 CYS HA . 16 . HA 1 1 196 1 1 1 1 15 CYS HA . 15 . HA 1 1 196 1 2 1 1 17 SER H . 17 . HN 1 1 197 1 1 1 1 16 CYS HA . 16 . HA 1 1 197 1 2 1 1 17 SER H . 17 . HN 1 1 198 1 1 1 1 17 SER H . 17 . HN 1 1 198 1 2 1 1 18 GLY HA3 . 18 . HA1 1 1 199 1 1 1 1 17 SER H . 17 . HN 1 1 199 1 2 1 1 18 GLY HA2 . 18 . HA2 1 1 200 1 1 1 1 17 SER H . 17 . HN 1 1 200 1 2 1 1 17 SER HB3 . 17 . HB1 1 1 201 1 1 1 1 17 SER H . 17 . HN 1 1 201 1 2 1 1 17 SER HB2 . 17 . HB2 1 1 202 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 202 1 2 1 1 17 SER H . 17 . HN 1 1 203 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 203 1 2 1 1 17 SER H . 17 . HN 1 1 204 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 204 1 2 1 1 17 SER H . 17 . HN 1 1 205 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 205 1 2 1 1 17 SER H . 17 . HN 1 1 206 1 1 1 1 17 SER H . 17 . HN 1 1 206 1 2 1 1 18 GLY H . 18 . HN 1 1 207 1 1 1 1 17 SER HA . 17 . HA 1 1 207 1 2 1 1 18 GLY HA3 . 18 . HA1 1 1 208 1 1 1 1 17 SER HA . 17 . HA 1 1 208 1 2 1 1 18 GLY HA2 . 18 . HA2 1 1 209 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 209 1 2 1 1 17 SER HB3 . 17 . HB1 1 1 210 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 210 1 2 1 1 17 SER HB3 . 17 . HB1 1 1 211 1 1 1 1 15 CYS QB . 15 . HB* 1 1 211 1 2 1 1 17 SER HB2 . 17 . HB2 1 1 212 1 1 1 1 17 SER HA . 17 . HA 1 1 212 1 2 1 1 18 GLY H . 18 . HN 1 1 213 1 1 1 1 17 SER QB . 17 . HB* 1 1 213 1 2 1 1 18 GLY H . 18 . HN 1 1 214 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 214 1 2 1 1 18 GLY H . 18 . HN 1 1 215 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 215 1 2 1 1 18 GLY H . 18 . HN 1 1 216 1 1 1 1 18 GLY H . 18 . HN 1 1 216 1 2 1 1 19 SER H . 19 . HN 1 1 217 1 1 1 1 17 SER HA . 17 . HA 1 1 217 1 2 1 1 19 SER H . 19 . HN 1 1 218 1 1 1 1 18 GLY HA3 . 18 . HA1 1 1 218 1 2 1 1 19 SER H . 19 . HN 1 1 219 1 1 1 1 18 GLY HA2 . 18 . HA2 1 1 219 1 2 1 1 19 SER H . 19 . HN 1 1 220 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 220 1 2 1 1 19 SER H . 19 . HN 1 1 221 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 221 1 2 1 1 19 SER H . 19 . HN 1 1 222 1 1 1 1 19 SER HA . 19 . HA 1 1 222 1 2 1 1 20 CYS H . 20 . HN 1 1 223 1 1 1 1 19 SER HB3 . 19 . HB1 1 1 223 1 2 1 1 20 CYS H . 20 . HN 1 1 224 1 1 1 1 19 SER HB2 . 19 . HB2 1 1 224 1 2 1 1 20 CYS H . 20 . HN 1 1 225 1 1 1 1 20 CYS H . 20 . HN 1 1 225 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 226 1 1 1 1 20 CYS H . 20 . HN 1 1 226 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 227 1 1 1 1 10 LYS HA . 10 . HA 1 1 227 1 2 1 1 20 CYS H . 20 . HN 1 1 228 1 1 1 1 20 CYS H . 20 . HN 1 1 228 1 2 1 1 21 GLY H . 21 . HN 1 1 229 1 1 1 1 15 CYS H . 15 . HN 1 1 229 1 2 1 1 20 CYS H . 20 . HN 1 1 230 1 1 1 1 19 SER H . 19 . HN 1 1 230 1 2 1 1 20 CYS H . 20 . HN 1 1 231 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 231 1 2 1 1 20 CYS HA . 20 . HA 1 1 232 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 232 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 233 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 233 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 234 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 234 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 235 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 235 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 236 1 1 1 1 20 CYS HA . 20 . HA 1 1 236 1 2 1 1 26 CYS HA . 26 . HA 1 1 237 1 1 1 1 21 GLY H . 21 . HN 1 1 237 1 2 1 1 26 CYS HA . 26 . HA 1 1 238 1 1 1 1 21 GLY H . 21 . HN 1 1 238 1 2 1 1 25 LYS HA . 25 . HA 1 1 239 1 1 1 1 20 CYS HA . 20 . HA 1 1 239 1 2 1 1 21 GLY H . 21 . HN 1 1 240 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 240 1 2 1 1 21 GLY H . 21 . HN 1 1 241 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 241 1 2 1 1 21 GLY H . 21 . HN 1 1 242 1 1 1 1 21 GLY H . 21 . HN 1 1 242 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 243 1 1 1 1 21 GLY H . 21 . HN 1 1 243 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 244 1 1 1 1 10 LYS QD . 10 . HD* 1 1 244 1 2 1 1 21 GLY H . 21 . HN 1 1 245 1 1 1 1 10 LYS QG . 10 . HG* 1 1 245 1 2 1 1 21 GLY H . 21 . HN 1 1 246 1 1 1 1 21 GLY HA3 . 21 . HA1 1 1 246 1 2 1 1 22 ARG H . 22 . HN 1 1 247 1 1 1 1 21 GLY HA2 . 21 . HA2 1 1 247 1 2 1 1 22 ARG H . 22 . HN 1 1 248 1 1 1 1 22 ARG H . 22 . HN 1 1 248 1 2 1 1 23 ARG HA . 23 . HA 1 1 249 1 1 1 1 22 ARG H . 22 . HN 1 1 249 1 2 1 1 22 ARG QD . 22 . HD* 1 1 250 1 1 1 1 22 ARG H . 22 . HN 1 1 250 1 2 1 1 22 ARG QB . 22 . HB* 1 1 251 1 1 1 1 22 ARG H . 22 . HN 1 1 251 1 2 1 1 22 ARG QG . 22 . HG* 1 1 252 1 1 1 1 22 ARG H . 22 . HN 1 1 252 1 2 1 1 23 ARG H . 23 . HN 1 1 253 1 1 1 1 22 ARG H . 22 . HN 1 1 253 1 2 1 1 24 GLY H . 24 . HN 1 1 254 1 1 1 1 21 GLY H . 21 . HN 1 1 254 1 2 1 1 22 ARG H . 22 . HN 1 1 255 1 1 1 1 21 GLY QA . 21 . HA* 1 1 255 1 2 1 1 23 ARG H . 23 . HN 1 1 256 1 1 1 1 22 ARG HA . 22 . HA 1 1 256 1 2 1 1 23 ARG H . 23 . HN 1 1 257 1 1 1 1 23 ARG H . 23 . HN 1 1 257 1 2 1 1 23 ARG QG . 23 . HG* 1 1 258 1 1 1 1 22 ARG QB . 22 . HB* 1 1 258 1 2 1 1 23 ARG H . 23 . HN 1 1 259 1 1 1 1 23 ARG H . 23 . HN 1 1 259 1 2 1 1 24 GLY H . 24 . HN 1 1 260 1 1 1 1 23 ARG H . 23 . HN 1 1 260 1 2 1 1 25 LYS H . 25 . HN 1 1 261 1 1 1 1 23 ARG HA . 23 . HA 1 1 261 1 2 1 1 24 GLY H . 24 . HN 1 1 262 1 1 1 1 21 GLY HA3 . 21 . HA1 1 1 262 1 2 1 1 24 GLY H . 24 . HN 1 1 263 1 1 1 1 21 GLY HA2 . 21 . HA2 1 1 263 1 2 1 1 24 GLY H . 24 . HN 1 1 264 1 1 1 1 23 ARG QB . 23 . HB* 1 1 264 1 2 1 1 24 GLY H . 24 . HN 1 1 265 1 1 1 1 22 ARG QB . 22 . HB* 1 1 265 1 2 1 1 24 GLY H . 24 . HN 1 1 266 1 1 1 1 24 GLY H . 24 . HN 1 1 266 1 2 1 1 25 LYS H . 25 . HN 1 1 267 1 1 1 1 21 GLY H . 21 . HN 1 1 267 1 2 1 1 24 GLY H . 24 . HN 1 1 268 1 1 1 1 7 PRO HA . 7 . HA 1 1 268 1 2 1 1 25 LYS H . 25 . HN 1 1 269 1 1 1 1 21 GLY QA . 21 . HA* 1 1 269 1 2 1 1 25 LYS H . 25 . HN 1 1 270 1 1 1 1 23 ARG HA . 23 . HA 1 1 270 1 2 1 1 25 LYS H . 25 . HN 1 1 271 1 1 1 1 23 ARG HD3 . 23 . HD1 1 1 271 1 2 1 1 25 LYS H . 25 . HN 1 1 272 1 1 1 1 23 ARG HD2 . 23 . HD2 1 1 272 1 2 1 1 25 LYS H . 25 . HN 1 1 273 1 1 1 1 24 GLY HA3 . 24 . HA1 1 1 273 1 2 1 1 25 LYS H . 25 . HN 1 1 274 1 1 1 1 24 GLY HA2 . 24 . HA2 1 1 274 1 2 1 1 25 LYS H . 25 . HN 1 1 275 1 1 1 1 25 LYS H . 25 . HN 1 1 275 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 276 1 1 1 1 25 LYS H . 25 . HN 1 1 276 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 277 1 1 1 1 7 PRO HA . 7 . HA 1 1 277 1 2 1 1 25 LYS HA . 25 . HA 1 1 278 1 1 1 1 7 PRO HB3 . 7 . HB1 1 1 278 1 2 1 1 25 LYS HA . 25 . HA 1 1 279 1 1 1 1 7 PRO HB2 . 7 . HB2 1 1 279 1 2 1 1 25 LYS HA . 25 . HA 1 1 280 1 1 1 1 25 LYS HA . 25 . HA 1 1 280 1 2 1 1 25 LYS HD3 . 25 . HD1 1 1 281 1 1 1 1 25 LYS HA . 25 . HA 1 1 281 1 2 1 1 25 LYS HD2 . 25 . HD2 1 1 282 1 1 1 1 5 GLY QA . 5 . HA* 1 1 282 1 2 1 1 25 LYS HA . 25 . HA 1 1 283 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 283 1 2 1 1 25 LYS HA . 25 . HA 1 1 284 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 284 1 2 1 1 25 LYS HA . 25 . HA 1 1 285 1 1 1 1 25 LYS HA . 25 . HA 1 1 285 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 286 1 1 1 1 25 LYS HA . 25 . HA 1 1 286 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 287 1 1 1 1 25 LYS HA . 25 . HA 1 1 287 1 2 1 1 26 CYS H . 26 . HN 1 1 288 1 1 1 1 21 GLY H . 21 . HN 1 1 288 1 2 1 1 26 CYS H . 26 . HN 1 1 289 1 1 1 1 20 CYS HA . 20 . HA 1 1 289 1 2 1 1 26 CYS H . 26 . HN 1 1 290 1 1 1 1 8 CYS HA . 8 . HA 1 1 290 1 2 1 1 26 CYS H . 26 . HN 1 1 291 1 1 1 1 7 PRO HA . 7 . HA 1 1 291 1 2 1 1 26 CYS H . 26 . HN 1 1 292 1 1 1 1 5 GLY QA . 5 . HA* 1 1 292 1 2 1 1 26 CYS H . 26 . HN 1 1 293 1 1 1 1 4 LYS HA . 4 . HA 1 1 293 1 2 1 1 26 CYS H . 26 . HN 1 1 294 1 1 1 1 25 LYS HB3 . 25 . HB1 1 1 294 1 2 1 1 26 CYS H . 26 . HN 1 1 295 1 1 1 1 25 LYS HB2 . 25 . HB2 1 1 295 1 2 1 1 26 CYS H . 26 . HN 1 1 296 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 296 1 2 1 1 26 CYS H . 26 . HN 1 1 297 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 297 1 2 1 1 26 CYS H . 26 . HN 1 1 298 1 1 1 1 25 LYS QG . 25 . HG* 1 1 298 1 2 1 1 26 CYS H . 26 . HN 1 1 299 1 1 1 1 25 LYS HD3 . 25 . HD1 1 1 299 1 2 1 1 26 CYS H . 26 . HN 1 1 300 1 1 1 1 25 LYS HD2 . 25 . HD2 1 1 300 1 2 1 1 26 CYS H . 26 . HN 1 1 301 1 1 1 1 6 ALA H . 6 . HN 1 1 301 1 2 1 1 26 CYS H . 26 . HN 1 1 302 1 1 1 1 5 GLY H . 5 . HN 1 1 302 1 2 1 1 26 CYS H . 26 . HN 1 1 303 1 1 1 1 8 CYS H . 8 . HN 1 1 303 1 2 1 1 26 CYS H . 26 . HN 1 1 304 1 1 1 1 26 CYS HA . 26 . HA 1 1 304 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 305 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 305 1 2 1 1 26 CYS HA . 26 . HA 1 1 306 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 306 1 2 1 1 26 CYS HA . 26 . HA 1 1 307 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 307 1 2 1 1 26 CYS HB3 . 26 . HB1 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 . . . . . 0.0 0.0 6.0 1 1 2 1 . . . . . 0.0 0.0 6.0 1 1 3 1 . . . . . 0.0 0.0 6.0 1 1 4 1 . . . . . 0.0 0.0 6.0 1 1 5 1 . . . . . 0.0 0.0 6.0 1 1 6 1 . . . . . 0.0 0.0 2.7 1 1 7 1 . . . . . 0.0 0.0 6.0 1 1 8 1 . . . . . 0.0 0.0 2.7 1 1 9 1 . . . . . 0.0 0.0 5.0 1 1 10 1 . . . . . 0.0 0.0 5.0 1 1 11 1 . . . . . 0.0 0.0 5.0 1 1 12 1 . . . . . 0.0 0.0 6.0 1 1 13 1 . . . . . 0.0 0.0 6.0 1 1 14 1 . . . . . 0.0 0.0 6.0 1 1 15 1 . . . . . 0.0 0.0 6.0 1 1 16 1 . . . . . 0.0 0.0 6.0 1 1 17 1 . . . . . 0.0 0.0 7.0 1 1 18 1 . . . . . 0.0 0.0 4.5 1 1 19 1 . . . . . 0.0 0.0 6.0 1 1 20 1 . . . . . 0.0 0.0 6.0 1 1 21 1 . . . . . 0.0 0.0 5.0 1 1 22 1 . . . . . 0.0 0.0 5.0 1 1 23 1 . . . . . 0.0 0.0 5.0 1 1 24 1 . . . . . 0.0 0.0 3.5 1 1 25 1 . . . . . 0.0 0.0 7.5 1 1 26 1 . . . . . 0.0 0.0 8.0 1 1 27 1 . . . . . 0.0 0.0 8.0 1 1 28 1 . . . . . 0.0 0.0 7.0 1 1 29 1 . . . . . 0.0 0.0 2.7 1 1 30 1 . . . . . 0.0 0.0 5.0 1 1 31 1 . . . . . 0.0 0.0 5.0 1 1 32 1 . . . . . 0.0 0.0 5.0 1 1 33 1 . . . . . 0.0 0.0 6.0 1 1 34 1 . . . . . 0.0 0.0 6.0 1 1 35 1 . . . . . 0.0 0.0 6.0 1 1 36 1 . . . . . 0.0 0.0 5.0 1 1 37 1 . . . . . 0.0 0.0 6.0 1 1 38 1 . . . . . 0.0 0.0 6.0 1 1 39 1 . . . . . 0.0 0.0 6.0 1 1 40 1 . . . . . 0.0 0.0 6.0 1 1 41 1 . . . . . 0.0 0.0 3.5 1 1 42 1 . . . . . 0.0 0.0 3.5 1 1 43 1 . . . . . 0.0 0.0 6.0 1 1 44 1 . . . . . 0.0 0.0 6.0 1 1 45 1 . . . . . 0.0 0.0 7.5 1 1 46 1 . . . . . 0.0 0.0 3.5 1 1 47 1 . . . . . 0.0 0.0 3.5 1 1 48 1 . . . . . 0.0 0.0 6.0 1 1 49 1 . . . . . 0.0 0.0 7.0 1 1 50 1 . . . . . 0.0 0.0 6.0 1 1 51 1 . . . . . 0.0 0.0 2.7 1 1 52 1 . . . . . 0.0 0.0 3.5 1 1 53 1 . . . . . 0.0 0.0 2.7 1 1 54 1 . . . . . 0.0 0.0 3.5 1 1 55 1 . . . . . 0.0 0.0 5.0 1 1 56 1 . . . . . 0.0 0.0 6.0 1 1 57 1 . . . . . 0.0 0.0 5.0 1 1 58 1 . . . . . 0.0 0.0 5.0 1 1 59 1 . . . . . 0.0 0.0 5.0 1 1 60 1 . . . . . 0.0 0.0 2.7 1 1 61 1 . . . . . 0.0 0.0 5.0 1 1 62 1 . . . . . 0.0 0.0 5.0 1 1 63 1 . . . . . 0.0 0.0 5.0 1 1 64 1 . . . . . 0.0 0.0 5.0 1 1 65 1 . . . . . 0.0 0.0 6.0 1 1 66 1 . . . . . 0.0 0.0 6.0 1 1 67 1 . . . . . 0.0 0.0 6.0 1 1 68 1 . . . . . 0.0 0.0 6.0 1 1 69 1 . . . . . 0.0 0.0 6.0 1 1 70 1 . . . . . 0.0 0.0 6.0 1 1 71 1 . . . . . 0.0 0.0 5.0 1 1 72 1 . . . . . 0.0 0.0 5.0 1 1 73 1 . . . . . 0.0 0.0 5.0 1 1 74 1 . . . . . 0.0 0.0 7.0 1 1 75 1 . . . . . 0.0 0.0 3.5 1 1 76 1 . . . . . 0.0 0.0 5.0 1 1 77 1 . . . . . 0.0 0.0 6.0 1 1 78 1 . . . . . 0.0 0.0 2.7 1 1 79 1 . . . . . 0.0 0.0 2.7 1 1 80 1 . . . . . 0.0 0.0 6.0 1 1 81 1 . . . . . 0.0 0.0 6.0 1 1 82 1 . . . . . 0.0 0.0 6.0 1 1 83 1 . . . . . 0.0 0.0 6.0 1 1 84 1 . . . . . 0.0 0.0 6.0 1 1 85 1 . . . . . 0.0 0.0 6.0 1 1 86 1 . . . . . 0.0 0.0 6.0 1 1 87 1 . . . . . 0.0 0.0 5.0 1 1 88 1 . . . . . 0.0 0.0 5.0 1 1 89 1 . . . . . 0.0 0.0 3.5 1 1 90 1 . . . . . 0.0 0.0 2.7 1 1 91 1 . . . . . 0.0 0.0 5.0 1 1 92 1 . . . . . 0.0 0.0 5.0 1 1 93 1 . . . . . 0.0 0.0 6.0 1 1 94 1 . . . . . 0.0 0.0 6.0 1 1 95 1 . . . . . 0.0 0.0 6.0 1 1 96 1 . . . . . 0.0 0.0 7.0 1 1 97 1 . . . . . 0.0 0.0 6.0 1 1 98 1 . . . . . 0.0 0.0 6.0 1 1 99 1 . . . . . 0.0 0.0 5.0 1 1 100 1 . . . . . 0.0 0.0 5.0 1 1 101 1 . . . . . 0.0 0.0 5.0 1 1 102 1 . . . . . 0.0 0.0 5.0 1 1 103 1 . . . . . 0.0 0.0 6.0 1 1 104 1 . . . . . 0.0 0.0 5.0 1 1 105 1 . . . . . 0.0 0.0 5.0 1 1 106 1 . . . . . 0.0 0.0 5.0 1 1 107 1 . . . . . 0.0 0.0 5.0 1 1 108 1 . . . . . 0.0 0.0 2.7 1 1 109 1 . . . . . 0.0 0.0 6.0 1 1 110 1 . . . . . 0.0 0.0 6.0 1 1 111 1 . . . . . 0.0 0.0 4.5 1 1 112 1 . . . . . 0.0 0.0 2.7 1 1 113 1 . . . . . 0.0 0.0 3.5 1 1 114 1 . . . . . 0.0 0.0 5.0 1 1 115 1 . . . . . 0.0 0.0 8.0 1 1 116 1 . . . . . 0.0 0.0 6.0 1 1 117 1 . . . . . 0.0 0.0 6.0 1 1 118 1 . . . . . 0.0 0.0 6.0 1 1 119 1 . . . . . 0.0 0.0 6.0 1 1 120 1 . . . . . 0.0 0.0 6.0 1 1 121 1 . . . . . 0.0 0.0 6.0 1 1 122 1 . . . . . 0.0 0.0 2.7 1 1 123 1 . . . . . 0.0 0.0 6.0 1 1 124 1 . . . . . 0.0 0.0 3.7 1 1 125 1 . . . . . 0.0 0.0 6.0 1 1 126 1 . . . . . 0.0 0.0 6.0 1 1 127 1 . . . . . 0.0 0.0 7.5 1 1 128 1 . . . . . 0.0 0.0 5.0 1 1 129 1 . . . . . 0.0 0.0 3.5 1 1 130 1 . . . . . 0.0 0.0 2.7 1 1 131 1 . . . . . 0.0 0.0 5.0 1 1 132 1 . . . . . 0.0 0.0 6.0 1 1 133 1 . . . . . 0.0 0.0 7.5 1 1 134 1 . . . . . 0.0 0.0 5.0 1 1 135 1 . . . . . 0.0 0.0 6.0 1 1 136 1 . . . . . 0.0 0.0 6.0 1 1 137 1 . . . . . 0.0 0.0 5.0 1 1 138 1 . . . . . 0.0 0.0 5.0 1 1 139 1 . . . . . 0.0 0.0 3.5 1 1 140 1 . . . . . 0.0 0.0 6.0 1 1 141 1 . . . . . 0.0 0.0 6.0 1 1 142 1 . . . . . 0.0 0.0 5.0 1 1 143 1 . . . . . 0.0 0.0 5.0 1 1 144 1 . . . . . 0.0 0.0 7.0 1 1 145 1 . . . . . 0.0 0.0 6.5 1 1 146 1 . . . . . 0.0 0.0 3.5 1 1 147 1 . . . . . 0.0 0.0 3.5 1 1 148 1 . . . . . 0.0 0.0 5.0 1 1 149 1 . . . . . 0.0 0.0 4.5 1 1 150 1 . . . . . 0.0 0.0 7.0 1 1 151 1 . . . . . 0.0 0.0 3.5 1 1 152 1 . . . . . 0.0 0.0 3.5 1 1 153 1 . . . . . 0.0 0.0 5.5 1 1 154 1 . . . . . 0.0 0.0 7.0 1 1 155 1 . . . . . 0.0 0.0 8.0 1 1 156 1 . . . . . 0.0 0.0 8.0 1 1 157 1 . . . . . 0.0 0.0 8.0 1 1 158 1 . . . . . 0.0 0.0 7.0 1 1 159 1 . . . . . 0.0 0.0 8.0 1 1 160 1 . . . . . 0.0 0.0 9.0 1 1 161 1 . . . . . 0.0 0.0 8.0 1 1 162 1 . . . . . 0.0 0.0 8.0 1 1 163 1 . . . . . 0.0 0.0 3.5 1 1 164 1 . . . . . 0.0 0.0 6.0 1 1 165 1 . . . . . 0.0 0.0 6.0 1 1 166 1 . . . . . 0.0 0.0 5.0 1 1 167 1 . . . . . 0.0 0.0 5.0 1 1 168 1 . . . . . 0.0 0.0 5.0 1 1 169 1 . . . . . 0.0 0.0 3.5 1 1 170 1 . . . . . 0.0 0.0 5.0 1 1 171 1 . . . . . 0.0 0.0 5.0 1 1 172 1 . . . . . 0.0 0.0 6.0 1 1 173 1 . . . . . 0.0 0.0 2.7 1 1 174 1 . . . . . 0.0 0.0 5.0 1 1 175 1 . . . . . 0.0 0.0 5.0 1 1 176 1 . . . . . 0.0 0.0 6.0 1 1 177 1 . . . . . 0.0 0.0 6.0 1 1 178 1 . . . . . 0.0 0.0 6.0 1 1 179 1 . . . . . 0.0 0.0 5.0 1 1 180 1 . . . . . 0.0 0.0 5.0 1 1 181 1 . . . . . 0.0 0.0 2.7 1 1 182 1 . . . . . 0.0 0.0 6.0 1 1 183 1 . . . . . 0.0 0.0 6.0 1 1 184 1 . . . . . 0.0 0.0 6.0 1 1 185 1 . . . . . 0.0 0.0 6.0 1 1 186 1 . . . . . 0.0 0.0 3.5 1 1 187 1 . . . . . 0.0 0.0 3.5 1 1 188 1 . . . . . 0.0 0.0 5.0 1 1 189 1 . . . . . 0.0 0.0 5.0 1 1 190 1 . . . . . 0.0 0.0 6.0 1 1 191 1 . . . . . 0.0 0.0 6.0 1 1 192 1 . . . . . 0.0 0.0 3.5 1 1 193 1 . . . . . 0.0 0.0 3.5 1 1 194 1 . . . . . 0.0 0.0 2.7 1 1 195 1 . . . . . 0.0 0.0 4.5 1 1 196 1 . . . . . 0.0 0.0 5.0 1 1 197 1 . . . . . 0.0 0.0 5.0 1 1 198 1 . . . . . 0.0 0.0 6.0 1 1 199 1 . . . . . 0.0 0.0 6.0 1 1 200 1 . . . . . 0.0 0.0 3.5 1 1 201 1 . . . . . 0.0 0.0 3.5 1 1 202 1 . . . . . 0.0 0.0 2.7 1 1 203 1 . . . . . 0.0 0.0 5.0 1 1 204 1 . . . . . 0.0 0.0 3.5 1 1 205 1 . . . . . 0.0 0.0 3.5 1 1 206 1 . . . . . 0.0 0.0 3.5 1 1 207 1 . . . . . 0.0 0.0 6.0 1 1 208 1 . . . . . 0.0 0.0 6.0 1 1 209 1 . . . . . 0.0 0.0 6.0 1 1 210 1 . . . . . 0.0 0.0 6.0 1 1 211 1 . . . . . 0.0 0.0 7.0 1 1 212 1 . . . . . 0.0 0.0 3.5 1 1 213 1 . . . . . 0.0 0.0 4.5 1 1 214 1 . . . . . 0.0 0.0 6.0 1 1 215 1 . . . . . 0.0 0.0 6.0 1 1 216 1 . . . . . 0.0 0.0 5.0 1 1 217 1 . . . . . 0.0 0.0 5.0 1 1 218 1 . . . . . 0.0 0.0 3.5 1 1 219 1 . . . . . 0.0 0.0 3.5 1 1 220 1 . . . . . 0.0 0.0 5.0 1 1 221 1 . . . . . 0.0 0.0 6.0 1 1 222 1 . . . . . 0.0 0.0 3.5 1 1 223 1 . . . . . 0.0 0.0 5.0 1 1 224 1 . . . . . 0.0 0.0 5.0 1 1 225 1 . . . . . 0.0 0.0 3.5 1 1 226 1 . . . . . 0.0 0.0 2.7 1 1 227 1 . . . . . 0.0 0.0 5.0 1 1 228 1 . . . . . 0.0 0.0 5.0 1 1 229 1 . . . . . 0.0 0.0 6.0 1 1 230 1 . . . . . 0.0 0.0 5.0 1 1 231 1 . . . . . 0.0 0.0 6.0 1 1 232 1 . . . . . 0.0 0.0 5.0 1 1 233 1 . . . . . 0.0 0.0 5.0 1 1 234 1 . . . . . 0.0 0.0 5.0 1 1 235 1 . . . . . 0.0 0.0 5.0 1 1 236 1 . . . . . 0.0 0.0 5.0 1 1 237 1 . . . . . 0.0 0.0 3.5 1 1 238 1 . . . . . 0.0 0.0 6.0 1 1 239 1 . . . . . 0.0 0.0 2.7 1 1 240 1 . . . . . 0.0 0.0 6.0 1 1 241 1 . . . . . 0.0 0.0 6.0 1 1 242 1 . . . . . 0.0 0.0 6.0 1 1 243 1 . . . . . 0.0 0.0 6.0 1 1 244 1 . . . . . 0.0 0.0 7.0 1 1 245 1 . . . . . 0.0 0.0 7.0 1 1 246 1 . . . . . 0.0 0.0 3.5 1 1 247 1 . . . . . 0.0 0.0 3.5 1 1 248 1 . . . . . 0.0 0.0 6.0 1 1 249 1 . . . . . 0.0 0.0 6.0 1 1 250 1 . . . . . 0.0 0.0 3.7 1 1 251 1 . . . . . 0.0 0.0 4.5 1 1 252 1 . . . . . 0.0 0.0 2.7 1 1 253 1 . . . . . 0.0 0.0 5.0 1 1 254 1 . . . . . 0.0 0.0 5.0 1 1 255 1 . . . . . 0.0 0.0 6.0 1 1 256 1 . . . . . 0.0 0.0 5.0 1 1 257 1 . . . . . 0.0 0.0 4.5 1 1 258 1 . . . . . 0.0 0.0 6.0 1 1 259 1 . . . . . 0.0 0.0 3.5 1 1 260 1 . . . . . 0.0 0.0 5.0 1 1 261 1 . . . . . 0.0 0.0 5.0 1 1 262 1 . . . . . 0.0 0.0 6.0 1 1 263 1 . . . . . 0.0 0.0 6.0 1 1 264 1 . . . . . 0.0 0.0 7.0 1 1 265 1 . . . . . 0.0 0.0 7.0 1 1 266 1 . . . . . 0.0 0.0 2.7 1 1 267 1 . . . . . 0.0 0.0 5.0 1 1 268 1 . . . . . 0.0 0.0 6.0 1 1 269 1 . . . . . 0.0 0.0 7.0 1 1 270 1 . . . . . 0.0 0.0 6.0 1 1 271 1 . . . . . 0.0 0.0 6.0 1 1 272 1 . . . . . 0.0 0.0 6.0 1 1 273 1 . . . . . 0.0 0.0 5.0 1 1 274 1 . . . . . 0.0 0.0 5.0 1 1 275 1 . . . . . 0.0 0.0 6.0 1 1 276 1 . . . . . 0.0 0.0 6.0 1 1 277 1 . . . . . 0.0 0.0 3.5 1 1 278 1 . . . . . 0.0 0.0 6.0 1 1 279 1 . . . . . 0.0 0.0 6.0 1 1 280 1 . . . . . 0.0 0.0 5.0 1 1 281 1 . . . . . 0.0 0.0 5.0 1 1 282 1 . . . . . 0.0 0.0 7.0 1 1 283 1 . . . . . 0.0 0.0 6.0 1 1 284 1 . . . . . 0.0 0.0 6.0 1 1 285 1 . . . . . 0.0 0.0 6.0 1 1 286 1 . . . . . 0.0 0.0 6.0 1 1 287 1 . . . . . 0.0 0.0 2.7 1 1 288 1 . . . . . 0.0 0.0 5.0 1 1 289 1 . . . . . 0.0 0.0 6.0 1 1 290 1 . . . . . 0.0 0.0 6.0 1 1 291 1 . . . . . 0.0 0.0 5.0 1 1 292 1 . . . . . 0.0 0.0 7.0 1 1 293 1 . . . . . 0.0 0.0 5.0 1 1 294 1 . . . . . 0.0 0.0 3.5 1 1 295 1 . . . . . 0.0 0.0 3.5 1 1 296 1 . . . . . 0.0 0.0 6.0 1 1 297 1 . . . . . 0.0 0.0 6.0 1 1 298 1 . . . . . 0.0 0.0 6.0 1 1 299 1 . . . . . 0.0 0.0 6.0 1 1 300 1 . . . . . 0.0 0.0 6.0 1 1 301 1 . . . . . 0.0 0.0 2.7 1 1 302 1 . . . . . 0.0 0.0 3.5 1 1 303 1 . . . . . 0.0 0.0 5.0 1 1 304 1 . . . . . 0.0 0.0 2.7 1 1 305 1 . . . . . 0.0 0.0 5.0 1 1 306 1 . . . . . 0.0 0.0 5.0 1 1 307 1 . . . . . 0.0 0.0 5.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 25 LYS H . 25 . HN 1 2 1 1 2 1 1 26 CYS H . 26 . HN 1 2 2 1 1 1 1 1 CYS HA . 1 . HA 1 2 2 1 2 1 1 3 GLY H . 3 . HN 1 2 3 1 1 1 1 22 ARG H . 22 . HN 1 2 3 1 2 1 1 25 LYS H . 25 . HN 1 2 4 1 1 1 1 13 TYR QE . 13 . HE* 1 2 4 1 2 1 1 20 CYS H . 20 . HN 1 2 5 1 1 1 1 8 CYS H . 8 . HN 1 2 5 1 2 1 1 25 LYS H . 25 . HN 1 2 6 1 1 1 1 4 LYS H . 4 . HN 1 2 6 1 2 1 1 16 CYS QB . 16 . HB* 1 2 7 1 1 1 1 13 TYR HA . 13 . HA 1 2 7 1 2 1 1 14 ASP HB3 . 14 . HB1 1 2 8 1 1 1 1 13 TYR HA . 13 . HA 1 2 8 1 2 1 1 14 ASP HB2 . 14 . HB2 1 2 9 1 1 1 1 1 CYS HA . 1 . HA 1 2 9 1 2 1 1 2 LYS QB . 2 . HB* 1 2 10 1 1 1 1 1 CYS HA . 1 . HA 1 2 10 1 2 1 1 2 LYS QD . 2 . HD* 1 2 11 1 1 1 1 9 ARG HA . 9 . HA 1 2 11 1 2 1 1 10 LYS HA . 10 . HA 1 2 12 1 1 1 1 9 ARG HA . 9 . HA 1 2 12 1 2 1 1 10 LYS QE . 10 . HE* 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 0.0 5.0 1 2 2 1 . . . . . 0.0 0.0 6.0 1 2 3 1 . . . . . 0.0 0.0 5.0 1 2 4 1 . . . . . 0.0 0.0 7.0 1 2 5 1 . . . . . 0.0 0.0 5.0 1 2 6 1 . . . . . 0.0 0.0 7.0 1 2 7 1 . . . . . 0.0 0.0 6.0 1 2 8 1 . . . . . 0.0 0.0 6.0 1 2 9 1 . . . . . 0.0 0.0 7.0 1 2 10 1 . . . . . 0.0 0.0 7.0 1 2 11 1 . . . . . 0.0 0.0 6.0 1 2 12 1 . . . . . 0.0 0.0 7.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 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 21 GLY H . 21 . HN 1 3 1 1 2 1 1 25 LYS O . 25 . O 1 3 2 1 1 1 1 21 GLY N . 21 . N 1 3 2 1 2 1 1 25 LYS O . 25 . O 1 3 3 1 1 1 1 21 GLY O . 21 . O 1 3 3 1 2 1 1 24 GLY H . 24 . HN 1 3 4 1 1 1 1 21 GLY O . 21 . O 1 3 4 1 2 1 1 24 GLY N . 24 . N 1 3 5 1 1 1 1 3 GLY O . 3 . O 1 3 5 1 2 1 1 6 ALA H . 6 . HN 1 3 6 1 1 1 1 3 GLY O . 3 . O 1 3 6 1 2 1 1 6 ALA N . 6 . N 1 3 7 1 1 1 1 9 ARG O . 9 . O 1 3 7 1 2 1 1 14 ASP H . 14 . HN 1 3 8 1 1 1 1 9 ARG O . 9 . O 1 3 8 1 2 1 1 14 ASP N . 14 . N 1 3 9 1 1 1 1 9 ARG O . 9 . O 1 3 9 1 2 1 1 12 MET H . 12 . HN 1 3 10 1 1 1 1 9 ARG O . 9 . O 1 3 10 1 2 1 1 12 MET N . 12 . N 1 3 11 1 1 1 1 10 LYS O . 10 . O 1 3 11 1 2 1 1 13 TYR H . 13 . HN 1 3 12 1 1 1 1 10 LYS O . 10 . O 1 3 12 1 2 1 1 13 TYR N . 13 . N 1 3 13 1 1 1 1 15 CYS O . 15 . O 1 3 13 1 2 1 1 18 GLY H . 18 . HN 1 3 14 1 1 1 1 15 CYS O . 15 . O 1 3 14 1 2 1 1 18 GLY N . 18 . N 1 3 15 1 1 1 1 6 ALA O . 6 . O 1 3 15 1 2 1 1 26 CYS H . 26 . HN 1 3 16 1 1 1 1 6 ALA O . 6 . O 1 3 16 1 2 1 1 26 CYS N . 26 . N 1 3 17 1 1 1 1 5 GLY H . 5 . HN 1 3 17 1 2 1 1 26 CYS O . 26 . O 1 3 18 1 1 1 1 5 GLY N . 5 . N 1 3 18 1 2 1 1 26 CYS O . 26 . O 1 3 19 1 1 1 1 8 CYS H . 8 . HN 1 3 19 1 2 1 1 24 GLY O . 24 . O 1 3 20 1 1 1 1 8 CYS N . 8 . N 1 3 20 1 2 1 1 24 GLY O . 24 . O 1 3 21 1 1 1 1 2 LYS H . 2 . HN 1 3 21 1 2 1 1 14 ASP O . 14 . O 1 3 22 1 1 1 1 2 LYS N . 2 . N 1 3 22 1 2 1 1 14 ASP O . 14 . O 1 3 23 1 1 1 1 2 LYS O . 2 . O 1 3 23 1 2 1 1 16 CYS H . 16 . HN 1 3 24 1 1 1 1 2 LYS O . 2 . O 1 3 24 1 2 1 1 16 CYS N . 16 . N 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.88 1.58 2.3 1 3 2 1 . . . . . 1.88 1.58 3.2 1 3 3 1 . . . . . 1.88 1.58 2.3 1 3 4 1 . . . . . 1.88 1.58 3.2 1 3 5 1 . . . . . 1.88 1.58 2.3 1 3 6 1 . . . . . 1.88 1.58 3.2 1 3 7 1 . . . . . 1.88 1.58 2.3 1 3 8 1 . . . . . 1.88 1.58 3.2 1 3 9 1 . . . . . 1.88 1.58 2.3 1 3 10 1 . . . . . 1.88 1.58 3.2 1 3 11 1 . . . . . 1.88 1.58 2.3 1 3 12 1 . . . . . 1.88 1.58 3.2 1 3 13 1 . . . . . 1.88 1.58 2.3 1 3 14 1 . . . . . 1.88 1.58 3.2 1 3 15 1 . . . . . 1.88 1.58 2.3 1 3 16 1 . . . . . 1.88 1.58 3.2 1 3 17 1 . . . . . 1.88 1.58 2.3 1 3 18 1 . . . . . 1.88 1.58 3.2 1 3 19 1 . . . . . 1.88 1.58 2.3 1 3 20 1 . . . . . 1.88 1.58 3.2 1 3 21 1 . . . . . 1.88 1.58 2.3 1 3 22 1 . . . . . 1.88 1.58 3.2 1 3 23 1 . . . . . 1.88 1.58 2.3 1 3 24 1 . . . . . 1.88 1.58 3.2 1 3 stop_ save_ save_CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 7 PRO C 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS C -150.0 -89.99999 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 2 . 1 1 8 CYS C 1 1 9 ARG N 1 1 9 ARG CA 1 1 9 ARG C -150.0 -89.99999 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 3 . 1 1 11 THR C 1 1 12 MET N 1 1 12 MET CA 1 1 12 MET C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 4 . 1 1 13 TYR C 1 1 14 ASP N 1 1 14 ASP CA 1 1 14 ASP C -160.0 -80.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 5 . 1 1 18 GLY C 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER C -170.0 -70.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 6 . 1 1 22 ARG C 1 1 23 ARG N 1 1 23 ARG CA 1 1 23 ARG C -160.0 -80.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 7 . 1 1 24 GLY C 1 1 25 LYS N 1 1 25 LYS CA 1 1 25 LYS C -150.0 -89.99999 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 8 . 1 1 3 GLY C 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C -95.0 -35.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 9 . 1 1 5 GLY C 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C -95.0 -35.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 10 . 1 1 9 ARG C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -95.0 -35.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 11 . 1 1 15 CYS C 1 1 16 CYS N 1 1 16 CYS CA 1 1 16 CYS C -95.0 -35.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 12 . 1 1 21 GLY C 1 1 22 ARG N 1 1 22 ARG CA 1 1 22 ARG C -95.0 -35.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 13 . 1 1 25 LYS C 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS C -95.0 -35.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 14 . 1 1 1 CYS C 1 1 2 LYS N 1 1 2 LYS CA 1 1 2 LYS C -170.0 -70.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 15 . 1 1 6 ALA C 1 1 7 PRO N 1 1 7 PRO CA 1 1 7 PRO C -160.0 -20.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 16 . 1 1 14 ASP C 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS C -160.0 -20.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 17 . 1 1 16 CYS C 1 1 17 SER N 1 1 17 SER CA 1 1 17 SER C -160.0 -20.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 18 . 1 1 19 SER C 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS C -160.0 -20.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 19 . 1 1 4 LYS C 1 1 5 GLY N 1 1 5 GLY CA 1 1 5 GLY C 40.0 140.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 20 . 1 1 17 SER C 1 1 18 GLY N 1 1 18 GLY CA 1 1 18 GLY C 40.0 140.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 21 . 1 1 20 CYS C 1 1 21 GLY N 1 1 21 GLY CA 1 1 21 GLY C -95.0 -35.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 22 . 1 1 23 ARG C 1 1 24 GLY N 1 1 24 GLY CA 1 1 24 GLY C 30.0 150.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 23 . 1 1 12 MET C 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR C 20.0 120.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 24 . 1 1 1 CYS N 1 1 1 CYS CA 1 1 1 CYS CB 1 1 1 CYS SG 30.0 89.99999 . 1 . N . 1 . CA . 1 . CB . 1 . SG 1 1 25 . 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR CB 1 1 13 TYR CG -89.99999 -30.0 . 13 . N . 13 . CA . 13 . CB . 13 . CG 1 1 26 . 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS CB 1 1 15 CYS SG -89.99999 -30.0 . 15 . N . 15 . CA . 15 . CB . 15 . SG 1 1 27 . 1 1 16 CYS N 1 1 16 CYS CA 1 1 16 CYS CB 1 1 16 CYS SG -89.99999 -30.0 . 16 . N . 16 . CA . 16 . CB . 16 . SG 1 1 28 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS CB 1 1 20 CYS SG 150.0 210.0 . 20 . N . 20 . CA . 20 . CB . 20 . SG 1 1 29 . 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS CB 1 1 26 CYS SG -89.99999 -30.0 . 26 . N . 26 . CA . 26 . CB . 26 . SG 1 1 30 . 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER CB 1 1 19 SER OG 30.0 89.99999 . 19 . N . 19 . CA . 19 . CB . 19 . OG 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 CYS C C -6.043 6.424 1.854 1.00 . A A . 1 CYS C 1 1 1 2 1 1 1 CYS CA C -7.107 6.013 0.826 1.00 . A A . 1 CYS CA 1 1 1 3 1 1 1 CYS CB C -6.639 6.431 -0.570 1.00 . A A . 1 CYS CB 1 1 1 4 1 1 1 CYS H1 H -8.255 7.707 1.198 1.00 . A A . 1 CYS H1 1 1 1 5 1 1 1 CYS H2 H -9.100 6.457 0.418 1.00 . A A . 1 CYS H2 1 1 1 6 1 1 1 CYS H3 H -8.741 6.336 2.075 1.00 . A A . 1 CYS H3 1 1 1 7 1 1 1 CYS HA H -7.242 4.940 0.875 1.00 . A A . 1 CYS HA 1 1 1 8 1 1 1 CYS HB2 H -5.739 5.882 -0.799 1.00 . A A . 1 CYS HB2 1 1 1 9 1 1 1 CYS HB3 H -7.389 6.130 -1.286 1.00 . A A . 1 CYS HB3 1 1 1 10 1 1 1 CYS N N -8.400 6.679 1.154 1.00 . A A . 1 CYS N 1 1 1 11 1 1 1 CYS O O -6.114 7.484 2.447 1.00 . A A . 1 CYS O 1 1 1 12 1 1 1 CYS SG S -6.302 8.189 -0.833 1.00 . A A . 1 CYS SG 1 1 1 13 1 1 2 LYS C C -2.698 6.258 2.242 1.00 . A A . 2 LYS C 1 1 1 14 1 1 2 LYS CA C -3.955 5.755 2.973 1.00 . A A . 2 LYS CA 1 1 1 15 1 1 2 LYS CB C -3.696 4.400 3.683 1.00 . A A . 2 LYS CB 1 1 1 16 1 1 2 LYS CD C -6.240 4.041 4.130 1.00 . A A . 2 LYS CD 1 1 1 17 1 1 2 LYS CE C -7.235 3.517 5.180 1.00 . A A . 2 LYS CE 1 1 1 18 1 1 2 LYS CG C -4.805 4.028 4.716 1.00 . A A . 2 LYS CG 1 1 1 19 1 1 2 LYS H H -5.113 4.723 1.492 1.00 . A A . 2 LYS H 1 1 1 20 1 1 2 LYS HA H -4.244 6.491 3.711 1.00 . A A . 2 LYS HA 1 1 1 21 1 1 2 LYS HB2 H -3.639 3.618 2.940 1.00 . A A . 2 LYS HB2 1 1 1 22 1 1 2 LYS HB3 H -2.753 4.433 4.200 1.00 . A A . 2 LYS HB3 1 1 1 23 1 1 2 LYS HD2 H -6.523 5.060 3.921 1.00 . A A . 2 LYS HD2 1 1 1 24 1 1 2 LYS HD3 H -6.307 3.474 3.215 1.00 . A A . 2 LYS HD3 1 1 1 25 1 1 2 LYS HE2 H -8.238 3.538 4.777 1.00 . A A . 2 LYS HE2 1 1 1 26 1 1 2 LYS HE3 H -6.992 2.502 5.459 1.00 . A A . 2 LYS HE3 1 1 1 27 1 1 2 LYS HG2 H -4.591 3.043 5.107 1.00 . A A . 2 LYS HG2 1 1 1 28 1 1 2 LYS HG3 H -4.754 4.728 5.537 1.00 . A A . 2 LYS HG3 1 1 1 29 1 1 2 LYS HZ1 H -7.201 5.375 6.123 1.00 . A A . 2 LYS HZ1 1 1 1 30 1 1 2 LYS HZ2 H -8.032 4.173 6.989 1.00 . A A . 2 LYS HZ2 1 1 1 31 1 1 2 LYS HZ3 H -6.334 4.165 6.941 1.00 . A A . 2 LYS HZ3 1 1 1 32 1 1 2 LYS N N -5.087 5.549 2.018 1.00 . A A . 2 LYS N 1 1 1 33 1 1 2 LYS NZ N -7.199 4.372 6.401 1.00 . A A . 2 LYS NZ 1 1 1 34 1 1 2 LYS O O -2.214 5.621 1.328 1.00 . A A . 2 LYS O 1 1 1 35 1 1 3 GLY C C 0.250 7.090 2.136 1.00 . A A . 3 GLY C 1 1 1 36 1 1 3 GLY CA C -0.982 8.007 2.060 1.00 . A A . 3 GLY CA 1 1 1 37 1 1 3 GLY H H -2.648 7.852 3.420 1.00 . A A . 3 GLY H 1 1 1 38 1 1 3 GLY HA2 H -1.187 8.230 1.022 1.00 . A A . 3 GLY HA2 1 1 1 39 1 1 3 GLY HA3 H -0.760 8.928 2.577 1.00 . A A . 3 GLY HA3 1 1 1 40 1 1 3 GLY N N -2.205 7.394 2.676 1.00 . A A . 3 GLY N 1 1 1 41 1 1 3 GLY O O 0.210 6.056 2.769 1.00 . A A . 3 GLY O 1 1 1 42 1 1 4 LYS C C 3.093 6.340 2.876 1.00 . A A . 4 LYS C 1 1 1 43 1 1 4 LYS CA C 2.582 6.711 1.468 1.00 . A A . 4 LYS CA 1 1 1 44 1 1 4 LYS CB C 3.635 7.543 0.716 1.00 . A A . 4 LYS CB 1 1 1 45 1 1 4 LYS CD C 4.223 8.600 -1.504 1.00 . A A . 4 LYS CD 1 1 1 46 1 1 4 LYS CE C 3.746 8.839 -2.952 1.00 . A A . 4 LYS CE 1 1 1 47 1 1 4 LYS CG C 3.167 7.773 -0.742 1.00 . A A . 4 LYS CG 1 1 1 48 1 1 4 LYS H H 1.289 8.346 0.995 1.00 . A A . 4 LYS H 1 1 1 49 1 1 4 LYS HA H 2.403 5.799 0.917 1.00 . A A . 4 LYS HA 1 1 1 50 1 1 4 LYS HB2 H 3.773 8.493 1.212 1.00 . A A . 4 LYS HB2 1 1 1 51 1 1 4 LYS HB3 H 4.571 7.013 0.716 1.00 . A A . 4 LYS HB3 1 1 1 52 1 1 4 LYS HD2 H 4.366 9.552 -1.014 1.00 . A A . 4 LYS HD2 1 1 1 53 1 1 4 LYS HD3 H 5.166 8.073 -1.517 1.00 . A A . 4 LYS HD3 1 1 1 54 1 1 4 LYS HE2 H 2.812 9.383 -2.955 1.00 . A A . 4 LYS HE2 1 1 1 55 1 1 4 LYS HE3 H 4.484 9.414 -3.491 1.00 . A A . 4 LYS HE3 1 1 1 56 1 1 4 LYS HG2 H 3.039 6.817 -1.227 1.00 . A A . 4 LYS HG2 1 1 1 57 1 1 4 LYS HG3 H 2.222 8.297 -0.755 1.00 . A A . 4 LYS HG3 1 1 1 58 1 1 4 LYS HZ1 H 4.156 6.815 -3.237 1.00 . A A . 4 LYS HZ1 1 1 1 59 1 1 4 LYS HZ2 H 2.550 7.251 -3.571 1.00 . A A . 4 LYS HZ2 1 1 1 60 1 1 4 LYS HZ3 H 3.784 7.655 -4.665 1.00 . A A . 4 LYS HZ3 1 1 1 61 1 1 4 LYS N N 1.311 7.500 1.487 1.00 . A A . 4 LYS N 1 1 1 62 1 1 4 LYS NZ N 3.545 7.542 -3.659 1.00 . A A . 4 LYS NZ 1 1 1 63 1 1 4 LYS O O 3.135 7.168 3.765 1.00 . A A . 4 LYS O 1 1 1 64 1 1 5 GLY C C 2.900 4.390 5.392 1.00 . A A . 5 GLY C 1 1 1 65 1 1 5 GLY CA C 3.981 4.545 4.308 1.00 . A A . 5 GLY CA 1 1 1 66 1 1 5 GLY H H 3.390 4.488 2.245 1.00 . A A . 5 GLY H 1 1 1 67 1 1 5 GLY HA2 H 4.414 3.576 4.114 1.00 . A A . 5 GLY HA2 1 1 1 68 1 1 5 GLY HA3 H 4.756 5.197 4.683 1.00 . A A . 5 GLY HA3 1 1 1 69 1 1 5 GLY N N 3.460 5.090 3.015 1.00 . A A . 5 GLY N 1 1 1 70 1 1 5 GLY O O 3.218 4.056 6.516 1.00 . A A . 5 GLY O 1 1 1 71 1 1 6 ALA C C 0.008 3.055 6.077 1.00 . A A . 6 ALA C 1 1 1 72 1 1 6 ALA CA C 0.536 4.507 6.021 1.00 . A A . 6 ALA CA 1 1 1 73 1 1 6 ALA CB C -0.580 5.464 5.592 1.00 . A A . 6 ALA CB 1 1 1 74 1 1 6 ALA H H 1.469 4.892 4.110 1.00 . A A . 6 ALA H 1 1 1 75 1 1 6 ALA HA H 0.899 4.797 6.996 1.00 . A A . 6 ALA HA 1 1 1 76 1 1 6 ALA HB1 H -0.208 6.479 5.572 1.00 . A A . 6 ALA HB1 1 1 1 77 1 1 6 ALA HB2 H -0.924 5.200 4.606 1.00 . A A . 6 ALA HB2 1 1 1 78 1 1 6 ALA HB3 H -1.416 5.417 6.272 1.00 . A A . 6 ALA HB3 1 1 1 79 1 1 6 ALA N N 1.661 4.630 5.035 1.00 . A A . 6 ALA N 1 1 1 80 1 1 6 ALA O O 0.134 2.341 5.101 1.00 . A A . 6 ALA O 1 1 1 81 1 1 7 PRO C C -2.114 0.764 6.502 1.00 . A A . 7 PRO C 1 1 1 82 1 1 7 PRO CA C -0.981 1.236 7.442 1.00 . A A . 7 PRO CA 1 1 1 83 1 1 7 PRO CB C -1.386 1.181 8.923 1.00 . A A . 7 PRO CB 1 1 1 84 1 1 7 PRO CD C -0.871 3.538 8.367 1.00 . A A . 7 PRO CD 1 1 1 85 1 1 7 PRO CG C -1.564 2.630 9.392 1.00 . A A . 7 PRO CG 1 1 1 86 1 1 7 PRO HA H -0.121 0.600 7.295 1.00 . A A . 7 PRO HA 1 1 1 87 1 1 7 PRO HB2 H -2.305 0.630 9.067 1.00 . A A . 7 PRO HB2 1 1 1 88 1 1 7 PRO HB3 H -0.606 0.704 9.498 1.00 . A A . 7 PRO HB3 1 1 1 89 1 1 7 PRO HD2 H -1.528 4.337 8.061 1.00 . A A . 7 PRO HD2 1 1 1 90 1 1 7 PRO HD3 H 0.047 3.942 8.771 1.00 . A A . 7 PRO HD3 1 1 1 91 1 1 7 PRO HG2 H -2.614 2.874 9.449 1.00 . A A . 7 PRO HG2 1 1 1 92 1 1 7 PRO HG3 H -1.121 2.764 10.369 1.00 . A A . 7 PRO HG3 1 1 1 93 1 1 7 PRO N N -0.564 2.653 7.198 1.00 . A A . 7 PRO N 1 1 1 94 1 1 7 PRO O O -3.283 0.809 6.832 1.00 . A A . 7 PRO O 1 1 1 95 1 1 8 CYS C C -2.525 -1.707 4.137 1.00 . A A . 8 CYS C 1 1 1 96 1 1 8 CYS CA C -2.620 -0.182 4.283 1.00 . A A . 8 CYS CA 1 1 1 97 1 1 8 CYS CB C -2.233 0.458 2.971 1.00 . A A . 8 CYS CB 1 1 1 98 1 1 8 CYS H H -0.732 0.336 5.152 1.00 . A A . 8 CYS H 1 1 1 99 1 1 8 CYS HA H -3.633 0.082 4.534 1.00 . A A . 8 CYS HA 1 1 1 100 1 1 8 CYS HB2 H -2.828 0.048 2.170 1.00 . A A . 8 CYS HB2 1 1 1 101 1 1 8 CYS HB3 H -2.440 1.509 2.975 1.00 . A A . 8 CYS HB3 1 1 1 102 1 1 8 CYS N N -1.695 0.327 5.344 1.00 . A A . 8 CYS N 1 1 1 103 1 1 8 CYS O O -1.933 -2.399 4.942 1.00 . A A . 8 CYS O 1 1 1 104 1 1 8 CYS SG S -0.499 0.179 2.541 1.00 . A A . 8 CYS SG 1 1 1 105 1 1 9 ARG C C -3.306 -3.677 1.160 1.00 . A A . 9 ARG C 1 1 1 106 1 1 9 ARG CA C -3.199 -3.577 2.692 1.00 . A A . 9 ARG CA 1 1 1 107 1 1 9 ARG CB C -4.420 -4.281 3.397 1.00 . A A . 9 ARG CB 1 1 1 108 1 1 9 ARG CD C -5.909 -2.253 3.977 1.00 . A A . 9 ARG CD 1 1 1 109 1 1 9 ARG CG C -5.823 -3.613 3.245 1.00 . A A . 9 ARG CG 1 1 1 110 1 1 9 ARG CZ C -5.594 -1.472 6.281 1.00 . A A . 9 ARG CZ 1 1 1 111 1 1 9 ARG H H -3.600 -1.507 2.496 1.00 . A A . 9 ARG H 1 1 1 112 1 1 9 ARG HA H -2.284 -4.057 3.009 1.00 . A A . 9 ARG HA 1 1 1 113 1 1 9 ARG HB2 H -4.495 -5.285 3.003 1.00 . A A . 9 ARG HB2 1 1 1 114 1 1 9 ARG HB3 H -4.191 -4.373 4.447 1.00 . A A . 9 ARG HB3 1 1 1 115 1 1 9 ARG HD2 H -5.257 -1.514 3.552 1.00 . A A . 9 ARG HD2 1 1 1 116 1 1 9 ARG HD3 H -6.923 -1.885 3.932 1.00 . A A . 9 ARG HD3 1 1 1 117 1 1 9 ARG HE H -5.245 -3.338 5.716 1.00 . A A . 9 ARG HE 1 1 1 118 1 1 9 ARG HG2 H -6.053 -3.467 2.201 1.00 . A A . 9 ARG HG2 1 1 1 119 1 1 9 ARG HG3 H -6.571 -4.274 3.659 1.00 . A A . 9 ARG HG3 1 1 1 120 1 1 9 ARG HH11 H -6.251 -0.113 4.963 1.00 . A A . 9 ARG HH11 1 1 1 121 1 1 9 ARG HH12 H -6.016 0.463 6.577 1.00 . A A . 9 ARG HH12 1 1 1 122 1 1 9 ARG HH21 H -4.951 -2.639 7.774 1.00 . A A . 9 ARG HH21 1 1 1 123 1 1 9 ARG HH22 H -5.277 -0.992 8.196 1.00 . A A . 9 ARG HH22 1 1 1 124 1 1 9 ARG N N -3.145 -2.150 3.075 1.00 . A A . 9 ARG N 1 1 1 125 1 1 9 ARG NE N -5.540 -2.454 5.415 1.00 . A A . 9 ARG NE 1 1 1 126 1 1 9 ARG NH1 N -5.984 -0.281 5.911 1.00 . A A . 9 ARG NH1 1 1 1 127 1 1 9 ARG NH2 N -5.247 -1.720 7.512 1.00 . A A . 9 ARG NH2 1 1 1 128 1 1 9 ARG O O -4.290 -3.316 0.535 1.00 . A A . 9 ARG O 1 1 1 129 1 1 10 LYS C C -3.110 -5.380 -1.389 1.00 . A A . 10 LYS C 1 1 1 130 1 1 10 LYS CA C -2.088 -4.377 -0.857 1.00 . A A . 10 LYS CA 1 1 1 131 1 1 10 LYS CB C -0.608 -4.815 -1.123 1.00 . A A . 10 LYS CB 1 1 1 132 1 1 10 LYS CD C -0.864 -7.299 -0.465 1.00 . A A . 10 LYS CD 1 1 1 133 1 1 10 LYS CE C -0.266 -8.432 0.388 1.00 . A A . 10 LYS CE 1 1 1 134 1 1 10 LYS CG C -0.085 -5.997 -0.247 1.00 . A A . 10 LYS CG 1 1 1 135 1 1 10 LYS H H -1.475 -4.426 1.201 1.00 . A A . 10 LYS H 1 1 1 136 1 1 10 LYS HA H -2.279 -3.442 -1.355 1.00 . A A . 10 LYS HA 1 1 1 137 1 1 10 LYS HB2 H -0.494 -5.072 -2.166 1.00 . A A . 10 LYS HB2 1 1 1 138 1 1 10 LYS HB3 H 0.023 -3.965 -0.923 1.00 . A A . 10 LYS HB3 1 1 1 139 1 1 10 LYS HD2 H -1.875 -7.166 -0.131 1.00 . A A . 10 LYS HD2 1 1 1 140 1 1 10 LYS HD3 H -0.858 -7.556 -1.512 1.00 . A A . 10 LYS HD3 1 1 1 141 1 1 10 LYS HE2 H -0.819 -9.346 0.221 1.00 . A A . 10 LYS HE2 1 1 1 142 1 1 10 LYS HE3 H 0.768 -8.601 0.132 1.00 . A A . 10 LYS HE3 1 1 1 143 1 1 10 LYS HG2 H 0.955 -6.165 -0.487 1.00 . A A . 10 LYS HG2 1 1 1 144 1 1 10 LYS HG3 H -0.147 -5.719 0.795 1.00 . A A . 10 LYS HG3 1 1 1 145 1 1 10 LYS HZ1 H -1.298 -7.714 2.048 1.00 . A A . 10 LYS HZ1 1 1 1 146 1 1 10 LYS HZ2 H -0.183 -8.944 2.405 1.00 . A A . 10 LYS HZ2 1 1 1 147 1 1 10 LYS HZ3 H 0.365 -7.372 2.068 1.00 . A A . 10 LYS HZ3 1 1 1 148 1 1 10 LYS N N -2.222 -4.178 0.618 1.00 . A A . 10 LYS N 1 1 1 149 1 1 10 LYS NZ N -0.351 -8.090 1.837 1.00 . A A . 10 LYS NZ 1 1 1 150 1 1 10 LYS O O -3.267 -5.537 -2.584 1.00 . A A . 10 LYS O 1 1 1 151 1 1 11 THR C C -5.832 -6.434 -1.715 1.00 . A A . 11 THR C 1 1 1 152 1 1 11 THR CA C -4.826 -7.031 -0.727 1.00 . A A . 11 THR CA 1 1 1 153 1 1 11 THR CB C -5.496 -7.367 0.610 1.00 . A A . 11 THR CB 1 1 1 154 1 1 11 THR CG2 C -6.491 -8.536 0.481 1.00 . A A . 11 THR CG2 1 1 1 155 1 1 11 THR H H -3.567 -5.809 0.485 1.00 . A A . 11 THR H 1 1 1 156 1 1 11 THR HA H -4.365 -7.903 -1.167 1.00 . A A . 11 THR HA 1 1 1 157 1 1 11 THR HB H -5.913 -6.481 1.080 1.00 . A A . 11 THR HB 1 1 1 158 1 1 11 THR HG1 H -3.965 -8.538 0.905 1.00 . A A . 11 THR HG1 1 1 1 159 1 1 11 THR HG21 H -5.985 -9.426 0.134 1.00 . A A . 11 THR HG21 1 1 1 160 1 1 11 THR HG22 H -6.941 -8.745 1.442 1.00 . A A . 11 THR HG22 1 1 1 161 1 1 11 THR HG23 H -7.273 -8.286 -0.219 1.00 . A A . 11 THR HG23 1 1 1 162 1 1 11 THR N N -3.772 -6.011 -0.451 1.00 . A A . 11 THR N 1 1 1 163 1 1 11 THR O O -6.418 -7.126 -2.526 1.00 . A A . 11 THR O 1 1 1 164 1 1 11 THR OG1 O -4.443 -7.881 1.417 1.00 . A A . 11 THR OG1 1 1 1 165 1 1 12 MET C C -6.274 -2.993 -2.757 1.00 . A A . 12 MET C 1 1 1 166 1 1 12 MET CA C -6.906 -4.357 -2.448 1.00 . A A . 12 MET CA 1 1 1 167 1 1 12 MET CB C -8.244 -4.188 -1.688 1.00 . A A . 12 MET CB 1 1 1 168 1 1 12 MET CE C -9.794 -1.474 0.144 1.00 . A A . 12 MET CE 1 1 1 169 1 1 12 MET CG C -8.006 -3.486 -0.328 1.00 . A A . 12 MET CG 1 1 1 170 1 1 12 MET H H -5.460 -4.670 -0.900 1.00 . A A . 12 MET H 1 1 1 171 1 1 12 MET HA H -7.065 -4.881 -3.379 1.00 . A A . 12 MET HA 1 1 1 172 1 1 12 MET HB2 H -8.932 -3.604 -2.283 1.00 . A A . 12 MET HB2 1 1 1 173 1 1 12 MET HB3 H -8.683 -5.161 -1.517 1.00 . A A . 12 MET HB3 1 1 1 174 1 1 12 MET HE1 H -9.877 -1.455 -0.933 1.00 . A A . 12 MET HE1 1 1 1 175 1 1 12 MET HE2 H -10.739 -1.157 0.561 1.00 . A A . 12 MET HE2 1 1 1 176 1 1 12 MET HE3 H -9.017 -0.806 0.484 1.00 . A A . 12 MET HE3 1 1 1 177 1 1 12 MET HG2 H -7.338 -4.102 0.256 1.00 . A A . 12 MET HG2 1 1 1 178 1 1 12 MET HG3 H -7.504 -2.545 -0.500 1.00 . A A . 12 MET HG3 1 1 1 179 1 1 12 MET N N -5.977 -5.141 -1.586 1.00 . A A . 12 MET N 1 1 1 180 1 1 12 MET O O -6.949 -2.116 -3.263 1.00 . A A . 12 MET O 1 1 1 181 1 1 12 MET SD S -9.455 -3.162 0.706 1.00 . A A . 12 MET SD 1 1 1 182 1 1 13 TYR C C -5.078 -0.450 -2.072 1.00 . A A . 13 TYR C 1 1 1 183 1 1 13 TYR CA C -4.247 -1.588 -2.687 1.00 . A A . 13 TYR CA 1 1 1 184 1 1 13 TYR CB C -4.054 -1.423 -4.213 1.00 . A A . 13 TYR CB 1 1 1 185 1 1 13 TYR CD1 C -1.974 -2.878 -4.335 1.00 . A A . 13 TYR CD1 1 1 1 186 1 1 13 TYR CD2 C -3.888 -3.559 -5.574 1.00 . A A . 13 TYR CD2 1 1 1 187 1 1 13 TYR CE1 C -1.287 -3.985 -4.786 1.00 . A A . 13 TYR CE1 1 1 1 188 1 1 13 TYR CE2 C -3.201 -4.667 -6.024 1.00 . A A . 13 TYR CE2 1 1 1 189 1 1 13 TYR CG C -3.281 -2.653 -4.723 1.00 . A A . 13 TYR CG 1 1 1 190 1 1 13 TYR CZ C -1.896 -4.887 -5.634 1.00 . A A . 13 TYR CZ 1 1 1 191 1 1 13 TYR H H -4.523 -3.628 -2.059 1.00 . A A . 13 TYR H 1 1 1 192 1 1 13 TYR HA H -3.295 -1.641 -2.180 1.00 . A A . 13 TYR HA 1 1 1 193 1 1 13 TYR HB2 H -5.008 -1.368 -4.713 1.00 . A A . 13 TYR HB2 1 1 1 194 1 1 13 TYR HB3 H -3.483 -0.532 -4.431 1.00 . A A . 13 TYR HB3 1 1 1 195 1 1 13 TYR HD1 H -1.482 -2.184 -3.672 1.00 . A A . 13 TYR HD1 1 1 1 196 1 1 13 TYR HD2 H -4.910 -3.402 -5.890 1.00 . A A . 13 TYR HD2 1 1 1 197 1 1 13 TYR HE1 H -0.266 -4.146 -4.473 1.00 . A A . 13 TYR HE1 1 1 1 198 1 1 13 TYR HE2 H -3.688 -5.365 -6.688 1.00 . A A . 13 TYR HE2 1 1 1 199 1 1 13 TYR HH H -1.811 -6.744 -6.060 1.00 . A A . 13 TYR HH 1 1 1 200 1 1 13 TYR N N -5.000 -2.865 -2.450 1.00 . A A . 13 TYR N 1 1 1 201 1 1 13 TYR O O -5.705 0.349 -2.741 1.00 . A A . 13 TYR O 1 1 1 202 1 1 13 TYR OH O -1.210 -5.996 -6.084 1.00 . A A . 13 TYR OH 1 1 1 203 1 1 14 ASP C C -5.058 1.914 0.181 1.00 . A A . 14 ASP C 1 1 1 204 1 1 14 ASP CA C -5.741 0.539 0.089 1.00 . A A . 14 ASP CA 1 1 1 205 1 1 14 ASP CB C -5.863 -0.156 1.454 1.00 . A A . 14 ASP CB 1 1 1 206 1 1 14 ASP CG C -6.427 0.752 2.556 1.00 . A A . 14 ASP CG 1 1 1 207 1 1 14 ASP H H -4.471 -1.137 -0.330 1.00 . A A . 14 ASP H 1 1 1 208 1 1 14 ASP HA H -6.732 0.683 -0.317 1.00 . A A . 14 ASP HA 1 1 1 209 1 1 14 ASP HB2 H -6.518 -1.004 1.357 1.00 . A A . 14 ASP HB2 1 1 1 210 1 1 14 ASP HB3 H -4.899 -0.538 1.744 1.00 . A A . 14 ASP HB3 1 1 1 211 1 1 14 ASP N N -5.020 -0.452 -0.768 1.00 . A A . 14 ASP N 1 1 1 212 1 1 14 ASP O O -5.471 2.759 0.952 1.00 . A A . 14 ASP O 1 1 1 213 1 1 14 ASP OD1 O -7.619 1.010 2.516 1.00 . A A . 14 ASP OD1 1 1 1 214 1 1 14 ASP OD2 O -5.614 1.135 3.380 1.00 . A A . 14 ASP OD2 1 1 1 215 1 1 15 CYS C C -3.629 4.406 -1.708 1.00 . A A . 15 CYS C 1 1 1 216 1 1 15 CYS CA C -3.302 3.413 -0.595 1.00 . A A . 15 CYS CA 1 1 1 217 1 1 15 CYS CB C -1.834 3.112 -0.653 1.00 . A A . 15 CYS CB 1 1 1 218 1 1 15 CYS H H -3.764 1.382 -1.216 1.00 . A A . 15 CYS H 1 1 1 219 1 1 15 CYS HA H -3.499 3.898 0.348 1.00 . A A . 15 CYS HA 1 1 1 220 1 1 15 CYS HB2 H -1.607 2.650 -1.603 1.00 . A A . 15 CYS HB2 1 1 1 221 1 1 15 CYS HB3 H -1.272 4.032 -0.589 1.00 . A A . 15 CYS HB3 1 1 1 222 1 1 15 CYS N N -4.039 2.106 -0.613 1.00 . A A . 15 CYS N 1 1 1 223 1 1 15 CYS O O -4.119 4.045 -2.761 1.00 . A A . 15 CYS O 1 1 1 224 1 1 15 CYS SG S -1.251 2.019 0.654 1.00 . A A . 15 CYS SG 1 1 1 225 1 1 16 CYS C C -2.471 6.614 -3.430 1.00 . A A . 16 CYS C 1 1 1 226 1 1 16 CYS CA C -3.550 6.773 -2.349 1.00 . A A . 16 CYS CA 1 1 1 227 1 1 16 CYS CB C -3.374 8.089 -1.597 1.00 . A A . 16 CYS CB 1 1 1 228 1 1 16 CYS H H -2.938 5.859 -0.533 1.00 . A A . 16 CYS H 1 1 1 229 1 1 16 CYS HA H -4.532 6.692 -2.793 1.00 . A A . 16 CYS HA 1 1 1 230 1 1 16 CYS HB2 H -2.345 8.165 -1.274 1.00 . A A . 16 CYS HB2 1 1 1 231 1 1 16 CYS HB3 H -3.554 8.889 -2.291 1.00 . A A . 16 CYS HB3 1 1 1 232 1 1 16 CYS N N -3.325 5.645 -1.405 1.00 . A A . 16 CYS N 1 1 1 233 1 1 16 CYS O O -2.671 6.959 -4.579 1.00 . A A . 16 CYS O 1 1 1 234 1 1 16 CYS SG S -4.414 8.383 -0.146 1.00 . A A . 16 CYS SG 1 1 1 235 1 1 17 SER C C -0.604 4.836 -4.973 1.00 . A A . 17 SER C 1 1 1 236 1 1 17 SER CA C -0.179 5.834 -3.881 1.00 . A A . 17 SER CA 1 1 1 237 1 1 17 SER CB C 0.962 5.257 -3.025 1.00 . A A . 17 SER CB 1 1 1 238 1 1 17 SER H H -1.284 5.840 -2.045 1.00 . A A . 17 SER H 1 1 1 239 1 1 17 SER HA H 0.119 6.765 -4.343 1.00 . A A . 17 SER HA 1 1 1 240 1 1 17 SER HB2 H 1.261 5.953 -2.255 1.00 . A A . 17 SER HB2 1 1 1 241 1 1 17 SER HB3 H 0.688 4.311 -2.582 1.00 . A A . 17 SER HB3 1 1 1 242 1 1 17 SER HG H 2.167 5.875 -4.424 1.00 . A A . 17 SER HG 1 1 1 243 1 1 17 SER N N -1.353 6.082 -2.991 1.00 . A A . 17 SER N 1 1 1 244 1 1 17 SER O O -0.010 4.782 -6.033 1.00 . A A . 17 SER O 1 1 1 245 1 1 17 SER OG O 2.039 5.061 -3.930 1.00 . A A . 17 SER OG 1 1 1 246 1 1 18 GLY C C -1.448 1.718 -5.545 1.00 . A A . 18 GLY C 1 1 1 247 1 1 18 GLY CA C -2.164 3.063 -5.612 1.00 . A A . 18 GLY CA 1 1 1 248 1 1 18 GLY H H -2.052 4.176 -3.781 1.00 . A A . 18 GLY H 1 1 1 249 1 1 18 GLY HA2 H -3.211 2.910 -5.399 1.00 . A A . 18 GLY HA2 1 1 1 250 1 1 18 GLY HA3 H -2.053 3.447 -6.611 1.00 . A A . 18 GLY HA3 1 1 1 251 1 1 18 GLY N N -1.628 4.077 -4.659 1.00 . A A . 18 GLY N 1 1 1 252 1 1 18 GLY O O -1.849 0.784 -6.213 1.00 . A A . 18 GLY O 1 1 1 253 1 1 19 SER C C 0.873 0.180 -3.185 1.00 . A A . 19 SER C 1 1 1 254 1 1 19 SER CA C 0.355 0.383 -4.613 1.00 . A A . 19 SER CA 1 1 1 255 1 1 19 SER CB C 1.520 0.426 -5.636 1.00 . A A . 19 SER CB 1 1 1 256 1 1 19 SER H H -0.141 2.443 -4.232 1.00 . A A . 19 SER H 1 1 1 257 1 1 19 SER HA H -0.291 -0.450 -4.855 1.00 . A A . 19 SER HA 1 1 1 258 1 1 19 SER HB2 H 2.159 -0.440 -5.543 1.00 . A A . 19 SER HB2 1 1 1 259 1 1 19 SER HB3 H 1.152 0.505 -6.648 1.00 . A A . 19 SER HB3 1 1 1 260 1 1 19 SER HG H 2.919 1.358 -4.655 1.00 . A A . 19 SER HG 1 1 1 261 1 1 19 SER N N -0.414 1.654 -4.747 1.00 . A A . 19 SER N 1 1 1 262 1 1 19 SER O O 1.968 0.589 -2.843 1.00 . A A . 19 SER O 1 1 1 263 1 1 19 SER OG O 2.262 1.595 -5.312 1.00 . A A . 19 SER OG 1 1 1 264 1 1 20 CYS C C 1.499 -1.838 -0.936 1.00 . A A . 20 CYS C 1 1 1 265 1 1 20 CYS CA C 0.453 -0.714 -0.974 1.00 . A A . 20 CYS CA 1 1 1 266 1 1 20 CYS CB C -0.791 -1.107 -0.155 1.00 . A A . 20 CYS CB 1 1 1 267 1 1 20 CYS H H -0.822 -0.754 -2.712 1.00 . A A . 20 CYS H 1 1 1 268 1 1 20 CYS HA H 0.891 0.182 -0.567 1.00 . A A . 20 CYS HA 1 1 1 269 1 1 20 CYS HB2 H -1.464 -0.265 -0.152 1.00 . A A . 20 CYS HB2 1 1 1 270 1 1 20 CYS HB3 H -1.321 -1.902 -0.630 1.00 . A A . 20 CYS HB3 1 1 1 271 1 1 20 CYS N N 0.052 -0.454 -2.385 1.00 . A A . 20 CYS N 1 1 1 272 1 1 20 CYS O O 1.708 -2.550 -1.901 1.00 . A A . 20 CYS O 1 1 1 273 1 1 20 CYS SG S -0.523 -1.587 1.568 1.00 . A A . 20 CYS SG 1 1 1 274 1 1 21 GLY C C 2.666 -4.210 1.162 1.00 . A A . 21 GLY C 1 1 1 275 1 1 21 GLY CA C 3.181 -2.953 0.466 1.00 . A A . 21 GLY CA 1 1 1 276 1 1 21 GLY H H 1.860 -1.324 0.915 1.00 . A A . 21 GLY H 1 1 1 277 1 1 21 GLY HA2 H 3.644 -3.234 -0.469 1.00 . A A . 21 GLY HA2 1 1 1 278 1 1 21 GLY HA3 H 3.933 -2.501 1.096 1.00 . A A . 21 GLY HA3 1 1 1 279 1 1 21 GLY N N 2.119 -1.939 0.206 1.00 . A A . 21 GLY N 1 1 1 280 1 1 21 GLY O O 1.629 -4.207 1.798 1.00 . A A . 21 GLY O 1 1 1 281 1 1 22 ARG C C 3.448 -6.519 3.116 1.00 . A A . 22 ARG C 1 1 1 282 1 1 22 ARG CA C 3.128 -6.577 1.614 1.00 . A A . 22 ARG CA 1 1 1 283 1 1 22 ARG CB C 3.979 -7.668 0.941 1.00 . A A . 22 ARG CB 1 1 1 284 1 1 22 ARG CD C 4.510 -8.829 -1.241 1.00 . A A . 22 ARG CD 1 1 1 285 1 1 22 ARG CG C 3.684 -7.710 -0.579 1.00 . A A . 22 ARG CG 1 1 1 286 1 1 22 ARG CZ C 4.710 -11.257 -0.953 1.00 . A A . 22 ARG CZ 1 1 1 287 1 1 22 ARG H H 4.269 -5.136 0.488 1.00 . A A . 22 ARG H 1 1 1 288 1 1 22 ARG HA H 2.076 -6.784 1.486 1.00 . A A . 22 ARG HA 1 1 1 289 1 1 22 ARG HB2 H 5.028 -7.458 1.100 1.00 . A A . 22 ARG HB2 1 1 1 290 1 1 22 ARG HB3 H 3.750 -8.625 1.387 1.00 . A A . 22 ARG HB3 1 1 1 291 1 1 22 ARG HD2 H 4.318 -8.858 -2.304 1.00 . A A . 22 ARG HD2 1 1 1 292 1 1 22 ARG HD3 H 5.566 -8.670 -1.074 1.00 . A A . 22 ARG HD3 1 1 1 293 1 1 22 ARG HE H 3.374 -10.159 0.013 1.00 . A A . 22 ARG HE 1 1 1 294 1 1 22 ARG HG2 H 2.634 -7.891 -0.749 1.00 . A A . 22 ARG HG2 1 1 1 295 1 1 22 ARG HG3 H 3.948 -6.765 -1.030 1.00 . A A . 22 ARG HG3 1 1 1 296 1 1 22 ARG HH11 H 5.993 -10.413 -2.243 1.00 . A A . 22 ARG HH11 1 1 1 297 1 1 22 ARG HH12 H 6.144 -12.127 -2.046 1.00 . A A . 22 ARG HH12 1 1 1 298 1 1 22 ARG HH21 H 3.546 -12.326 0.276 1.00 . A A . 22 ARG HH21 1 1 1 299 1 1 22 ARG HH22 H 4.739 -13.227 -0.600 1.00 . A A . 22 ARG HH22 1 1 1 300 1 1 22 ARG N N 3.448 -5.247 1.010 1.00 . A A . 22 ARG N 1 1 1 301 1 1 22 ARG NE N 4.108 -10.138 -0.637 1.00 . A A . 22 ARG NE 1 1 1 302 1 1 22 ARG NH1 N 5.693 -11.265 -1.815 1.00 . A A . 22 ARG NH1 1 1 1 303 1 1 22 ARG NH2 N 4.300 -12.356 -0.382 1.00 . A A . 22 ARG NH2 1 1 1 304 1 1 22 ARG O O 3.062 -7.385 3.879 1.00 . A A . 22 ARG O 1 1 1 305 1 1 23 ARG C C 3.357 -4.645 5.622 1.00 . A A . 23 ARG C 1 1 1 306 1 1 23 ARG CA C 4.569 -5.228 4.889 1.00 . A A . 23 ARG CA 1 1 1 307 1 1 23 ARG CB C 5.702 -4.205 4.922 1.00 . A A . 23 ARG CB 1 1 1 308 1 1 23 ARG CD C 7.969 -3.587 4.066 1.00 . A A . 23 ARG CD 1 1 1 309 1 1 23 ARG CG C 6.891 -4.682 4.071 1.00 . A A . 23 ARG CG 1 1 1 310 1 1 23 ARG CZ C 9.318 -2.428 5.751 1.00 . A A . 23 ARG CZ 1 1 1 311 1 1 23 ARG H H 4.423 -4.826 2.793 1.00 . A A . 23 ARG H 1 1 1 312 1 1 23 ARG HA H 4.861 -6.160 5.353 1.00 . A A . 23 ARG HA 1 1 1 313 1 1 23 ARG HB2 H 5.342 -3.260 4.540 1.00 . A A . 23 ARG HB2 1 1 1 314 1 1 23 ARG HB3 H 6.019 -4.062 5.945 1.00 . A A . 23 ARG HB3 1 1 1 315 1 1 23 ARG HD2 H 8.793 -3.883 3.441 1.00 . A A . 23 ARG HD2 1 1 1 316 1 1 23 ARG HD3 H 7.557 -2.661 3.691 1.00 . A A . 23 ARG HD3 1 1 1 317 1 1 23 ARG HE H 8.123 -3.949 6.184 1.00 . A A . 23 ARG HE 1 1 1 318 1 1 23 ARG HG2 H 7.298 -5.594 4.483 1.00 . A A . 23 ARG HG2 1 1 1 319 1 1 23 ARG HG3 H 6.574 -4.872 3.055 1.00 . A A . 23 ARG HG3 1 1 1 320 1 1 23 ARG HH11 H 9.477 -1.756 3.867 1.00 . A A . 23 ARG HH11 1 1 1 321 1 1 23 ARG HH12 H 10.437 -0.925 5.044 1.00 . A A . 23 ARG HH12 1 1 1 322 1 1 23 ARG HH21 H 9.329 -2.912 7.692 1.00 . A A . 23 ARG HH21 1 1 1 323 1 1 23 ARG HH22 H 10.353 -1.589 7.244 1.00 . A A . 23 ARG HH22 1 1 1 324 1 1 23 ARG N N 4.153 -5.476 3.475 1.00 . A A . 23 ARG N 1 1 1 325 1 1 23 ARG NE N 8.455 -3.372 5.465 1.00 . A A . 23 ARG NE 1 1 1 326 1 1 23 ARG NH1 N 9.779 -1.643 4.814 1.00 . A A . 23 ARG NH1 1 1 1 327 1 1 23 ARG NH2 N 9.696 -2.299 6.993 1.00 . A A . 23 ARG NH2 1 1 1 328 1 1 23 ARG O O 3.242 -4.749 6.829 1.00 . A A . 23 ARG O 1 1 1 329 1 1 24 GLY C C 1.383 -1.890 5.300 1.00 . A A . 24 GLY C 1 1 1 330 1 1 24 GLY CA C 1.259 -3.415 5.367 1.00 . A A . 24 GLY CA 1 1 1 331 1 1 24 GLY H H 2.665 -4.009 3.871 1.00 . A A . 24 GLY H 1 1 1 332 1 1 24 GLY HA2 H 0.421 -3.726 4.759 1.00 . A A . 24 GLY HA2 1 1 1 333 1 1 24 GLY HA3 H 1.090 -3.716 6.390 1.00 . A A . 24 GLY HA3 1 1 1 334 1 1 24 GLY N N 2.495 -4.046 4.837 1.00 . A A . 24 GLY N 1 1 1 335 1 1 24 GLY O O 0.517 -1.208 5.809 1.00 . A A . 24 GLY O 1 1 1 336 1 1 25 LYS C C 2.492 0.478 3.118 1.00 . A A . 25 LYS C 1 1 1 337 1 1 25 LYS CA C 2.611 0.095 4.588 1.00 . A A . 25 LYS CA 1 1 1 338 1 1 25 LYS CB C 3.990 0.539 5.080 1.00 . A A . 25 LYS CB 1 1 1 339 1 1 25 LYS CD C 3.222 0.678 7.507 1.00 . A A . 25 LYS CD 1 1 1 340 1 1 25 LYS CE C 3.505 0.208 8.944 1.00 . A A . 25 LYS CE 1 1 1 341 1 1 25 LYS CG C 4.260 0.063 6.530 1.00 . A A . 25 LYS CG 1 1 1 342 1 1 25 LYS H H 3.113 -1.996 4.290 1.00 . A A . 25 LYS H 1 1 1 343 1 1 25 LYS HA H 1.834 0.601 5.139 1.00 . A A . 25 LYS HA 1 1 1 344 1 1 25 LYS HB2 H 4.731 0.201 4.380 1.00 . A A . 25 LYS HB2 1 1 1 345 1 1 25 LYS HB3 H 4.017 1.619 5.077 1.00 . A A . 25 LYS HB3 1 1 1 346 1 1 25 LYS HD2 H 3.278 1.755 7.470 1.00 . A A . 25 LYS HD2 1 1 1 347 1 1 25 LYS HD3 H 2.222 0.379 7.233 1.00 . A A . 25 LYS HD3 1 1 1 348 1 1 25 LYS HE2 H 2.772 0.624 9.618 1.00 . A A . 25 LYS HE2 1 1 1 349 1 1 25 LYS HE3 H 3.462 -0.870 9.004 1.00 . A A . 25 LYS HE3 1 1 1 350 1 1 25 LYS HG2 H 4.213 -1.015 6.576 1.00 . A A . 25 LYS HG2 1 1 1 351 1 1 25 LYS HG3 H 5.255 0.372 6.818 1.00 . A A . 25 LYS HG3 1 1 1 352 1 1 25 LYS HZ1 H 5.044 1.607 8.996 1.00 . A A . 25 LYS HZ1 1 1 1 353 1 1 25 LYS HZ2 H 4.899 0.685 10.415 1.00 . A A . 25 LYS HZ2 1 1 1 354 1 1 25 LYS HZ3 H 5.575 -0.004 9.017 1.00 . A A . 25 LYS HZ3 1 1 1 355 1 1 25 LYS N N 2.438 -1.395 4.687 1.00 . A A . 25 LYS N 1 1 1 356 1 1 25 LYS NZ N 4.858 0.658 9.376 1.00 . A A . 25 LYS NZ 1 1 1 357 1 1 25 LYS O O 2.773 -0.316 2.245 1.00 . A A . 25 LYS O 1 1 1 358 1 1 26 CYS C C 3.163 2.517 0.689 1.00 . A A . 26 CYS C 1 1 1 359 1 1 26 CYS CA C 1.909 2.217 1.510 1.00 . A A . 26 CYS CA 1 1 1 360 1 1 26 CYS CB C 1.053 3.472 1.594 1.00 . A A . 26 CYS CB 1 1 1 361 1 1 26 CYS H H 1.914 2.261 3.682 1.00 . A A . 26 CYS H 1 1 1 362 1 1 26 CYS HA H 1.340 1.481 0.964 1.00 . A A . 26 CYS HA 1 1 1 363 1 1 26 CYS HB2 H 1.512 4.151 2.287 1.00 . A A . 26 CYS HB2 1 1 1 364 1 1 26 CYS HB3 H 1.010 3.947 0.629 1.00 . A A . 26 CYS HB3 1 1 1 365 1 1 26 CYS N N 2.088 1.696 2.902 1.00 . A A . 26 CYS N 1 1 1 366 1 1 26 CYS O O 4.254 2.665 1.204 1.00 . A A . 26 CYS O 1 1 1 367 1 1 26 CYS SG S -0.648 3.234 2.146 1.00 . A A . 26 CYS SG 1 1 1 368 1 1 27 NH2 HN1 H 2.133 2.488 -1.019 1.00 . A A . 27 NH2 HN1 1 1 1 369 1 1 27 NH2 HN2 H 3.787 2.797 -1.188 1.00 . A A . 27 NH2 HN2 1 1 1 370 1 1 27 NH2 N N 3.019 2.609 -0.611 1.00 . A A . 27 NH2 N 1 1 2 371 1 1 1 CYS C C -5.921 6.692 1.556 1.00 . A A . 1 CYS C 1 1 2 372 1 1 1 CYS CA C -7.020 6.305 0.557 1.00 . A A . 1 CYS CA 1 1 2 373 1 1 1 CYS CB C -6.528 6.610 -0.859 1.00 . A A . 1 CYS CB 1 1 2 374 1 1 1 CYS H1 H -8.036 8.099 0.825 1.00 . A A . 1 CYS H1 1 1 2 375 1 1 1 CYS H2 H -8.982 6.863 0.144 1.00 . A A . 1 CYS H2 1 1 2 376 1 1 1 CYS H3 H -8.602 6.829 1.800 1.00 . A A . 1 CYS H3 1 1 2 377 1 1 1 CYS HA H -7.239 5.250 0.660 1.00 . A A . 1 CYS HA 1 1 2 378 1 1 1 CYS HB2 H -5.667 5.991 -1.055 1.00 . A A . 1 CYS HB2 1 1 2 379 1 1 1 CYS HB3 H -7.298 6.319 -1.559 1.00 . A A . 1 CYS HB3 1 1 2 380 1 1 1 CYS N N -8.254 7.083 0.854 1.00 . A A . 1 CYS N 1 1 2 381 1 1 1 CYS O O -5.787 7.841 1.930 1.00 . A A . 1 CYS O 1 1 2 382 1 1 1 CYS SG S -6.078 8.327 -1.215 1.00 . A A . 1 CYS SG 1 1 2 383 1 1 2 LYS C C -2.798 6.413 2.227 1.00 . A A . 2 LYS C 1 1 2 384 1 1 2 LYS CA C -4.045 5.874 2.920 1.00 . A A . 2 LYS CA 1 1 2 385 1 1 2 LYS CB C -3.750 4.513 3.571 1.00 . A A . 2 LYS CB 1 1 2 386 1 1 2 LYS CD C -6.258 4.149 4.338 1.00 . A A . 2 LYS CD 1 1 2 387 1 1 2 LYS CE C -6.851 5.570 4.495 1.00 . A A . 2 LYS CE 1 1 2 388 1 1 2 LYS CG C -4.747 4.066 4.682 1.00 . A A . 2 LYS CG 1 1 2 389 1 1 2 LYS H H -5.351 4.808 1.593 1.00 . A A . 2 LYS H 1 1 2 390 1 1 2 LYS HA H -4.341 6.579 3.685 1.00 . A A . 2 LYS HA 1 1 2 391 1 1 2 LYS HB2 H -3.739 3.757 2.801 1.00 . A A . 2 LYS HB2 1 1 2 392 1 1 2 LYS HB3 H -2.765 4.535 4.007 1.00 . A A . 2 LYS HB3 1 1 2 393 1 1 2 LYS HD2 H -6.430 3.801 3.331 1.00 . A A . 2 LYS HD2 1 1 2 394 1 1 2 LYS HD3 H -6.776 3.500 5.018 1.00 . A A . 2 LYS HD3 1 1 2 395 1 1 2 LYS HE2 H -6.366 6.307 3.890 1.00 . A A . 2 LYS HE2 1 1 2 396 1 1 2 LYS HE3 H -7.899 5.552 4.235 1.00 . A A . 2 LYS HE3 1 1 2 397 1 1 2 LYS HG2 H -4.522 3.040 4.933 1.00 . A A . 2 LYS HG2 1 1 2 398 1 1 2 LYS HG3 H -4.557 4.661 5.563 1.00 . A A . 2 LYS HG3 1 1 2 399 1 1 2 LYS HZ1 H -6.950 5.212 6.543 1.00 . A A . 2 LYS HZ1 1 1 2 400 1 1 2 LYS HZ2 H -5.763 6.340 6.094 1.00 . A A . 2 LYS HZ2 1 1 2 401 1 1 2 LYS HZ3 H -7.402 6.786 6.091 1.00 . A A . 2 LYS HZ3 1 1 2 402 1 1 2 LYS N N -5.170 5.697 1.950 1.00 . A A . 2 LYS N 1 1 2 403 1 1 2 LYS NZ N -6.732 6.011 5.914 1.00 . A A . 2 LYS NZ 1 1 2 404 1 1 2 LYS O O -2.362 5.897 1.217 1.00 . A A . 2 LYS O 1 1 2 405 1 1 3 GLY C C 0.160 7.131 2.256 1.00 . A A . 3 GLY C 1 1 2 406 1 1 3 GLY CA C -1.032 8.101 2.260 1.00 . A A . 3 GLY CA 1 1 2 407 1 1 3 GLY H H -2.690 7.785 3.632 1.00 . A A . 3 GLY H 1 1 2 408 1 1 3 GLY HA2 H -1.229 8.419 1.247 1.00 . A A . 3 GLY HA2 1 1 2 409 1 1 3 GLY HA3 H -0.788 8.965 2.858 1.00 . A A . 3 GLY HA3 1 1 2 410 1 1 3 GLY N N -2.263 7.449 2.816 1.00 . A A . 3 GLY N 1 1 2 411 1 1 3 GLY O O 0.085 6.065 2.835 1.00 . A A . 3 GLY O 1 1 2 412 1 1 4 LYS C C 2.976 6.316 2.943 1.00 . A A . 4 LYS C 1 1 2 413 1 1 4 LYS CA C 2.448 6.659 1.534 1.00 . A A . 4 LYS CA 1 1 2 414 1 1 4 LYS CB C 3.524 7.410 0.718 1.00 . A A . 4 LYS CB 1 1 2 415 1 1 4 LYS CD C 5.889 7.163 -0.335 1.00 . A A . 4 LYS CD 1 1 2 416 1 1 4 LYS CE C 6.458 8.492 0.222 1.00 . A A . 4 LYS CE 1 1 2 417 1 1 4 LYS CG C 4.788 6.520 0.563 1.00 . A A . 4 LYS CG 1 1 2 418 1 1 4 LYS H H 1.226 8.399 1.162 1.00 . A A . 4 LYS H 1 1 2 419 1 1 4 LYS HA H 2.187 5.745 1.021 1.00 . A A . 4 LYS HA 1 1 2 420 1 1 4 LYS HB2 H 3.132 7.670 -0.254 1.00 . A A . 4 LYS HB2 1 1 2 421 1 1 4 LYS HB3 H 3.763 8.315 1.253 1.00 . A A . 4 LYS HB3 1 1 2 422 1 1 4 LYS HD2 H 6.701 6.458 -0.441 1.00 . A A . 4 LYS HD2 1 1 2 423 1 1 4 LYS HD3 H 5.479 7.345 -1.319 1.00 . A A . 4 LYS HD3 1 1 2 424 1 1 4 LYS HE2 H 6.821 8.343 1.227 1.00 . A A . 4 LYS HE2 1 1 2 425 1 1 4 LYS HE3 H 7.280 8.821 -0.396 1.00 . A A . 4 LYS HE3 1 1 2 426 1 1 4 LYS HG2 H 5.216 6.328 1.537 1.00 . A A . 4 LYS HG2 1 1 2 427 1 1 4 LYS HG3 H 4.502 5.571 0.132 1.00 . A A . 4 LYS HG3 1 1 2 428 1 1 4 LYS HZ1 H 4.631 9.302 -0.364 1.00 . A A . 4 LYS HZ1 1 1 2 429 1 1 4 LYS HZ2 H 5.089 9.701 1.222 1.00 . A A . 4 LYS HZ2 1 1 2 430 1 1 4 LYS HZ3 H 5.845 10.456 -0.096 1.00 . A A . 4 LYS HZ3 1 1 2 431 1 1 4 LYS N N 1.227 7.526 1.606 1.00 . A A . 4 LYS N 1 1 2 432 1 1 4 LYS NZ N 5.428 9.568 0.248 1.00 . A A . 4 LYS NZ 1 1 2 433 1 1 4 LYS O O 3.018 7.158 3.817 1.00 . A A . 4 LYS O 1 1 2 434 1 1 5 GLY C C 2.819 4.385 5.479 1.00 . A A . 5 GLY C 1 1 2 435 1 1 5 GLY CA C 3.897 4.568 4.401 1.00 . A A . 5 GLY CA 1 1 2 436 1 1 5 GLY H H 3.289 4.457 2.342 1.00 . A A . 5 GLY H 1 1 2 437 1 1 5 GLY HA2 H 4.372 3.615 4.223 1.00 . A A . 5 GLY HA2 1 1 2 438 1 1 5 GLY HA3 H 4.638 5.256 4.774 1.00 . A A . 5 GLY HA3 1 1 2 439 1 1 5 GLY N N 3.358 5.073 3.100 1.00 . A A . 5 GLY N 1 1 2 440 1 1 5 GLY O O 3.152 4.135 6.622 1.00 . A A . 5 GLY O 1 1 2 441 1 1 6 ALA C C -0.106 2.906 6.038 1.00 . A A . 6 ALA C 1 1 2 442 1 1 6 ALA CA C 0.445 4.351 6.080 1.00 . A A . 6 ALA CA 1 1 2 443 1 1 6 ALA CB C -0.654 5.351 5.719 1.00 . A A . 6 ALA CB 1 1 2 444 1 1 6 ALA H H 1.366 4.719 4.165 1.00 . A A . 6 ALA H 1 1 2 445 1 1 6 ALA HA H 0.814 4.570 7.070 1.00 . A A . 6 ALA HA 1 1 2 446 1 1 6 ALA HB1 H -1.004 5.160 4.719 1.00 . A A . 6 ALA HB1 1 1 2 447 1 1 6 ALA HB2 H -1.487 5.265 6.401 1.00 . A A . 6 ALA HB2 1 1 2 448 1 1 6 ALA HB3 H -0.269 6.359 5.766 1.00 . A A . 6 ALA HB3 1 1 2 449 1 1 6 ALA N N 1.569 4.513 5.101 1.00 . A A . 6 ALA N 1 1 2 450 1 1 6 ALA O O -0.052 2.279 4.997 1.00 . A A . 6 ALA O 1 1 2 451 1 1 7 PRO C C -2.204 0.621 6.277 1.00 . A A . 7 PRO C 1 1 2 452 1 1 7 PRO CA C -1.084 0.997 7.270 1.00 . A A . 7 PRO CA 1 1 2 453 1 1 7 PRO CB C -1.527 0.830 8.733 1.00 . A A . 7 PRO CB 1 1 2 454 1 1 7 PRO CD C -0.807 3.185 8.416 1.00 . A A . 7 PRO CD 1 1 2 455 1 1 7 PRO CG C -1.509 2.220 9.381 1.00 . A A . 7 PRO CG 1 1 2 456 1 1 7 PRO HA H -0.242 0.350 7.090 1.00 . A A . 7 PRO HA 1 1 2 457 1 1 7 PRO HB2 H -2.518 0.406 8.800 1.00 . A A . 7 PRO HB2 1 1 2 458 1 1 7 PRO HB3 H -0.839 0.177 9.248 1.00 . A A . 7 PRO HB3 1 1 2 459 1 1 7 PRO HD2 H -1.417 4.056 8.228 1.00 . A A . 7 PRO HD2 1 1 2 460 1 1 7 PRO HD3 H 0.157 3.480 8.806 1.00 . A A . 7 PRO HD3 1 1 2 461 1 1 7 PRO HG2 H -2.519 2.554 9.567 1.00 . A A . 7 PRO HG2 1 1 2 462 1 1 7 PRO HG3 H -0.976 2.183 10.321 1.00 . A A . 7 PRO HG3 1 1 2 463 1 1 7 PRO N N -0.621 2.413 7.148 1.00 . A A . 7 PRO N 1 1 2 464 1 1 7 PRO O O -3.370 0.858 6.521 1.00 . A A . 7 PRO O 1 1 2 465 1 1 8 CYS C C -2.730 -1.923 3.923 1.00 . A A . 8 CYS C 1 1 2 466 1 1 8 CYS CA C -2.710 -0.400 4.088 1.00 . A A . 8 CYS CA 1 1 2 467 1 1 8 CYS CB C -2.256 0.210 2.792 1.00 . A A . 8 CYS CB 1 1 2 468 1 1 8 CYS H H -0.817 -0.089 5.049 1.00 . A A . 8 CYS H 1 1 2 469 1 1 8 CYS HA H -3.709 -0.063 4.299 1.00 . A A . 8 CYS HA 1 1 2 470 1 1 8 CYS HB2 H -2.837 -0.201 1.980 1.00 . A A . 8 CYS HB2 1 1 2 471 1 1 8 CYS HB3 H -2.427 1.267 2.771 1.00 . A A . 8 CYS HB3 1 1 2 472 1 1 8 CYS N N -1.781 0.048 5.177 1.00 . A A . 8 CYS N 1 1 2 473 1 1 8 CYS O O -2.086 -2.659 4.646 1.00 . A A . 8 CYS O 1 1 2 474 1 1 8 CYS SG S -0.520 -0.126 2.424 1.00 . A A . 8 CYS SG 1 1 2 475 1 1 9 ARG C C -3.674 -3.841 1.031 1.00 . A A . 9 ARG C 1 1 2 476 1 1 9 ARG CA C -3.686 -3.736 2.566 1.00 . A A . 9 ARG CA 1 1 2 477 1 1 9 ARG CB C -5.038 -4.312 3.133 1.00 . A A . 9 ARG CB 1 1 2 478 1 1 9 ARG CD C -6.395 -2.218 3.718 1.00 . A A . 9 ARG CD 1 1 2 479 1 1 9 ARG CG C -6.319 -3.479 2.831 1.00 . A A . 9 ARG CG 1 1 2 480 1 1 9 ARG CZ C -6.046 -1.905 6.134 1.00 . A A . 9 ARG CZ 1 1 2 481 1 1 9 ARG H H -3.983 -1.636 2.424 1.00 . A A . 9 ARG H 1 1 2 482 1 1 9 ARG HA H -2.862 -4.315 2.962 1.00 . A A . 9 ARG HA 1 1 2 483 1 1 9 ARG HB2 H -5.179 -5.305 2.731 1.00 . A A . 9 ARG HB2 1 1 2 484 1 1 9 ARG HB3 H -4.933 -4.416 4.203 1.00 . A A . 9 ARG HB3 1 1 2 485 1 1 9 ARG HD2 H -5.551 -1.568 3.572 1.00 . A A . 9 ARG HD2 1 1 2 486 1 1 9 ARG HD3 H -7.302 -1.671 3.504 1.00 . A A . 9 ARG HD3 1 1 2 487 1 1 9 ARG HE H -6.776 -3.566 5.347 1.00 . A A . 9 ARG HE 1 1 2 488 1 1 9 ARG HG2 H -6.327 -3.176 1.797 1.00 . A A . 9 ARG HG2 1 1 2 489 1 1 9 ARG HG3 H -7.193 -4.090 3.008 1.00 . A A . 9 ARG HG3 1 1 2 490 1 1 9 ARG HH11 H -5.538 -0.348 4.979 1.00 . A A . 9 ARG HH11 1 1 2 491 1 1 9 ARG HH12 H -5.296 -0.132 6.678 1.00 . A A . 9 ARG HH12 1 1 2 492 1 1 9 ARG HH21 H -6.476 -3.309 7.492 1.00 . A A . 9 ARG HH21 1 1 2 493 1 1 9 ARG HH22 H -5.831 -1.829 8.121 1.00 . A A . 9 ARG HH22 1 1 2 494 1 1 9 ARG N N -3.502 -2.314 2.940 1.00 . A A . 9 ARG N 1 1 2 495 1 1 9 ARG NE N -6.440 -2.669 5.145 1.00 . A A . 9 ARG NE 1 1 2 496 1 1 9 ARG NH1 N -5.592 -0.702 5.911 1.00 . A A . 9 ARG NH1 1 1 2 497 1 1 9 ARG NH2 N -6.123 -2.385 7.344 1.00 . A A . 9 ARG NH2 1 1 2 498 1 1 9 ARG O O -4.460 -3.233 0.319 1.00 . A A . 9 ARG O 1 1 2 499 1 1 10 LYS C C -3.776 -5.511 -1.396 1.00 . A A . 10 LYS C 1 1 2 500 1 1 10 LYS CA C -2.473 -4.947 -0.843 1.00 . A A . 10 LYS CA 1 1 2 501 1 1 10 LYS CB C -1.386 -6.034 -1.025 1.00 . A A . 10 LYS CB 1 1 2 502 1 1 10 LYS CD C -0.060 -5.507 1.141 1.00 . A A . 10 LYS CD 1 1 2 503 1 1 10 LYS CE C -0.654 -6.733 1.861 1.00 . A A . 10 LYS CE 1 1 2 504 1 1 10 LYS CG C -0.010 -5.693 -0.396 1.00 . A A . 10 LYS CG 1 1 2 505 1 1 10 LYS H H -2.175 -5.063 1.291 1.00 . A A . 10 LYS H 1 1 2 506 1 1 10 LYS HA H -2.221 -4.036 -1.366 1.00 . A A . 10 LYS HA 1 1 2 507 1 1 10 LYS HB2 H -1.740 -6.972 -0.622 1.00 . A A . 10 LYS HB2 1 1 2 508 1 1 10 LYS HB3 H -1.233 -6.179 -2.085 1.00 . A A . 10 LYS HB3 1 1 2 509 1 1 10 LYS HD2 H 0.951 -5.445 1.480 1.00 . A A . 10 LYS HD2 1 1 2 510 1 1 10 LYS HD3 H -0.540 -4.584 1.425 1.00 . A A . 10 LYS HD3 1 1 2 511 1 1 10 LYS HE2 H -1.668 -6.922 1.541 1.00 . A A . 10 LYS HE2 1 1 2 512 1 1 10 LYS HE3 H -0.055 -7.611 1.668 1.00 . A A . 10 LYS HE3 1 1 2 513 1 1 10 LYS HG2 H 0.688 -6.481 -0.632 1.00 . A A . 10 LYS HG2 1 1 2 514 1 1 10 LYS HG3 H 0.354 -4.782 -0.843 1.00 . A A . 10 LYS HG3 1 1 2 515 1 1 10 LYS HZ1 H -1.153 -5.579 3.519 1.00 . A A . 10 LYS HZ1 1 1 2 516 1 1 10 LYS HZ2 H -1.175 -7.252 3.809 1.00 . A A . 10 LYS HZ2 1 1 2 517 1 1 10 LYS HZ3 H 0.307 -6.432 3.681 1.00 . A A . 10 LYS HZ3 1 1 2 518 1 1 10 LYS N N -2.729 -4.645 0.607 1.00 . A A . 10 LYS N 1 1 2 519 1 1 10 LYS NZ N -0.670 -6.480 3.329 1.00 . A A . 10 LYS NZ 1 1 2 520 1 1 10 LYS O O -4.139 -5.290 -2.536 1.00 . A A . 10 LYS O 1 1 2 521 1 1 11 THR C C -6.608 -6.156 -1.686 1.00 . A A . 11 THR C 1 1 2 522 1 1 11 THR CA C -5.708 -6.927 -0.713 1.00 . A A . 11 THR CA 1 1 2 523 1 1 11 THR CB C -6.404 -7.059 0.651 1.00 . A A . 11 THR CB 1 1 2 524 1 1 11 THR CG2 C -7.663 -7.946 0.571 1.00 . A A . 11 THR CG2 1 1 2 525 1 1 11 THR H H -3.952 -6.322 0.376 1.00 . A A . 11 THR H 1 1 2 526 1 1 11 THR HA H -5.511 -7.906 -1.127 1.00 . A A . 11 THR HA 1 1 2 527 1 1 11 THR HB H -6.591 -6.097 1.112 1.00 . A A . 11 THR HB 1 1 2 528 1 1 11 THR HG1 H -4.727 -7.261 1.611 1.00 . A A . 11 THR HG1 1 1 2 529 1 1 11 THR HG21 H -7.405 -8.940 0.235 1.00 . A A . 11 THR HG21 1 1 2 530 1 1 11 THR HG22 H -8.125 -8.016 1.546 1.00 . A A . 11 THR HG22 1 1 2 531 1 1 11 THR HG23 H -8.377 -7.521 -0.119 1.00 . A A . 11 THR HG23 1 1 2 532 1 1 11 THR N N -4.397 -6.235 -0.496 1.00 . A A . 11 THR N 1 1 2 533 1 1 11 THR O O -7.244 -6.736 -2.544 1.00 . A A . 11 THR O 1 1 2 534 1 1 11 THR OG1 O -5.497 -7.810 1.446 1.00 . A A . 11 THR OG1 1 1 2 535 1 1 12 MET C C -6.680 -2.671 -2.673 1.00 . A A . 12 MET C 1 1 2 536 1 1 12 MET CA C -7.443 -3.962 -2.362 1.00 . A A . 12 MET CA 1 1 2 537 1 1 12 MET CB C -8.764 -3.640 -1.619 1.00 . A A . 12 MET CB 1 1 2 538 1 1 12 MET CE C -9.978 -0.736 0.204 1.00 . A A . 12 MET CE 1 1 2 539 1 1 12 MET CG C -8.469 -2.969 -0.256 1.00 . A A . 12 MET CG 1 1 2 540 1 1 12 MET H H -6.073 -4.472 -0.781 1.00 . A A . 12 MET H 1 1 2 541 1 1 12 MET HA H -7.658 -4.458 -3.296 1.00 . A A . 12 MET HA 1 1 2 542 1 1 12 MET HB2 H -9.374 -2.984 -2.221 1.00 . A A . 12 MET HB2 1 1 2 543 1 1 12 MET HB3 H -9.313 -4.555 -1.452 1.00 . A A . 12 MET HB3 1 1 2 544 1 1 12 MET HE1 H -10.049 -0.696 -0.874 1.00 . A A . 12 MET HE1 1 1 2 545 1 1 12 MET HE2 H -10.870 -0.290 0.618 1.00 . A A . 12 MET HE2 1 1 2 546 1 1 12 MET HE3 H -9.117 -0.188 0.556 1.00 . A A . 12 MET HE3 1 1 2 547 1 1 12 MET HG2 H -7.901 -3.668 0.338 1.00 . A A . 12 MET HG2 1 1 2 548 1 1 12 MET HG3 H -7.846 -2.101 -0.415 1.00 . A A . 12 MET HG3 1 1 2 549 1 1 12 MET N N -6.617 -4.861 -1.498 1.00 . A A . 12 MET N 1 1 2 550 1 1 12 MET O O -7.244 -1.765 -3.258 1.00 . A A . 12 MET O 1 1 2 551 1 1 12 MET SD S -9.885 -2.459 0.752 1.00 . A A . 12 MET SD 1 1 2 552 1 1 13 TYR C C -5.317 -0.237 -1.932 1.00 . A A . 13 TYR C 1 1 2 553 1 1 13 TYR CA C -4.557 -1.431 -2.510 1.00 . A A . 13 TYR CA 1 1 2 554 1 1 13 TYR CB C -4.303 -1.295 -4.029 1.00 . A A . 13 TYR CB 1 1 2 555 1 1 13 TYR CD1 C -2.236 -2.757 -4.150 1.00 . A A . 13 TYR CD1 1 1 2 556 1 1 13 TYR CD2 C -4.220 -3.545 -5.203 1.00 . A A . 13 TYR CD2 1 1 2 557 1 1 13 TYR CE1 C -1.573 -3.901 -4.540 1.00 . A A . 13 TYR CE1 1 1 2 558 1 1 13 TYR CE2 C -3.557 -4.689 -5.593 1.00 . A A . 13 TYR CE2 1 1 2 559 1 1 13 TYR CG C -3.566 -2.568 -4.477 1.00 . A A . 13 TYR CG 1 1 2 560 1 1 13 TYR CZ C -2.230 -4.874 -5.265 1.00 . A A . 13 TYR CZ 1 1 2 561 1 1 13 TYR H H -5.043 -3.408 -1.825 1.00 . A A . 13 TYR H 1 1 2 562 1 1 13 TYR HA H -3.630 -1.558 -1.971 1.00 . A A . 13 TYR HA 1 1 2 563 1 1 13 TYR HB2 H -5.232 -1.212 -4.570 1.00 . A A . 13 TYR HB2 1 1 2 564 1 1 13 TYR HB3 H -3.688 -0.433 -4.238 1.00 . A A . 13 TYR HB3 1 1 2 565 1 1 13 TYR HD1 H -1.709 -2.005 -3.583 1.00 . A A . 13 TYR HD1 1 1 2 566 1 1 13 TYR HD2 H -5.260 -3.415 -5.468 1.00 . A A . 13 TYR HD2 1 1 2 567 1 1 13 TYR HE1 H -0.535 -4.035 -4.277 1.00 . A A . 13 TYR HE1 1 1 2 568 1 1 13 TYR HE2 H -4.080 -5.444 -6.160 1.00 . A A . 13 TYR HE2 1 1 2 569 1 1 13 TYR HH H -2.145 -6.769 -5.483 1.00 . A A . 13 TYR HH 1 1 2 570 1 1 13 TYR N N -5.425 -2.631 -2.280 1.00 . A A . 13 TYR N 1 1 2 571 1 1 13 TYR O O -5.864 0.603 -2.620 1.00 . A A . 13 TYR O 1 1 2 572 1 1 13 TYR OH O -1.568 -6.020 -5.654 1.00 . A A . 13 TYR OH 1 1 2 573 1 1 14 ASP C C -5.156 2.089 0.296 1.00 . A A . 14 ASP C 1 1 2 574 1 1 14 ASP CA C -5.967 0.791 0.205 1.00 . A A . 14 ASP CA 1 1 2 575 1 1 14 ASP CB C -6.185 0.124 1.573 1.00 . A A . 14 ASP CB 1 1 2 576 1 1 14 ASP CG C -6.798 1.064 2.624 1.00 . A A . 14 ASP CG 1 1 2 577 1 1 14 ASP H H -4.810 -0.972 -0.181 1.00 . A A . 14 ASP H 1 1 2 578 1 1 14 ASP HA H -6.926 1.020 -0.238 1.00 . A A . 14 ASP HA 1 1 2 579 1 1 14 ASP HB2 H -6.857 -0.706 1.440 1.00 . A A . 14 ASP HB2 1 1 2 580 1 1 14 ASP HB3 H -5.246 -0.270 1.932 1.00 . A A . 14 ASP HB3 1 1 2 581 1 1 14 ASP N N -5.295 -0.250 -0.628 1.00 . A A . 14 ASP N 1 1 2 582 1 1 14 ASP O O -5.417 2.925 1.138 1.00 . A A . 14 ASP O 1 1 2 583 1 1 14 ASP OD1 O -7.865 1.590 2.349 1.00 . A A . 14 ASP OD1 1 1 2 584 1 1 14 ASP OD2 O -6.153 1.198 3.651 1.00 . A A . 14 ASP OD2 1 1 2 585 1 1 15 CYS C C -3.588 4.371 -1.783 1.00 . A A . 15 CYS C 1 1 2 586 1 1 15 CYS CA C -3.325 3.431 -0.608 1.00 . A A . 15 CYS CA 1 1 2 587 1 1 15 CYS CB C -1.888 2.997 -0.675 1.00 . A A . 15 CYS CB 1 1 2 588 1 1 15 CYS H H -4.054 1.487 -1.227 1.00 . A A . 15 CYS H 1 1 2 589 1 1 15 CYS HA H -3.468 3.984 0.307 1.00 . A A . 15 CYS HA 1 1 2 590 1 1 15 CYS HB2 H -1.728 2.483 -1.612 1.00 . A A . 15 CYS HB2 1 1 2 591 1 1 15 CYS HB3 H -1.251 3.870 -0.662 1.00 . A A . 15 CYS HB3 1 1 2 592 1 1 15 CYS N N -4.197 2.213 -0.584 1.00 . A A . 15 CYS N 1 1 2 593 1 1 15 CYS O O -4.060 3.965 -2.828 1.00 . A A . 15 CYS O 1 1 2 594 1 1 15 CYS SG S -1.348 1.905 0.652 1.00 . A A . 15 CYS SG 1 1 2 595 1 1 16 CYS C C -2.401 6.391 -3.675 1.00 . A A . 16 CYS C 1 1 2 596 1 1 16 CYS CA C -3.426 6.684 -2.569 1.00 . A A . 16 CYS CA 1 1 2 597 1 1 16 CYS CB C -3.153 8.029 -1.901 1.00 . A A . 16 CYS CB 1 1 2 598 1 1 16 CYS H H -2.889 5.868 -0.679 1.00 . A A . 16 CYS H 1 1 2 599 1 1 16 CYS HA H -4.427 6.642 -2.974 1.00 . A A . 16 CYS HA 1 1 2 600 1 1 16 CYS HB2 H -2.131 8.033 -1.551 1.00 . A A . 16 CYS HB2 1 1 2 601 1 1 16 CYS HB3 H -3.244 8.808 -2.634 1.00 . A A . 16 CYS HB3 1 1 2 602 1 1 16 CYS N N -3.257 5.617 -1.547 1.00 . A A . 16 CYS N 1 1 2 603 1 1 16 CYS O O -2.631 6.653 -4.839 1.00 . A A . 16 CYS O 1 1 2 604 1 1 16 CYS SG S -4.197 8.474 -0.493 1.00 . A A . 16 CYS SG 1 1 2 605 1 1 17 SER C C -0.616 4.285 -5.016 1.00 . A A . 17 SER C 1 1 2 606 1 1 17 SER CA C -0.170 5.476 -4.149 1.00 . A A . 17 SER CA 1 1 2 607 1 1 17 SER CB C 1.047 5.096 -3.291 1.00 . A A . 17 SER CB 1 1 2 608 1 1 17 SER H H -1.195 5.674 -2.277 1.00 . A A . 17 SER H 1 1 2 609 1 1 17 SER HA H 0.061 6.317 -4.788 1.00 . A A . 17 SER HA 1 1 2 610 1 1 17 SER HB2 H 1.371 5.925 -2.679 1.00 . A A . 17 SER HB2 1 1 2 611 1 1 17 SER HB3 H 0.842 4.236 -2.669 1.00 . A A . 17 SER HB3 1 1 2 612 1 1 17 SER HG H 1.813 3.947 -4.658 1.00 . A A . 17 SER HG 1 1 2 613 1 1 17 SER N N -1.291 5.845 -3.237 1.00 . A A . 17 SER N 1 1 2 614 1 1 17 SER O O -0.119 4.093 -6.110 1.00 . A A . 17 SER O 1 1 2 615 1 1 17 SER OG O 2.064 4.768 -4.228 1.00 . A A . 17 SER OG 1 1 2 616 1 1 18 GLY C C -1.137 1.124 -5.141 1.00 . A A . 18 GLY C 1 1 2 617 1 1 18 GLY CA C -2.081 2.331 -5.202 1.00 . A A . 18 GLY CA 1 1 2 618 1 1 18 GLY H H -1.893 3.745 -3.593 1.00 . A A . 18 GLY H 1 1 2 619 1 1 18 GLY HA2 H -3.024 2.058 -4.753 1.00 . A A . 18 GLY HA2 1 1 2 620 1 1 18 GLY HA3 H -2.246 2.590 -6.236 1.00 . A A . 18 GLY HA3 1 1 2 621 1 1 18 GLY N N -1.544 3.525 -4.483 1.00 . A A . 18 GLY N 1 1 2 622 1 1 18 GLY O O -1.528 0.028 -5.493 1.00 . A A . 18 GLY O 1 1 2 623 1 1 19 SER C C 1.412 0.042 -3.107 1.00 . A A . 19 SER C 1 1 2 624 1 1 19 SER CA C 1.087 0.270 -4.588 1.00 . A A . 19 SER CA 1 1 2 625 1 1 19 SER CB C 2.336 0.705 -5.400 1.00 . A A . 19 SER CB 1 1 2 626 1 1 19 SER H H 0.331 2.266 -4.426 1.00 . A A . 19 SER H 1 1 2 627 1 1 19 SER HA H 0.692 -0.647 -5.000 1.00 . A A . 19 SER HA 1 1 2 628 1 1 19 SER HB2 H 3.135 -0.015 -5.310 1.00 . A A . 19 SER HB2 1 1 2 629 1 1 19 SER HB3 H 2.092 0.856 -6.440 1.00 . A A . 19 SER HB3 1 1 2 630 1 1 19 SER HG H 3.323 1.744 -4.085 1.00 . A A . 19 SER HG 1 1 2 631 1 1 19 SER N N 0.074 1.360 -4.697 1.00 . A A . 19 SER N 1 1 2 632 1 1 19 SER O O 2.507 0.306 -2.645 1.00 . A A . 19 SER O 1 1 2 633 1 1 19 SER OG O 2.744 1.940 -4.826 1.00 . A A . 19 SER OG 1 1 2 634 1 1 20 CYS C C 1.732 -1.724 -0.672 1.00 . A A . 20 CYS C 1 1 2 635 1 1 20 CYS CA C 0.610 -0.717 -0.946 1.00 . A A . 20 CYS CA 1 1 2 636 1 1 20 CYS CB C -0.706 -1.246 -0.337 1.00 . A A . 20 CYS CB 1 1 2 637 1 1 20 CYS H H -0.439 -0.639 -2.828 1.00 . A A . 20 CYS H 1 1 2 638 1 1 20 CYS HA H 0.858 0.219 -0.472 1.00 . A A . 20 CYS HA 1 1 2 639 1 1 20 CYS HB2 H -1.419 -0.436 -0.346 1.00 . A A . 20 CYS HB2 1 1 2 640 1 1 20 CYS HB3 H -1.132 -2.033 -0.924 1.00 . A A . 20 CYS HB3 1 1 2 641 1 1 20 CYS N N 0.422 -0.449 -2.401 1.00 . A A . 20 CYS N 1 1 2 642 1 1 20 CYS O O 1.737 -2.825 -1.188 1.00 . A A . 20 CYS O 1 1 2 643 1 1 20 CYS SG S -0.596 -1.839 1.367 1.00 . A A . 20 CYS SG 1 1 2 644 1 1 21 GLY C C 3.419 -3.454 1.097 1.00 . A A . 21 GLY C 1 1 2 645 1 1 21 GLY CA C 3.836 -2.080 0.566 1.00 . A A . 21 GLY CA 1 1 2 646 1 1 21 GLY H H 2.549 -0.370 0.504 1.00 . A A . 21 GLY H 1 1 2 647 1 1 21 GLY HA2 H 4.487 -2.205 -0.288 1.00 . A A . 21 GLY HA2 1 1 2 648 1 1 21 GLY HA3 H 4.369 -1.549 1.340 1.00 . A A . 21 GLY HA3 1 1 2 649 1 1 21 GLY N N 2.647 -1.276 0.149 1.00 . A A . 21 GLY N 1 1 2 650 1 1 21 GLY O O 2.426 -3.600 1.783 1.00 . A A . 21 GLY O 1 1 2 651 1 1 22 ARG C C 4.157 -6.092 2.621 1.00 . A A . 22 ARG C 1 1 2 652 1 1 22 ARG CA C 4.058 -5.835 1.117 1.00 . A A . 22 ARG CA 1 1 2 653 1 1 22 ARG CB C 5.130 -6.698 0.384 1.00 . A A . 22 ARG CB 1 1 2 654 1 1 22 ARG CD C 7.068 -4.980 0.629 1.00 . A A . 22 ARG CD 1 1 2 655 1 1 22 ARG CG C 6.605 -6.437 0.846 1.00 . A A . 22 ARG CG 1 1 2 656 1 1 22 ARG CZ C 9.484 -5.194 0.229 1.00 . A A . 22 ARG CZ 1 1 2 657 1 1 22 ARG H H 5.006 -4.137 0.202 1.00 . A A . 22 ARG H 1 1 2 658 1 1 22 ARG HA H 3.079 -6.148 0.783 1.00 . A A . 22 ARG HA 1 1 2 659 1 1 22 ARG HB2 H 4.902 -7.743 0.542 1.00 . A A . 22 ARG HB2 1 1 2 660 1 1 22 ARG HB3 H 5.063 -6.506 -0.676 1.00 . A A . 22 ARG HB3 1 1 2 661 1 1 22 ARG HD2 H 6.956 -4.677 -0.402 1.00 . A A . 22 ARG HD2 1 1 2 662 1 1 22 ARG HD3 H 6.511 -4.308 1.262 1.00 . A A . 22 ARG HD3 1 1 2 663 1 1 22 ARG HE H 8.718 -4.554 1.939 1.00 . A A . 22 ARG HE 1 1 2 664 1 1 22 ARG HG2 H 6.704 -6.687 1.892 1.00 . A A . 22 ARG HG2 1 1 2 665 1 1 22 ARG HG3 H 7.257 -7.093 0.289 1.00 . A A . 22 ARG HG3 1 1 2 666 1 1 22 ARG HH11 H 8.299 -5.718 -1.302 1.00 . A A . 22 ARG HH11 1 1 2 667 1 1 22 ARG HH12 H 10.000 -5.864 -1.586 1.00 . A A . 22 ARG HH12 1 1 2 668 1 1 22 ARG HH21 H 10.867 -4.735 1.600 1.00 . A A . 22 ARG HH21 1 1 2 669 1 1 22 ARG HH22 H 11.477 -5.300 0.080 1.00 . A A . 22 ARG HH22 1 1 2 670 1 1 22 ARG N N 4.238 -4.401 0.739 1.00 . A A . 22 ARG N 1 1 2 671 1 1 22 ARG NE N 8.504 -4.874 1.039 1.00 . A A . 22 ARG NE 1 1 2 672 1 1 22 ARG NH1 N 9.241 -5.625 -0.980 1.00 . A A . 22 ARG NH1 1 1 2 673 1 1 22 ARG NH2 N 10.704 -5.067 0.671 1.00 . A A . 22 ARG NH2 1 1 2 674 1 1 22 ARG O O 3.563 -7.033 3.113 1.00 . A A . 22 ARG O 1 1 2 675 1 1 23 ARG C C 3.824 -4.922 5.557 1.00 . A A . 23 ARG C 1 1 2 676 1 1 23 ARG CA C 5.040 -5.446 4.781 1.00 . A A . 23 ARG CA 1 1 2 677 1 1 23 ARG CB C 6.384 -4.749 5.200 1.00 . A A . 23 ARG CB 1 1 2 678 1 1 23 ARG CD C 5.577 -2.385 5.836 1.00 . A A . 23 ARG CD 1 1 2 679 1 1 23 ARG CG C 6.485 -3.222 4.919 1.00 . A A . 23 ARG CG 1 1 2 680 1 1 23 ARG CZ C 5.115 -2.833 8.226 1.00 . A A . 23 ARG CZ 1 1 2 681 1 1 23 ARG H H 5.345 -4.511 2.859 1.00 . A A . 23 ARG H 1 1 2 682 1 1 23 ARG HA H 5.136 -6.504 4.982 1.00 . A A . 23 ARG HA 1 1 2 683 1 1 23 ARG HB2 H 6.547 -4.925 6.254 1.00 . A A . 23 ARG HB2 1 1 2 684 1 1 23 ARG HB3 H 7.189 -5.236 4.666 1.00 . A A . 23 ARG HB3 1 1 2 685 1 1 23 ARG HD2 H 5.740 -1.340 5.626 1.00 . A A . 23 ARG HD2 1 1 2 686 1 1 23 ARG HD3 H 4.539 -2.608 5.685 1.00 . A A . 23 ARG HD3 1 1 2 687 1 1 23 ARG HE H 6.934 -2.679 7.473 1.00 . A A . 23 ARG HE 1 1 2 688 1 1 23 ARG HG2 H 7.509 -2.908 5.064 1.00 . A A . 23 ARG HG2 1 1 2 689 1 1 23 ARG HG3 H 6.221 -3.028 3.889 1.00 . A A . 23 ARG HG3 1 1 2 690 1 1 23 ARG HH11 H 3.466 -2.635 7.095 1.00 . A A . 23 ARG HH11 1 1 2 691 1 1 23 ARG HH12 H 3.196 -2.950 8.772 1.00 . A A . 23 ARG HH12 1 1 2 692 1 1 23 ARG HH21 H 6.578 -3.072 9.570 1.00 . A A . 23 ARG HH21 1 1 2 693 1 1 23 ARG HH22 H 4.964 -3.202 10.185 1.00 . A A . 23 ARG HH22 1 1 2 694 1 1 23 ARG N N 4.894 -5.256 3.308 1.00 . A A . 23 ARG N 1 1 2 695 1 1 23 ARG NE N 5.980 -2.645 7.257 1.00 . A A . 23 ARG NE 1 1 2 696 1 1 23 ARG NH1 N 3.826 -2.803 8.012 1.00 . A A . 23 ARG NH1 1 1 2 697 1 1 23 ARG NH2 N 5.589 -3.052 9.420 1.00 . A A . 23 ARG NH2 1 1 2 698 1 1 23 ARG O O 3.705 -5.195 6.735 1.00 . A A . 23 ARG O 1 1 2 699 1 1 24 GLY C C 1.594 -2.117 5.501 1.00 . A A . 24 GLY C 1 1 2 700 1 1 24 GLY CA C 1.733 -3.642 5.547 1.00 . A A . 24 GLY CA 1 1 2 701 1 1 24 GLY H H 3.115 -4.005 3.932 1.00 . A A . 24 GLY H 1 1 2 702 1 1 24 GLY HA2 H 0.873 -4.067 5.051 1.00 . A A . 24 GLY HA2 1 1 2 703 1 1 24 GLY HA3 H 1.708 -3.952 6.581 1.00 . A A . 24 GLY HA3 1 1 2 704 1 1 24 GLY N N 2.959 -4.194 4.883 1.00 . A A . 24 GLY N 1 1 2 705 1 1 24 GLY O O 0.630 -1.601 6.033 1.00 . A A . 24 GLY O 1 1 2 706 1 1 25 LYS C C 2.313 0.453 3.345 1.00 . A A . 25 LYS C 1 1 2 707 1 1 25 LYS CA C 2.443 0.065 4.802 1.00 . A A . 25 LYS CA 1 1 2 708 1 1 25 LYS CB C 3.717 0.719 5.383 1.00 . A A . 25 LYS CB 1 1 2 709 1 1 25 LYS CD C 2.719 0.990 7.697 1.00 . A A . 25 LYS CD 1 1 2 710 1 1 25 LYS CE C 2.874 0.640 9.181 1.00 . A A . 25 LYS CE 1 1 2 711 1 1 25 LYS CG C 3.887 0.395 6.882 1.00 . A A . 25 LYS CG 1 1 2 712 1 1 25 LYS H H 3.278 -1.909 4.452 1.00 . A A . 25 LYS H 1 1 2 713 1 1 25 LYS HA H 1.561 0.415 5.317 1.00 . A A . 25 LYS HA 1 1 2 714 1 1 25 LYS HB2 H 4.576 0.383 4.824 1.00 . A A . 25 LYS HB2 1 1 2 715 1 1 25 LYS HB3 H 3.644 1.789 5.268 1.00 . A A . 25 LYS HB3 1 1 2 716 1 1 25 LYS HD2 H 2.708 2.062 7.593 1.00 . A A . 25 LYS HD2 1 1 2 717 1 1 25 LYS HD3 H 1.780 0.608 7.341 1.00 . A A . 25 LYS HD3 1 1 2 718 1 1 25 LYS HE2 H 2.864 -0.431 9.322 1.00 . A A . 25 LYS HE2 1 1 2 719 1 1 25 LYS HE3 H 3.798 1.041 9.569 1.00 . A A . 25 LYS HE3 1 1 2 720 1 1 25 LYS HG2 H 3.910 -0.672 7.016 1.00 . A A . 25 LYS HG2 1 1 2 721 1 1 25 LYS HG3 H 4.823 0.806 7.232 1.00 . A A . 25 LYS HG3 1 1 2 722 1 1 25 LYS HZ1 H 0.903 1.295 9.334 1.00 . A A . 25 LYS HZ1 1 1 2 723 1 1 25 LYS HZ2 H 1.521 0.626 10.768 1.00 . A A . 25 LYS HZ2 1 1 2 724 1 1 25 LYS HZ3 H 2.002 2.180 10.278 1.00 . A A . 25 LYS HZ3 1 1 2 725 1 1 25 LYS N N 2.526 -1.437 4.880 1.00 . A A . 25 LYS N 1 1 2 726 1 1 25 LYS NZ N 1.740 1.228 9.949 1.00 . A A . 25 LYS NZ 1 1 2 727 1 1 25 LYS O O 2.526 -0.378 2.491 1.00 . A A . 25 LYS O 1 1 2 728 1 1 26 CYS C C 3.119 2.460 0.937 1.00 . A A . 26 CYS C 1 1 2 729 1 1 26 CYS CA C 1.817 2.146 1.679 1.00 . A A . 26 CYS CA 1 1 2 730 1 1 26 CYS CB C 0.923 3.375 1.676 1.00 . A A . 26 CYS CB 1 1 2 731 1 1 26 CYS H H 1.812 2.308 3.833 1.00 . A A . 26 CYS H 1 1 2 732 1 1 26 CYS HA H 1.307 1.370 1.132 1.00 . A A . 26 CYS HA 1 1 2 733 1 1 26 CYS HB2 H 1.344 4.112 2.334 1.00 . A A . 26 CYS HB2 1 1 2 734 1 1 26 CYS HB3 H 0.898 3.777 0.681 1.00 . A A . 26 CYS HB3 1 1 2 735 1 1 26 CYS N N 1.969 1.688 3.092 1.00 . A A . 26 CYS N 1 1 2 736 1 1 26 CYS O O 4.163 2.672 1.522 1.00 . A A . 26 CYS O 1 1 2 737 1 1 26 CYS SG S -0.795 3.124 2.161 1.00 . A A . 26 CYS SG 1 1 2 738 1 1 27 NH2 HN1 H 2.229 2.323 -0.834 1.00 . A A . 27 NH2 HN1 1 1 2 739 1 1 27 NH2 HN2 H 3.881 2.692 -0.893 1.00 . A A . 27 NH2 HN2 1 1 2 740 1 1 27 NH2 N N 3.077 2.495 -0.370 1.00 . A A . 27 NH2 N 1 1 3 741 1 1 1 CYS C C -6.053 6.799 1.728 1.00 . A A . 1 CYS C 1 1 3 742 1 1 1 CYS CA C -7.167 6.336 0.780 1.00 . A A . 1 CYS CA 1 1 3 743 1 1 1 CYS CB C -6.718 6.611 -0.655 1.00 . A A . 1 CYS CB 1 1 3 744 1 1 1 CYS H1 H -8.223 8.097 1.121 1.00 . A A . 1 CYS H1 1 1 3 745 1 1 1 CYS H2 H -9.131 6.880 0.359 1.00 . A A . 1 CYS H2 1 1 3 746 1 1 1 CYS H3 H -8.782 6.767 2.019 1.00 . A A . 1 CYS H3 1 1 3 747 1 1 1 CYS HA H -7.341 5.280 0.926 1.00 . A A . 1 CYS HA 1 1 3 748 1 1 1 CYS HB2 H -5.845 6.009 -0.855 1.00 . A A . 1 CYS HB2 1 1 3 749 1 1 1 CYS HB3 H -7.496 6.283 -1.327 1.00 . A A . 1 CYS HB3 1 1 3 750 1 1 1 CYS N N -8.421 7.077 1.094 1.00 . A A . 1 CYS N 1 1 3 751 1 1 1 CYS O O -6.026 7.938 2.153 1.00 . A A . 1 CYS O 1 1 3 752 1 1 1 CYS SG S -6.319 8.329 -1.063 1.00 . A A . 1 CYS SG 1 1 3 753 1 1 2 LYS C C -2.702 6.432 2.176 1.00 . A A . 2 LYS C 1 1 3 754 1 1 2 LYS CA C -4.010 6.151 2.932 1.00 . A A . 2 LYS CA 1 1 3 755 1 1 2 LYS CB C -3.868 4.931 3.871 1.00 . A A . 2 LYS CB 1 1 3 756 1 1 2 LYS CD C -6.286 5.354 4.729 1.00 . A A . 2 LYS CD 1 1 3 757 1 1 2 LYS CE C -6.902 4.146 4.020 1.00 . A A . 2 LYS CE 1 1 3 758 1 1 2 LYS CG C -4.807 5.099 5.094 1.00 . A A . 2 LYS CG 1 1 3 759 1 1 2 LYS H H -5.267 4.987 1.636 1.00 . A A . 2 LYS H 1 1 3 760 1 1 2 LYS HA H -4.261 7.001 3.557 1.00 . A A . 2 LYS HA 1 1 3 761 1 1 2 LYS HB2 H -4.115 4.023 3.339 1.00 . A A . 2 LYS HB2 1 1 3 762 1 1 2 LYS HB3 H -2.856 4.844 4.221 1.00 . A A . 2 LYS HB3 1 1 3 763 1 1 2 LYS HD2 H -6.808 5.564 5.643 1.00 . A A . 2 LYS HD2 1 1 3 764 1 1 2 LYS HD3 H -6.378 6.235 4.118 1.00 . A A . 2 LYS HD3 1 1 3 765 1 1 2 LYS HE2 H -6.339 3.880 3.142 1.00 . A A . 2 LYS HE2 1 1 3 766 1 1 2 LYS HE3 H -6.920 3.309 4.700 1.00 . A A . 2 LYS HE3 1 1 3 767 1 1 2 LYS HG2 H -4.740 4.203 5.694 1.00 . A A . 2 LYS HG2 1 1 3 768 1 1 2 LYS HG3 H -4.446 5.925 5.687 1.00 . A A . 2 LYS HG3 1 1 3 769 1 1 2 LYS HZ1 H -8.310 5.270 2.978 1.00 . A A . 2 LYS HZ1 1 1 3 770 1 1 2 LYS HZ2 H -8.704 3.624 3.126 1.00 . A A . 2 LYS HZ2 1 1 3 771 1 1 2 LYS HZ3 H -8.870 4.660 4.462 1.00 . A A . 2 LYS HZ3 1 1 3 772 1 1 2 LYS N N -5.168 5.882 2.023 1.00 . A A . 2 LYS N 1 1 3 773 1 1 2 LYS NZ N -8.303 4.448 3.618 1.00 . A A . 2 LYS NZ 1 1 3 774 1 1 2 LYS O O -2.239 5.619 1.400 1.00 . A A . 2 LYS O 1 1 3 775 1 1 3 GLY C C 0.299 7.049 2.055 1.00 . A A . 3 GLY C 1 1 3 776 1 1 3 GLY CA C -0.865 8.012 1.775 1.00 . A A . 3 GLY CA 1 1 3 777 1 1 3 GLY H H -2.572 8.194 3.075 1.00 . A A . 3 GLY H 1 1 3 778 1 1 3 GLY HA2 H -1.026 8.067 0.708 1.00 . A A . 3 GLY HA2 1 1 3 779 1 1 3 GLY HA3 H -0.597 8.993 2.140 1.00 . A A . 3 GLY HA3 1 1 3 780 1 1 3 GLY N N -2.143 7.590 2.434 1.00 . A A . 3 GLY N 1 1 3 781 1 1 3 GLY O O 0.227 6.229 2.948 1.00 . A A . 3 GLY O 1 1 3 782 1 1 4 LYS C C 3.074 6.137 2.840 1.00 . A A . 4 LYS C 1 1 3 783 1 1 4 LYS CA C 2.565 6.343 1.396 1.00 . A A . 4 LYS CA 1 1 3 784 1 1 4 LYS CB C 3.652 6.993 0.513 1.00 . A A . 4 LYS CB 1 1 3 785 1 1 4 LYS CD C 4.940 9.177 0.010 1.00 . A A . 4 LYS CD 1 1 3 786 1 1 4 LYS CE C 6.352 8.540 -0.030 1.00 . A A . 4 LYS CE 1 1 3 787 1 1 4 LYS CG C 3.943 8.450 0.957 1.00 . A A . 4 LYS CG 1 1 3 788 1 1 4 LYS H H 1.327 7.882 0.577 1.00 . A A . 4 LYS H 1 1 3 789 1 1 4 LYS HA H 2.343 5.380 0.968 1.00 . A A . 4 LYS HA 1 1 3 790 1 1 4 LYS HB2 H 4.535 6.389 0.610 1.00 . A A . 4 LYS HB2 1 1 3 791 1 1 4 LYS HB3 H 3.337 6.978 -0.520 1.00 . A A . 4 LYS HB3 1 1 3 792 1 1 4 LYS HD2 H 4.531 9.169 -0.989 1.00 . A A . 4 LYS HD2 1 1 3 793 1 1 4 LYS HD3 H 5.026 10.205 0.326 1.00 . A A . 4 LYS HD3 1 1 3 794 1 1 4 LYS HE2 H 7.010 9.157 -0.624 1.00 . A A . 4 LYS HE2 1 1 3 795 1 1 4 LYS HE3 H 6.755 8.473 0.970 1.00 . A A . 4 LYS HE3 1 1 3 796 1 1 4 LYS HG2 H 3.023 9.014 0.981 1.00 . A A . 4 LYS HG2 1 1 3 797 1 1 4 LYS HG3 H 4.363 8.448 1.952 1.00 . A A . 4 LYS HG3 1 1 3 798 1 1 4 LYS HZ1 H 5.444 7.040 -1.155 1.00 . A A . 4 LYS HZ1 1 1 3 799 1 1 4 LYS HZ2 H 7.138 7.060 -1.263 1.00 . A A . 4 LYS HZ2 1 1 3 800 1 1 4 LYS HZ3 H 6.385 6.464 0.136 1.00 . A A . 4 LYS HZ3 1 1 3 801 1 1 4 LYS N N 1.340 7.193 1.272 1.00 . A A . 4 LYS N 1 1 3 802 1 1 4 LYS NZ N 6.327 7.172 -0.623 1.00 . A A . 4 LYS NZ 1 1 3 803 1 1 4 LYS O O 3.130 7.061 3.629 1.00 . A A . 4 LYS O 1 1 3 804 1 1 5 GLY C C 2.831 4.288 5.513 1.00 . A A . 5 GLY C 1 1 3 805 1 1 5 GLY CA C 3.937 4.502 4.467 1.00 . A A . 5 GLY CA 1 1 3 806 1 1 5 GLY H H 3.334 4.223 2.426 1.00 . A A . 5 GLY H 1 1 3 807 1 1 5 GLY HA2 H 4.486 3.578 4.352 1.00 . A A . 5 GLY HA2 1 1 3 808 1 1 5 GLY HA3 H 4.619 5.254 4.831 1.00 . A A . 5 GLY HA3 1 1 3 809 1 1 5 GLY N N 3.420 4.905 3.122 1.00 . A A . 5 GLY N 1 1 3 810 1 1 5 GLY O O 3.132 3.990 6.653 1.00 . A A . 5 GLY O 1 1 3 811 1 1 6 ALA C C -0.097 2.807 6.007 1.00 . A A . 6 ALA C 1 1 3 812 1 1 6 ALA CA C 0.439 4.259 6.046 1.00 . A A . 6 ALA CA 1 1 3 813 1 1 6 ALA CB C -0.652 5.242 5.634 1.00 . A A . 6 ALA CB 1 1 3 814 1 1 6 ALA H H 1.420 4.685 4.175 1.00 . A A . 6 ALA H 1 1 3 815 1 1 6 ALA HA H 0.767 4.495 7.047 1.00 . A A . 6 ALA HA 1 1 3 816 1 1 6 ALA HB1 H -0.936 5.033 4.616 1.00 . A A . 6 ALA HB1 1 1 3 817 1 1 6 ALA HB2 H -1.520 5.154 6.268 1.00 . A A . 6 ALA HB2 1 1 3 818 1 1 6 ALA HB3 H -0.281 6.254 5.693 1.00 . A A . 6 ALA HB3 1 1 3 819 1 1 6 ALA N N 1.595 4.443 5.107 1.00 . A A . 6 ALA N 1 1 3 820 1 1 6 ALA O O 0.044 2.147 4.996 1.00 . A A . 6 ALA O 1 1 3 821 1 1 7 PRO C C -2.251 0.518 6.265 1.00 . A A . 7 PRO C 1 1 3 822 1 1 7 PRO CA C -1.120 0.918 7.240 1.00 . A A . 7 PRO CA 1 1 3 823 1 1 7 PRO CB C -1.534 0.775 8.710 1.00 . A A . 7 PRO CB 1 1 3 824 1 1 7 PRO CD C -1.035 3.164 8.295 1.00 . A A . 7 PRO CD 1 1 3 825 1 1 7 PRO CG C -1.750 2.195 9.249 1.00 . A A . 7 PRO CG 1 1 3 826 1 1 7 PRO HA H -0.262 0.289 7.057 1.00 . A A . 7 PRO HA 1 1 3 827 1 1 7 PRO HB2 H -2.437 0.192 8.816 1.00 . A A . 7 PRO HB2 1 1 3 828 1 1 7 PRO HB3 H -0.744 0.293 9.268 1.00 . A A . 7 PRO HB3 1 1 3 829 1 1 7 PRO HD2 H -1.687 3.978 8.018 1.00 . A A . 7 PRO HD2 1 1 3 830 1 1 7 PRO HD3 H -0.127 3.544 8.743 1.00 . A A . 7 PRO HD3 1 1 3 831 1 1 7 PRO HG2 H -2.806 2.420 9.280 1.00 . A A . 7 PRO HG2 1 1 3 832 1 1 7 PRO HG3 H -1.343 2.284 10.246 1.00 . A A . 7 PRO HG3 1 1 3 833 1 1 7 PRO N N -0.697 2.345 7.089 1.00 . A A . 7 PRO N 1 1 3 834 1 1 7 PRO O O -3.422 0.675 6.552 1.00 . A A . 7 PRO O 1 1 3 835 1 1 8 CYS C C -2.874 -1.964 3.871 1.00 . A A . 8 CYS C 1 1 3 836 1 1 8 CYS CA C -2.762 -0.445 4.047 1.00 . A A . 8 CYS CA 1 1 3 837 1 1 8 CYS CB C -2.287 0.134 2.749 1.00 . A A . 8 CYS CB 1 1 3 838 1 1 8 CYS H H -0.868 -0.067 4.979 1.00 . A A . 8 CYS H 1 1 3 839 1 1 8 CYS HA H -3.743 -0.045 4.244 1.00 . A A . 8 CYS HA 1 1 3 840 1 1 8 CYS HB2 H -2.799 -0.358 1.934 1.00 . A A . 8 CYS HB2 1 1 3 841 1 1 8 CYS HB3 H -2.539 1.172 2.671 1.00 . A A . 8 CYS HB3 1 1 3 842 1 1 8 CYS N N -1.834 0.012 5.133 1.00 . A A . 8 CYS N 1 1 3 843 1 1 8 CYS O O -2.115 -2.737 4.424 1.00 . A A . 8 CYS O 1 1 3 844 1 1 8 CYS SG S -0.515 -0.111 2.479 1.00 . A A . 8 CYS SG 1 1 3 845 1 1 9 ARG C C -3.992 -3.876 1.191 1.00 . A A . 9 ARG C 1 1 3 846 1 1 9 ARG CA C -4.187 -3.703 2.713 1.00 . A A . 9 ARG CA 1 1 3 847 1 1 9 ARG CB C -5.650 -3.989 3.178 1.00 . A A . 9 ARG CB 1 1 3 848 1 1 9 ARG CD C -8.026 -3.262 3.307 1.00 . A A . 9 ARG CD 1 1 3 849 1 1 9 ARG CG C -6.630 -2.890 2.770 1.00 . A A . 9 ARG CG 1 1 3 850 1 1 9 ARG CZ C -9.033 -1.053 3.612 1.00 . A A . 9 ARG CZ 1 1 3 851 1 1 9 ARG H H -4.410 -1.581 2.692 1.00 . A A . 9 ARG H 1 1 3 852 1 1 9 ARG HA H -3.517 -4.371 3.237 1.00 . A A . 9 ARG HA 1 1 3 853 1 1 9 ARG HB2 H -5.984 -4.915 2.730 1.00 . A A . 9 ARG HB2 1 1 3 854 1 1 9 ARG HB3 H -5.676 -4.103 4.251 1.00 . A A . 9 ARG HB3 1 1 3 855 1 1 9 ARG HD2 H -8.372 -4.189 2.877 1.00 . A A . 9 ARG HD2 1 1 3 856 1 1 9 ARG HD3 H -8.009 -3.370 4.382 1.00 . A A . 9 ARG HD3 1 1 3 857 1 1 9 ARG HE H -9.577 -2.298 2.167 1.00 . A A . 9 ARG HE 1 1 3 858 1 1 9 ARG HG2 H -6.322 -1.959 3.219 1.00 . A A . 9 ARG HG2 1 1 3 859 1 1 9 ARG HG3 H -6.644 -2.771 1.700 1.00 . A A . 9 ARG HG3 1 1 3 860 1 1 9 ARG HH11 H -7.600 -1.569 4.920 1.00 . A A . 9 ARG HH11 1 1 3 861 1 1 9 ARG HH12 H -8.297 -0.002 5.151 1.00 . A A . 9 ARG HH12 1 1 3 862 1 1 9 ARG HH21 H -10.474 -0.315 2.440 1.00 . A A . 9 ARG HH21 1 1 3 863 1 1 9 ARG HH22 H -9.947 0.721 3.726 1.00 . A A . 9 ARG HH22 1 1 3 864 1 1 9 ARG N N -3.858 -2.296 3.072 1.00 . A A . 9 ARG N 1 1 3 865 1 1 9 ARG NE N -8.981 -2.173 2.934 1.00 . A A . 9 ARG NE 1 1 3 866 1 1 9 ARG NH1 N -8.249 -0.861 4.642 1.00 . A A . 9 ARG NH1 1 1 3 867 1 1 9 ARG NH2 N -9.886 -0.145 3.230 1.00 . A A . 9 ARG NH2 1 1 3 868 1 1 9 ARG O O -4.663 -3.280 0.359 1.00 . A A . 9 ARG O 1 1 3 869 1 1 10 LYS C C -3.816 -5.593 -1.227 1.00 . A A . 10 LYS C 1 1 3 870 1 1 10 LYS CA C -2.587 -5.101 -0.455 1.00 . A A . 10 LYS CA 1 1 3 871 1 1 10 LYS CB C -1.565 -6.275 -0.462 1.00 . A A . 10 LYS CB 1 1 3 872 1 1 10 LYS CD C -0.588 -6.127 1.925 1.00 . A A . 10 LYS CD 1 1 3 873 1 1 10 LYS CE C 0.704 -6.296 2.739 1.00 . A A . 10 LYS CE 1 1 3 874 1 1 10 LYS CG C -0.273 -6.128 0.406 1.00 . A A . 10 LYS CG 1 1 3 875 1 1 10 LYS H H -2.572 -5.138 1.690 1.00 . A A . 10 LYS H 1 1 3 876 1 1 10 LYS HA H -2.180 -4.230 -0.948 1.00 . A A . 10 LYS HA 1 1 3 877 1 1 10 LYS HB2 H -2.071 -7.174 -0.142 1.00 . A A . 10 LYS HB2 1 1 3 878 1 1 10 LYS HB3 H -1.253 -6.434 -1.485 1.00 . A A . 10 LYS HB3 1 1 3 879 1 1 10 LYS HD2 H -0.982 -5.163 2.209 1.00 . A A . 10 LYS HD2 1 1 3 880 1 1 10 LYS HD3 H -1.301 -6.897 2.178 1.00 . A A . 10 LYS HD3 1 1 3 881 1 1 10 LYS HE2 H 1.208 -7.211 2.466 1.00 . A A . 10 LYS HE2 1 1 3 882 1 1 10 LYS HE3 H 1.363 -5.463 2.574 1.00 . A A . 10 LYS HE3 1 1 3 883 1 1 10 LYS HG2 H 0.394 -6.946 0.176 1.00 . A A . 10 LYS HG2 1 1 3 884 1 1 10 LYS HG3 H 0.224 -5.206 0.146 1.00 . A A . 10 LYS HG3 1 1 3 885 1 1 10 LYS HZ1 H -0.404 -5.698 4.398 1.00 . A A . 10 LYS HZ1 1 1 3 886 1 1 10 LYS HZ2 H 0.109 -7.318 4.451 1.00 . A A . 10 LYS HZ2 1 1 3 887 1 1 10 LYS HZ3 H 1.218 -6.065 4.744 1.00 . A A . 10 LYS HZ3 1 1 3 888 1 1 10 LYS N N -3.023 -4.726 0.930 1.00 . A A . 10 LYS N 1 1 3 889 1 1 10 LYS NZ N 0.382 -6.348 4.193 1.00 . A A . 10 LYS NZ 1 1 3 890 1 1 10 LYS O O -3.962 -5.349 -2.409 1.00 . A A . 10 LYS O 1 1 3 891 1 1 11 THR C C -6.619 -6.077 -2.015 1.00 . A A . 11 THR C 1 1 3 892 1 1 11 THR CA C -5.919 -6.892 -0.923 1.00 . A A . 11 THR CA 1 1 3 893 1 1 11 THR CB C -6.814 -7.032 0.322 1.00 . A A . 11 THR CB 1 1 3 894 1 1 11 THR CG2 C -8.114 -7.806 0.023 1.00 . A A . 11 THR CG2 1 1 3 895 1 1 11 THR H H -4.385 -6.401 0.473 1.00 . A A . 11 THR H 1 1 3 896 1 1 11 THR HA H -5.698 -7.872 -1.322 1.00 . A A . 11 THR HA 1 1 3 897 1 1 11 THR HB H -6.972 -6.082 0.817 1.00 . A A . 11 THR HB 1 1 3 898 1 1 11 THR HG1 H -5.865 -8.690 0.699 1.00 . A A . 11 THR HG1 1 1 3 899 1 1 11 THR HG21 H -7.892 -8.802 -0.331 1.00 . A A . 11 THR HG21 1 1 3 900 1 1 11 THR HG22 H -8.709 -7.883 0.921 1.00 . A A . 11 THR HG22 1 1 3 901 1 1 11 THR HG23 H -8.691 -7.292 -0.731 1.00 . A A . 11 THR HG23 1 1 3 902 1 1 11 THR N N -4.634 -6.280 -0.467 1.00 . A A . 11 THR N 1 1 3 903 1 1 11 THR O O -7.178 -6.634 -2.939 1.00 . A A . 11 THR O 1 1 3 904 1 1 11 THR OG1 O -6.085 -7.893 1.187 1.00 . A A . 11 THR OG1 1 1 3 905 1 1 12 MET C C -6.418 -2.571 -2.991 1.00 . A A . 12 MET C 1 1 3 906 1 1 12 MET CA C -7.203 -3.870 -2.864 1.00 . A A . 12 MET CA 1 1 3 907 1 1 12 MET CB C -8.657 -3.559 -2.422 1.00 . A A . 12 MET CB 1 1 3 908 1 1 12 MET CE C -9.768 -4.857 0.642 1.00 . A A . 12 MET CE 1 1 3 909 1 1 12 MET CG C -8.706 -2.957 -1.002 1.00 . A A . 12 MET CG 1 1 3 910 1 1 12 MET H H -6.090 -4.395 -1.093 1.00 . A A . 12 MET H 1 1 3 911 1 1 12 MET HA H -7.209 -4.351 -3.833 1.00 . A A . 12 MET HA 1 1 3 912 1 1 12 MET HB2 H -9.130 -2.888 -3.126 1.00 . A A . 12 MET HB2 1 1 3 913 1 1 12 MET HB3 H -9.208 -4.483 -2.410 1.00 . A A . 12 MET HB3 1 1 3 914 1 1 12 MET HE1 H -10.116 -5.327 -0.266 1.00 . A A . 12 MET HE1 1 1 3 915 1 1 12 MET HE2 H -9.628 -5.623 1.390 1.00 . A A . 12 MET HE2 1 1 3 916 1 1 12 MET HE3 H -10.488 -4.141 1.009 1.00 . A A . 12 MET HE3 1 1 3 917 1 1 12 MET HG2 H -8.080 -2.077 -0.972 1.00 . A A . 12 MET HG2 1 1 3 918 1 1 12 MET HG3 H -9.710 -2.645 -0.772 1.00 . A A . 12 MET HG3 1 1 3 919 1 1 12 MET N N -6.560 -4.778 -1.865 1.00 . A A . 12 MET N 1 1 3 920 1 1 12 MET O O -6.895 -1.631 -3.597 1.00 . A A . 12 MET O 1 1 3 921 1 1 12 MET SD S -8.179 -4.042 0.343 1.00 . A A . 12 MET SD 1 1 3 922 1 1 13 TYR C C -5.184 -0.199 -1.915 1.00 . A A . 13 TYR C 1 1 3 923 1 1 13 TYR CA C -4.356 -1.361 -2.455 1.00 . A A . 13 TYR CA 1 1 3 924 1 1 13 TYR CB C -3.894 -1.124 -3.911 1.00 . A A . 13 TYR CB 1 1 3 925 1 1 13 TYR CD1 C -1.773 -2.485 -3.862 1.00 . A A . 13 TYR CD1 1 1 3 926 1 1 13 TYR CD2 C -3.593 -3.328 -5.142 1.00 . A A . 13 TYR CD2 1 1 3 927 1 1 13 TYR CE1 C -1.014 -3.580 -4.210 1.00 . A A . 13 TYR CE1 1 1 3 928 1 1 13 TYR CE2 C -2.834 -4.424 -5.492 1.00 . A A . 13 TYR CE2 1 1 3 929 1 1 13 TYR CG C -3.066 -2.349 -4.322 1.00 . A A . 13 TYR CG 1 1 3 930 1 1 13 TYR CZ C -1.540 -4.557 -5.028 1.00 . A A . 13 TYR CZ 1 1 3 931 1 1 13 TYR H H -4.920 -3.369 -1.959 1.00 . A A . 13 TYR H 1 1 3 932 1 1 13 TYR HA H -3.510 -1.527 -1.803 1.00 . A A . 13 TYR HA 1 1 3 933 1 1 13 TYR HB2 H -4.736 -1.022 -4.577 1.00 . A A . 13 TYR HB2 1 1 3 934 1 1 13 TYR HB3 H -3.277 -0.239 -3.971 1.00 . A A . 13 TYR HB3 1 1 3 935 1 1 13 TYR HD1 H -1.356 -1.723 -3.221 1.00 . A A . 13 TYR HD1 1 1 3 936 1 1 13 TYR HD2 H -4.604 -3.235 -5.512 1.00 . A A . 13 TYR HD2 1 1 3 937 1 1 13 TYR HE1 H -0.003 -3.670 -3.840 1.00 . A A . 13 TYR HE1 1 1 3 938 1 1 13 TYR HE2 H -3.256 -5.183 -6.134 1.00 . A A . 13 TYR HE2 1 1 3 939 1 1 13 TYR HH H -0.563 -5.581 -6.310 1.00 . A A . 13 TYR HH 1 1 3 940 1 1 13 TYR N N -5.236 -2.566 -2.420 1.00 . A A . 13 TYR N 1 1 3 941 1 1 13 TYR O O -5.682 0.651 -2.629 1.00 . A A . 13 TYR O 1 1 3 942 1 1 13 TYR OH O -0.781 -5.655 -5.378 1.00 . A A . 13 TYR OH 1 1 3 943 1 1 14 ASP C C -5.265 2.101 0.309 1.00 . A A . 14 ASP C 1 1 3 944 1 1 14 ASP CA C -6.043 0.782 0.160 1.00 . A A . 14 ASP CA 1 1 3 945 1 1 14 ASP CB C -6.351 0.112 1.510 1.00 . A A . 14 ASP CB 1 1 3 946 1 1 14 ASP CG C -7.008 1.058 2.528 1.00 . A A . 14 ASP CG 1 1 3 947 1 1 14 ASP H H -4.831 -0.972 -0.142 1.00 . A A . 14 ASP H 1 1 3 948 1 1 14 ASP HA H -6.970 0.987 -0.357 1.00 . A A . 14 ASP HA 1 1 3 949 1 1 14 ASP HB2 H -7.037 -0.693 1.323 1.00 . A A . 14 ASP HB2 1 1 3 950 1 1 14 ASP HB3 H -5.453 -0.323 1.924 1.00 . A A . 14 ASP HB3 1 1 3 951 1 1 14 ASP N N -5.279 -0.240 -0.616 1.00 . A A . 14 ASP N 1 1 3 952 1 1 14 ASP O O -5.587 2.939 1.128 1.00 . A A . 14 ASP O 1 1 3 953 1 1 14 ASP OD1 O -7.998 1.675 2.169 1.00 . A A . 14 ASP OD1 1 1 3 954 1 1 14 ASP OD2 O -6.465 1.103 3.619 1.00 . A A . 14 ASP OD2 1 1 3 955 1 1 15 CYS C C -3.708 4.434 -1.629 1.00 . A A . 15 CYS C 1 1 3 956 1 1 15 CYS CA C -3.411 3.471 -0.479 1.00 . A A . 15 CYS CA 1 1 3 957 1 1 15 CYS CB C -1.968 3.080 -0.575 1.00 . A A . 15 CYS CB 1 1 3 958 1 1 15 CYS H H -4.061 1.515 -1.139 1.00 . A A . 15 CYS H 1 1 3 959 1 1 15 CYS HA H -3.579 3.989 0.452 1.00 . A A . 15 CYS HA 1 1 3 960 1 1 15 CYS HB2 H -1.779 2.674 -1.559 1.00 . A A . 15 CYS HB2 1 1 3 961 1 1 15 CYS HB3 H -1.373 3.975 -0.462 1.00 . A A . 15 CYS HB3 1 1 3 962 1 1 15 CYS N N -4.257 2.239 -0.508 1.00 . A A . 15 CYS N 1 1 3 963 1 1 15 CYS O O -4.208 4.035 -2.664 1.00 . A A . 15 CYS O 1 1 3 964 1 1 15 CYS SG S -1.376 1.896 0.644 1.00 . A A . 15 CYS SG 1 1 3 965 1 1 16 CYS C C -2.550 6.490 -3.526 1.00 . A A . 16 CYS C 1 1 3 966 1 1 16 CYS CA C -3.596 6.737 -2.427 1.00 . A A . 16 CYS CA 1 1 3 967 1 1 16 CYS CB C -3.386 8.100 -1.782 1.00 . A A . 16 CYS CB 1 1 3 968 1 1 16 CYS H H -2.983 5.946 -0.546 1.00 . A A . 16 CYS H 1 1 3 969 1 1 16 CYS HA H -4.590 6.645 -2.840 1.00 . A A . 16 CYS HA 1 1 3 970 1 1 16 CYS HB2 H -2.359 8.170 -1.454 1.00 . A A . 16 CYS HB2 1 1 3 971 1 1 16 CYS HB3 H -3.536 8.847 -2.539 1.00 . A A . 16 CYS HB3 1 1 3 972 1 1 16 CYS N N -3.378 5.682 -1.399 1.00 . A A . 16 CYS N 1 1 3 973 1 1 16 CYS O O -2.779 6.759 -4.690 1.00 . A A . 16 CYS O 1 1 3 974 1 1 16 CYS SG S -4.431 8.531 -0.370 1.00 . A A . 16 CYS SG 1 1 3 975 1 1 17 SER C C -0.688 4.503 -4.932 1.00 . A A . 17 SER C 1 1 3 976 1 1 17 SER CA C -0.283 5.653 -3.992 1.00 . A A . 17 SER CA 1 1 3 977 1 1 17 SER CB C 0.922 5.245 -3.123 1.00 . A A . 17 SER CB 1 1 3 978 1 1 17 SER H H -1.331 5.794 -2.127 1.00 . A A . 17 SER H 1 1 3 979 1 1 17 SER HA H -0.046 6.526 -4.583 1.00 . A A . 17 SER HA 1 1 3 980 1 1 17 SER HB2 H 1.229 6.049 -2.469 1.00 . A A . 17 SER HB2 1 1 3 981 1 1 17 SER HB3 H 0.713 4.357 -2.543 1.00 . A A . 17 SER HB3 1 1 3 982 1 1 17 SER HG H 1.721 4.180 -4.542 1.00 . A A . 17 SER HG 1 1 3 983 1 1 17 SER N N -1.425 5.975 -3.085 1.00 . A A . 17 SER N 1 1 3 984 1 1 17 SER O O -0.089 4.315 -5.975 1.00 . A A . 17 SER O 1 1 3 985 1 1 17 SER OG O 1.965 4.966 -4.048 1.00 . A A . 17 SER OG 1 1 3 986 1 1 18 GLY C C -1.273 1.397 -5.213 1.00 . A A . 18 GLY C 1 1 3 987 1 1 18 GLY CA C -2.192 2.618 -5.335 1.00 . A A . 18 GLY CA 1 1 3 988 1 1 18 GLY H H -2.130 3.977 -3.669 1.00 . A A . 18 GLY H 1 1 3 989 1 1 18 GLY HA2 H -3.176 2.350 -4.982 1.00 . A A . 18 GLY HA2 1 1 3 990 1 1 18 GLY HA3 H -2.244 2.915 -6.369 1.00 . A A . 18 GLY HA3 1 1 3 991 1 1 18 GLY N N -1.695 3.769 -4.521 1.00 . A A . 18 GLY N 1 1 3 992 1 1 18 GLY O O -1.554 0.355 -5.773 1.00 . A A . 18 GLY O 1 1 3 993 1 1 19 SER C C 1.056 0.377 -2.757 1.00 . A A . 19 SER C 1 1 3 994 1 1 19 SER CA C 0.795 0.490 -4.263 1.00 . A A . 19 SER CA 1 1 3 995 1 1 19 SER CB C 2.085 0.851 -5.036 1.00 . A A . 19 SER CB 1 1 3 996 1 1 19 SER H H -0.044 2.447 -4.063 1.00 . A A . 19 SER H 1 1 3 997 1 1 19 SER HA H 0.401 -0.450 -4.625 1.00 . A A . 19 SER HA 1 1 3 998 1 1 19 SER HB2 H 2.863 0.119 -4.873 1.00 . A A . 19 SER HB2 1 1 3 999 1 1 19 SER HB3 H 1.889 0.950 -6.094 1.00 . A A . 19 SER HB3 1 1 3 1000 1 1 19 SER HG H 1.729 2.666 -4.419 1.00 . A A . 19 SER HG 1 1 3 1001 1 1 19 SER N N -0.202 1.576 -4.482 1.00 . A A . 19 SER N 1 1 3 1002 1 1 19 SER O O 1.503 1.318 -2.129 1.00 . A A . 19 SER O 1 1 3 1003 1 1 19 SER OG O 2.504 2.108 -4.519 1.00 . A A . 19 SER OG 1 1 3 1004 1 1 20 CYS C C 2.002 -2.155 -0.600 1.00 . A A . 20 CYS C 1 1 3 1005 1 1 20 CYS CA C 0.959 -1.049 -0.779 1.00 . A A . 20 CYS CA 1 1 3 1006 1 1 20 CYS CB C -0.396 -1.459 -0.158 1.00 . A A . 20 CYS CB 1 1 3 1007 1 1 20 CYS H H 0.401 -1.495 -2.803 1.00 . A A . 20 CYS H 1 1 3 1008 1 1 20 CYS HA H 1.315 -0.153 -0.294 1.00 . A A . 20 CYS HA 1 1 3 1009 1 1 20 CYS HB2 H -1.059 -0.612 -0.250 1.00 . A A . 20 CYS HB2 1 1 3 1010 1 1 20 CYS HB3 H -0.856 -2.267 -0.694 1.00 . A A . 20 CYS HB3 1 1 3 1011 1 1 20 CYS N N 0.759 -0.785 -2.232 1.00 . A A . 20 CYS N 1 1 3 1012 1 1 20 CYS O O 1.802 -3.285 -1.003 1.00 . A A . 20 CYS O 1 1 3 1013 1 1 20 CYS SG S -0.368 -1.915 1.591 1.00 . A A . 20 CYS SG 1 1 3 1014 1 1 21 GLY C C 3.833 -3.938 1.038 1.00 . A A . 21 GLY C 1 1 3 1015 1 1 21 GLY CA C 4.243 -2.669 0.291 1.00 . A A . 21 GLY CA 1 1 3 1016 1 1 21 GLY H H 3.156 -0.826 0.294 1.00 . A A . 21 GLY H 1 1 3 1017 1 1 21 GLY HA2 H 4.705 -2.943 -0.646 1.00 . A A . 21 GLY HA2 1 1 3 1018 1 1 21 GLY HA3 H 4.963 -2.133 0.891 1.00 . A A . 21 GLY HA3 1 1 3 1019 1 1 21 GLY N N 3.092 -1.760 0.010 1.00 . A A . 21 GLY N 1 1 3 1020 1 1 21 GLY O O 2.765 -4.014 1.610 1.00 . A A . 21 GLY O 1 1 3 1021 1 1 22 ARG C C 4.510 -6.094 3.187 1.00 . A A . 22 ARG C 1 1 3 1022 1 1 22 ARG CA C 4.527 -6.217 1.662 1.00 . A A . 22 ARG CA 1 1 3 1023 1 1 22 ARG CB C 5.665 -7.167 1.230 1.00 . A A . 22 ARG CB 1 1 3 1024 1 1 22 ARG CD C 4.363 -8.092 -0.759 1.00 . A A . 22 ARG CD 1 1 3 1025 1 1 22 ARG CG C 5.672 -7.403 -0.303 1.00 . A A . 22 ARG CG 1 1 3 1026 1 1 22 ARG CZ C 5.131 -9.337 -2.731 1.00 . A A . 22 ARG CZ 1 1 3 1027 1 1 22 ARG H H 5.563 -4.710 0.523 1.00 . A A . 22 ARG H 1 1 3 1028 1 1 22 ARG HA H 3.571 -6.612 1.352 1.00 . A A . 22 ARG HA 1 1 3 1029 1 1 22 ARG HB2 H 6.613 -6.735 1.519 1.00 . A A . 22 ARG HB2 1 1 3 1030 1 1 22 ARG HB3 H 5.559 -8.116 1.736 1.00 . A A . 22 ARG HB3 1 1 3 1031 1 1 22 ARG HD2 H 4.214 -9.029 -0.242 1.00 . A A . 22 ARG HD2 1 1 3 1032 1 1 22 ARG HD3 H 3.513 -7.452 -0.575 1.00 . A A . 22 ARG HD3 1 1 3 1033 1 1 22 ARG HE H 3.946 -7.754 -2.842 1.00 . A A . 22 ARG HE 1 1 3 1034 1 1 22 ARG HG2 H 5.779 -6.459 -0.817 1.00 . A A . 22 ARG HG2 1 1 3 1035 1 1 22 ARG HG3 H 6.517 -8.025 -0.559 1.00 . A A . 22 ARG HG3 1 1 3 1036 1 1 22 ARG HH11 H 5.784 -10.012 -0.958 1.00 . A A . 22 ARG HH11 1 1 3 1037 1 1 22 ARG HH12 H 6.324 -10.898 -2.345 1.00 . A A . 22 ARG HH12 1 1 3 1038 1 1 22 ARG HH21 H 4.620 -8.861 -4.606 1.00 . A A . 22 ARG HH21 1 1 3 1039 1 1 22 ARG HH22 H 5.659 -10.238 -4.439 1.00 . A A . 22 ARG HH22 1 1 3 1040 1 1 22 ARG N N 4.730 -4.888 1.000 1.00 . A A . 22 ARG N 1 1 3 1041 1 1 22 ARG NE N 4.435 -8.344 -2.233 1.00 . A A . 22 ARG NE 1 1 3 1042 1 1 22 ARG NH1 N 5.798 -10.144 -1.950 1.00 . A A . 22 ARG NH1 1 1 3 1043 1 1 22 ARG NH2 N 5.137 -9.491 -4.026 1.00 . A A . 22 ARG NH2 1 1 3 1044 1 1 22 ARG O O 3.976 -6.949 3.867 1.00 . A A . 22 ARG O 1 1 3 1045 1 1 23 ARG C C 3.800 -4.230 5.649 1.00 . A A . 23 ARG C 1 1 3 1046 1 1 23 ARG CA C 5.143 -4.792 5.149 1.00 . A A . 23 ARG CA 1 1 3 1047 1 1 23 ARG CB C 6.289 -3.800 5.458 1.00 . A A . 23 ARG CB 1 1 3 1048 1 1 23 ARG CD C 7.180 -1.460 5.098 1.00 . A A . 23 ARG CD 1 1 3 1049 1 1 23 ARG CG C 6.079 -2.461 4.703 1.00 . A A . 23 ARG CG 1 1 3 1050 1 1 23 ARG CZ C 7.829 -0.310 7.166 1.00 . A A . 23 ARG CZ 1 1 3 1051 1 1 23 ARG H H 5.504 -4.380 3.063 1.00 . A A . 23 ARG H 1 1 3 1052 1 1 23 ARG HA H 5.336 -5.730 5.650 1.00 . A A . 23 ARG HA 1 1 3 1053 1 1 23 ARG HB2 H 6.329 -3.626 6.523 1.00 . A A . 23 ARG HB2 1 1 3 1054 1 1 23 ARG HB3 H 7.227 -4.240 5.151 1.00 . A A . 23 ARG HB3 1 1 3 1055 1 1 23 ARG HD2 H 8.159 -1.858 4.873 1.00 . A A . 23 ARG HD2 1 1 3 1056 1 1 23 ARG HD3 H 7.041 -0.528 4.570 1.00 . A A . 23 ARG HD3 1 1 3 1057 1 1 23 ARG HE H 6.440 -1.720 7.106 1.00 . A A . 23 ARG HE 1 1 3 1058 1 1 23 ARG HG2 H 6.132 -2.630 3.638 1.00 . A A . 23 ARG HG2 1 1 3 1059 1 1 23 ARG HG3 H 5.109 -2.049 4.932 1.00 . A A . 23 ARG HG3 1 1 3 1060 1 1 23 ARG HH11 H 8.790 0.252 5.498 1.00 . A A . 23 ARG HH11 1 1 3 1061 1 1 23 ARG HH12 H 9.258 1.075 6.949 1.00 . A A . 23 ARG HH12 1 1 3 1062 1 1 23 ARG HH21 H 7.013 -0.692 8.953 1.00 . A A . 23 ARG HH21 1 1 3 1063 1 1 23 ARG HH22 H 8.240 0.532 8.933 1.00 . A A . 23 ARG HH22 1 1 3 1064 1 1 23 ARG N N 5.095 -5.028 3.674 1.00 . A A . 23 ARG N 1 1 3 1065 1 1 23 ARG NE N 7.081 -1.205 6.572 1.00 . A A . 23 ARG NE 1 1 3 1066 1 1 23 ARG NH1 N 8.693 0.394 6.483 1.00 . A A . 23 ARG NH1 1 1 3 1067 1 1 23 ARG NH2 N 7.683 -0.144 8.451 1.00 . A A . 23 ARG NH2 1 1 3 1068 1 1 23 ARG O O 3.660 -3.909 6.814 1.00 . A A . 23 ARG O 1 1 3 1069 1 1 24 GLY C C 1.477 -2.082 5.118 1.00 . A A . 24 GLY C 1 1 3 1070 1 1 24 GLY CA C 1.505 -3.604 5.091 1.00 . A A . 24 GLY CA 1 1 3 1071 1 1 24 GLY H H 3.037 -4.400 3.820 1.00 . A A . 24 GLY H 1 1 3 1072 1 1 24 GLY HA2 H 0.802 -3.938 4.344 1.00 . A A . 24 GLY HA2 1 1 3 1073 1 1 24 GLY HA3 H 1.205 -3.988 6.055 1.00 . A A . 24 GLY HA3 1 1 3 1074 1 1 24 GLY N N 2.857 -4.130 4.745 1.00 . A A . 24 GLY N 1 1 3 1075 1 1 24 GLY O O 0.554 -1.511 5.665 1.00 . A A . 24 GLY O 1 1 3 1076 1 1 25 LYS C C 2.366 0.473 3.063 1.00 . A A . 25 LYS C 1 1 3 1077 1 1 25 LYS CA C 2.528 0.029 4.510 1.00 . A A . 25 LYS CA 1 1 3 1078 1 1 25 LYS CB C 3.876 0.550 5.034 1.00 . A A . 25 LYS CB 1 1 3 1079 1 1 25 LYS CD C 3.098 0.618 7.463 1.00 . A A . 25 LYS CD 1 1 3 1080 1 1 25 LYS CE C 3.405 0.100 8.878 1.00 . A A . 25 LYS CE 1 1 3 1081 1 1 25 LYS CG C 4.154 0.066 6.478 1.00 . A A . 25 LYS CG 1 1 3 1082 1 1 25 LYS H H 3.194 -1.992 4.102 1.00 . A A . 25 LYS H 1 1 3 1083 1 1 25 LYS HA H 1.715 0.439 5.089 1.00 . A A . 25 LYS HA 1 1 3 1084 1 1 25 LYS HB2 H 4.661 0.262 4.356 1.00 . A A . 25 LYS HB2 1 1 3 1085 1 1 25 LYS HB3 H 3.840 1.628 5.047 1.00 . A A . 25 LYS HB3 1 1 3 1086 1 1 25 LYS HD2 H 3.130 1.696 7.469 1.00 . A A . 25 LYS HD2 1 1 3 1087 1 1 25 LYS HD3 H 2.106 0.310 7.173 1.00 . A A . 25 LYS HD3 1 1 3 1088 1 1 25 LYS HE2 H 2.676 0.485 9.577 1.00 . A A . 25 LYS HE2 1 1 3 1089 1 1 25 LYS HE3 H 3.373 -0.979 8.901 1.00 . A A . 25 LYS HE3 1 1 3 1090 1 1 25 LYS HG2 H 4.153 -1.013 6.517 1.00 . A A . 25 LYS HG2 1 1 3 1091 1 1 25 LYS HG3 H 5.131 0.418 6.772 1.00 . A A . 25 LYS HG3 1 1 3 1092 1 1 25 LYS HZ1 H 4.876 1.559 9.094 1.00 . A A . 25 LYS HZ1 1 1 3 1093 1 1 25 LYS HZ2 H 4.865 0.398 10.335 1.00 . A A . 25 LYS HZ2 1 1 3 1094 1 1 25 LYS HZ3 H 5.483 -0.001 8.803 1.00 . A A . 25 LYS HZ3 1 1 3 1095 1 1 25 LYS N N 2.478 -1.468 4.532 1.00 . A A . 25 LYS N 1 1 3 1096 1 1 25 LYS NZ N 4.760 0.548 9.311 1.00 . A A . 25 LYS NZ 1 1 3 1097 1 1 25 LYS O O 2.594 -0.292 2.149 1.00 . A A . 25 LYS O 1 1 3 1098 1 1 26 CYS C C 3.043 2.710 0.808 1.00 . A A . 26 CYS C 1 1 3 1099 1 1 26 CYS CA C 1.769 2.276 1.541 1.00 . A A . 26 CYS CA 1 1 3 1100 1 1 26 CYS CB C 0.815 3.449 1.689 1.00 . A A . 26 CYS CB 1 1 3 1101 1 1 26 CYS H H 1.818 2.251 3.704 1.00 . A A . 26 CYS H 1 1 3 1102 1 1 26 CYS HA H 1.279 1.532 0.935 1.00 . A A . 26 CYS HA 1 1 3 1103 1 1 26 CYS HB2 H 1.225 4.137 2.406 1.00 . A A . 26 CYS HB2 1 1 3 1104 1 1 26 CYS HB3 H 0.722 3.953 0.744 1.00 . A A . 26 CYS HB3 1 1 3 1105 1 1 26 CYS N N 1.975 1.706 2.906 1.00 . A A . 26 CYS N 1 1 3 1106 1 1 26 CYS O O 4.142 2.627 1.319 1.00 . A A . 26 CYS O 1 1 3 1107 1 1 26 CYS SG S -0.860 3.045 2.220 1.00 . A A . 26 CYS SG 1 1 3 1108 1 1 27 NH2 HN1 H 2.033 3.242 -0.818 1.00 . A A . 27 NH2 HN1 1 1 3 1109 1 1 27 NH2 HN2 H 3.707 3.461 -0.918 1.00 . A A . 27 NH2 HN2 1 1 3 1110 1 1 27 NH2 N N 2.921 3.176 -0.408 1.00 . A A . 27 NH2 N 1 1 4 1111 1 1 1 CYS C C -5.965 6.535 1.621 1.00 . A A . 1 CYS C 1 1 4 1112 1 1 1 CYS CA C -7.079 6.108 0.655 1.00 . A A . 1 CYS CA 1 1 4 1113 1 1 1 CYS CB C -6.677 6.497 -0.774 1.00 . A A . 1 CYS CB 1 1 4 1114 1 1 1 CYS H1 H -8.157 7.826 1.122 1.00 . A A . 1 CYS H1 1 1 4 1115 1 1 1 CYS H2 H -9.065 6.632 0.326 1.00 . A A . 1 CYS H2 1 1 4 1116 1 1 1 CYS H3 H -8.662 6.440 1.965 1.00 . A A . 1 CYS H3 1 1 4 1117 1 1 1 CYS HA H -7.227 5.037 0.735 1.00 . A A . 1 CYS HA 1 1 4 1118 1 1 1 CYS HB2 H -5.824 5.901 -1.056 1.00 . A A . 1 CYS HB2 1 1 4 1119 1 1 1 CYS HB3 H -7.490 6.226 -1.431 1.00 . A A . 1 CYS HB3 1 1 4 1120 1 1 1 CYS N N -8.337 6.804 1.047 1.00 . A A . 1 CYS N 1 1 4 1121 1 1 1 CYS O O -5.845 7.695 1.964 1.00 . A A . 1 CYS O 1 1 4 1122 1 1 1 CYS SG S -6.286 8.235 -1.100 1.00 . A A . 1 CYS SG 1 1 4 1123 1 1 2 LYS C C -2.803 6.310 2.244 1.00 . A A . 2 LYS C 1 1 4 1124 1 1 2 LYS CA C -4.046 5.815 2.977 1.00 . A A . 2 LYS CA 1 1 4 1125 1 1 2 LYS CB C -3.721 4.509 3.725 1.00 . A A . 2 LYS CB 1 1 4 1126 1 1 2 LYS CD C -6.223 4.126 4.468 1.00 . A A . 2 LYS CD 1 1 4 1127 1 1 2 LYS CE C -6.848 5.540 4.538 1.00 . A A . 2 LYS CE 1 1 4 1128 1 1 2 LYS CG C -4.724 4.107 4.853 1.00 . A A . 2 LYS CG 1 1 4 1129 1 1 2 LYS H H -5.350 4.664 1.705 1.00 . A A . 2 LYS H 1 1 4 1130 1 1 2 LYS HA H -4.338 6.569 3.694 1.00 . A A . 2 LYS HA 1 1 4 1131 1 1 2 LYS HB2 H -3.674 3.703 3.007 1.00 . A A . 2 LYS HB2 1 1 4 1132 1 1 2 LYS HB3 H -2.746 4.595 4.175 1.00 . A A . 2 LYS HB3 1 1 4 1133 1 1 2 LYS HD2 H -6.362 3.717 3.479 1.00 . A A . 2 LYS HD2 1 1 4 1134 1 1 2 LYS HD3 H -6.739 3.504 5.172 1.00 . A A . 2 LYS HD3 1 1 4 1135 1 1 2 LYS HE2 H -6.886 5.846 5.573 1.00 . A A . 2 LYS HE2 1 1 4 1136 1 1 2 LYS HE3 H -6.312 6.294 3.999 1.00 . A A . 2 LYS HE3 1 1 4 1137 1 1 2 LYS HG2 H -4.472 3.106 5.177 1.00 . A A . 2 LYS HG2 1 1 4 1138 1 1 2 LYS HG3 H -4.569 4.765 5.696 1.00 . A A . 2 LYS HG3 1 1 4 1139 1 1 2 LYS HZ1 H -8.258 5.065 3.088 1.00 . A A . 2 LYS HZ1 1 1 4 1140 1 1 2 LYS HZ2 H -8.833 4.922 4.679 1.00 . A A . 2 LYS HZ2 1 1 4 1141 1 1 2 LYS HZ3 H -8.633 6.459 3.984 1.00 . A A . 2 LYS HZ3 1 1 4 1142 1 1 2 LYS N N -5.183 5.569 2.031 1.00 . A A . 2 LYS N 1 1 4 1143 1 1 2 LYS NZ N -8.249 5.493 4.035 1.00 . A A . 2 LYS NZ 1 1 4 1144 1 1 2 LYS O O -2.364 5.733 1.272 1.00 . A A . 2 LYS O 1 1 4 1145 1 1 3 GLY C C 0.136 7.027 2.141 1.00 . A A . 3 GLY C 1 1 4 1146 1 1 3 GLY CA C -1.043 8.010 2.172 1.00 . A A . 3 GLY CA 1 1 4 1147 1 1 3 GLY H H -2.706 7.767 3.557 1.00 . A A . 3 GLY H 1 1 4 1148 1 1 3 GLY HA2 H -1.262 8.334 1.163 1.00 . A A . 3 GLY HA2 1 1 4 1149 1 1 3 GLY HA3 H -0.767 8.870 2.765 1.00 . A A . 3 GLY HA3 1 1 4 1150 1 1 3 GLY N N -2.273 7.385 2.764 1.00 . A A . 3 GLY N 1 1 4 1151 1 1 3 GLY O O 0.078 5.979 2.752 1.00 . A A . 3 GLY O 1 1 4 1152 1 1 4 LYS C C 2.993 6.211 2.718 1.00 . A A . 4 LYS C 1 1 4 1153 1 1 4 LYS CA C 2.375 6.502 1.334 1.00 . A A . 4 LYS CA 1 1 4 1154 1 1 4 LYS CB C 3.384 7.199 0.392 1.00 . A A . 4 LYS CB 1 1 4 1155 1 1 4 LYS CD C 4.781 9.214 -0.118 1.00 . A A . 4 LYS CD 1 1 4 1156 1 1 4 LYS CE C 5.239 10.602 0.353 1.00 . A A . 4 LYS CE 1 1 4 1157 1 1 4 LYS CG C 3.808 8.595 0.909 1.00 . A A . 4 LYS CG 1 1 4 1158 1 1 4 LYS H H 1.184 8.240 0.951 1.00 . A A . 4 LYS H 1 1 4 1159 1 1 4 LYS HA H 2.072 5.571 0.878 1.00 . A A . 4 LYS HA 1 1 4 1160 1 1 4 LYS HB2 H 4.252 6.571 0.295 1.00 . A A . 4 LYS HB2 1 1 4 1161 1 1 4 LYS HB3 H 2.933 7.300 -0.586 1.00 . A A . 4 LYS HB3 1 1 4 1162 1 1 4 LYS HD2 H 5.644 8.574 -0.235 1.00 . A A . 4 LYS HD2 1 1 4 1163 1 1 4 LYS HD3 H 4.289 9.308 -1.075 1.00 . A A . 4 LYS HD3 1 1 4 1164 1 1 4 LYS HE2 H 4.394 11.261 0.482 1.00 . A A . 4 LYS HE2 1 1 4 1165 1 1 4 LYS HE3 H 5.771 10.527 1.289 1.00 . A A . 4 LYS HE3 1 1 4 1166 1 1 4 LYS HG2 H 2.939 9.230 1.017 1.00 . A A . 4 LYS HG2 1 1 4 1167 1 1 4 LYS HG3 H 4.298 8.502 1.866 1.00 . A A . 4 LYS HG3 1 1 4 1168 1 1 4 LYS HZ1 H 6.103 10.638 -1.541 1.00 . A A . 4 LYS HZ1 1 1 4 1169 1 1 4 LYS HZ2 H 5.869 12.174 -0.859 1.00 . A A . 4 LYS HZ2 1 1 4 1170 1 1 4 LYS HZ3 H 7.129 11.180 -0.301 1.00 . A A . 4 LYS HZ3 1 1 4 1171 1 1 4 LYS N N 1.176 7.387 1.430 1.00 . A A . 4 LYS N 1 1 4 1172 1 1 4 LYS NZ N 6.154 11.193 -0.662 1.00 . A A . 4 LYS NZ 1 1 4 1173 1 1 4 LYS O O 3.098 7.088 3.554 1.00 . A A . 4 LYS O 1 1 4 1174 1 1 5 GLY C C 2.966 4.326 5.317 1.00 . A A . 5 GLY C 1 1 4 1175 1 1 5 GLY CA C 3.993 4.507 4.186 1.00 . A A . 5 GLY CA 1 1 4 1176 1 1 5 GLY H H 3.253 4.327 2.177 1.00 . A A . 5 GLY H 1 1 4 1177 1 1 5 GLY HA2 H 4.475 3.560 4.008 1.00 . A A . 5 GLY HA2 1 1 4 1178 1 1 5 GLY HA3 H 4.737 5.218 4.509 1.00 . A A . 5 GLY HA3 1 1 4 1179 1 1 5 GLY N N 3.375 4.971 2.902 1.00 . A A . 5 GLY N 1 1 4 1180 1 1 5 GLY O O 3.342 4.013 6.429 1.00 . A A . 5 GLY O 1 1 4 1181 1 1 6 ALA C C 0.032 2.950 5.998 1.00 . A A . 6 ALA C 1 1 4 1182 1 1 6 ALA CA C 0.623 4.379 6.029 1.00 . A A . 6 ALA CA 1 1 4 1183 1 1 6 ALA CB C -0.463 5.414 5.722 1.00 . A A . 6 ALA CB 1 1 4 1184 1 1 6 ALA H H 1.472 4.775 4.088 1.00 . A A . 6 ALA H 1 1 4 1185 1 1 6 ALA HA H 1.038 4.576 7.006 1.00 . A A . 6 ALA HA 1 1 4 1186 1 1 6 ALA HB1 H -0.045 6.410 5.762 1.00 . A A . 6 ALA HB1 1 1 4 1187 1 1 6 ALA HB2 H -0.861 5.241 4.736 1.00 . A A . 6 ALA HB2 1 1 4 1188 1 1 6 ALA HB3 H -1.273 5.350 6.433 1.00 . A A . 6 ALA HB3 1 1 4 1189 1 1 6 ALA N N 1.708 4.526 5.006 1.00 . A A . 6 ALA N 1 1 4 1190 1 1 6 ALA O O 0.072 2.311 4.964 1.00 . A A . 6 ALA O 1 1 4 1191 1 1 7 PRO C C -2.104 0.715 6.239 1.00 . A A . 7 PRO C 1 1 4 1192 1 1 7 PRO CA C -0.991 1.076 7.246 1.00 . A A . 7 PRO CA 1 1 4 1193 1 1 7 PRO CB C -1.460 0.937 8.703 1.00 . A A . 7 PRO CB 1 1 4 1194 1 1 7 PRO CD C -0.679 3.271 8.372 1.00 . A A . 7 PRO CD 1 1 4 1195 1 1 7 PRO CG C -1.421 2.336 9.335 1.00 . A A . 7 PRO CG 1 1 4 1196 1 1 7 PRO HA H -0.151 0.420 7.092 1.00 . A A . 7 PRO HA 1 1 4 1197 1 1 7 PRO HB2 H -2.464 0.538 8.758 1.00 . A A . 7 PRO HB2 1 1 4 1198 1 1 7 PRO HB3 H -0.798 0.271 9.237 1.00 . A A . 7 PRO HB3 1 1 4 1199 1 1 7 PRO HD2 H -1.261 4.157 8.172 1.00 . A A . 7 PRO HD2 1 1 4 1200 1 1 7 PRO HD3 H 0.288 3.542 8.769 1.00 . A A . 7 PRO HD3 1 1 4 1201 1 1 7 PRO HG2 H -2.427 2.697 9.494 1.00 . A A . 7 PRO HG2 1 1 4 1202 1 1 7 PRO HG3 H -0.908 2.300 10.285 1.00 . A A . 7 PRO HG3 1 1 4 1203 1 1 7 PRO N N -0.499 2.482 7.112 1.00 . A A . 7 PRO N 1 1 4 1204 1 1 7 PRO O O -3.260 1.037 6.440 1.00 . A A . 7 PRO O 1 1 4 1205 1 1 8 CYS C C -2.807 -1.902 3.947 1.00 . A A . 8 CYS C 1 1 4 1206 1 1 8 CYS CA C -2.647 -0.384 4.100 1.00 . A A . 8 CYS CA 1 1 4 1207 1 1 8 CYS CB C -2.153 0.192 2.805 1.00 . A A . 8 CYS CB 1 1 4 1208 1 1 8 CYS H H -0.746 -0.159 5.087 1.00 . A A . 8 CYS H 1 1 4 1209 1 1 8 CYS HA H -3.619 0.038 4.298 1.00 . A A . 8 CYS HA 1 1 4 1210 1 1 8 CYS HB2 H -2.698 -0.229 1.976 1.00 . A A . 8 CYS HB2 1 1 4 1211 1 1 8 CYS HB3 H -2.367 1.239 2.776 1.00 . A A . 8 CYS HB3 1 1 4 1212 1 1 8 CYS N N -1.701 0.053 5.182 1.00 . A A . 8 CYS N 1 1 4 1213 1 1 8 CYS O O -2.338 -2.682 4.753 1.00 . A A . 8 CYS O 1 1 4 1214 1 1 8 CYS SG S -0.403 -0.128 2.481 1.00 . A A . 8 CYS SG 1 1 4 1215 1 1 9 ARG C C -3.794 -3.735 0.944 1.00 . A A . 9 ARG C 1 1 4 1216 1 1 9 ARG CA C -3.784 -3.641 2.495 1.00 . A A . 9 ARG CA 1 1 4 1217 1 1 9 ARG CB C -5.133 -3.960 3.116 1.00 . A A . 9 ARG CB 1 1 4 1218 1 1 9 ARG CD C -6.950 -5.659 3.391 1.00 . A A . 9 ARG CD 1 1 4 1219 1 1 9 ARG CG C -5.556 -5.382 2.789 1.00 . A A . 9 ARG CG 1 1 4 1220 1 1 9 ARG CZ C -8.198 -3.537 3.514 1.00 . A A . 9 ARG CZ 1 1 4 1221 1 1 9 ARG H H -3.823 -1.530 2.292 1.00 . A A . 9 ARG H 1 1 4 1222 1 1 9 ARG HA H -3.017 -4.292 2.890 1.00 . A A . 9 ARG HA 1 1 4 1223 1 1 9 ARG HB2 H -5.076 -3.831 4.188 1.00 . A A . 9 ARG HB2 1 1 4 1224 1 1 9 ARG HB3 H -5.849 -3.256 2.721 1.00 . A A . 9 ARG HB3 1 1 4 1225 1 1 9 ARG HD2 H -7.288 -6.639 3.084 1.00 . A A . 9 ARG HD2 1 1 4 1226 1 1 9 ARG HD3 H -6.922 -5.623 4.469 1.00 . A A . 9 ARG HD3 1 1 4 1227 1 1 9 ARG HE H -8.377 -4.820 2.013 1.00 . A A . 9 ARG HE 1 1 4 1228 1 1 9 ARG HG2 H -5.560 -5.488 1.722 1.00 . A A . 9 ARG HG2 1 1 4 1229 1 1 9 ARG HG3 H -4.841 -6.081 3.200 1.00 . A A . 9 ARG HG3 1 1 4 1230 1 1 9 ARG HH11 H -6.963 -3.894 5.059 1.00 . A A . 9 ARG HH11 1 1 4 1231 1 1 9 ARG HH12 H -7.847 -2.409 5.128 1.00 . A A . 9 ARG HH12 1 1 4 1232 1 1 9 ARG HH21 H -9.486 -2.938 2.113 1.00 . A A . 9 ARG HH21 1 1 4 1233 1 1 9 ARG HH22 H -9.280 -1.856 3.449 1.00 . A A . 9 ARG HH22 1 1 4 1234 1 1 9 ARG N N -3.487 -2.237 2.877 1.00 . A A . 9 ARG N 1 1 4 1235 1 1 9 ARG NE N -7.928 -4.648 2.866 1.00 . A A . 9 ARG NE 1 1 4 1236 1 1 9 ARG NH1 N -7.624 -3.261 4.656 1.00 . A A . 9 ARG NH1 1 1 4 1237 1 1 9 ARG NH2 N -9.055 -2.712 2.984 1.00 . A A . 9 ARG NH2 1 1 4 1238 1 1 9 ARG O O -4.708 -3.287 0.270 1.00 . A A . 9 ARG O 1 1 4 1239 1 1 10 LYS C C -3.735 -5.198 -1.657 1.00 . A A . 10 LYS C 1 1 4 1240 1 1 10 LYS CA C -2.509 -4.548 -1.012 1.00 . A A . 10 LYS CA 1 1 4 1241 1 1 10 LYS CB C -1.312 -5.503 -1.308 1.00 . A A . 10 LYS CB 1 1 4 1242 1 1 10 LYS CD C -0.061 -5.895 0.935 1.00 . A A . 10 LYS CD 1 1 4 1243 1 1 10 LYS CE C -0.013 -7.431 0.783 1.00 . A A . 10 LYS CE 1 1 4 1244 1 1 10 LYS CG C -0.043 -5.202 -0.468 1.00 . A A . 10 LYS CG 1 1 4 1245 1 1 10 LYS H H -2.070 -4.649 1.093 1.00 . A A . 10 LYS H 1 1 4 1246 1 1 10 LYS HA H -2.346 -3.588 -1.481 1.00 . A A . 10 LYS HA 1 1 4 1247 1 1 10 LYS HB2 H -1.624 -6.526 -1.164 1.00 . A A . 10 LYS HB2 1 1 4 1248 1 1 10 LYS HB3 H -1.051 -5.389 -2.350 1.00 . A A . 10 LYS HB3 1 1 4 1249 1 1 10 LYS HD2 H 0.790 -5.567 1.500 1.00 . A A . 10 LYS HD2 1 1 4 1250 1 1 10 LYS HD3 H -0.929 -5.668 1.524 1.00 . A A . 10 LYS HD3 1 1 4 1251 1 1 10 LYS HE2 H 0.021 -7.892 1.760 1.00 . A A . 10 LYS HE2 1 1 4 1252 1 1 10 LYS HE3 H -0.881 -7.802 0.260 1.00 . A A . 10 LYS HE3 1 1 4 1253 1 1 10 LYS HG2 H 0.837 -5.507 -1.016 1.00 . A A . 10 LYS HG2 1 1 4 1254 1 1 10 LYS HG3 H 0.018 -4.138 -0.310 1.00 . A A . 10 LYS HG3 1 1 4 1255 1 1 10 LYS HZ1 H 1.977 -7.161 0.221 1.00 . A A . 10 LYS HZ1 1 1 4 1256 1 1 10 LYS HZ2 H 1.505 -8.788 0.333 1.00 . A A . 10 LYS HZ2 1 1 4 1257 1 1 10 LYS HZ3 H 1.004 -7.844 -0.987 1.00 . A A . 10 LYS HZ3 1 1 4 1258 1 1 10 LYS N N -2.734 -4.335 0.457 1.00 . A A . 10 LYS N 1 1 4 1259 1 1 10 LYS NZ N 1.210 -7.838 0.032 1.00 . A A . 10 LYS NZ 1 1 4 1260 1 1 10 LYS O O -4.025 -4.951 -2.813 1.00 . A A . 10 LYS O 1 1 4 1261 1 1 11 THR C C -6.474 -5.968 -2.259 1.00 . A A . 11 THR C 1 1 4 1262 1 1 11 THR CA C -5.626 -6.762 -1.267 1.00 . A A . 11 THR CA 1 1 4 1263 1 1 11 THR CB C -6.481 -7.052 -0.028 1.00 . A A . 11 THR CB 1 1 4 1264 1 1 11 THR CG2 C -7.634 -8.029 -0.337 1.00 . A A . 11 THR CG2 1 1 4 1265 1 1 11 THR H H -4.034 -6.126 0.052 1.00 . A A . 11 THR H 1 1 4 1266 1 1 11 THR HA H -5.322 -7.689 -1.734 1.00 . A A . 11 THR HA 1 1 4 1267 1 1 11 THR HB H -6.828 -6.137 0.441 1.00 . A A . 11 THR HB 1 1 4 1268 1 1 11 THR HG1 H -5.253 -8.516 0.344 1.00 . A A . 11 THR HG1 1 1 4 1269 1 1 11 THR HG21 H -7.243 -8.970 -0.696 1.00 . A A . 11 THR HG21 1 1 4 1270 1 1 11 THR HG22 H -8.211 -8.211 0.558 1.00 . A A . 11 THR HG22 1 1 4 1271 1 1 11 THR HG23 H -8.288 -7.612 -1.088 1.00 . A A . 11 THR HG23 1 1 4 1272 1 1 11 THR N N -4.387 -6.010 -0.858 1.00 . A A . 11 THR N 1 1 4 1273 1 1 11 THR O O -6.915 -6.490 -3.266 1.00 . A A . 11 THR O 1 1 4 1274 1 1 11 THR OG1 O -5.634 -7.790 0.842 1.00 . A A . 11 THR OG1 1 1 4 1275 1 1 12 MET C C -6.780 -2.457 -2.913 1.00 . A A . 12 MET C 1 1 4 1276 1 1 12 MET CA C -7.472 -3.808 -2.782 1.00 . A A . 12 MET CA 1 1 4 1277 1 1 12 MET CB C -8.870 -3.647 -2.148 1.00 . A A . 12 MET CB 1 1 4 1278 1 1 12 MET CE C -10.791 -4.514 0.581 1.00 . A A . 12 MET CE 1 1 4 1279 1 1 12 MET CG C -8.796 -3.123 -0.698 1.00 . A A . 12 MET CG 1 1 4 1280 1 1 12 MET H H -6.269 -4.376 -1.088 1.00 . A A . 12 MET H 1 1 4 1281 1 1 12 MET HA H -7.567 -4.232 -3.771 1.00 . A A . 12 MET HA 1 1 4 1282 1 1 12 MET HB2 H -9.478 -2.985 -2.749 1.00 . A A . 12 MET HB2 1 1 4 1283 1 1 12 MET HB3 H -9.338 -4.615 -2.126 1.00 . A A . 12 MET HB3 1 1 4 1284 1 1 12 MET HE1 H -9.904 -5.018 0.936 1.00 . A A . 12 MET HE1 1 1 4 1285 1 1 12 MET HE2 H -11.506 -4.489 1.391 1.00 . A A . 12 MET HE2 1 1 4 1286 1 1 12 MET HE3 H -11.215 -5.044 -0.259 1.00 . A A . 12 MET HE3 1 1 4 1287 1 1 12 MET HG2 H -8.267 -3.851 -0.103 1.00 . A A . 12 MET HG2 1 1 4 1288 1 1 12 MET HG3 H -8.225 -2.209 -0.662 1.00 . A A . 12 MET HG3 1 1 4 1289 1 1 12 MET N N -6.664 -4.721 -1.919 1.00 . A A . 12 MET N 1 1 4 1290 1 1 12 MET O O -7.382 -1.493 -3.344 1.00 . A A . 12 MET O 1 1 4 1291 1 1 12 MET SD S -10.390 -2.813 0.106 1.00 . A A . 12 MET SD 1 1 4 1292 1 1 13 TYR C C -5.444 -0.105 -1.864 1.00 . A A . 13 TYR C 1 1 4 1293 1 1 13 TYR CA C -4.692 -1.213 -2.591 1.00 . A A . 13 TYR CA 1 1 4 1294 1 1 13 TYR CB C -4.430 -0.862 -4.073 1.00 . A A . 13 TYR CB 1 1 4 1295 1 1 13 TYR CD1 C -2.344 -2.273 -4.291 1.00 . A A . 13 TYR CD1 1 1 4 1296 1 1 13 TYR CD2 C -4.213 -2.841 -5.652 1.00 . A A . 13 TYR CD2 1 1 4 1297 1 1 13 TYR CE1 C -1.627 -3.315 -4.837 1.00 . A A . 13 TYR CE1 1 1 4 1298 1 1 13 TYR CE2 C -3.495 -3.883 -6.197 1.00 . A A . 13 TYR CE2 1 1 4 1299 1 1 13 TYR CG C -3.642 -2.025 -4.694 1.00 . A A . 13 TYR CG 1 1 4 1300 1 1 13 TYR CZ C -2.199 -4.128 -5.792 1.00 . A A . 13 TYR CZ 1 1 4 1301 1 1 13 TYR H H -5.117 -3.275 -2.205 1.00 . A A . 13 TYR H 1 1 4 1302 1 1 13 TYR HA H -3.762 -1.401 -2.074 1.00 . A A . 13 TYR HA 1 1 4 1303 1 1 13 TYR HB2 H -5.354 -0.727 -4.612 1.00 . A A . 13 TYR HB2 1 1 4 1304 1 1 13 TYR HB3 H -3.838 0.038 -4.147 1.00 . A A . 13 TYR HB3 1 1 4 1305 1 1 13 TYR HD1 H -1.884 -1.645 -3.543 1.00 . A A . 13 TYR HD1 1 1 4 1306 1 1 13 TYR HD2 H -5.228 -2.661 -5.979 1.00 . A A . 13 TYR HD2 1 1 4 1307 1 1 13 TYR HE1 H -0.614 -3.496 -4.510 1.00 . A A . 13 TYR HE1 1 1 4 1308 1 1 13 TYR HE2 H -3.951 -4.513 -6.946 1.00 . A A . 13 TYR HE2 1 1 4 1309 1 1 13 TYR HH H -1.351 -4.981 -7.272 1.00 . A A . 13 TYR HH 1 1 4 1310 1 1 13 TYR N N -5.524 -2.448 -2.535 1.00 . A A . 13 TYR N 1 1 4 1311 1 1 13 TYR O O -6.034 0.790 -2.439 1.00 . A A . 13 TYR O 1 1 4 1312 1 1 13 TYR OH O -1.481 -5.172 -6.340 1.00 . A A . 13 TYR OH 1 1 4 1313 1 1 14 ASP C C -5.164 1.978 0.515 1.00 . A A . 14 ASP C 1 1 4 1314 1 1 14 ASP CA C -6.009 0.699 0.384 1.00 . A A . 14 ASP CA 1 1 4 1315 1 1 14 ASP CB C -6.145 -0.072 1.720 1.00 . A A . 14 ASP CB 1 1 4 1316 1 1 14 ASP CG C -6.726 0.800 2.848 1.00 . A A . 14 ASP CG 1 1 4 1317 1 1 14 ASP H H -4.860 -1.009 -0.221 1.00 . A A . 14 ASP H 1 1 4 1318 1 1 14 ASP HA H -6.987 0.965 0.010 1.00 . A A . 14 ASP HA 1 1 4 1319 1 1 14 ASP HB2 H -6.807 -0.903 1.570 1.00 . A A . 14 ASP HB2 1 1 4 1320 1 1 14 ASP HB3 H -5.197 -0.487 2.015 1.00 . A A . 14 ASP HB3 1 1 4 1321 1 1 14 ASP N N -5.363 -0.247 -0.570 1.00 . A A . 14 ASP N 1 1 4 1322 1 1 14 ASP O O -5.294 2.719 1.468 1.00 . A A . 14 ASP O 1 1 4 1323 1 1 14 ASP OD1 O -7.877 1.181 2.711 1.00 . A A . 14 ASP OD1 1 1 4 1324 1 1 14 ASP OD2 O -5.978 1.037 3.784 1.00 . A A . 14 ASP OD2 1 1 4 1325 1 1 15 CYS C C -3.701 4.331 -1.659 1.00 . A A . 15 CYS C 1 1 4 1326 1 1 15 CYS CA C -3.425 3.392 -0.485 1.00 . A A . 15 CYS CA 1 1 4 1327 1 1 15 CYS CB C -1.984 2.963 -0.598 1.00 . A A . 15 CYS CB 1 1 4 1328 1 1 15 CYS H H -4.272 1.536 -1.193 1.00 . A A . 15 CYS H 1 1 4 1329 1 1 15 CYS HA H -3.561 3.942 0.431 1.00 . A A . 15 CYS HA 1 1 4 1330 1 1 15 CYS HB2 H -1.831 2.496 -1.559 1.00 . A A . 15 CYS HB2 1 1 4 1331 1 1 15 CYS HB3 H -1.360 3.845 -0.560 1.00 . A A . 15 CYS HB3 1 1 4 1332 1 1 15 CYS N N -4.318 2.190 -0.465 1.00 . A A . 15 CYS N 1 1 4 1333 1 1 15 CYS O O -4.167 3.914 -2.702 1.00 . A A . 15 CYS O 1 1 4 1334 1 1 15 CYS SG S -1.380 1.825 0.659 1.00 . A A . 15 CYS SG 1 1 4 1335 1 1 16 CYS C C -2.534 6.338 -3.560 1.00 . A A . 16 CYS C 1 1 4 1336 1 1 16 CYS CA C -3.583 6.628 -2.472 1.00 . A A . 16 CYS CA 1 1 4 1337 1 1 16 CYS CB C -3.350 7.992 -1.831 1.00 . A A . 16 CYS CB 1 1 4 1338 1 1 16 CYS H H -3.022 5.857 -0.571 1.00 . A A . 16 CYS H 1 1 4 1339 1 1 16 CYS HA H -4.578 6.546 -2.882 1.00 . A A . 16 CYS HA 1 1 4 1340 1 1 16 CYS HB2 H -2.323 8.043 -1.497 1.00 . A A . 16 CYS HB2 1 1 4 1341 1 1 16 CYS HB3 H -3.487 8.752 -2.580 1.00 . A A . 16 CYS HB3 1 1 4 1342 1 1 16 CYS N N -3.389 5.583 -1.433 1.00 . A A . 16 CYS N 1 1 4 1343 1 1 16 CYS O O -2.744 6.603 -4.728 1.00 . A A . 16 CYS O 1 1 4 1344 1 1 16 CYS SG S -4.394 8.418 -0.416 1.00 . A A . 16 CYS SG 1 1 4 1345 1 1 17 SER C C -0.720 4.269 -4.904 1.00 . A A . 17 SER C 1 1 4 1346 1 1 17 SER CA C -0.287 5.424 -3.988 1.00 . A A . 17 SER CA 1 1 4 1347 1 1 17 SER CB C 0.893 4.993 -3.100 1.00 . A A . 17 SER CB 1 1 4 1348 1 1 17 SER H H -1.354 5.618 -2.140 1.00 . A A . 17 SER H 1 1 4 1349 1 1 17 SER HA H -0.012 6.278 -4.591 1.00 . A A . 17 SER HA 1 1 4 1350 1 1 17 SER HB2 H 1.210 5.798 -2.454 1.00 . A A . 17 SER HB2 1 1 4 1351 1 1 17 SER HB3 H 0.648 4.121 -2.510 1.00 . A A . 17 SER HB3 1 1 4 1352 1 1 17 SER HG H 2.437 5.472 -4.183 1.00 . A A . 17 SER HG 1 1 4 1353 1 1 17 SER N N -1.432 5.793 -3.103 1.00 . A A . 17 SER N 1 1 4 1354 1 1 17 SER O O -0.212 4.118 -5.999 1.00 . A A . 17 SER O 1 1 4 1355 1 1 17 SER OG O 1.937 4.671 -4.007 1.00 . A A . 17 SER OG 1 1 4 1356 1 1 18 GLY C C -1.192 1.157 -5.246 1.00 . A A . 18 GLY C 1 1 4 1357 1 1 18 GLY CA C -2.182 2.326 -5.182 1.00 . A A . 18 GLY CA 1 1 4 1358 1 1 18 GLY H H -2.018 3.677 -3.520 1.00 . A A . 18 GLY H 1 1 4 1359 1 1 18 GLY HA2 H -3.093 1.990 -4.713 1.00 . A A . 18 GLY HA2 1 1 4 1360 1 1 18 GLY HA3 H -2.398 2.648 -6.186 1.00 . A A . 18 GLY HA3 1 1 4 1361 1 1 18 GLY N N -1.655 3.490 -4.412 1.00 . A A . 18 GLY N 1 1 4 1362 1 1 18 GLY O O -1.468 0.158 -5.879 1.00 . A A . 18 GLY O 1 1 4 1363 1 1 19 SER C C 1.415 0.051 -3.101 1.00 . A A . 19 SER C 1 1 4 1364 1 1 19 SER CA C 0.988 0.276 -4.559 1.00 . A A . 19 SER CA 1 1 4 1365 1 1 19 SER CB C 2.162 0.770 -5.444 1.00 . A A . 19 SER CB 1 1 4 1366 1 1 19 SER H H 0.075 2.164 -4.104 1.00 . A A . 19 SER H 1 1 4 1367 1 1 19 SER HA H 0.598 -0.652 -4.948 1.00 . A A . 19 SER HA 1 1 4 1368 1 1 19 SER HB2 H 2.993 0.082 -5.417 1.00 . A A . 19 SER HB2 1 1 4 1369 1 1 19 SER HB3 H 1.844 0.926 -6.464 1.00 . A A . 19 SER HB3 1 1 4 1370 1 1 19 SER HG H 3.224 1.841 -4.214 1.00 . A A . 19 SER HG 1 1 4 1371 1 1 19 SER N N -0.073 1.328 -4.589 1.00 . A A . 19 SER N 1 1 4 1372 1 1 19 SER O O 2.497 0.420 -2.682 1.00 . A A . 19 SER O 1 1 4 1373 1 1 19 SER OG O 2.558 2.014 -4.883 1.00 . A A . 19 SER OG 1 1 4 1374 1 1 20 CYS C C 1.881 -1.911 -0.719 1.00 . A A . 20 CYS C 1 1 4 1375 1 1 20 CYS CA C 0.792 -0.851 -0.930 1.00 . A A . 20 CYS CA 1 1 4 1376 1 1 20 CYS CB C -0.517 -1.311 -0.257 1.00 . A A . 20 CYS CB 1 1 4 1377 1 1 20 CYS H H -0.332 -0.832 -2.765 1.00 . A A . 20 CYS H 1 1 4 1378 1 1 20 CYS HA H 1.113 0.069 -0.468 1.00 . A A . 20 CYS HA 1 1 4 1379 1 1 20 CYS HB2 H -1.205 -0.481 -0.280 1.00 . A A . 20 CYS HB2 1 1 4 1380 1 1 20 CYS HB3 H -0.979 -2.099 -0.817 1.00 . A A . 20 CYS HB3 1 1 4 1381 1 1 20 CYS N N 0.521 -0.562 -2.367 1.00 . A A . 20 CYS N 1 1 4 1382 1 1 20 CYS O O 1.883 -2.957 -1.339 1.00 . A A . 20 CYS O 1 1 4 1383 1 1 20 CYS SG S -0.405 -1.866 1.459 1.00 . A A . 20 CYS SG 1 1 4 1384 1 1 21 GLY C C 3.439 -3.708 1.264 1.00 . A A . 21 GLY C 1 1 4 1385 1 1 21 GLY CA C 3.928 -2.447 0.537 1.00 . A A . 21 GLY CA 1 1 4 1386 1 1 21 GLY H H 2.692 -0.697 0.605 1.00 . A A . 21 GLY H 1 1 4 1387 1 1 21 GLY HA2 H 4.463 -2.726 -0.359 1.00 . A A . 21 GLY HA2 1 1 4 1388 1 1 21 GLY HA3 H 4.591 -1.900 1.193 1.00 . A A . 21 GLY HA3 1 1 4 1389 1 1 21 GLY N N 2.779 -1.568 0.168 1.00 . A A . 21 GLY N 1 1 4 1390 1 1 21 GLY O O 2.443 -3.689 1.964 1.00 . A A . 21 GLY O 1 1 4 1391 1 1 22 ARG C C 4.163 -6.078 3.195 1.00 . A A . 22 ARG C 1 1 4 1392 1 1 22 ARG CA C 3.859 -6.086 1.691 1.00 . A A . 22 ARG CA 1 1 4 1393 1 1 22 ARG CB C 4.682 -7.168 0.940 1.00 . A A . 22 ARG CB 1 1 4 1394 1 1 22 ARG CD C 5.060 -9.658 0.623 1.00 . A A . 22 ARG CD 1 1 4 1395 1 1 22 ARG CG C 4.320 -8.589 1.451 1.00 . A A . 22 ARG CG 1 1 4 1396 1 1 22 ARG CZ C 7.220 -10.177 1.681 1.00 . A A . 22 ARG CZ 1 1 4 1397 1 1 22 ARG H H 4.977 -4.674 0.507 1.00 . A A . 22 ARG H 1 1 4 1398 1 1 22 ARG HA H 2.805 -6.276 1.562 1.00 . A A . 22 ARG HA 1 1 4 1399 1 1 22 ARG HB2 H 4.469 -7.102 -0.118 1.00 . A A . 22 ARG HB2 1 1 4 1400 1 1 22 ARG HB3 H 5.736 -6.985 1.087 1.00 . A A . 22 ARG HB3 1 1 4 1401 1 1 22 ARG HD2 H 4.758 -10.650 0.924 1.00 . A A . 22 ARG HD2 1 1 4 1402 1 1 22 ARG HD3 H 4.829 -9.535 -0.424 1.00 . A A . 22 ARG HD3 1 1 4 1403 1 1 22 ARG HE H 7.010 -8.841 0.236 1.00 . A A . 22 ARG HE 1 1 4 1404 1 1 22 ARG HG2 H 4.614 -8.695 2.484 1.00 . A A . 22 ARG HG2 1 1 4 1405 1 1 22 ARG HG3 H 3.255 -8.750 1.379 1.00 . A A . 22 ARG HG3 1 1 4 1406 1 1 22 ARG HH11 H 5.650 -11.207 2.397 1.00 . A A . 22 ARG HH11 1 1 4 1407 1 1 22 ARG HH12 H 7.179 -11.567 3.120 1.00 . A A . 22 ARG HH12 1 1 4 1408 1 1 22 ARG HH21 H 8.935 -9.291 1.158 1.00 . A A . 22 ARG HH21 1 1 4 1409 1 1 22 ARG HH22 H 9.056 -10.473 2.419 1.00 . A A . 22 ARG HH22 1 1 4 1410 1 1 22 ARG N N 4.185 -4.766 1.069 1.00 . A A . 22 ARG N 1 1 4 1411 1 1 22 ARG NE N 6.537 -9.487 0.799 1.00 . A A . 22 ARG NE 1 1 4 1412 1 1 22 ARG NH1 N 6.635 -11.052 2.458 1.00 . A A . 22 ARG NH1 1 1 4 1413 1 1 22 ARG NH2 N 8.504 -9.964 1.759 1.00 . A A . 22 ARG NH2 1 1 4 1414 1 1 22 ARG O O 3.738 -6.961 3.914 1.00 . A A . 22 ARG O 1 1 4 1415 1 1 23 ARG C C 4.021 -4.407 5.843 1.00 . A A . 23 ARG C 1 1 4 1416 1 1 23 ARG CA C 5.233 -4.969 5.077 1.00 . A A . 23 ARG CA 1 1 4 1417 1 1 23 ARG CB C 6.458 -4.035 5.232 1.00 . A A . 23 ARG CB 1 1 4 1418 1 1 23 ARG CD C 7.398 -1.732 4.880 1.00 . A A . 23 ARG CD 1 1 4 1419 1 1 23 ARG CG C 6.161 -2.622 4.674 1.00 . A A . 23 ARG CG 1 1 4 1420 1 1 23 ARG CZ C 7.622 0.717 4.809 1.00 . A A . 23 ARG CZ 1 1 4 1421 1 1 23 ARG H H 5.199 -4.392 2.999 1.00 . A A . 23 ARG H 1 1 4 1422 1 1 23 ARG HA H 5.469 -5.950 5.464 1.00 . A A . 23 ARG HA 1 1 4 1423 1 1 23 ARG HB2 H 6.724 -3.965 6.278 1.00 . A A . 23 ARG HB2 1 1 4 1424 1 1 23 ARG HB3 H 7.294 -4.464 4.699 1.00 . A A . 23 ARG HB3 1 1 4 1425 1 1 23 ARG HD2 H 7.623 -1.659 5.933 1.00 . A A . 23 ARG HD2 1 1 4 1426 1 1 23 ARG HD3 H 8.254 -2.132 4.355 1.00 . A A . 23 ARG HD3 1 1 4 1427 1 1 23 ARG HE H 6.442 -0.303 3.592 1.00 . A A . 23 ARG HE 1 1 4 1428 1 1 23 ARG HG2 H 5.933 -2.676 3.621 1.00 . A A . 23 ARG HG2 1 1 4 1429 1 1 23 ARG HG3 H 5.319 -2.188 5.189 1.00 . A A . 23 ARG HG3 1 1 4 1430 1 1 23 ARG HH11 H 8.736 -0.206 6.200 1.00 . A A . 23 ARG HH11 1 1 4 1431 1 1 23 ARG HH12 H 8.878 1.517 6.145 1.00 . A A . 23 ARG HH12 1 1 4 1432 1 1 23 ARG HH21 H 6.617 1.867 3.515 1.00 . A A . 23 ARG HH21 1 1 4 1433 1 1 23 ARG HH22 H 7.669 2.707 4.606 1.00 . A A . 23 ARG HH22 1 1 4 1434 1 1 23 ARG N N 4.885 -5.075 3.627 1.00 . A A . 23 ARG N 1 1 4 1435 1 1 23 ARG NE N 7.079 -0.377 4.332 1.00 . A A . 23 ARG NE 1 1 4 1436 1 1 23 ARG NH1 N 8.478 0.670 5.795 1.00 . A A . 23 ARG NH1 1 1 4 1437 1 1 23 ARG NH2 N 7.275 1.852 4.268 1.00 . A A . 23 ARG NH2 1 1 4 1438 1 1 23 ARG O O 4.067 -4.255 7.049 1.00 . A A . 23 ARG O 1 1 4 1439 1 1 24 GLY C C 1.675 -2.041 5.649 1.00 . A A . 24 GLY C 1 1 4 1440 1 1 24 GLY CA C 1.723 -3.567 5.710 1.00 . A A . 24 GLY CA 1 1 4 1441 1 1 24 GLY H H 3.003 -4.255 4.136 1.00 . A A . 24 GLY H 1 1 4 1442 1 1 24 GLY HA2 H 0.881 -3.958 5.161 1.00 . A A . 24 GLY HA2 1 1 4 1443 1 1 24 GLY HA3 H 1.644 -3.885 6.739 1.00 . A A . 24 GLY HA3 1 1 4 1444 1 1 24 GLY N N 2.972 -4.115 5.106 1.00 . A A . 24 GLY N 1 1 4 1445 1 1 24 GLY O O 0.792 -1.449 6.236 1.00 . A A . 24 GLY O 1 1 4 1446 1 1 25 LYS C C 2.448 0.386 3.355 1.00 . A A . 25 LYS C 1 1 4 1447 1 1 25 LYS CA C 2.648 0.046 4.823 1.00 . A A . 25 LYS CA 1 1 4 1448 1 1 25 LYS CB C 4.010 0.591 5.273 1.00 . A A . 25 LYS CB 1 1 4 1449 1 1 25 LYS CD C 3.306 0.822 7.697 1.00 . A A . 25 LYS CD 1 1 4 1450 1 1 25 LYS CE C 3.609 0.371 9.130 1.00 . A A . 25 LYS CE 1 1 4 1451 1 1 25 LYS CG C 4.331 0.189 6.732 1.00 . A A . 25 LYS CG 1 1 4 1452 1 1 25 LYS H H 3.291 -1.993 4.483 1.00 . A A . 25 LYS H 1 1 4 1453 1 1 25 LYS HA H 1.844 0.491 5.389 1.00 . A A . 25 LYS HA 1 1 4 1454 1 1 25 LYS HB2 H 4.764 0.230 4.596 1.00 . A A . 25 LYS HB2 1 1 4 1455 1 1 25 LYS HB3 H 3.994 1.669 5.204 1.00 . A A . 25 LYS HB3 1 1 4 1456 1 1 25 LYS HD2 H 3.385 1.896 7.649 1.00 . A A . 25 LYS HD2 1 1 4 1457 1 1 25 LYS HD3 H 2.301 0.542 7.430 1.00 . A A . 25 LYS HD3 1 1 4 1458 1 1 25 LYS HE2 H 3.545 -0.705 9.206 1.00 . A A . 25 LYS HE2 1 1 4 1459 1 1 25 LYS HE3 H 4.597 0.692 9.423 1.00 . A A . 25 LYS HE3 1 1 4 1460 1 1 25 LYS HG2 H 4.311 -0.887 6.828 1.00 . A A . 25 LYS HG2 1 1 4 1461 1 1 25 LYS HG3 H 5.324 0.534 6.984 1.00 . A A . 25 LYS HG3 1 1 4 1462 1 1 25 LYS HZ1 H 1.654 0.796 9.709 1.00 . A A . 25 LYS HZ1 1 1 4 1463 1 1 25 LYS HZ2 H 2.726 0.548 11.005 1.00 . A A . 25 LYS HZ2 1 1 4 1464 1 1 25 LYS HZ3 H 2.780 2.000 10.122 1.00 . A A . 25 LYS HZ3 1 1 4 1465 1 1 25 LYS N N 2.611 -1.451 4.944 1.00 . A A . 25 LYS N 1 1 4 1466 1 1 25 LYS NZ N 2.617 0.975 10.062 1.00 . A A . 25 LYS NZ 1 1 4 1467 1 1 25 LYS O O 2.624 -0.470 2.514 1.00 . A A . 25 LYS O 1 1 4 1468 1 1 26 CYS C C 3.144 2.389 0.899 1.00 . A A . 26 CYS C 1 1 4 1469 1 1 26 CYS CA C 1.868 2.043 1.670 1.00 . A A . 26 CYS CA 1 1 4 1470 1 1 26 CYS CB C 0.937 3.253 1.662 1.00 . A A . 26 CYS CB 1 1 4 1471 1 1 26 CYS H H 1.976 2.245 3.825 1.00 . A A . 26 CYS H 1 1 4 1472 1 1 26 CYS HA H 1.375 1.243 1.147 1.00 . A A . 26 CYS HA 1 1 4 1473 1 1 26 CYS HB2 H 1.350 4.010 2.300 1.00 . A A . 26 CYS HB2 1 1 4 1474 1 1 26 CYS HB3 H 0.889 3.642 0.660 1.00 . A A . 26 CYS HB3 1 1 4 1475 1 1 26 CYS N N 2.092 1.614 3.086 1.00 . A A . 26 CYS N 1 1 4 1476 1 1 26 CYS O O 4.226 2.469 1.446 1.00 . A A . 26 CYS O 1 1 4 1477 1 1 26 CYS SG S -0.766 2.991 2.189 1.00 . A A . 26 CYS SG 1 1 4 1478 1 1 27 NH2 HN1 H 2.167 2.536 -0.831 1.00 . A A . 27 NH2 HN1 1 1 4 1479 1 1 27 NH2 HN2 H 3.837 2.825 -0.915 1.00 . A A . 27 NH2 HN2 1 1 4 1480 1 1 27 NH2 N N 3.042 2.601 -0.388 1.00 . A A . 27 NH2 N 1 1 5 1481 1 1 1 CYS C C -5.998 6.682 1.930 1.00 . A A . 1 CYS C 1 1 5 1482 1 1 1 CYS CA C -7.085 6.293 0.925 1.00 . A A . 1 CYS CA 1 1 5 1483 1 1 1 CYS CB C -6.592 6.630 -0.484 1.00 . A A . 1 CYS CB 1 1 5 1484 1 1 1 CYS H1 H -8.157 8.052 1.225 1.00 . A A . 1 CYS H1 1 1 5 1485 1 1 1 CYS H2 H -9.054 6.811 0.493 1.00 . A A . 1 CYS H2 1 1 5 1486 1 1 1 CYS H3 H -8.705 6.741 2.154 1.00 . A A . 1 CYS H3 1 1 5 1487 1 1 1 CYS HA H -7.269 5.231 1.015 1.00 . A A . 1 CYS HA 1 1 5 1488 1 1 1 CYS HB2 H -5.705 6.044 -0.671 1.00 . A A . 1 CYS HB2 1 1 5 1489 1 1 1 CYS HB3 H -7.340 6.315 -1.195 1.00 . A A . 1 CYS HB3 1 1 5 1490 1 1 1 CYS N N -8.346 7.029 1.222 1.00 . A A . 1 CYS N 1 1 5 1491 1 1 1 CYS O O -5.989 7.772 2.471 1.00 . A A . 1 CYS O 1 1 5 1492 1 1 1 CYS SG S -6.196 8.364 -0.819 1.00 . A A . 1 CYS SG 1 1 5 1493 1 1 2 LYS C C -2.724 6.410 2.324 1.00 . A A . 2 LYS C 1 1 5 1494 1 1 2 LYS CA C -3.967 5.909 3.075 1.00 . A A . 2 LYS CA 1 1 5 1495 1 1 2 LYS CB C -3.708 4.535 3.746 1.00 . A A . 2 LYS CB 1 1 5 1496 1 1 2 LYS CD C -6.249 4.110 4.151 1.00 . A A . 2 LYS CD 1 1 5 1497 1 1 2 LYS CE C -7.265 3.593 5.188 1.00 . A A . 2 LYS CE 1 1 5 1498 1 1 2 LYS CG C -4.824 4.130 4.758 1.00 . A A . 2 LYS CG 1 1 5 1499 1 1 2 LYS H H -5.206 4.900 1.649 1.00 . A A . 2 LYS H 1 1 5 1500 1 1 2 LYS HA H -4.234 6.631 3.834 1.00 . A A . 2 LYS HA 1 1 5 1501 1 1 2 LYS HB2 H -3.635 3.774 2.981 1.00 . A A . 2 LYS HB2 1 1 5 1502 1 1 2 LYS HB3 H -2.773 4.557 4.276 1.00 . A A . 2 LYS HB3 1 1 5 1503 1 1 2 LYS HD2 H -6.548 5.118 3.908 1.00 . A A . 2 LYS HD2 1 1 5 1504 1 1 2 LYS HD3 H -6.280 3.519 3.252 1.00 . A A . 2 LYS HD3 1 1 5 1505 1 1 2 LYS HE2 H -8.253 3.561 4.754 1.00 . A A . 2 LYS HE2 1 1 5 1506 1 1 2 LYS HE3 H -6.999 2.601 5.521 1.00 . A A . 2 LYS HE3 1 1 5 1507 1 1 2 LYS HG2 H -4.589 3.144 5.134 1.00 . A A . 2 LYS HG2 1 1 5 1508 1 1 2 LYS HG3 H -4.796 4.821 5.588 1.00 . A A . 2 LYS HG3 1 1 5 1509 1 1 2 LYS HZ1 H -7.291 5.484 6.060 1.00 . A A . 2 LYS HZ1 1 1 5 1510 1 1 2 LYS HZ2 H -8.162 4.310 6.925 1.00 . A A . 2 LYS HZ2 1 1 5 1511 1 1 2 LYS HZ3 H -6.464 4.313 6.970 1.00 . A A . 2 LYS HZ3 1 1 5 1512 1 1 2 LYS N N -5.113 5.745 2.134 1.00 . A A . 2 LYS N 1 1 5 1513 1 1 2 LYS NZ N -7.298 4.493 6.376 1.00 . A A . 2 LYS NZ 1 1 5 1514 1 1 2 LYS O O -2.326 5.838 1.329 1.00 . A A . 2 LYS O 1 1 5 1515 1 1 3 GLY C C 0.274 7.116 2.223 1.00 . A A . 3 GLY C 1 1 5 1516 1 1 3 GLY CA C -0.927 8.076 2.205 1.00 . A A . 3 GLY CA 1 1 5 1517 1 1 3 GLY H H -2.534 7.878 3.636 1.00 . A A . 3 GLY H 1 1 5 1518 1 1 3 GLY HA2 H -1.151 8.334 1.180 1.00 . A A . 3 GLY HA2 1 1 5 1519 1 1 3 GLY HA3 H -0.669 8.976 2.741 1.00 . A A . 3 GLY HA3 1 1 5 1520 1 1 3 GLY N N -2.150 7.473 2.831 1.00 . A A . 3 GLY N 1 1 5 1521 1 1 3 GLY O O 0.155 5.996 2.675 1.00 . A A . 3 GLY O 1 1 5 1522 1 1 4 LYS C C 3.083 6.286 3.102 1.00 . A A . 4 LYS C 1 1 5 1523 1 1 4 LYS CA C 2.633 6.732 1.695 1.00 . A A . 4 LYS CA 1 1 5 1524 1 1 4 LYS CB C 3.755 7.541 1.002 1.00 . A A . 4 LYS CB 1 1 5 1525 1 1 4 LYS CD C 6.161 7.409 0.116 1.00 . A A . 4 LYS CD 1 1 5 1526 1 1 4 LYS CE C 6.605 8.685 0.855 1.00 . A A . 4 LYS CE 1 1 5 1527 1 1 4 LYS CG C 5.036 6.668 0.880 1.00 . A A . 4 LYS CG 1 1 5 1528 1 1 4 LYS H H 1.430 8.498 1.388 1.00 . A A . 4 LYS H 1 1 5 1529 1 1 4 LYS HA H 2.421 5.856 1.101 1.00 . A A . 4 LYS HA 1 1 5 1530 1 1 4 LYS HB2 H 3.425 7.845 0.019 1.00 . A A . 4 LYS HB2 1 1 5 1531 1 1 4 LYS HB3 H 3.960 8.425 1.586 1.00 . A A . 4 LYS HB3 1 1 5 1532 1 1 4 LYS HD2 H 7.008 6.747 0.009 1.00 . A A . 4 LYS HD2 1 1 5 1533 1 1 4 LYS HD3 H 5.810 7.672 -0.872 1.00 . A A . 4 LYS HD3 1 1 5 1534 1 1 4 LYS HE2 H 5.791 9.390 0.931 1.00 . A A . 4 LYS HE2 1 1 5 1535 1 1 4 LYS HE3 H 6.959 8.444 1.848 1.00 . A A . 4 LYS HE3 1 1 5 1536 1 1 4 LYS HG2 H 5.399 6.412 1.864 1.00 . A A . 4 LYS HG2 1 1 5 1537 1 1 4 LYS HG3 H 4.799 5.752 0.359 1.00 . A A . 4 LYS HG3 1 1 5 1538 1 1 4 LYS HZ1 H 8.502 8.668 0.001 1.00 . A A . 4 LYS HZ1 1 1 5 1539 1 1 4 LYS HZ2 H 7.371 9.609 -0.845 1.00 . A A . 4 LYS HZ2 1 1 5 1540 1 1 4 LYS HZ3 H 8.033 10.181 0.611 1.00 . A A . 4 LYS HZ3 1 1 5 1541 1 1 4 LYS N N 1.397 7.582 1.733 1.00 . A A . 4 LYS N 1 1 5 1542 1 1 4 LYS NZ N 7.711 9.336 0.099 1.00 . A A . 4 LYS NZ 1 1 5 1543 1 1 4 LYS O O 3.059 7.056 4.044 1.00 . A A . 4 LYS O 1 1 5 1544 1 1 5 GLY C C 2.835 4.228 5.485 1.00 . A A . 5 GLY C 1 1 5 1545 1 1 5 GLY CA C 3.955 4.422 4.456 1.00 . A A . 5 GLY CA 1 1 5 1546 1 1 5 GLY H H 3.462 4.492 2.367 1.00 . A A . 5 GLY H 1 1 5 1547 1 1 5 GLY HA2 H 4.386 3.460 4.227 1.00 . A A . 5 GLY HA2 1 1 5 1548 1 1 5 GLY HA3 H 4.719 5.045 4.894 1.00 . A A . 5 GLY HA3 1 1 5 1549 1 1 5 GLY N N 3.480 5.039 3.178 1.00 . A A . 5 GLY N 1 1 5 1550 1 1 5 GLY O O 3.094 3.787 6.589 1.00 . A A . 5 GLY O 1 1 5 1551 1 1 6 ALA C C -0.092 2.967 5.949 1.00 . A A . 6 ALA C 1 1 5 1552 1 1 6 ALA CA C 0.461 4.407 6.026 1.00 . A A . 6 ALA CA 1 1 5 1553 1 1 6 ALA CB C -0.606 5.426 5.613 1.00 . A A . 6 ALA CB 1 1 5 1554 1 1 6 ALA H H 1.488 4.902 4.193 1.00 . A A . 6 ALA H 1 1 5 1555 1 1 6 ALA HA H 0.788 4.617 7.034 1.00 . A A . 6 ALA HA 1 1 5 1556 1 1 6 ALA HB1 H -0.910 5.241 4.598 1.00 . A A . 6 ALA HB1 1 1 5 1557 1 1 6 ALA HB2 H -1.471 5.356 6.254 1.00 . A A . 6 ALA HB2 1 1 5 1558 1 1 6 ALA HB3 H -0.207 6.428 5.679 1.00 . A A . 6 ALA HB3 1 1 5 1559 1 1 6 ALA N N 1.627 4.556 5.101 1.00 . A A . 6 ALA N 1 1 5 1560 1 1 6 ALA O O 0.039 2.335 4.917 1.00 . A A . 6 ALA O 1 1 5 1561 1 1 7 PRO C C -2.243 0.673 6.187 1.00 . A A . 7 PRO C 1 1 5 1562 1 1 7 PRO CA C -1.101 1.055 7.152 1.00 . A A . 7 PRO CA 1 1 5 1563 1 1 7 PRO CB C -1.486 0.882 8.627 1.00 . A A . 7 PRO CB 1 1 5 1564 1 1 7 PRO CD C -1.034 3.283 8.242 1.00 . A A . 7 PRO CD 1 1 5 1565 1 1 7 PRO CG C -1.729 2.289 9.186 1.00 . A A . 7 PRO CG 1 1 5 1566 1 1 7 PRO HA H -0.243 0.434 6.939 1.00 . A A . 7 PRO HA 1 1 5 1567 1 1 7 PRO HB2 H -2.371 0.272 8.739 1.00 . A A . 7 PRO HB2 1 1 5 1568 1 1 7 PRO HB3 H -0.672 0.412 9.161 1.00 . A A . 7 PRO HB3 1 1 5 1569 1 1 7 PRO HD2 H -1.695 4.093 7.976 1.00 . A A . 7 PRO HD2 1 1 5 1570 1 1 7 PRO HD3 H -0.132 3.669 8.695 1.00 . A A . 7 PRO HD3 1 1 5 1571 1 1 7 PRO HG2 H -2.789 2.493 9.226 1.00 . A A . 7 PRO HG2 1 1 5 1572 1 1 7 PRO HG3 H -1.318 2.370 10.182 1.00 . A A . 7 PRO HG3 1 1 5 1573 1 1 7 PRO N N -0.689 2.486 7.022 1.00 . A A . 7 PRO N 1 1 5 1574 1 1 7 PRO O O -3.413 0.753 6.514 1.00 . A A . 7 PRO O 1 1 5 1575 1 1 8 CYS C C -3.000 -1.666 3.901 1.00 . A A . 8 CYS C 1 1 5 1576 1 1 8 CYS CA C -2.774 -0.150 3.928 1.00 . A A . 8 CYS CA 1 1 5 1577 1 1 8 CYS CB C -2.190 0.300 2.612 1.00 . A A . 8 CYS CB 1 1 5 1578 1 1 8 CYS H H -0.870 0.249 4.831 1.00 . A A . 8 CYS H 1 1 5 1579 1 1 8 CYS HA H -3.723 0.335 4.073 1.00 . A A . 8 CYS HA 1 1 5 1580 1 1 8 CYS HB2 H -2.788 -0.071 1.795 1.00 . A A . 8 CYS HB2 1 1 5 1581 1 1 8 CYS HB3 H -2.238 1.367 2.540 1.00 . A A . 8 CYS HB3 1 1 5 1582 1 1 8 CYS N N -1.834 0.272 5.012 1.00 . A A . 8 CYS N 1 1 5 1583 1 1 8 CYS O O -2.636 -2.384 4.813 1.00 . A A . 8 CYS O 1 1 5 1584 1 1 8 CYS SG S -0.498 -0.269 2.330 1.00 . A A . 8 CYS SG 1 1 5 1585 1 1 9 ARG C C -3.691 -3.749 1.069 1.00 . A A . 9 ARG C 1 1 5 1586 1 1 9 ARG CA C -3.936 -3.503 2.559 1.00 . A A . 9 ARG CA 1 1 5 1587 1 1 9 ARG CB C -5.420 -3.765 2.894 1.00 . A A . 9 ARG CB 1 1 5 1588 1 1 9 ARG CD C -7.207 -3.705 4.676 1.00 . A A . 9 ARG CD 1 1 5 1589 1 1 9 ARG CG C -5.715 -3.437 4.376 1.00 . A A . 9 ARG CG 1 1 5 1590 1 1 9 ARG CZ C -8.232 -1.566 4.026 1.00 . A A . 9 ARG CZ 1 1 5 1591 1 1 9 ARG H H -3.860 -1.423 2.140 1.00 . A A . 9 ARG H 1 1 5 1592 1 1 9 ARG HA H -3.270 -4.148 3.121 1.00 . A A . 9 ARG HA 1 1 5 1593 1 1 9 ARG HB2 H -6.041 -3.151 2.260 1.00 . A A . 9 ARG HB2 1 1 5 1594 1 1 9 ARG HB3 H -5.651 -4.804 2.703 1.00 . A A . 9 ARG HB3 1 1 5 1595 1 1 9 ARG HD2 H -7.447 -4.739 4.480 1.00 . A A . 9 ARG HD2 1 1 5 1596 1 1 9 ARG HD3 H -7.435 -3.485 5.710 1.00 . A A . 9 ARG HD3 1 1 5 1597 1 1 9 ARG HE H -8.481 -3.243 3.004 1.00 . A A . 9 ARG HE 1 1 5 1598 1 1 9 ARG HG2 H -5.105 -4.056 5.018 1.00 . A A . 9 ARG HG2 1 1 5 1599 1 1 9 ARG HG3 H -5.491 -2.401 4.579 1.00 . A A . 9 ARG HG3 1 1 5 1600 1 1 9 ARG HH11 H -7.105 -1.524 5.686 1.00 . A A . 9 ARG HH11 1 1 5 1601 1 1 9 ARG HH12 H -7.822 -0.017 5.225 1.00 . A A . 9 ARG HH12 1 1 5 1602 1 1 9 ARG HH21 H -9.398 -1.348 2.416 1.00 . A A . 9 ARG HH21 1 1 5 1603 1 1 9 ARG HH22 H -9.136 0.086 3.353 1.00 . A A . 9 ARG HH22 1 1 5 1604 1 1 9 ARG N N -3.608 -2.079 2.818 1.00 . A A . 9 ARG N 1 1 5 1605 1 1 9 ARG NE N -8.051 -2.842 3.788 1.00 . A A . 9 ARG NE 1 1 5 1606 1 1 9 ARG NH1 N -7.676 -0.992 5.060 1.00 . A A . 9 ARG NH1 1 1 5 1607 1 1 9 ARG NH2 N -8.980 -0.890 3.201 1.00 . A A . 9 ARG NH2 1 1 5 1608 1 1 9 ARG O O -4.342 -3.183 0.213 1.00 . A A . 9 ARG O 1 1 5 1609 1 1 10 LYS C C -3.530 -5.552 -1.228 1.00 . A A . 10 LYS C 1 1 5 1610 1 1 10 LYS CA C -2.277 -5.040 -0.526 1.00 . A A . 10 LYS CA 1 1 5 1611 1 1 10 LYS CB C -1.323 -6.178 -0.377 1.00 . A A . 10 LYS CB 1 1 5 1612 1 1 10 LYS CD C 0.453 -7.056 1.098 1.00 . A A . 10 LYS CD 1 1 5 1613 1 1 10 LYS CE C 1.223 -7.849 0.026 1.00 . A A . 10 LYS CE 1 1 5 1614 1 1 10 LYS CG C -0.206 -5.790 0.578 1.00 . A A . 10 LYS CG 1 1 5 1615 1 1 10 LYS H H -2.283 -4.980 1.630 1.00 . A A . 10 LYS H 1 1 5 1616 1 1 10 LYS HA H -1.857 -4.205 -1.066 1.00 . A A . 10 LYS HA 1 1 5 1617 1 1 10 LYS HB2 H -1.842 -7.054 -0.014 1.00 . A A . 10 LYS HB2 1 1 5 1618 1 1 10 LYS HB3 H -0.912 -6.393 -1.352 1.00 . A A . 10 LYS HB3 1 1 5 1619 1 1 10 LYS HD2 H 1.059 -6.779 1.936 1.00 . A A . 10 LYS HD2 1 1 5 1620 1 1 10 LYS HD3 H -0.341 -7.687 1.472 1.00 . A A . 10 LYS HD3 1 1 5 1621 1 1 10 LYS HE2 H 1.932 -7.191 -0.452 1.00 . A A . 10 LYS HE2 1 1 5 1622 1 1 10 LYS HE3 H 1.750 -8.661 0.502 1.00 . A A . 10 LYS HE3 1 1 5 1623 1 1 10 LYS HG2 H 0.523 -5.206 0.039 1.00 . A A . 10 LYS HG2 1 1 5 1624 1 1 10 LYS HG3 H -0.547 -5.210 1.422 1.00 . A A . 10 LYS HG3 1 1 5 1625 1 1 10 LYS HZ1 H -0.636 -8.515 -0.642 1.00 . A A . 10 LYS HZ1 1 1 5 1626 1 1 10 LYS HZ2 H 0.308 -7.769 -1.842 1.00 . A A . 10 LYS HZ2 1 1 5 1627 1 1 10 LYS HZ3 H 0.680 -9.340 -1.321 1.00 . A A . 10 LYS HZ3 1 1 5 1628 1 1 10 LYS N N -2.731 -4.603 0.844 1.00 . A A . 10 LYS N 1 1 5 1629 1 1 10 LYS NZ N 0.326 -8.409 -1.024 1.00 . A A . 10 LYS NZ 1 1 5 1630 1 1 10 LYS O O -3.798 -5.276 -2.383 1.00 . A A . 10 LYS O 1 1 5 1631 1 1 11 THR C C -6.374 -6.251 -1.699 1.00 . A A . 11 THR C 1 1 5 1632 1 1 11 THR CA C -5.504 -7.001 -0.689 1.00 . A A . 11 THR CA 1 1 5 1633 1 1 11 THR CB C -6.253 -7.140 0.646 1.00 . A A . 11 THR CB 1 1 5 1634 1 1 11 THR CG2 C -7.518 -8.012 0.520 1.00 . A A . 11 THR CG2 1 1 5 1635 1 1 11 THR H H -3.814 -6.428 0.492 1.00 . A A . 11 THR H 1 1 5 1636 1 1 11 THR HA H -5.278 -7.980 -1.088 1.00 . A A . 11 THR HA 1 1 5 1637 1 1 11 THR HB H -6.438 -6.170 1.098 1.00 . A A . 11 THR HB 1 1 5 1638 1 1 11 THR HG1 H -5.150 -7.363 2.232 1.00 . A A . 11 THR HG1 1 1 5 1639 1 1 11 THR HG21 H -7.260 -9.006 0.186 1.00 . A A . 11 THR HG21 1 1 5 1640 1 1 11 THR HG22 H -8.011 -8.083 1.480 1.00 . A A . 11 THR HG22 1 1 5 1641 1 1 11 THR HG23 H -8.208 -7.576 -0.187 1.00 . A A . 11 THR HG23 1 1 5 1642 1 1 11 THR N N -4.210 -6.309 -0.401 1.00 . A A . 11 THR N 1 1 5 1643 1 1 11 THR O O -7.076 -6.846 -2.495 1.00 . A A . 11 THR O 1 1 5 1644 1 1 11 THR OG1 O -5.383 -7.902 1.472 1.00 . A A . 11 THR OG1 1 1 5 1645 1 1 12 MET C C -6.341 -2.729 -2.780 1.00 . A A . 12 MET C 1 1 5 1646 1 1 12 MET CA C -7.063 -4.055 -2.516 1.00 . A A . 12 MET CA 1 1 5 1647 1 1 12 MET CB C -8.438 -3.787 -1.856 1.00 . A A . 12 MET CB 1 1 5 1648 1 1 12 MET CE C -9.783 -0.948 0.004 1.00 . A A . 12 MET CE 1 1 5 1649 1 1 12 MET CG C -8.237 -3.147 -0.459 1.00 . A A . 12 MET CG 1 1 5 1650 1 1 12 MET H H -5.671 -4.577 -0.937 1.00 . A A . 12 MET H 1 1 5 1651 1 1 12 MET HA H -7.205 -4.551 -3.467 1.00 . A A . 12 MET HA 1 1 5 1652 1 1 12 MET HB2 H -9.023 -3.126 -2.480 1.00 . A A . 12 MET HB2 1 1 5 1653 1 1 12 MET HB3 H -8.974 -4.719 -1.749 1.00 . A A . 12 MET HB3 1 1 5 1654 1 1 12 MET HE1 H -9.844 -0.856 -1.070 1.00 . A A . 12 MET HE1 1 1 5 1655 1 1 12 MET HE2 H -10.668 -0.505 0.438 1.00 . A A . 12 MET HE2 1 1 5 1656 1 1 12 MET HE3 H -8.915 -0.433 0.388 1.00 . A A . 12 MET HE3 1 1 5 1657 1 1 12 MET HG2 H -7.684 -3.841 0.156 1.00 . A A . 12 MET HG2 1 1 5 1658 1 1 12 MET HG3 H -7.630 -2.259 -0.562 1.00 . A A . 12 MET HG3 1 1 5 1659 1 1 12 MET N N -6.280 -4.953 -1.613 1.00 . A A . 12 MET N 1 1 5 1660 1 1 12 MET O O -6.916 -1.840 -3.380 1.00 . A A . 12 MET O 1 1 5 1661 1 1 12 MET SD S -9.723 -2.696 0.472 1.00 . A A . 12 MET SD 1 1 5 1662 1 1 13 TYR C C -5.108 -0.234 -1.947 1.00 . A A . 13 TYR C 1 1 5 1663 1 1 13 TYR CA C -4.288 -1.401 -2.511 1.00 . A A . 13 TYR CA 1 1 5 1664 1 1 13 TYR CB C -3.984 -1.237 -4.016 1.00 . A A . 13 TYR CB 1 1 5 1665 1 1 13 TYR CD1 C -1.881 -2.649 -4.064 1.00 . A A . 13 TYR CD1 1 1 5 1666 1 1 13 TYR CD2 C -3.771 -3.420 -5.290 1.00 . A A . 13 TYR CD2 1 1 5 1667 1 1 13 TYR CE1 C -1.167 -3.758 -4.465 1.00 . A A . 13 TYR CE1 1 1 5 1668 1 1 13 TYR CE2 C -3.056 -4.529 -5.692 1.00 . A A . 13 TYR CE2 1 1 5 1669 1 1 13 TYR CG C -3.190 -2.471 -4.472 1.00 . A A . 13 TYR CG 1 1 5 1670 1 1 13 TYR CZ C -1.750 -4.704 -5.282 1.00 . A A . 13 TYR CZ 1 1 5 1671 1 1 13 TYR H H -4.717 -3.406 -1.868 1.00 . A A . 13 TYR H 1 1 5 1672 1 1 13 TYR HA H -3.375 -1.502 -1.941 1.00 . A A . 13 TYR HA 1 1 5 1673 1 1 13 TYR HB2 H -4.897 -1.170 -4.586 1.00 . A A . 13 TYR HB2 1 1 5 1674 1 1 13 TYR HB3 H -3.394 -0.352 -4.187 1.00 . A A . 13 TYR HB3 1 1 5 1675 1 1 13 TYR HD1 H -1.411 -1.917 -3.425 1.00 . A A . 13 TYR HD1 1 1 5 1676 1 1 13 TYR HD2 H -4.792 -3.298 -5.619 1.00 . A A . 13 TYR HD2 1 1 5 1677 1 1 13 TYR HE1 H -0.146 -3.882 -4.139 1.00 . A A . 13 TYR HE1 1 1 5 1678 1 1 13 TYR HE2 H -3.524 -5.263 -6.331 1.00 . A A . 13 TYR HE2 1 1 5 1679 1 1 13 TYR HH H -0.292 -5.511 -6.212 1.00 . A A . 13 TYR HH 1 1 5 1680 1 1 13 TYR N N -5.110 -2.640 -2.332 1.00 . A A . 13 TYR N 1 1 5 1681 1 1 13 TYR O O -5.678 0.580 -2.648 1.00 . A A . 13 TYR O 1 1 5 1682 1 1 13 TYR OH O -1.034 -5.813 -5.684 1.00 . A A . 13 TYR OH 1 1 5 1683 1 1 14 ASP C C -5.060 2.104 0.284 1.00 . A A . 14 ASP C 1 1 5 1684 1 1 14 ASP CA C -5.829 0.779 0.184 1.00 . A A . 14 ASP CA 1 1 5 1685 1 1 14 ASP CB C -6.048 0.088 1.551 1.00 . A A . 14 ASP CB 1 1 5 1686 1 1 14 ASP CG C -6.711 0.985 2.606 1.00 . A A . 14 ASP CG 1 1 5 1687 1 1 14 ASP H H -4.600 -0.929 -0.183 1.00 . A A . 14 ASP H 1 1 5 1688 1 1 14 ASP HA H -6.788 0.973 -0.276 1.00 . A A . 14 ASP HA 1 1 5 1689 1 1 14 ASP HB2 H -6.690 -0.758 1.395 1.00 . A A . 14 ASP HB2 1 1 5 1690 1 1 14 ASP HB3 H -5.117 -0.300 1.928 1.00 . A A . 14 ASP HB3 1 1 5 1691 1 1 14 ASP N N -5.107 -0.233 -0.642 1.00 . A A . 14 ASP N 1 1 5 1692 1 1 14 ASP O O -5.350 2.936 1.121 1.00 . A A . 14 ASP O 1 1 5 1693 1 1 14 ASP OD1 O -7.728 1.578 2.284 1.00 . A A . 14 ASP OD1 1 1 5 1694 1 1 14 ASP OD2 O -6.151 1.018 3.689 1.00 . A A . 14 ASP OD2 1 1 5 1695 1 1 15 CYS C C -3.654 4.450 -1.736 1.00 . A A . 15 CYS C 1 1 5 1696 1 1 15 CYS CA C -3.261 3.494 -0.613 1.00 . A A . 15 CYS CA 1 1 5 1697 1 1 15 CYS CB C -1.817 3.108 -0.798 1.00 . A A . 15 CYS CB 1 1 5 1698 1 1 15 CYS H H -3.924 1.532 -1.229 1.00 . A A . 15 CYS H 1 1 5 1699 1 1 15 CYS HA H -3.354 4.012 0.327 1.00 . A A . 15 CYS HA 1 1 5 1700 1 1 15 CYS HB2 H -1.696 2.670 -1.776 1.00 . A A . 15 CYS HB2 1 1 5 1701 1 1 15 CYS HB3 H -1.220 4.007 -0.747 1.00 . A A . 15 CYS HB3 1 1 5 1702 1 1 15 CYS N N -4.096 2.254 -0.587 1.00 . A A . 15 CYS N 1 1 5 1703 1 1 15 CYS O O -4.176 4.040 -2.755 1.00 . A A . 15 CYS O 1 1 5 1704 1 1 15 CYS SG S -1.154 1.961 0.425 1.00 . A A . 15 CYS SG 1 1 5 1705 1 1 16 CYS C C -2.786 6.526 -3.707 1.00 . A A . 16 CYS C 1 1 5 1706 1 1 16 CYS CA C -3.682 6.778 -2.482 1.00 . A A . 16 CYS CA 1 1 5 1707 1 1 16 CYS CB C -3.369 8.119 -1.827 1.00 . A A . 16 CYS CB 1 1 5 1708 1 1 16 CYS H H -2.957 5.964 -0.649 1.00 . A A . 16 CYS H 1 1 5 1709 1 1 16 CYS HA H -4.720 6.717 -2.774 1.00 . A A . 16 CYS HA 1 1 5 1710 1 1 16 CYS HB2 H -2.312 8.149 -1.605 1.00 . A A . 16 CYS HB2 1 1 5 1711 1 1 16 CYS HB3 H -3.574 8.907 -2.527 1.00 . A A . 16 CYS HB3 1 1 5 1712 1 1 16 CYS N N -3.376 5.707 -1.493 1.00 . A A . 16 CYS N 1 1 5 1713 1 1 16 CYS O O -3.129 6.846 -4.828 1.00 . A A . 16 CYS O 1 1 5 1714 1 1 16 CYS SG S -4.251 8.502 -0.294 1.00 . A A . 16 CYS SG 1 1 5 1715 1 1 17 SER C C -1.025 4.260 -5.074 1.00 . A A . 17 SER C 1 1 5 1716 1 1 17 SER CA C -0.624 5.593 -4.422 1.00 . A A . 17 SER CA 1 1 5 1717 1 1 17 SER CB C 0.720 5.457 -3.709 1.00 . A A . 17 SER CB 1 1 5 1718 1 1 17 SER H H -1.473 5.729 -2.466 1.00 . A A . 17 SER H 1 1 5 1719 1 1 17 SER HA H -0.583 6.367 -5.177 1.00 . A A . 17 SER HA 1 1 5 1720 1 1 17 SER HB2 H 0.978 6.359 -3.176 1.00 . A A . 17 SER HB2 1 1 5 1721 1 1 17 SER HB3 H 0.709 4.622 -3.023 1.00 . A A . 17 SER HB3 1 1 5 1722 1 1 17 SER HG H 1.431 4.359 -5.149 1.00 . A A . 17 SER HG 1 1 5 1723 1 1 17 SER N N -1.654 5.944 -3.405 1.00 . A A . 17 SER N 1 1 5 1724 1 1 17 SER O O -0.687 3.993 -6.210 1.00 . A A . 17 SER O 1 1 5 1725 1 1 17 SER OG O 1.659 5.199 -4.743 1.00 . A A . 17 SER OG 1 1 5 1726 1 1 18 GLY C C -1.054 1.122 -4.866 1.00 . A A . 18 GLY C 1 1 5 1727 1 1 18 GLY CA C -2.206 2.134 -4.787 1.00 . A A . 18 GLY CA 1 1 5 1728 1 1 18 GLY H H -1.970 3.757 -3.401 1.00 . A A . 18 GLY H 1 1 5 1729 1 1 18 GLY HA2 H -2.945 1.766 -4.092 1.00 . A A . 18 GLY HA2 1 1 5 1730 1 1 18 GLY HA3 H -2.649 2.241 -5.764 1.00 . A A . 18 GLY HA3 1 1 5 1731 1 1 18 GLY N N -1.738 3.468 -4.309 1.00 . A A . 18 GLY N 1 1 5 1732 1 1 18 GLY O O -1.219 0.040 -5.395 1.00 . A A . 18 GLY O 1 1 5 1733 1 1 19 SER C C 1.562 0.163 -2.890 1.00 . A A . 19 SER C 1 1 5 1734 1 1 19 SER CA C 1.293 0.645 -4.326 1.00 . A A . 19 SER CA 1 1 5 1735 1 1 19 SER CB C 2.469 1.486 -4.883 1.00 . A A . 19 SER CB 1 1 5 1736 1 1 19 SER H H 0.130 2.403 -3.925 1.00 . A A . 19 SER H 1 1 5 1737 1 1 19 SER HA H 1.132 -0.216 -4.958 1.00 . A A . 19 SER HA 1 1 5 1738 1 1 19 SER HB2 H 3.395 0.931 -4.879 1.00 . A A . 19 SER HB2 1 1 5 1739 1 1 19 SER HB3 H 2.256 1.841 -5.881 1.00 . A A . 19 SER HB3 1 1 5 1740 1 1 19 SER HG H 3.013 2.304 -3.203 1.00 . A A . 19 SER HG 1 1 5 1741 1 1 19 SER N N 0.077 1.514 -4.333 1.00 . A A . 19 SER N 1 1 5 1742 1 1 19 SER O O 2.649 0.313 -2.362 1.00 . A A . 19 SER O 1 1 5 1743 1 1 19 SER OG O 2.574 2.599 -4.003 1.00 . A A . 19 SER OG 1 1 5 1744 1 1 20 CYS C C 1.649 -2.104 -0.794 1.00 . A A . 20 CYS C 1 1 5 1745 1 1 20 CYS CA C 0.673 -0.920 -0.904 1.00 . A A . 20 CYS CA 1 1 5 1746 1 1 20 CYS CB C -0.715 -1.337 -0.395 1.00 . A A . 20 CYS CB 1 1 5 1747 1 1 20 CYS H H -0.309 -0.502 -2.777 1.00 . A A . 20 CYS H 1 1 5 1748 1 1 20 CYS HA H 1.035 -0.116 -0.286 1.00 . A A . 20 CYS HA 1 1 5 1749 1 1 20 CYS HB2 H -1.360 -0.472 -0.425 1.00 . A A . 20 CYS HB2 1 1 5 1750 1 1 20 CYS HB3 H -1.156 -2.076 -1.036 1.00 . A A . 20 CYS HB3 1 1 5 1751 1 1 20 CYS N N 0.542 -0.410 -2.300 1.00 . A A . 20 CYS N 1 1 5 1752 1 1 20 CYS O O 1.420 -3.174 -1.326 1.00 . A A . 20 CYS O 1 1 5 1753 1 1 20 CYS SG S -0.748 -1.981 1.293 1.00 . A A . 20 CYS SG 1 1 5 1754 1 1 21 GLY C C 3.393 -4.103 0.895 1.00 . A A . 21 GLY C 1 1 5 1755 1 1 21 GLY CA C 3.814 -2.819 0.160 1.00 . A A . 21 GLY CA 1 1 5 1756 1 1 21 GLY H H 2.806 -0.936 0.289 1.00 . A A . 21 GLY H 1 1 5 1757 1 1 21 GLY HA2 H 4.244 -3.093 -0.792 1.00 . A A . 21 GLY HA2 1 1 5 1758 1 1 21 GLY HA3 H 4.576 -2.329 0.747 1.00 . A A . 21 GLY HA3 1 1 5 1759 1 1 21 GLY N N 2.719 -1.833 -0.089 1.00 . A A . 21 GLY N 1 1 5 1760 1 1 21 GLY O O 2.305 -4.224 1.421 1.00 . A A . 21 GLY O 1 1 5 1761 1 1 22 ARG C C 4.084 -6.179 3.049 1.00 . A A . 22 ARG C 1 1 5 1762 1 1 22 ARG CA C 4.193 -6.362 1.528 1.00 . A A . 22 ARG CA 1 1 5 1763 1 1 22 ARG CB C 5.451 -7.170 1.084 1.00 . A A . 22 ARG CB 1 1 5 1764 1 1 22 ARG CD C 5.435 -9.073 2.884 1.00 . A A . 22 ARG CD 1 1 5 1765 1 1 22 ARG CG C 5.438 -8.700 1.388 1.00 . A A . 22 ARG CG 1 1 5 1766 1 1 22 ARG CZ C 4.486 -11.337 2.755 1.00 . A A . 22 ARG CZ 1 1 5 1767 1 1 22 ARG H H 5.177 -4.788 0.448 1.00 . A A . 22 ARG H 1 1 5 1768 1 1 22 ARG HA H 3.297 -6.831 1.164 1.00 . A A . 22 ARG HA 1 1 5 1769 1 1 22 ARG HB2 H 5.572 -7.047 0.017 1.00 . A A . 22 ARG HB2 1 1 5 1770 1 1 22 ARG HB3 H 6.319 -6.739 1.560 1.00 . A A . 22 ARG HB3 1 1 5 1771 1 1 22 ARG HD2 H 6.283 -8.638 3.393 1.00 . A A . 22 ARG HD2 1 1 5 1772 1 1 22 ARG HD3 H 4.529 -8.771 3.374 1.00 . A A . 22 ARG HD3 1 1 5 1773 1 1 22 ARG HE H 6.377 -10.977 3.220 1.00 . A A . 22 ARG HE 1 1 5 1774 1 1 22 ARG HG2 H 4.566 -9.129 0.918 1.00 . A A . 22 ARG HG2 1 1 5 1775 1 1 22 ARG HG3 H 6.309 -9.143 0.928 1.00 . A A . 22 ARG HG3 1 1 5 1776 1 1 22 ARG HH11 H 3.218 -9.832 2.359 1.00 . A A . 22 ARG HH11 1 1 5 1777 1 1 22 ARG HH12 H 2.546 -11.425 2.265 1.00 . A A . 22 ARG HH12 1 1 5 1778 1 1 22 ARG HH21 H 5.546 -12.997 3.105 1.00 . A A . 22 ARG HH21 1 1 5 1779 1 1 22 ARG HH22 H 3.881 -13.243 2.693 1.00 . A A . 22 ARG HH22 1 1 5 1780 1 1 22 ARG N N 4.335 -5.012 0.890 1.00 . A A . 22 ARG N 1 1 5 1781 1 1 22 ARG NE N 5.522 -10.565 2.982 1.00 . A A . 22 ARG NE 1 1 5 1782 1 1 22 ARG NH1 N 3.327 -10.823 2.435 1.00 . A A . 22 ARG NH1 1 1 5 1783 1 1 22 ARG NH2 N 4.650 -12.627 2.858 1.00 . A A . 22 ARG NH2 1 1 5 1784 1 1 22 ARG O O 3.407 -6.931 3.724 1.00 . A A . 22 ARG O 1 1 5 1785 1 1 23 ARG C C 3.414 -4.184 5.443 1.00 . A A . 23 ARG C 1 1 5 1786 1 1 23 ARG CA C 4.723 -4.869 5.009 1.00 . A A . 23 ARG CA 1 1 5 1787 1 1 23 ARG CB C 5.937 -3.965 5.344 1.00 . A A . 23 ARG CB 1 1 5 1788 1 1 23 ARG CD C 7.067 -1.745 4.888 1.00 . A A . 23 ARG CD 1 1 5 1789 1 1 23 ARG CG C 5.919 -2.679 4.471 1.00 . A A . 23 ARG CG 1 1 5 1790 1 1 23 ARG CZ C 7.551 -0.407 6.890 1.00 . A A . 23 ARG CZ 1 1 5 1791 1 1 23 ARG H H 5.254 -4.583 2.938 1.00 . A A . 23 ARG H 1 1 5 1792 1 1 23 ARG HA H 4.817 -5.800 5.551 1.00 . A A . 23 ARG HA 1 1 5 1793 1 1 23 ARG HB2 H 5.912 -3.705 6.391 1.00 . A A . 23 ARG HB2 1 1 5 1794 1 1 23 ARG HB3 H 6.848 -4.514 5.156 1.00 . A A . 23 ARG HB3 1 1 5 1795 1 1 23 ARG HD2 H 8.020 -2.250 4.821 1.00 . A A . 23 ARG HD2 1 1 5 1796 1 1 23 ARG HD3 H 7.080 -0.868 4.257 1.00 . A A . 23 ARG HD3 1 1 5 1797 1 1 23 ARG HE H 6.106 -1.754 6.809 1.00 . A A . 23 ARG HE 1 1 5 1798 1 1 23 ARG HG2 H 6.049 -2.941 3.431 1.00 . A A . 23 ARG HG2 1 1 5 1799 1 1 23 ARG HG3 H 4.974 -2.168 4.577 1.00 . A A . 23 ARG HG3 1 1 5 1800 1 1 23 ARG HH11 H 8.733 -0.068 5.305 1.00 . A A . 23 ARG HH11 1 1 5 1801 1 1 23 ARG HH12 H 9.068 0.887 6.708 1.00 . A A . 23 ARG HH12 1 1 5 1802 1 1 23 ARG HH21 H 6.507 -0.565 8.588 1.00 . A A . 23 ARG HH21 1 1 5 1803 1 1 23 ARG HH22 H 7.788 0.599 8.606 1.00 . A A . 23 ARG HH22 1 1 5 1804 1 1 23 ARG N N 4.742 -5.160 3.541 1.00 . A A . 23 ARG N 1 1 5 1805 1 1 23 ARG NE N 6.829 -1.328 6.304 1.00 . A A . 23 ARG NE 1 1 5 1806 1 1 23 ARG NH1 N 8.527 0.183 6.250 1.00 . A A . 23 ARG NH1 1 1 5 1807 1 1 23 ARG NH2 N 7.261 -0.100 8.125 1.00 . A A . 23 ARG NH2 1 1 5 1808 1 1 23 ARG O O 3.315 -3.677 6.545 1.00 . A A . 23 ARG O 1 1 5 1809 1 1 24 GLY C C 1.197 -2.041 4.918 1.00 . A A . 24 GLY C 1 1 5 1810 1 1 24 GLY CA C 1.126 -3.567 4.856 1.00 . A A . 24 GLY CA 1 1 5 1811 1 1 24 GLY H H 2.588 -4.613 3.684 1.00 . A A . 24 GLY H 1 1 5 1812 1 1 24 GLY HA2 H 0.432 -3.848 4.078 1.00 . A A . 24 GLY HA2 1 1 5 1813 1 1 24 GLY HA3 H 0.763 -3.942 5.802 1.00 . A A . 24 GLY HA3 1 1 5 1814 1 1 24 GLY N N 2.448 -4.193 4.558 1.00 . A A . 24 GLY N 1 1 5 1815 1 1 24 GLY O O 0.262 -1.421 5.381 1.00 . A A . 24 GLY O 1 1 5 1816 1 1 25 LYS C C 2.382 0.463 3.021 1.00 . A A . 25 LYS C 1 1 5 1817 1 1 25 LYS CA C 2.453 0.008 4.472 1.00 . A A . 25 LYS CA 1 1 5 1818 1 1 25 LYS CB C 3.817 0.423 5.042 1.00 . A A . 25 LYS CB 1 1 5 1819 1 1 25 LYS CD C 2.986 0.376 7.456 1.00 . A A . 25 LYS CD 1 1 5 1820 1 1 25 LYS CE C 3.241 -0.278 8.826 1.00 . A A . 25 LYS CE 1 1 5 1821 1 1 25 LYS CG C 4.039 -0.144 6.457 1.00 . A A . 25 LYS CG 1 1 5 1822 1 1 25 LYS H H 3.012 -2.050 4.095 1.00 . A A . 25 LYS H 1 1 5 1823 1 1 25 LYS HA H 1.646 0.468 5.022 1.00 . A A . 25 LYS HA 1 1 5 1824 1 1 25 LYS HB2 H 4.595 0.100 4.371 1.00 . A A . 25 LYS HB2 1 1 5 1825 1 1 25 LYS HB3 H 3.856 1.500 5.098 1.00 . A A . 25 LYS HB3 1 1 5 1826 1 1 25 LYS HD2 H 3.078 1.446 7.555 1.00 . A A . 25 LYS HD2 1 1 5 1827 1 1 25 LYS HD3 H 1.989 0.149 7.116 1.00 . A A . 25 LYS HD3 1 1 5 1828 1 1 25 LYS HE2 H 4.233 -0.035 9.179 1.00 . A A . 25 LYS HE2 1 1 5 1829 1 1 25 LYS HE3 H 2.518 0.071 9.548 1.00 . A A . 25 LYS HE3 1 1 5 1830 1 1 25 LYS HG2 H 4.032 -1.223 6.424 1.00 . A A . 25 LYS HG2 1 1 5 1831 1 1 25 LYS HG3 H 5.006 0.185 6.800 1.00 . A A . 25 LYS HG3 1 1 5 1832 1 1 25 LYS HZ1 H 2.453 -2.002 7.958 1.00 . A A . 25 LYS HZ1 1 1 5 1833 1 1 25 LYS HZ2 H 4.057 -2.165 8.487 1.00 . A A . 25 LYS HZ2 1 1 5 1834 1 1 25 LYS HZ3 H 2.788 -2.153 9.618 1.00 . A A . 25 LYS HZ3 1 1 5 1835 1 1 25 LYS N N 2.293 -1.485 4.458 1.00 . A A . 25 LYS N 1 1 5 1836 1 1 25 LYS NZ N 3.126 -1.761 8.715 1.00 . A A . 25 LYS NZ 1 1 5 1837 1 1 25 LYS O O 2.587 -0.328 2.124 1.00 . A A . 25 LYS O 1 1 5 1838 1 1 26 CYS C C 3.331 2.618 0.765 1.00 . A A . 26 CYS C 1 1 5 1839 1 1 26 CYS CA C 2.002 2.262 1.437 1.00 . A A . 26 CYS CA 1 1 5 1840 1 1 26 CYS CB C 1.106 3.482 1.482 1.00 . A A . 26 CYS CB 1 1 5 1841 1 1 26 CYS H H 1.949 2.302 3.603 1.00 . A A . 26 CYS H 1 1 5 1842 1 1 26 CYS HA H 1.512 1.526 0.822 1.00 . A A . 26 CYS HA 1 1 5 1843 1 1 26 CYS HB2 H 1.515 4.166 2.203 1.00 . A A . 26 CYS HB2 1 1 5 1844 1 1 26 CYS HB3 H 1.091 3.966 0.519 1.00 . A A . 26 CYS HB3 1 1 5 1845 1 1 26 CYS N N 2.098 1.722 2.827 1.00 . A A . 26 CYS N 1 1 5 1846 1 1 26 CYS O O 4.338 2.860 1.400 1.00 . A A . 26 CYS O 1 1 5 1847 1 1 26 CYS SG S -0.600 3.149 1.960 1.00 . A A . 26 CYS SG 1 1 5 1848 1 1 27 NH2 HN1 H 2.531 2.457 -1.044 1.00 . A A . 27 NH2 HN1 1 1 5 1849 1 1 27 NH2 HN2 H 4.170 2.877 -1.025 1.00 . A A . 27 NH2 HN2 1 1 5 1850 1 1 27 NH2 N N 3.350 2.655 -0.541 1.00 . A A . 27 NH2 N 1 1 6 1851 1 1 1 CYS C C -6.112 6.405 1.829 1.00 . A A . 1 CYS C 1 1 6 1852 1 1 1 CYS CA C -7.153 6.142 0.735 1.00 . A A . 1 CYS CA 1 1 6 1853 1 1 1 CYS CB C -6.605 6.602 -0.620 1.00 . A A . 1 CYS CB 1 1 6 1854 1 1 1 CYS H1 H -8.782 6.568 1.958 1.00 . A A . 1 CYS H1 1 1 6 1855 1 1 1 CYS H2 H -8.220 7.899 1.065 1.00 . A A . 1 CYS H2 1 1 6 1856 1 1 1 CYS H3 H -9.116 6.678 0.295 1.00 . A A . 1 CYS H3 1 1 6 1857 1 1 1 CYS HA H -7.362 5.084 0.717 1.00 . A A . 1 CYS HA 1 1 6 1858 1 1 1 CYS HB2 H -5.724 6.018 -0.833 1.00 . A A . 1 CYS HB2 1 1 6 1859 1 1 1 CYS HB3 H -7.336 6.365 -1.380 1.00 . A A . 1 CYS HB3 1 1 6 1860 1 1 1 CYS N N -8.414 6.878 1.036 1.00 . A A . 1 CYS N 1 1 6 1861 1 1 1 CYS O O -6.289 7.276 2.659 1.00 . A A . 1 CYS O 1 1 6 1862 1 1 1 CYS SG S -6.172 8.350 -0.806 1.00 . A A . 1 CYS SG 1 1 6 1863 1 1 2 LYS C C -2.662 6.291 2.141 1.00 . A A . 2 LYS C 1 1 6 1864 1 1 2 LYS CA C -3.952 5.765 2.790 1.00 . A A . 2 LYS CA 1 1 6 1865 1 1 2 LYS CB C -3.701 4.379 3.424 1.00 . A A . 2 LYS CB 1 1 6 1866 1 1 2 LYS CD C -5.496 4.762 5.256 1.00 . A A . 2 LYS CD 1 1 6 1867 1 1 2 LYS CE C -4.424 4.976 6.340 1.00 . A A . 2 LYS CE 1 1 6 1868 1 1 2 LYS CG C -4.973 3.829 4.131 1.00 . A A . 2 LYS CG 1 1 6 1869 1 1 2 LYS H H -4.985 4.955 1.082 1.00 . A A . 2 LYS H 1 1 6 1870 1 1 2 LYS HA H -4.245 6.461 3.562 1.00 . A A . 2 LYS HA 1 1 6 1871 1 1 2 LYS HB2 H -3.412 3.682 2.651 1.00 . A A . 2 LYS HB2 1 1 6 1872 1 1 2 LYS HB3 H -2.893 4.435 4.135 1.00 . A A . 2 LYS HB3 1 1 6 1873 1 1 2 LYS HD2 H -5.797 5.714 4.846 1.00 . A A . 2 LYS HD2 1 1 6 1874 1 1 2 LYS HD3 H -6.362 4.305 5.711 1.00 . A A . 2 LYS HD3 1 1 6 1875 1 1 2 LYS HE2 H -4.120 4.035 6.773 1.00 . A A . 2 LYS HE2 1 1 6 1876 1 1 2 LYS HE3 H -3.565 5.470 5.917 1.00 . A A . 2 LYS HE3 1 1 6 1877 1 1 2 LYS HG2 H -5.759 3.687 3.405 1.00 . A A . 2 LYS HG2 1 1 6 1878 1 1 2 LYS HG3 H -4.735 2.868 4.562 1.00 . A A . 2 LYS HG3 1 1 6 1879 1 1 2 LYS HZ1 H -5.825 5.414 7.817 1.00 . A A . 2 LYS HZ1 1 1 6 1880 1 1 2 LYS HZ2 H -4.254 5.959 8.165 1.00 . A A . 2 LYS HZ2 1 1 6 1881 1 1 2 LYS HZ3 H -5.203 6.780 7.022 1.00 . A A . 2 LYS HZ3 1 1 6 1882 1 1 2 LYS N N -5.054 5.633 1.786 1.00 . A A . 2 LYS N 1 1 6 1883 1 1 2 LYS NZ N -4.968 5.848 7.418 1.00 . A A . 2 LYS NZ 1 1 6 1884 1 1 2 LYS O O -2.127 5.690 1.230 1.00 . A A . 2 LYS O 1 1 6 1885 1 1 3 GLY C C 0.266 7.124 2.245 1.00 . A A . 3 GLY C 1 1 6 1886 1 1 3 GLY CA C -0.953 8.053 2.119 1.00 . A A . 3 GLY CA 1 1 6 1887 1 1 3 GLY H H -2.698 7.833 3.375 1.00 . A A . 3 GLY H 1 1 6 1888 1 1 3 GLY HA2 H -1.096 8.308 1.080 1.00 . A A . 3 GLY HA2 1 1 6 1889 1 1 3 GLY HA3 H -0.764 8.955 2.681 1.00 . A A . 3 GLY HA3 1 1 6 1890 1 1 3 GLY N N -2.204 7.411 2.643 1.00 . A A . 3 GLY N 1 1 6 1891 1 1 3 GLY O O 0.197 6.106 2.903 1.00 . A A . 3 GLY O 1 1 6 1892 1 1 4 LYS C C 3.068 6.298 3.059 1.00 . A A . 4 LYS C 1 1 6 1893 1 1 4 LYS CA C 2.606 6.695 1.643 1.00 . A A . 4 LYS CA 1 1 6 1894 1 1 4 LYS CB C 3.715 7.502 0.953 1.00 . A A . 4 LYS CB 1 1 6 1895 1 1 4 LYS CD C 4.405 8.606 -1.290 1.00 . A A . 4 LYS CD 1 1 6 1896 1 1 4 LYS CE C 5.811 7.952 -1.374 1.00 . A A . 4 LYS CE 1 1 6 1897 1 1 4 LYS CG C 3.348 7.747 -0.532 1.00 . A A . 4 LYS CG 1 1 6 1898 1 1 4 LYS H H 1.352 8.338 1.099 1.00 . A A . 4 LYS H 1 1 6 1899 1 1 4 LYS HA H 2.436 5.793 1.074 1.00 . A A . 4 LYS HA 1 1 6 1900 1 1 4 LYS HB2 H 3.870 8.440 1.464 1.00 . A A . 4 LYS HB2 1 1 6 1901 1 1 4 LYS HB3 H 4.610 6.914 1.018 1.00 . A A . 4 LYS HB3 1 1 6 1902 1 1 4 LYS HD2 H 4.049 8.786 -2.294 1.00 . A A . 4 LYS HD2 1 1 6 1903 1 1 4 LYS HD3 H 4.497 9.563 -0.796 1.00 . A A . 4 LYS HD3 1 1 6 1904 1 1 4 LYS HE2 H 5.734 6.968 -1.813 1.00 . A A . 4 LYS HE2 1 1 6 1905 1 1 4 LYS HE3 H 6.455 8.556 -1.995 1.00 . A A . 4 LYS HE3 1 1 6 1906 1 1 4 LYS HG2 H 3.246 6.795 -1.035 1.00 . A A . 4 LYS HG2 1 1 6 1907 1 1 4 LYS HG3 H 2.396 8.256 -0.589 1.00 . A A . 4 LYS HG3 1 1 6 1908 1 1 4 LYS HZ1 H 5.959 8.438 0.646 1.00 . A A . 4 LYS HZ1 1 1 6 1909 1 1 4 LYS HZ2 H 6.382 6.831 0.286 1.00 . A A . 4 LYS HZ2 1 1 6 1910 1 1 4 LYS HZ3 H 7.448 8.096 -0.096 1.00 . A A . 4 LYS HZ3 1 1 6 1911 1 1 4 LYS N N 1.349 7.504 1.611 1.00 . A A . 4 LYS N 1 1 6 1912 1 1 4 LYS NZ N 6.447 7.819 -0.033 1.00 . A A . 4 LYS NZ 1 1 6 1913 1 1 4 LYS O O 3.063 7.102 3.972 1.00 . A A . 4 LYS O 1 1 6 1914 1 1 5 GLY C C 2.826 4.271 5.508 1.00 . A A . 5 GLY C 1 1 6 1915 1 1 5 GLY CA C 3.932 4.472 4.464 1.00 . A A . 5 GLY CA 1 1 6 1916 1 1 5 GLY H H 3.411 4.476 2.381 1.00 . A A . 5 GLY H 1 1 6 1917 1 1 5 GLY HA2 H 4.386 3.515 4.254 1.00 . A A . 5 GLY HA2 1 1 6 1918 1 1 5 GLY HA3 H 4.687 5.122 4.881 1.00 . A A . 5 GLY HA3 1 1 6 1919 1 1 5 GLY N N 3.447 5.050 3.172 1.00 . A A . 5 GLY N 1 1 6 1920 1 1 5 GLY O O 3.117 3.904 6.630 1.00 . A A . 5 GLY O 1 1 6 1921 1 1 6 ALA C C -0.052 2.885 6.057 1.00 . A A . 6 ALA C 1 1 6 1922 1 1 6 ALA CA C 0.450 4.347 6.071 1.00 . A A . 6 ALA CA 1 1 6 1923 1 1 6 ALA CB C -0.667 5.298 5.644 1.00 . A A . 6 ALA CB 1 1 6 1924 1 1 6 ALA H H 1.430 4.806 4.202 1.00 . A A . 6 ALA H 1 1 6 1925 1 1 6 ALA HA H 0.781 4.607 7.066 1.00 . A A . 6 ALA HA 1 1 6 1926 1 1 6 ALA HB1 H -0.311 6.319 5.664 1.00 . A A . 6 ALA HB1 1 1 6 1927 1 1 6 ALA HB2 H -0.988 5.059 4.644 1.00 . A A . 6 ALA HB2 1 1 6 1928 1 1 6 ALA HB3 H -1.508 5.212 6.311 1.00 . A A . 6 ALA HB3 1 1 6 1929 1 1 6 ALA N N 1.598 4.514 5.122 1.00 . A A . 6 ALA N 1 1 6 1930 1 1 6 ALA O O 0.100 2.221 5.050 1.00 . A A . 6 ALA O 1 1 6 1931 1 1 7 PRO C C -2.166 0.572 6.379 1.00 . A A . 7 PRO C 1 1 6 1932 1 1 7 PRO CA C -1.020 0.988 7.324 1.00 . A A . 7 PRO CA 1 1 6 1933 1 1 7 PRO CB C -1.391 0.850 8.808 1.00 . A A . 7 PRO CB 1 1 6 1934 1 1 7 PRO CD C -0.981 3.249 8.349 1.00 . A A . 7 PRO CD 1 1 6 1935 1 1 7 PRO CG C -1.642 2.270 9.332 1.00 . A A . 7 PRO CG 1 1 6 1936 1 1 7 PRO HA H -0.159 0.372 7.116 1.00 . A A . 7 PRO HA 1 1 6 1937 1 1 7 PRO HB2 H -2.268 0.234 8.944 1.00 . A A . 7 PRO HB2 1 1 6 1938 1 1 7 PRO HB3 H -0.567 0.404 9.346 1.00 . A A . 7 PRO HB3 1 1 6 1939 1 1 7 PRO HD2 H -1.667 4.033 8.068 1.00 . A A . 7 PRO HD2 1 1 6 1940 1 1 7 PRO HD3 H -0.083 3.670 8.775 1.00 . A A . 7 PRO HD3 1 1 6 1941 1 1 7 PRO HG2 H -2.704 2.460 9.388 1.00 . A A . 7 PRO HG2 1 1 6 1942 1 1 7 PRO HG3 H -1.214 2.385 10.317 1.00 . A A . 7 PRO HG3 1 1 6 1943 1 1 7 PRO N N -0.633 2.423 7.150 1.00 . A A . 7 PRO N 1 1 6 1944 1 1 7 PRO O O -3.329 0.588 6.734 1.00 . A A . 7 PRO O 1 1 6 1945 1 1 8 CYS C C -2.749 -1.741 3.878 1.00 . A A . 8 CYS C 1 1 6 1946 1 1 8 CYS CA C -2.700 -0.232 4.111 1.00 . A A . 8 CYS CA 1 1 6 1947 1 1 8 CYS CB C -2.289 0.389 2.816 1.00 . A A . 8 CYS CB 1 1 6 1948 1 1 8 CYS H H -0.804 0.242 4.982 1.00 . A A . 8 CYS H 1 1 6 1949 1 1 8 CYS HA H -3.694 0.115 4.352 1.00 . A A . 8 CYS HA 1 1 6 1950 1 1 8 CYS HB2 H -2.827 -0.092 2.010 1.00 . A A . 8 CYS HB2 1 1 6 1951 1 1 8 CYS HB3 H -2.543 1.428 2.763 1.00 . A A . 8 CYS HB3 1 1 6 1952 1 1 8 CYS N N -1.763 0.213 5.189 1.00 . A A . 8 CYS N 1 1 6 1953 1 1 8 CYS O O -1.863 -2.490 4.242 1.00 . A A . 8 CYS O 1 1 6 1954 1 1 8 CYS SG S -0.527 0.128 2.503 1.00 . A A . 8 CYS SG 1 1 6 1955 1 1 9 ARG C C -4.018 -3.574 1.337 1.00 . A A . 9 ARG C 1 1 6 1956 1 1 9 ARG CA C -4.145 -3.491 2.878 1.00 . A A . 9 ARG CA 1 1 6 1957 1 1 9 ARG CB C -5.560 -3.770 3.433 1.00 . A A . 9 ARG CB 1 1 6 1958 1 1 9 ARG CD C -7.975 -2.937 3.615 1.00 . A A . 9 ARG CD 1 1 6 1959 1 1 9 ARG CG C -6.612 -2.748 2.927 1.00 . A A . 9 ARG CG 1 1 6 1960 1 1 9 ARG CZ C -7.435 -3.332 5.990 1.00 . A A . 9 ARG CZ 1 1 6 1961 1 1 9 ARG H H -4.498 -1.409 3.034 1.00 . A A . 9 ARG H 1 1 6 1962 1 1 9 ARG HA H -3.431 -4.162 3.334 1.00 . A A . 9 ARG HA 1 1 6 1963 1 1 9 ARG HB2 H -5.866 -4.769 3.158 1.00 . A A . 9 ARG HB2 1 1 6 1964 1 1 9 ARG HB3 H -5.473 -3.714 4.503 1.00 . A A . 9 ARG HB3 1 1 6 1965 1 1 9 ARG HD2 H -8.718 -2.306 3.151 1.00 . A A . 9 ARG HD2 1 1 6 1966 1 1 9 ARG HD3 H -8.306 -3.966 3.568 1.00 . A A . 9 ARG HD3 1 1 6 1967 1 1 9 ARG HE H -7.981 -1.578 5.274 1.00 . A A . 9 ARG HE 1 1 6 1968 1 1 9 ARG HG2 H -6.274 -1.761 3.192 1.00 . A A . 9 ARG HG2 1 1 6 1969 1 1 9 ARG HG3 H -6.730 -2.792 1.859 1.00 . A A . 9 ARG HG3 1 1 6 1970 1 1 9 ARG HH11 H -7.306 -4.943 4.807 1.00 . A A . 9 ARG HH11 1 1 6 1971 1 1 9 ARG HH12 H -6.906 -5.203 6.471 1.00 . A A . 9 ARG HH12 1 1 6 1972 1 1 9 ARG HH21 H -7.484 -1.861 7.338 1.00 . A A . 9 ARG HH21 1 1 6 1973 1 1 9 ARG HH22 H -7.007 -3.415 7.942 1.00 . A A . 9 ARG HH22 1 1 6 1974 1 1 9 ARG N N -3.837 -2.094 3.253 1.00 . A A . 9 ARG N 1 1 6 1975 1 1 9 ARG NE N -7.810 -2.514 5.042 1.00 . A A . 9 ARG NE 1 1 6 1976 1 1 9 ARG NH1 N -7.198 -4.591 5.737 1.00 . A A . 9 ARG NH1 1 1 6 1977 1 1 9 ARG NH2 N -7.298 -2.831 7.186 1.00 . A A . 9 ARG NH2 1 1 6 1978 1 1 9 ARG O O -4.885 -3.181 0.575 1.00 . A A . 9 ARG O 1 1 6 1979 1 1 10 LYS C C -3.576 -5.201 -1.186 1.00 . A A . 10 LYS C 1 1 6 1980 1 1 10 LYS CA C -2.560 -4.270 -0.517 1.00 . A A . 10 LYS CA 1 1 6 1981 1 1 10 LYS CB C -1.124 -4.856 -0.668 1.00 . A A . 10 LYS CB 1 1 6 1982 1 1 10 LYS CD C -1.197 -6.416 1.400 1.00 . A A . 10 LYS CD 1 1 6 1983 1 1 10 LYS CE C -0.864 -7.839 1.881 1.00 . A A . 10 LYS CE 1 1 6 1984 1 1 10 LYS CG C -0.927 -6.301 -0.120 1.00 . A A . 10 LYS CG 1 1 6 1985 1 1 10 LYS H H -2.225 -4.376 1.611 1.00 . A A . 10 LYS H 1 1 6 1986 1 1 10 LYS HA H -2.617 -3.306 -1.002 1.00 . A A . 10 LYS HA 1 1 6 1987 1 1 10 LYS HB2 H -0.845 -4.835 -1.711 1.00 . A A . 10 LYS HB2 1 1 6 1988 1 1 10 LYS HB3 H -0.448 -4.208 -0.131 1.00 . A A . 10 LYS HB3 1 1 6 1989 1 1 10 LYS HD2 H -0.610 -5.690 1.946 1.00 . A A . 10 LYS HD2 1 1 6 1990 1 1 10 LYS HD3 H -2.244 -6.250 1.605 1.00 . A A . 10 LYS HD3 1 1 6 1991 1 1 10 LYS HE2 H -1.069 -7.930 2.937 1.00 . A A . 10 LYS HE2 1 1 6 1992 1 1 10 LYS HE3 H -1.459 -8.566 1.346 1.00 . A A . 10 LYS HE3 1 1 6 1993 1 1 10 LYS HG2 H -1.586 -6.973 -0.649 1.00 . A A . 10 LYS HG2 1 1 6 1994 1 1 10 LYS HG3 H 0.089 -6.603 -0.325 1.00 . A A . 10 LYS HG3 1 1 6 1995 1 1 10 LYS HZ1 H 1.139 -7.273 1.794 1.00 . A A . 10 LYS HZ1 1 1 6 1996 1 1 10 LYS HZ2 H 0.892 -8.870 2.320 1.00 . A A . 10 LYS HZ2 1 1 6 1997 1 1 10 LYS HZ3 H 0.710 -8.478 0.677 1.00 . A A . 10 LYS HZ3 1 1 6 1998 1 1 10 LYS N N -2.880 -4.097 0.938 1.00 . A A . 10 LYS N 1 1 6 1999 1 1 10 LYS NZ N 0.579 -8.138 1.651 1.00 . A A . 10 LYS NZ 1 1 6 2000 1 1 10 LYS O O -3.645 -5.286 -2.397 1.00 . A A . 10 LYS O 1 1 6 2001 1 1 11 THR C C -6.266 -6.191 -1.844 1.00 . A A . 11 THR C 1 1 6 2002 1 1 11 THR CA C -5.393 -6.825 -0.748 1.00 . A A . 11 THR CA 1 1 6 2003 1 1 11 THR CB C -6.207 -7.143 0.514 1.00 . A A . 11 THR CB 1 1 6 2004 1 1 11 THR CG2 C -7.291 -8.208 0.265 1.00 . A A . 11 THR CG2 1 1 6 2005 1 1 11 THR H H -4.179 -5.727 0.620 1.00 . A A . 11 THR H 1 1 6 2006 1 1 11 THR HA H -4.926 -7.717 -1.141 1.00 . A A . 11 THR HA 1 1 6 2007 1 1 11 THR HB H -6.576 -6.241 0.984 1.00 . A A . 11 THR HB 1 1 6 2008 1 1 11 THR HG1 H -4.886 -8.513 0.925 1.00 . A A . 11 THR HG1 1 1 6 2009 1 1 11 THR HG21 H -6.844 -9.131 -0.074 1.00 . A A . 11 THR HG21 1 1 6 2010 1 1 11 THR HG22 H -7.834 -8.400 1.179 1.00 . A A . 11 THR HG22 1 1 6 2011 1 1 11 THR HG23 H -7.988 -7.864 -0.486 1.00 . A A . 11 THR HG23 1 1 6 2012 1 1 11 THR N N -4.325 -5.864 -0.339 1.00 . A A . 11 THR N 1 1 6 2013 1 1 11 THR O O -6.740 -6.863 -2.740 1.00 . A A . 11 THR O 1 1 6 2014 1 1 11 THR OG1 O -5.275 -7.766 1.387 1.00 . A A . 11 THR OG1 1 1 6 2015 1 1 12 MET C C -6.599 -2.734 -2.900 1.00 . A A . 12 MET C 1 1 6 2016 1 1 12 MET CA C -7.249 -4.103 -2.680 1.00 . A A . 12 MET CA 1 1 6 2017 1 1 12 MET CB C -8.689 -3.934 -2.126 1.00 . A A . 12 MET CB 1 1 6 2018 1 1 12 MET CE C -9.460 -5.298 1.027 1.00 . A A . 12 MET CE 1 1 6 2019 1 1 12 MET CG C -8.718 -3.315 -0.718 1.00 . A A . 12 MET CG 1 1 6 2020 1 1 12 MET H H -6.017 -4.440 -0.955 1.00 . A A . 12 MET H 1 1 6 2021 1 1 12 MET HA H -7.281 -4.617 -3.630 1.00 . A A . 12 MET HA 1 1 6 2022 1 1 12 MET HB2 H -9.285 -3.338 -2.802 1.00 . A A . 12 MET HB2 1 1 6 2023 1 1 12 MET HB3 H -9.128 -4.913 -2.059 1.00 . A A . 12 MET HB3 1 1 6 2024 1 1 12 MET HE1 H -9.825 -5.807 0.147 1.00 . A A . 12 MET HE1 1 1 6 2025 1 1 12 MET HE2 H -9.174 -6.043 1.755 1.00 . A A . 12 MET HE2 1 1 6 2026 1 1 12 MET HE3 H -10.224 -4.668 1.455 1.00 . A A . 12 MET HE3 1 1 6 2027 1 1 12 MET HG2 H -8.191 -2.373 -0.739 1.00 . A A . 12 MET HG2 1 1 6 2028 1 1 12 MET HG3 H -9.742 -3.104 -0.452 1.00 . A A . 12 MET HG3 1 1 6 2029 1 1 12 MET N N -6.437 -4.900 -1.712 1.00 . A A . 12 MET N 1 1 6 2030 1 1 12 MET O O -7.230 -1.823 -3.401 1.00 . A A . 12 MET O 1 1 6 2031 1 1 12 MET SD S -8.001 -4.311 0.610 1.00 . A A . 12 MET SD 1 1 6 2032 1 1 13 TYR C C -5.336 -0.220 -2.039 1.00 . A A . 13 TYR C 1 1 6 2033 1 1 13 TYR CA C -4.556 -1.384 -2.654 1.00 . A A . 13 TYR CA 1 1 6 2034 1 1 13 TYR CB C -4.269 -1.158 -4.159 1.00 . A A . 13 TYR CB 1 1 6 2035 1 1 13 TYR CD1 C -2.084 -2.406 -4.442 1.00 . A A . 13 TYR CD1 1 1 6 2036 1 1 13 TYR CD2 C -4.065 -3.418 -5.292 1.00 . A A . 13 TYR CD2 1 1 6 2037 1 1 13 TYR CE1 C -1.346 -3.489 -4.870 1.00 . A A . 13 TYR CE1 1 1 6 2038 1 1 13 TYR CE2 C -3.326 -4.501 -5.720 1.00 . A A . 13 TYR CE2 1 1 6 2039 1 1 13 TYR CG C -3.449 -2.361 -4.648 1.00 . A A . 13 TYR CG 1 1 6 2040 1 1 13 TYR CZ C -1.963 -4.544 -5.512 1.00 . A A . 13 TYR CZ 1 1 6 2041 1 1 13 TYR H H -4.913 -3.431 -2.125 1.00 . A A . 13 TYR H 1 1 6 2042 1 1 13 TYR HA H -3.627 -1.500 -2.114 1.00 . A A . 13 TYR HA 1 1 6 2043 1 1 13 TYR HB2 H -5.186 -1.094 -4.727 1.00 . A A . 13 TYR HB2 1 1 6 2044 1 1 13 TYR HB3 H -3.697 -0.255 -4.308 1.00 . A A . 13 TYR HB3 1 1 6 2045 1 1 13 TYR HD1 H -1.588 -1.588 -3.941 1.00 . A A . 13 TYR HD1 1 1 6 2046 1 1 13 TYR HD2 H -5.132 -3.399 -5.461 1.00 . A A . 13 TYR HD2 1 1 6 2047 1 1 13 TYR HE1 H -0.280 -3.511 -4.703 1.00 . A A . 13 TYR HE1 1 1 6 2048 1 1 13 TYR HE2 H -3.820 -5.321 -6.221 1.00 . A A . 13 TYR HE2 1 1 6 2049 1 1 13 TYR HH H -0.565 -5.312 -6.561 1.00 . A A . 13 TYR HH 1 1 6 2050 1 1 13 TYR N N -5.347 -2.645 -2.516 1.00 . A A . 13 TYR N 1 1 6 2051 1 1 13 TYR O O -5.893 0.631 -2.706 1.00 . A A . 13 TYR O 1 1 6 2052 1 1 13 TYR OH O -1.225 -5.629 -5.939 1.00 . A A . 13 TYR OH 1 1 6 2053 1 1 14 ASP C C -5.216 2.075 0.226 1.00 . A A . 14 ASP C 1 1 6 2054 1 1 14 ASP CA C -6.007 0.757 0.114 1.00 . A A . 14 ASP CA 1 1 6 2055 1 1 14 ASP CB C -6.205 0.070 1.469 1.00 . A A . 14 ASP CB 1 1 6 2056 1 1 14 ASP CG C -6.809 0.972 2.561 1.00 . A A . 14 ASP CG 1 1 6 2057 1 1 14 ASP H H -4.839 -1.000 -0.303 1.00 . A A . 14 ASP H 1 1 6 2058 1 1 14 ASP HA H -6.973 0.974 -0.321 1.00 . A A . 14 ASP HA 1 1 6 2059 1 1 14 ASP HB2 H -6.891 -0.738 1.307 1.00 . A A . 14 ASP HB2 1 1 6 2060 1 1 14 ASP HB3 H -5.277 -0.369 1.802 1.00 . A A . 14 ASP HB3 1 1 6 2061 1 1 14 ASP N N -5.320 -0.262 -0.735 1.00 . A A . 14 ASP N 1 1 6 2062 1 1 14 ASP O O -5.533 2.926 1.033 1.00 . A A . 14 ASP O 1 1 6 2063 1 1 14 ASP OD1 O -7.813 1.605 2.275 1.00 . A A . 14 ASP OD1 1 1 6 2064 1 1 14 ASP OD2 O -6.221 0.970 3.630 1.00 . A A . 14 ASP OD2 1 1 6 2065 1 1 15 CYS C C -3.695 4.416 -1.718 1.00 . A A . 15 CYS C 1 1 6 2066 1 1 15 CYS CA C -3.360 3.433 -0.601 1.00 . A A . 15 CYS CA 1 1 6 2067 1 1 15 CYS CB C -1.911 3.043 -0.752 1.00 . A A . 15 CYS CB 1 1 6 2068 1 1 15 CYS H H -4.018 1.467 -1.224 1.00 . A A . 15 CYS H 1 1 6 2069 1 1 15 CYS HA H -3.474 3.939 0.344 1.00 . A A . 15 CYS HA 1 1 6 2070 1 1 15 CYS HB2 H -1.788 2.546 -1.703 1.00 . A A . 15 CYS HB2 1 1 6 2071 1 1 15 CYS HB3 H -1.303 3.936 -0.765 1.00 . A A . 15 CYS HB3 1 1 6 2072 1 1 15 CYS N N -4.211 2.199 -0.602 1.00 . A A . 15 CYS N 1 1 6 2073 1 1 15 CYS O O -4.227 4.046 -2.746 1.00 . A A . 15 CYS O 1 1 6 2074 1 1 15 CYS SG S -1.259 1.953 0.526 1.00 . A A . 15 CYS SG 1 1 6 2075 1 1 16 CYS C C -2.607 6.512 -3.581 1.00 . A A . 16 CYS C 1 1 6 2076 1 1 16 CYS CA C -3.593 6.755 -2.426 1.00 . A A . 16 CYS CA 1 1 6 2077 1 1 16 CYS CB C -3.310 8.077 -1.718 1.00 . A A . 16 CYS CB 1 1 6 2078 1 1 16 CYS H H -2.935 5.877 -0.602 1.00 . A A . 16 CYS H 1 1 6 2079 1 1 16 CYS HA H -4.608 6.708 -2.794 1.00 . A A . 16 CYS HA 1 1 6 2080 1 1 16 CYS HB2 H -2.260 8.119 -1.466 1.00 . A A . 16 CYS HB2 1 1 6 2081 1 1 16 CYS HB3 H -3.512 8.876 -2.409 1.00 . A A . 16 CYS HB3 1 1 6 2082 1 1 16 CYS N N -3.356 5.654 -1.454 1.00 . A A . 16 CYS N 1 1 6 2083 1 1 16 CYS O O -2.876 6.823 -4.725 1.00 . A A . 16 CYS O 1 1 6 2084 1 1 16 CYS SG S -4.245 8.408 -0.205 1.00 . A A . 16 CYS SG 1 1 6 2085 1 1 17 SER C C -0.798 4.351 -4.936 1.00 . A A . 17 SER C 1 1 6 2086 1 1 17 SER CA C -0.389 5.616 -4.155 1.00 . A A . 17 SER CA 1 1 6 2087 1 1 17 SER CB C 0.889 5.368 -3.340 1.00 . A A . 17 SER CB 1 1 6 2088 1 1 17 SER H H -1.361 5.739 -2.252 1.00 . A A . 17 SER H 1 1 6 2089 1 1 17 SER HA H -0.253 6.437 -4.845 1.00 . A A . 17 SER HA 1 1 6 2090 1 1 17 SER HB2 H 1.150 6.233 -2.748 1.00 . A A . 17 SER HB2 1 1 6 2091 1 1 17 SER HB3 H 0.787 4.503 -2.701 1.00 . A A . 17 SER HB3 1 1 6 2092 1 1 17 SER HG H 1.642 4.349 -4.817 1.00 . A A . 17 SER HG 1 1 6 2093 1 1 17 SER N N -1.486 5.949 -3.201 1.00 . A A . 17 SER N 1 1 6 2094 1 1 17 SER O O -0.310 4.106 -6.022 1.00 . A A . 17 SER O 1 1 6 2095 1 1 17 SER OG O 1.899 5.120 -4.307 1.00 . A A . 17 SER OG 1 1 6 2096 1 1 18 GLY C C -1.098 1.262 -5.089 1.00 . A A . 18 GLY C 1 1 6 2097 1 1 18 GLY CA C -2.191 2.330 -4.963 1.00 . A A . 18 GLY CA 1 1 6 2098 1 1 18 GLY H H -2.035 3.856 -3.460 1.00 . A A . 18 GLY H 1 1 6 2099 1 1 18 GLY HA2 H -2.984 1.939 -4.345 1.00 . A A . 18 GLY HA2 1 1 6 2100 1 1 18 GLY HA3 H -2.578 2.555 -5.945 1.00 . A A . 18 GLY HA3 1 1 6 2101 1 1 18 GLY N N -1.689 3.591 -4.339 1.00 . A A . 18 GLY N 1 1 6 2102 1 1 18 GLY O O -1.215 0.351 -5.886 1.00 . A A . 18 GLY O 1 1 6 2103 1 1 19 SER C C 1.475 0.164 -2.842 1.00 . A A . 19 SER C 1 1 6 2104 1 1 19 SER CA C 1.074 0.458 -4.295 1.00 . A A . 19 SER CA 1 1 6 2105 1 1 19 SER CB C 2.232 1.105 -5.098 1.00 . A A . 19 SER CB 1 1 6 2106 1 1 19 SER H H -0.053 2.178 -3.676 1.00 . A A . 19 SER H 1 1 6 2107 1 1 19 SER HA H 0.775 -0.471 -4.761 1.00 . A A . 19 SER HA 1 1 6 2108 1 1 19 SER HB2 H 3.114 0.482 -5.092 1.00 . A A . 19 SER HB2 1 1 6 2109 1 1 19 SER HB3 H 1.934 1.312 -6.116 1.00 . A A . 19 SER HB3 1 1 6 2110 1 1 19 SER HG H 1.696 2.826 -4.358 1.00 . A A . 19 SER HG 1 1 6 2111 1 1 19 SER N N -0.072 1.415 -4.291 1.00 . A A . 19 SER N 1 1 6 2112 1 1 19 SER O O 2.502 0.599 -2.357 1.00 . A A . 19 SER O 1 1 6 2113 1 1 19 SER OG O 2.515 2.330 -4.434 1.00 . A A . 19 SER OG 1 1 6 2114 1 1 20 CYS C C 1.808 -2.168 -0.688 1.00 . A A . 20 CYS C 1 1 6 2115 1 1 20 CYS CA C 0.872 -0.952 -0.766 1.00 . A A . 20 CYS CA 1 1 6 2116 1 1 20 CYS CB C -0.477 -1.253 -0.101 1.00 . A A . 20 CYS CB 1 1 6 2117 1 1 20 CYS H H -0.191 -0.901 -2.637 1.00 . A A . 20 CYS H 1 1 6 2118 1 1 20 CYS HA H 1.337 -0.119 -0.265 1.00 . A A . 20 CYS HA 1 1 6 2119 1 1 20 CYS HB2 H -1.094 -0.374 -0.191 1.00 . A A . 20 CYS HB2 1 1 6 2120 1 1 20 CYS HB3 H -0.993 -2.035 -0.619 1.00 . A A . 20 CYS HB3 1 1 6 2121 1 1 20 CYS N N 0.620 -0.583 -2.188 1.00 . A A . 20 CYS N 1 1 6 2122 1 1 20 CYS O O 1.477 -3.245 -1.139 1.00 . A A . 20 CYS O 1 1 6 2123 1 1 20 CYS SG S -0.417 -1.695 1.648 1.00 . A A . 20 CYS SG 1 1 6 2124 1 1 21 GLY C C 3.609 -4.225 0.865 1.00 . A A . 21 GLY C 1 1 6 2125 1 1 21 GLY CA C 4.014 -2.975 0.064 1.00 . A A . 21 GLY CA 1 1 6 2126 1 1 21 GLY H H 3.139 -1.025 0.219 1.00 . A A . 21 GLY H 1 1 6 2127 1 1 21 GLY HA2 H 4.344 -3.289 -0.916 1.00 . A A . 21 GLY HA2 1 1 6 2128 1 1 21 GLY HA3 H 4.854 -2.517 0.565 1.00 . A A . 21 GLY HA3 1 1 6 2129 1 1 21 GLY N N 2.960 -1.929 -0.111 1.00 . A A . 21 GLY N 1 1 6 2130 1 1 21 GLY O O 2.518 -4.337 1.391 1.00 . A A . 21 GLY O 1 1 6 2131 1 1 22 ARG C C 4.309 -6.235 3.145 1.00 . A A . 22 ARG C 1 1 6 2132 1 1 22 ARG CA C 4.422 -6.433 1.631 1.00 . A A . 22 ARG CA 1 1 6 2133 1 1 22 ARG CB C 5.655 -7.331 1.349 1.00 . A A . 22 ARG CB 1 1 6 2134 1 1 22 ARG CD C 5.831 -6.862 -1.231 1.00 . A A . 22 ARG CD 1 1 6 2135 1 1 22 ARG CG C 5.789 -7.905 -0.098 1.00 . A A . 22 ARG CG 1 1 6 2136 1 1 22 ARG CZ C 4.194 -5.483 -2.418 1.00 . A A . 22 ARG CZ 1 1 6 2137 1 1 22 ARG H H 5.403 -4.917 0.465 1.00 . A A . 22 ARG H 1 1 6 2138 1 1 22 ARG HA H 3.526 -6.925 1.280 1.00 . A A . 22 ARG HA 1 1 6 2139 1 1 22 ARG HB2 H 6.546 -6.760 1.565 1.00 . A A . 22 ARG HB2 1 1 6 2140 1 1 22 ARG HB3 H 5.636 -8.168 2.033 1.00 . A A . 22 ARG HB3 1 1 6 2141 1 1 22 ARG HD2 H 6.538 -6.079 -0.998 1.00 . A A . 22 ARG HD2 1 1 6 2142 1 1 22 ARG HD3 H 6.122 -7.338 -2.157 1.00 . A A . 22 ARG HD3 1 1 6 2143 1 1 22 ARG HE H 3.780 -6.443 -0.735 1.00 . A A . 22 ARG HE 1 1 6 2144 1 1 22 ARG HG2 H 6.696 -8.490 -0.144 1.00 . A A . 22 ARG HG2 1 1 6 2145 1 1 22 ARG HG3 H 4.961 -8.576 -0.277 1.00 . A A . 22 ARG HG3 1 1 6 2146 1 1 22 ARG HH11 H 6.021 -5.594 -3.239 1.00 . A A . 22 ARG HH11 1 1 6 2147 1 1 22 ARG HH12 H 4.870 -4.622 -4.093 1.00 . A A . 22 ARG HH12 1 1 6 2148 1 1 22 ARG HH21 H 2.313 -5.218 -1.796 1.00 . A A . 22 ARG HH21 1 1 6 2149 1 1 22 ARG HH22 H 2.739 -4.403 -3.264 1.00 . A A . 22 ARG HH22 1 1 6 2150 1 1 22 ARG N N 4.562 -5.123 0.916 1.00 . A A . 22 ARG N 1 1 6 2151 1 1 22 ARG NE N 4.476 -6.255 -1.399 1.00 . A A . 22 ARG NE 1 1 6 2152 1 1 22 ARG NH1 N 5.100 -5.212 -3.320 1.00 . A A . 22 ARG NH1 1 1 6 2153 1 1 22 ARG NH2 N 2.988 -4.997 -2.499 1.00 . A A . 22 ARG NH2 1 1 6 2154 1 1 22 ARG O O 3.691 -7.027 3.829 1.00 . A A . 22 ARG O 1 1 6 2155 1 1 23 ARG C C 3.549 -4.207 5.482 1.00 . A A . 23 ARG C 1 1 6 2156 1 1 23 ARG CA C 4.885 -4.852 5.075 1.00 . A A . 23 ARG CA 1 1 6 2157 1 1 23 ARG CB C 6.059 -3.894 5.392 1.00 . A A . 23 ARG CB 1 1 6 2158 1 1 23 ARG CD C 7.088 -1.632 4.913 1.00 . A A . 23 ARG CD 1 1 6 2159 1 1 23 ARG CG C 5.953 -2.602 4.541 1.00 . A A . 23 ARG CG 1 1 6 2160 1 1 23 ARG CZ C 7.703 -0.342 6.906 1.00 . A A . 23 ARG CZ 1 1 6 2161 1 1 23 ARG H H 5.388 -4.577 2.997 1.00 . A A . 23 ARG H 1 1 6 2162 1 1 23 ARG HA H 5.011 -5.767 5.637 1.00 . A A . 23 ARG HA 1 1 6 2163 1 1 23 ARG HB2 H 6.047 -3.652 6.445 1.00 . A A . 23 ARG HB2 1 1 6 2164 1 1 23 ARG HB3 H 6.992 -4.393 5.170 1.00 . A A . 23 ARG HB3 1 1 6 2165 1 1 23 ARG HD2 H 8.052 -2.098 4.769 1.00 . A A . 23 ARG HD2 1 1 6 2166 1 1 23 ARG HD3 H 7.027 -0.742 4.303 1.00 . A A . 23 ARG HD3 1 1 6 2167 1 1 23 ARG HE H 6.252 -1.689 6.896 1.00 . A A . 23 ARG HE 1 1 6 2168 1 1 23 ARG HG2 H 6.037 -2.846 3.491 1.00 . A A . 23 ARG HG2 1 1 6 2169 1 1 23 ARG HG3 H 4.999 -2.127 4.703 1.00 . A A . 23 ARG HG3 1 1 6 2170 1 1 23 ARG HH11 H 8.766 0.033 5.249 1.00 . A A . 23 ARG HH11 1 1 6 2171 1 1 23 ARG HH12 H 9.204 0.955 6.647 1.00 . A A . 23 ARG HH12 1 1 6 2172 1 1 23 ARG HH21 H 6.789 -0.538 8.677 1.00 . A A . 23 ARG HH21 1 1 6 2173 1 1 23 ARG HH22 H 8.070 0.627 8.618 1.00 . A A . 23 ARG HH22 1 1 6 2174 1 1 23 ARG N N 4.912 -5.171 3.614 1.00 . A A . 23 ARG N 1 1 6 2175 1 1 23 ARG NE N 6.939 -1.251 6.352 1.00 . A A . 23 ARG NE 1 1 6 2176 1 1 23 ARG NH1 N 8.630 0.262 6.212 1.00 . A A . 23 ARG NH1 1 1 6 2177 1 1 23 ARG NH2 N 7.505 -0.062 8.166 1.00 . A A . 23 ARG NH2 1 1 6 2178 1 1 23 ARG O O 3.401 -3.740 6.595 1.00 . A A . 23 ARG O 1 1 6 2179 1 1 24 GLY C C 1.323 -2.084 4.902 1.00 . A A . 24 GLY C 1 1 6 2180 1 1 24 GLY CA C 1.277 -3.612 4.828 1.00 . A A . 24 GLY CA 1 1 6 2181 1 1 24 GLY H H 2.800 -4.594 3.679 1.00 . A A . 24 GLY H 1 1 6 2182 1 1 24 GLY HA2 H 0.609 -3.901 4.029 1.00 . A A . 24 GLY HA2 1 1 6 2183 1 1 24 GLY HA3 H 0.896 -4.002 5.761 1.00 . A A . 24 GLY HA3 1 1 6 2184 1 1 24 GLY N N 2.618 -4.205 4.560 1.00 . A A . 24 GLY N 1 1 6 2185 1 1 24 GLY O O 0.426 -1.486 5.462 1.00 . A A . 24 GLY O 1 1 6 2186 1 1 25 LYS C C 2.382 0.481 2.927 1.00 . A A . 25 LYS C 1 1 6 2187 1 1 25 LYS CA C 2.475 -0.004 4.366 1.00 . A A . 25 LYS CA 1 1 6 2188 1 1 25 LYS CB C 3.828 0.449 4.943 1.00 . A A . 25 LYS CB 1 1 6 2189 1 1 25 LYS CD C 2.974 0.469 7.345 1.00 . A A . 25 LYS CD 1 1 6 2190 1 1 25 LYS CE C 3.216 -0.098 8.755 1.00 . A A . 25 LYS CE 1 1 6 2191 1 1 25 LYS CG C 4.046 -0.083 6.378 1.00 . A A . 25 LYS CG 1 1 6 2192 1 1 25 LYS H H 3.051 -2.043 3.905 1.00 . A A . 25 LYS H 1 1 6 2193 1 1 25 LYS HA H 1.661 0.426 4.927 1.00 . A A . 25 LYS HA 1 1 6 2194 1 1 25 LYS HB2 H 4.622 0.150 4.281 1.00 . A A . 25 LYS HB2 1 1 6 2195 1 1 25 LYS HB3 H 3.831 1.528 4.985 1.00 . A A . 25 LYS HB3 1 1 6 2196 1 1 25 LYS HD2 H 3.031 1.546 7.380 1.00 . A A . 25 LYS HD2 1 1 6 2197 1 1 25 LYS HD3 H 1.988 0.188 7.015 1.00 . A A . 25 LYS HD3 1 1 6 2198 1 1 25 LYS HE2 H 2.472 0.284 9.439 1.00 . A A . 25 LYS HE2 1 1 6 2199 1 1 25 LYS HE3 H 3.156 -1.177 8.740 1.00 . A A . 25 LYS HE3 1 1 6 2200 1 1 25 LYS HG2 H 4.024 -1.162 6.385 1.00 . A A . 25 LYS HG2 1 1 6 2201 1 1 25 LYS HG3 H 5.017 0.242 6.717 1.00 . A A . 25 LYS HG3 1 1 6 2202 1 1 25 LYS HZ1 H 4.813 1.235 8.871 1.00 . A A . 25 LYS HZ1 1 1 6 2203 1 1 25 LYS HZ2 H 4.557 0.336 10.289 1.00 . A A . 25 LYS HZ2 1 1 6 2204 1 1 25 LYS HZ3 H 5.268 -0.399 8.933 1.00 . A A . 25 LYS HZ3 1 1 6 2205 1 1 25 LYS N N 2.356 -1.500 4.343 1.00 . A A . 25 LYS N 1 1 6 2206 1 1 25 LYS NZ N 4.565 0.299 9.250 1.00 . A A . 25 LYS NZ 1 1 6 2207 1 1 25 LYS O O 2.615 -0.270 2.002 1.00 . A A . 25 LYS O 1 1 6 2208 1 1 26 CYS C C 3.232 2.730 0.761 1.00 . A A . 26 CYS C 1 1 6 2209 1 1 26 CYS CA C 1.914 2.328 1.424 1.00 . A A . 26 CYS CA 1 1 6 2210 1 1 26 CYS CB C 0.993 3.531 1.542 1.00 . A A . 26 CYS CB 1 1 6 2211 1 1 26 CYS H H 1.882 2.269 3.588 1.00 . A A . 26 CYS H 1 1 6 2212 1 1 26 CYS HA H 1.425 1.610 0.786 1.00 . A A . 26 CYS HA 1 1 6 2213 1 1 26 CYS HB2 H 1.408 4.203 2.271 1.00 . A A . 26 CYS HB2 1 1 6 2214 1 1 26 CYS HB3 H 0.946 4.040 0.595 1.00 . A A . 26 CYS HB3 1 1 6 2215 1 1 26 CYS N N 2.045 1.732 2.786 1.00 . A A . 26 CYS N 1 1 6 2216 1 1 26 CYS O O 4.265 2.851 1.391 1.00 . A A . 26 CYS O 1 1 6 2217 1 1 26 CYS SG S -0.705 3.174 2.036 1.00 . A A . 26 CYS SG 1 1 6 2218 1 1 27 NH2 HN1 H 2.381 2.840 -1.026 1.00 . A A . 27 NH2 HN1 1 1 6 2219 1 1 27 NH2 HN2 H 4.036 3.197 -1.003 1.00 . A A . 27 NH2 HN2 1 1 6 2220 1 1 27 NH2 N N 3.220 2.941 -0.528 1.00 . A A . 27 NH2 N 1 1 7 2221 1 1 1 CYS C C -6.072 6.056 2.052 1.00 . A A . 1 CYS C 1 1 7 2222 1 1 1 CYS CA C -7.100 5.866 0.929 1.00 . A A . 1 CYS CA 1 1 7 2223 1 1 1 CYS CB C -6.546 6.436 -0.383 1.00 . A A . 1 CYS CB 1 1 7 2224 1 1 1 CYS H1 H -8.193 7.574 1.395 1.00 . A A . 1 CYS H1 1 1 7 2225 1 1 1 CYS H2 H -9.059 6.421 0.496 1.00 . A A . 1 CYS H2 1 1 7 2226 1 1 1 CYS H3 H -8.760 6.161 2.149 1.00 . A A . 1 CYS H3 1 1 7 2227 1 1 1 CYS HA H -7.293 4.810 0.824 1.00 . A A . 1 CYS HA 1 1 7 2228 1 1 1 CYS HB2 H -5.651 5.886 -0.632 1.00 . A A . 1 CYS HB2 1 1 7 2229 1 1 1 CYS HB3 H -7.263 6.241 -1.166 1.00 . A A . 1 CYS HB3 1 1 7 2230 1 1 1 CYS N N -8.375 6.558 1.268 1.00 . A A . 1 CYS N 1 1 7 2231 1 1 1 CYS O O -6.333 6.733 3.029 1.00 . A A . 1 CYS O 1 1 7 2232 1 1 1 CYS SG S -6.149 8.201 -0.432 1.00 . A A . 1 CYS SG 1 1 7 2233 1 1 2 LYS C C -2.563 6.114 2.212 1.00 . A A . 2 LYS C 1 1 7 2234 1 1 2 LYS CA C -3.819 5.518 2.865 1.00 . A A . 2 LYS CA 1 1 7 2235 1 1 2 LYS CB C -3.533 4.089 3.390 1.00 . A A . 2 LYS CB 1 1 7 2236 1 1 2 LYS CD C -5.256 4.285 5.320 1.00 . A A . 2 LYS CD 1 1 7 2237 1 1 2 LYS CE C -4.152 4.346 6.388 1.00 . A A . 2 LYS CE 1 1 7 2238 1 1 2 LYS CG C -4.783 3.473 4.084 1.00 . A A . 2 LYS CG 1 1 7 2239 1 1 2 LYS H H -4.800 4.919 1.050 1.00 . A A . 2 LYS H 1 1 7 2240 1 1 2 LYS HA H -4.109 6.158 3.686 1.00 . A A . 2 LYS HA 1 1 7 2241 1 1 2 LYS HB2 H -3.271 3.457 2.554 1.00 . A A . 2 LYS HB2 1 1 7 2242 1 1 2 LYS HB3 H -2.696 4.096 4.070 1.00 . A A . 2 LYS HB3 1 1 7 2243 1 1 2 LYS HD2 H -5.536 5.287 5.029 1.00 . A A . 2 LYS HD2 1 1 7 2244 1 1 2 LYS HD3 H -6.127 3.805 5.742 1.00 . A A . 2 LYS HD3 1 1 7 2245 1 1 2 LYS HE2 H -3.877 3.353 6.712 1.00 . A A . 2 LYS HE2 1 1 7 2246 1 1 2 LYS HE3 H -3.283 4.841 5.990 1.00 . A A . 2 LYS HE3 1 1 7 2247 1 1 2 LYS HG2 H -5.598 3.419 3.379 1.00 . A A . 2 LYS HG2 1 1 7 2248 1 1 2 LYS HG3 H -4.543 2.467 4.396 1.00 . A A . 2 LYS HG3 1 1 7 2249 1 1 2 LYS HZ1 H -5.397 5.753 7.288 1.00 . A A . 2 LYS HZ1 1 1 7 2250 1 1 2 LYS HZ2 H -4.959 4.464 8.303 1.00 . A A . 2 LYS HZ2 1 1 7 2251 1 1 2 LYS HZ3 H -3.833 5.685 7.947 1.00 . A A . 2 LYS HZ3 1 1 7 2252 1 1 2 LYS N N -4.930 5.443 1.867 1.00 . A A . 2 LYS N 1 1 7 2253 1 1 2 LYS NZ N -4.621 5.120 7.571 1.00 . A A . 2 LYS NZ 1 1 7 2254 1 1 2 LYS O O -2.005 5.536 1.301 1.00 . A A . 2 LYS O 1 1 7 2255 1 1 3 GLY C C 0.295 7.056 2.148 1.00 . A A . 3 GLY C 1 1 7 2256 1 1 3 GLY CA C -0.946 7.966 2.174 1.00 . A A . 3 GLY CA 1 1 7 2257 1 1 3 GLY H H -2.671 7.658 3.440 1.00 . A A . 3 GLY H 1 1 7 2258 1 1 3 GLY HA2 H -1.152 8.311 1.172 1.00 . A A . 3 GLY HA2 1 1 7 2259 1 1 3 GLY HA3 H -0.738 8.818 2.805 1.00 . A A . 3 GLY HA3 1 1 7 2260 1 1 3 GLY N N -2.160 7.258 2.706 1.00 . A A . 3 GLY N 1 1 7 2261 1 1 3 GLY O O 0.278 5.980 2.709 1.00 . A A . 3 GLY O 1 1 7 2262 1 1 4 LYS C C 3.111 6.269 2.804 1.00 . A A . 4 LYS C 1 1 7 2263 1 1 4 LYS CA C 2.600 6.698 1.412 1.00 . A A . 4 LYS CA 1 1 7 2264 1 1 4 LYS CB C 3.659 7.549 0.680 1.00 . A A . 4 LYS CB 1 1 7 2265 1 1 4 LYS CD C 5.988 7.605 -0.268 1.00 . A A . 4 LYS CD 1 1 7 2266 1 1 4 LYS CE C 7.296 6.818 -0.432 1.00 . A A . 4 LYS CE 1 1 7 2267 1 1 4 LYS CG C 4.968 6.748 0.509 1.00 . A A . 4 LYS CG 1 1 7 2268 1 1 4 LYS H H 1.298 8.387 1.070 1.00 . A A . 4 LYS H 1 1 7 2269 1 1 4 LYS HA H 2.389 5.814 0.827 1.00 . A A . 4 LYS HA 1 1 7 2270 1 1 4 LYS HB2 H 3.276 7.836 -0.290 1.00 . A A . 4 LYS HB2 1 1 7 2271 1 1 4 LYS HB3 H 3.854 8.448 1.248 1.00 . A A . 4 LYS HB3 1 1 7 2272 1 1 4 LYS HD2 H 5.592 7.848 -1.244 1.00 . A A . 4 LYS HD2 1 1 7 2273 1 1 4 LYS HD3 H 6.180 8.524 0.265 1.00 . A A . 4 LYS HD3 1 1 7 2274 1 1 4 LYS HE2 H 7.717 6.588 0.537 1.00 . A A . 4 LYS HE2 1 1 7 2275 1 1 4 LYS HE3 H 7.122 5.897 -0.969 1.00 . A A . 4 LYS HE3 1 1 7 2276 1 1 4 LYS HG2 H 5.378 6.493 1.476 1.00 . A A . 4 LYS HG2 1 1 7 2277 1 1 4 LYS HG3 H 4.768 5.834 -0.033 1.00 . A A . 4 LYS HG3 1 1 7 2278 1 1 4 LYS HZ1 H 7.796 8.143 -1.956 1.00 . A A . 4 LYS HZ1 1 1 7 2279 1 1 4 LYS HZ2 H 8.737 8.316 -0.554 1.00 . A A . 4 LYS HZ2 1 1 7 2280 1 1 4 LYS HZ3 H 9.007 7.007 -1.602 1.00 . A A . 4 LYS HZ3 1 1 7 2281 1 1 4 LYS N N 1.340 7.509 1.501 1.00 . A A . 4 LYS N 1 1 7 2282 1 1 4 LYS NZ N 8.284 7.633 -1.193 1.00 . A A . 4 LYS NZ 1 1 7 2283 1 1 4 LYS O O 3.188 7.066 3.719 1.00 . A A . 4 LYS O 1 1 7 2284 1 1 5 GLY C C 2.874 4.273 5.258 1.00 . A A . 5 GLY C 1 1 7 2285 1 1 5 GLY CA C 3.953 4.406 4.171 1.00 . A A . 5 GLY CA 1 1 7 2286 1 1 5 GLY H H 3.344 4.432 2.111 1.00 . A A . 5 GLY H 1 1 7 2287 1 1 5 GLY HA2 H 4.348 3.425 3.955 1.00 . A A . 5 GLY HA2 1 1 7 2288 1 1 5 GLY HA3 H 4.753 5.023 4.554 1.00 . A A . 5 GLY HA3 1 1 7 2289 1 1 5 GLY N N 3.439 5.004 2.899 1.00 . A A . 5 GLY N 1 1 7 2290 1 1 5 GLY O O 3.199 3.988 6.394 1.00 . A A . 5 GLY O 1 1 7 2291 1 1 6 ALA C C -0.119 2.956 5.826 1.00 . A A . 6 ALA C 1 1 7 2292 1 1 6 ALA CA C 0.508 4.373 5.873 1.00 . A A . 6 ALA CA 1 1 7 2293 1 1 6 ALA CB C -0.537 5.437 5.516 1.00 . A A . 6 ALA CB 1 1 7 2294 1 1 6 ALA H H 1.438 4.702 3.954 1.00 . A A . 6 ALA H 1 1 7 2295 1 1 6 ALA HA H 0.892 4.564 6.864 1.00 . A A . 6 ALA HA 1 1 7 2296 1 1 6 ALA HB1 H -0.089 6.419 5.546 1.00 . A A . 6 ALA HB1 1 1 7 2297 1 1 6 ALA HB2 H -0.928 5.259 4.527 1.00 . A A . 6 ALA HB2 1 1 7 2298 1 1 6 ALA HB3 H -1.355 5.417 6.215 1.00 . A A . 6 ALA HB3 1 1 7 2299 1 1 6 ALA N N 1.633 4.478 4.888 1.00 . A A . 6 ALA N 1 1 7 2300 1 1 6 ALA O O -0.036 2.303 4.805 1.00 . A A . 6 ALA O 1 1 7 2301 1 1 7 PRO C C -2.307 0.700 6.053 1.00 . A A . 7 PRO C 1 1 7 2302 1 1 7 PRO CA C -1.223 1.117 7.073 1.00 . A A . 7 PRO CA 1 1 7 2303 1 1 7 PRO CB C -1.729 1.023 8.523 1.00 . A A . 7 PRO CB 1 1 7 2304 1 1 7 PRO CD C -0.989 3.355 8.130 1.00 . A A . 7 PRO CD 1 1 7 2305 1 1 7 PRO CG C -1.762 2.446 9.090 1.00 . A A . 7 PRO CG 1 1 7 2306 1 1 7 PRO HA H -0.384 0.450 6.967 1.00 . A A . 7 PRO HA 1 1 7 2307 1 1 7 PRO HB2 H -2.716 0.586 8.573 1.00 . A A . 7 PRO HB2 1 1 7 2308 1 1 7 PRO HB3 H -1.057 0.412 9.108 1.00 . A A . 7 PRO HB3 1 1 7 2309 1 1 7 PRO HD2 H -1.582 4.215 7.864 1.00 . A A . 7 PRO HD2 1 1 7 2310 1 1 7 PRO HD3 H -0.052 3.665 8.569 1.00 . A A . 7 PRO HD3 1 1 7 2311 1 1 7 PRO HG2 H -2.784 2.786 9.172 1.00 . A A . 7 PRO HG2 1 1 7 2312 1 1 7 PRO HG3 H -1.306 2.468 10.069 1.00 . A A . 7 PRO HG3 1 1 7 2313 1 1 7 PRO N N -0.724 2.520 6.916 1.00 . A A . 7 PRO N 1 1 7 2314 1 1 7 PRO O O -3.490 0.870 6.280 1.00 . A A . 7 PRO O 1 1 7 2315 1 1 8 CYS C C -2.803 -1.835 3.746 1.00 . A A . 8 CYS C 1 1 7 2316 1 1 8 CYS CA C -2.741 -0.308 3.849 1.00 . A A . 8 CYS CA 1 1 7 2317 1 1 8 CYS CB C -2.237 0.178 2.521 1.00 . A A . 8 CYS CB 1 1 7 2318 1 1 8 CYS H H -0.873 0.078 4.834 1.00 . A A . 8 CYS H 1 1 7 2319 1 1 8 CYS HA H -3.731 0.084 4.005 1.00 . A A . 8 CYS HA 1 1 7 2320 1 1 8 CYS HB2 H -2.834 -0.272 1.740 1.00 . A A . 8 CYS HB2 1 1 7 2321 1 1 8 CYS HB3 H -2.356 1.235 2.408 1.00 . A A . 8 CYS HB3 1 1 7 2322 1 1 8 CYS N N -1.843 0.166 4.951 1.00 . A A . 8 CYS N 1 1 7 2323 1 1 8 CYS O O -2.031 -2.557 4.346 1.00 . A A . 8 CYS O 1 1 7 2324 1 1 8 CYS SG S -0.522 -0.301 2.210 1.00 . A A . 8 CYS SG 1 1 7 2325 1 1 9 ARG C C -3.872 -3.808 1.146 1.00 . A A . 9 ARG C 1 1 7 2326 1 1 9 ARG CA C -4.033 -3.673 2.664 1.00 . A A . 9 ARG CA 1 1 7 2327 1 1 9 ARG CB C -5.473 -4.019 3.181 1.00 . A A . 9 ARG CB 1 1 7 2328 1 1 9 ARG CD C -7.816 -3.199 3.565 1.00 . A A . 9 ARG CD 1 1 7 2329 1 1 9 ARG CG C -6.444 -2.859 2.959 1.00 . A A . 9 ARG CG 1 1 7 2330 1 1 9 ARG CZ C -9.062 -1.382 2.483 1.00 . A A . 9 ARG CZ 1 1 7 2331 1 1 9 ARG H H -4.347 -1.580 2.530 1.00 . A A . 9 ARG H 1 1 7 2332 1 1 9 ARG HA H -3.302 -4.295 3.162 1.00 . A A . 9 ARG HA 1 1 7 2333 1 1 9 ARG HB2 H -5.846 -4.874 2.631 1.00 . A A . 9 ARG HB2 1 1 7 2334 1 1 9 ARG HB3 H -5.445 -4.281 4.227 1.00 . A A . 9 ARG HB3 1 1 7 2335 1 1 9 ARG HD2 H -8.331 -3.941 2.972 1.00 . A A . 9 ARG HD2 1 1 7 2336 1 1 9 ARG HD3 H -7.716 -3.558 4.580 1.00 . A A . 9 ARG HD3 1 1 7 2337 1 1 9 ARG HE H -8.798 -1.498 4.436 1.00 . A A . 9 ARG HE 1 1 7 2338 1 1 9 ARG HG2 H -6.073 -1.961 3.430 1.00 . A A . 9 ARG HG2 1 1 7 2339 1 1 9 ARG HG3 H -6.539 -2.688 1.898 1.00 . A A . 9 ARG HG3 1 1 7 2340 1 1 9 ARG HH11 H -8.330 -2.799 1.276 1.00 . A A . 9 ARG HH11 1 1 7 2341 1 1 9 ARG HH12 H -9.175 -1.510 0.490 1.00 . A A . 9 ARG HH12 1 1 7 2342 1 1 9 ARG HH21 H -9.866 0.141 3.490 1.00 . A A . 9 ARG HH21 1 1 7 2343 1 1 9 ARG HH22 H -10.068 0.188 1.768 1.00 . A A . 9 ARG HH22 1 1 7 2344 1 1 9 ARG N N -3.761 -2.244 2.957 1.00 . A A . 9 ARG N 1 1 7 2345 1 1 9 ARG NE N -8.615 -1.934 3.578 1.00 . A A . 9 ARG NE 1 1 7 2346 1 1 9 ARG NH1 N -8.839 -1.939 1.327 1.00 . A A . 9 ARG NH1 1 1 7 2347 1 1 9 ARG NH2 N -9.718 -0.263 2.588 1.00 . A A . 9 ARG NH2 1 1 7 2348 1 1 9 ARG O O -4.605 -3.223 0.367 1.00 . A A . 9 ARG O 1 1 7 2349 1 1 10 LYS C C -3.740 -5.479 -1.257 1.00 . A A . 10 LYS C 1 1 7 2350 1 1 10 LYS CA C -2.489 -4.901 -0.608 1.00 . A A . 10 LYS CA 1 1 7 2351 1 1 10 LYS CB C -1.375 -5.986 -0.688 1.00 . A A . 10 LYS CB 1 1 7 2352 1 1 10 LYS CD C -0.239 -5.592 1.670 1.00 . A A . 10 LYS CD 1 1 7 2353 1 1 10 LYS CE C -0.751 -6.911 2.314 1.00 . A A . 10 LYS CE 1 1 7 2354 1 1 10 LYS CG C -0.081 -5.661 0.115 1.00 . A A . 10 LYS CG 1 1 7 2355 1 1 10 LYS H H -2.368 -5.001 1.538 1.00 . A A . 10 LYS H 1 1 7 2356 1 1 10 LYS HA H -2.202 -3.992 -1.115 1.00 . A A . 10 LYS HA 1 1 7 2357 1 1 10 LYS HB2 H -1.762 -6.948 -0.396 1.00 . A A . 10 LYS HB2 1 1 7 2358 1 1 10 LYS HB3 H -1.089 -6.073 -1.727 1.00 . A A . 10 LYS HB3 1 1 7 2359 1 1 10 LYS HD2 H 0.747 -5.459 2.072 1.00 . A A . 10 LYS HD2 1 1 7 2360 1 1 10 LYS HD3 H -0.805 -4.733 1.987 1.00 . A A . 10 LYS HD3 1 1 7 2361 1 1 10 LYS HE2 H -0.080 -7.720 2.068 1.00 . A A . 10 LYS HE2 1 1 7 2362 1 1 10 LYS HE3 H -0.771 -6.799 3.387 1.00 . A A . 10 LYS HE3 1 1 7 2363 1 1 10 LYS HG2 H 0.665 -6.405 -0.124 1.00 . A A . 10 LYS HG2 1 1 7 2364 1 1 10 LYS HG3 H 0.290 -4.707 -0.223 1.00 . A A . 10 LYS HG3 1 1 7 2365 1 1 10 LYS HZ1 H -2.581 -6.476 1.403 1.00 . A A . 10 LYS HZ1 1 1 7 2366 1 1 10 LYS HZ2 H -2.056 -8.071 1.182 1.00 . A A . 10 LYS HZ2 1 1 7 2367 1 1 10 LYS HZ3 H -2.688 -7.583 2.679 1.00 . A A . 10 LYS HZ3 1 1 7 2368 1 1 10 LYS N N -2.875 -4.593 0.812 1.00 . A A . 10 LYS N 1 1 7 2369 1 1 10 LYS NZ N -2.121 -7.285 1.860 1.00 . A A . 10 LYS NZ 1 1 7 2370 1 1 10 LYS O O -4.054 -5.243 -2.407 1.00 . A A . 10 LYS O 1 1 7 2371 1 1 11 THR C C -6.589 -6.191 -1.612 1.00 . A A . 11 THR C 1 1 7 2372 1 1 11 THR CA C -5.649 -6.966 -0.683 1.00 . A A . 11 THR CA 1 1 7 2373 1 1 11 THR CB C -6.330 -7.210 0.667 1.00 . A A . 11 THR CB 1 1 7 2374 1 1 11 THR CG2 C -7.560 -8.128 0.537 1.00 . A A . 11 THR CG2 1 1 7 2375 1 1 11 THR H H -3.978 -6.334 0.486 1.00 . A A . 11 THR H 1 1 7 2376 1 1 11 THR HA H -5.404 -7.909 -1.149 1.00 . A A . 11 THR HA 1 1 7 2377 1 1 11 THR HB H -6.538 -6.269 1.169 1.00 . A A . 11 THR HB 1 1 7 2378 1 1 11 THR HG1 H -4.919 -8.550 0.824 1.00 . A A . 11 THR HG1 1 1 7 2379 1 1 11 THR HG21 H -7.274 -9.089 0.136 1.00 . A A . 11 THR HG21 1 1 7 2380 1 1 11 THR HG22 H -8.013 -8.276 1.507 1.00 . A A . 11 THR HG22 1 1 7 2381 1 1 11 THR HG23 H -8.293 -7.683 -0.118 1.00 . A A . 11 THR HG23 1 1 7 2382 1 1 11 THR N N -4.379 -6.239 -0.406 1.00 . A A . 11 THR N 1 1 7 2383 1 1 11 THR O O -7.230 -6.767 -2.470 1.00 . A A . 11 THR O 1 1 7 2384 1 1 11 THR OG1 O -5.396 -7.970 1.423 1.00 . A A . 11 THR OG1 1 1 7 2385 1 1 12 MET C C -6.713 -2.772 -2.667 1.00 . A A . 12 MET C 1 1 7 2386 1 1 12 MET CA C -7.506 -4.013 -2.215 1.00 . A A . 12 MET CA 1 1 7 2387 1 1 12 MET CB C -8.689 -3.541 -1.364 1.00 . A A . 12 MET CB 1 1 7 2388 1 1 12 MET CE C -12.046 -4.759 -0.722 1.00 . A A . 12 MET CE 1 1 7 2389 1 1 12 MET CG C -9.303 -4.693 -0.537 1.00 . A A . 12 MET CG 1 1 7 2390 1 1 12 MET H H -6.075 -4.511 -0.686 1.00 . A A . 12 MET H 1 1 7 2391 1 1 12 MET HA H -7.853 -4.540 -3.093 1.00 . A A . 12 MET HA 1 1 7 2392 1 1 12 MET HB2 H -8.341 -2.758 -0.712 1.00 . A A . 12 MET HB2 1 1 7 2393 1 1 12 MET HB3 H -9.450 -3.128 -2.011 1.00 . A A . 12 MET HB3 1 1 7 2394 1 1 12 MET HE1 H -11.951 -5.798 -1.000 1.00 . A A . 12 MET HE1 1 1 7 2395 1 1 12 MET HE2 H -13.010 -4.618 -0.254 1.00 . A A . 12 MET HE2 1 1 7 2396 1 1 12 MET HE3 H -11.987 -4.117 -1.589 1.00 . A A . 12 MET HE3 1 1 7 2397 1 1 12 MET HG2 H -9.507 -5.544 -1.161 1.00 . A A . 12 MET HG2 1 1 7 2398 1 1 12 MET HG3 H -8.544 -5.006 0.165 1.00 . A A . 12 MET HG3 1 1 7 2399 1 1 12 MET N N -6.627 -4.901 -1.394 1.00 . A A . 12 MET N 1 1 7 2400 1 1 12 MET O O -7.260 -1.936 -3.361 1.00 . A A . 12 MET O 1 1 7 2401 1 1 12 MET SD S -10.760 -4.317 0.472 1.00 . A A . 12 MET SD 1 1 7 2402 1 1 13 TYR C C -5.310 -0.300 -2.079 1.00 . A A . 13 TYR C 1 1 7 2403 1 1 13 TYR CA C -4.575 -1.533 -2.615 1.00 . A A . 13 TYR CA 1 1 7 2404 1 1 13 TYR CB C -4.386 -1.491 -4.149 1.00 . A A . 13 TYR CB 1 1 7 2405 1 1 13 TYR CD1 C -2.340 -2.971 -4.286 1.00 . A A . 13 TYR CD1 1 1 7 2406 1 1 13 TYR CD2 C -4.383 -3.806 -5.181 1.00 . A A . 13 TYR CD2 1 1 7 2407 1 1 13 TYR CE1 C -1.706 -4.142 -4.638 1.00 . A A . 13 TYR CE1 1 1 7 2408 1 1 13 TYR CE2 C -3.748 -4.976 -5.534 1.00 . A A . 13 TYR CE2 1 1 7 2409 1 1 13 TYR CG C -3.684 -2.794 -4.554 1.00 . A A . 13 TYR CG 1 1 7 2410 1 1 13 TYR CZ C -2.405 -5.152 -5.265 1.00 . A A . 13 TYR CZ 1 1 7 2411 1 1 13 TYR H H -5.093 -3.411 -1.719 1.00 . A A . 13 TYR H 1 1 7 2412 1 1 13 TYR HA H -3.630 -1.640 -2.102 1.00 . A A . 13 TYR HA 1 1 7 2413 1 1 13 TYR HB2 H -5.339 -1.433 -4.649 1.00 . A A . 13 TYR HB2 1 1 7 2414 1 1 13 TYR HB3 H -3.775 -0.648 -4.440 1.00 . A A . 13 TYR HB3 1 1 7 2415 1 1 13 TYR HD1 H -1.780 -2.188 -3.795 1.00 . A A . 13 TYR HD1 1 1 7 2416 1 1 13 TYR HD2 H -5.434 -3.683 -5.399 1.00 . A A . 13 TYR HD2 1 1 7 2417 1 1 13 TYR HE1 H -0.655 -4.267 -4.422 1.00 . A A . 13 TYR HE1 1 1 7 2418 1 1 13 TYR HE2 H -4.304 -5.761 -6.026 1.00 . A A . 13 TYR HE2 1 1 7 2419 1 1 13 TYR HH H -1.869 -6.439 -6.567 1.00 . A A . 13 TYR HH 1 1 7 2420 1 1 13 TYR N N -5.462 -2.691 -2.265 1.00 . A A . 13 TYR N 1 1 7 2421 1 1 13 TYR O O -5.825 0.540 -2.791 1.00 . A A . 13 TYR O 1 1 7 2422 1 1 13 TYR OH O -1.771 -6.324 -5.618 1.00 . A A . 13 TYR OH 1 1 7 2423 1 1 14 ASP C C -5.105 2.057 0.157 1.00 . A A . 14 ASP C 1 1 7 2424 1 1 14 ASP CA C -5.941 0.774 0.054 1.00 . A A . 14 ASP CA 1 1 7 2425 1 1 14 ASP CB C -6.190 0.098 1.414 1.00 . A A . 14 ASP CB 1 1 7 2426 1 1 14 ASP CG C -6.830 0.997 2.491 1.00 . A A . 14 ASP CG 1 1 7 2427 1 1 14 ASP H H -4.835 -1.016 -0.313 1.00 . A A . 14 ASP H 1 1 7 2428 1 1 14 ASP HA H -6.891 1.026 -0.395 1.00 . A A . 14 ASP HA 1 1 7 2429 1 1 14 ASP HB2 H -6.860 -0.715 1.231 1.00 . A A . 14 ASP HB2 1 1 7 2430 1 1 14 ASP HB3 H -5.278 -0.345 1.785 1.00 . A A . 14 ASP HB3 1 1 7 2431 1 1 14 ASP N N -5.298 -0.287 -0.773 1.00 . A A . 14 ASP N 1 1 7 2432 1 1 14 ASP O O -5.390 2.918 0.964 1.00 . A A . 14 ASP O 1 1 7 2433 1 1 14 ASP OD1 O -7.677 1.802 2.135 1.00 . A A . 14 ASP OD1 1 1 7 2434 1 1 14 ASP OD2 O -6.427 0.817 3.628 1.00 . A A . 14 ASP OD2 1 1 7 2435 1 1 15 CYS C C -3.573 4.409 -1.700 1.00 . A A . 15 CYS C 1 1 7 2436 1 1 15 CYS CA C -3.211 3.351 -0.664 1.00 . A A . 15 CYS CA 1 1 7 2437 1 1 15 CYS CB C -1.789 2.915 -0.916 1.00 . A A . 15 CYS CB 1 1 7 2438 1 1 15 CYS H H -3.934 1.405 -1.293 1.00 . A A . 15 CYS H 1 1 7 2439 1 1 15 CYS HA H -3.251 3.804 0.312 1.00 . A A . 15 CYS HA 1 1 7 2440 1 1 15 CYS HB2 H -1.746 2.445 -1.886 1.00 . A A . 15 CYS HB2 1 1 7 2441 1 1 15 CYS HB3 H -1.145 3.782 -0.936 1.00 . A A . 15 CYS HB3 1 1 7 2442 1 1 15 CYS N N -4.099 2.145 -0.671 1.00 . A A . 15 CYS N 1 1 7 2443 1 1 15 CYS O O -4.067 4.104 -2.767 1.00 . A A . 15 CYS O 1 1 7 2444 1 1 15 CYS SG S -1.113 1.759 0.292 1.00 . A A . 15 CYS SG 1 1 7 2445 1 1 16 CYS C C -2.598 6.669 -3.389 1.00 . A A . 16 CYS C 1 1 7 2446 1 1 16 CYS CA C -3.570 6.805 -2.208 1.00 . A A . 16 CYS CA 1 1 7 2447 1 1 16 CYS CB C -3.301 8.072 -1.405 1.00 . A A . 16 CYS CB 1 1 7 2448 1 1 16 CYS H H -2.903 5.806 -0.451 1.00 . A A . 16 CYS H 1 1 7 2449 1 1 16 CYS HA H -4.589 6.767 -2.566 1.00 . A A . 16 CYS HA 1 1 7 2450 1 1 16 CYS HB2 H -2.247 8.118 -1.170 1.00 . A A . 16 CYS HB2 1 1 7 2451 1 1 16 CYS HB3 H -3.535 8.919 -2.027 1.00 . A A . 16 CYS HB3 1 1 7 2452 1 1 16 CYS N N -3.298 5.636 -1.328 1.00 . A A . 16 CYS N 1 1 7 2453 1 1 16 CYS O O -2.893 7.046 -4.507 1.00 . A A . 16 CYS O 1 1 7 2454 1 1 16 CYS SG S -4.215 8.258 0.144 1.00 . A A . 16 CYS SG 1 1 7 2455 1 1 17 SER C C -0.717 4.606 -4.830 1.00 . A A . 17 SER C 1 1 7 2456 1 1 17 SER CA C -0.364 5.884 -4.046 1.00 . A A . 17 SER CA 1 1 7 2457 1 1 17 SER CB C 0.954 5.707 -3.275 1.00 . A A . 17 SER CB 1 1 7 2458 1 1 17 SER H H -1.311 5.853 -2.128 1.00 . A A . 17 SER H 1 1 7 2459 1 1 17 SER HA H -0.304 6.721 -4.726 1.00 . A A . 17 SER HA 1 1 7 2460 1 1 17 SER HB2 H 1.178 6.574 -2.672 1.00 . A A . 17 SER HB2 1 1 7 2461 1 1 17 SER HB3 H 0.932 4.824 -2.651 1.00 . A A . 17 SER HB3 1 1 7 2462 1 1 17 SER HG H 1.733 4.754 -4.783 1.00 . A A . 17 SER HG 1 1 7 2463 1 1 17 SER N N -1.454 6.120 -3.059 1.00 . A A . 17 SER N 1 1 7 2464 1 1 17 SER O O -0.277 4.422 -5.948 1.00 . A A . 17 SER O 1 1 7 2465 1 1 17 SER OG O 1.945 5.544 -4.279 1.00 . A A . 17 SER OG 1 1 7 2466 1 1 18 GLY C C -0.864 1.385 -4.748 1.00 . A A . 18 GLY C 1 1 7 2467 1 1 18 GLY CA C -1.941 2.477 -4.826 1.00 . A A . 18 GLY CA 1 1 7 2468 1 1 18 GLY H H -1.819 3.981 -3.298 1.00 . A A . 18 GLY H 1 1 7 2469 1 1 18 GLY HA2 H -2.822 2.126 -4.309 1.00 . A A . 18 GLY HA2 1 1 7 2470 1 1 18 GLY HA3 H -2.190 2.650 -5.862 1.00 . A A . 18 GLY HA3 1 1 7 2471 1 1 18 GLY N N -1.505 3.763 -4.201 1.00 . A A . 18 GLY N 1 1 7 2472 1 1 18 GLY O O -1.161 0.222 -4.949 1.00 . A A . 18 GLY O 1 1 7 2473 1 1 19 SER C C 1.655 0.359 -2.902 1.00 . A A . 19 SER C 1 1 7 2474 1 1 19 SER CA C 1.483 0.821 -4.358 1.00 . A A . 19 SER CA 1 1 7 2475 1 1 19 SER CB C 2.753 1.536 -4.892 1.00 . A A . 19 SER CB 1 1 7 2476 1 1 19 SER H H 0.530 2.737 -4.302 1.00 . A A . 19 SER H 1 1 7 2477 1 1 19 SER HA H 1.277 -0.044 -4.973 1.00 . A A . 19 SER HA 1 1 7 2478 1 1 19 SER HB2 H 3.630 0.914 -4.792 1.00 . A A . 19 SER HB2 1 1 7 2479 1 1 19 SER HB3 H 2.630 1.835 -5.923 1.00 . A A . 19 SER HB3 1 1 7 2480 1 1 19 SER HG H 2.207 3.316 -4.330 1.00 . A A . 19 SER HG 1 1 7 2481 1 1 19 SER N N 0.350 1.787 -4.460 1.00 . A A . 19 SER N 1 1 7 2482 1 1 19 SER O O 2.637 0.671 -2.254 1.00 . A A . 19 SER O 1 1 7 2483 1 1 19 SER OG O 2.896 2.695 -4.082 1.00 . A A . 19 SER OG 1 1 7 2484 1 1 20 CYS C C 1.782 -2.016 -0.870 1.00 . A A . 20 CYS C 1 1 7 2485 1 1 20 CYS CA C 0.766 -0.875 -1.018 1.00 . A A . 20 CYS CA 1 1 7 2486 1 1 20 CYS CB C -0.625 -1.357 -0.553 1.00 . A A . 20 CYS CB 1 1 7 2487 1 1 20 CYS H H -0.088 -0.609 -2.985 1.00 . A A . 20 CYS H 1 1 7 2488 1 1 20 CYS HA H 1.069 -0.058 -0.387 1.00 . A A . 20 CYS HA 1 1 7 2489 1 1 20 CYS HB2 H -1.311 -0.526 -0.606 1.00 . A A . 20 CYS HB2 1 1 7 2490 1 1 20 CYS HB3 H -1.015 -2.113 -1.204 1.00 . A A . 20 CYS HB3 1 1 7 2491 1 1 20 CYS N N 0.683 -0.382 -2.424 1.00 . A A . 20 CYS N 1 1 7 2492 1 1 20 CYS O O 1.614 -3.092 -1.411 1.00 . A A . 20 CYS O 1 1 7 2493 1 1 20 CYS SG S -0.678 -2.000 1.134 1.00 . A A . 20 CYS SG 1 1 7 2494 1 1 21 GLY C C 3.470 -3.887 0.969 1.00 . A A . 21 GLY C 1 1 7 2495 1 1 21 GLY CA C 3.927 -2.671 0.150 1.00 . A A . 21 GLY CA 1 1 7 2496 1 1 21 GLY H H 2.865 -0.810 0.258 1.00 . A A . 21 GLY H 1 1 7 2497 1 1 21 GLY HA2 H 4.339 -3.012 -0.789 1.00 . A A . 21 GLY HA2 1 1 7 2498 1 1 21 GLY HA3 H 4.698 -2.154 0.703 1.00 . A A . 21 GLY HA3 1 1 7 2499 1 1 21 GLY N N 2.818 -1.709 -0.127 1.00 . A A . 21 GLY N 1 1 7 2500 1 1 21 GLY O O 2.407 -3.893 1.556 1.00 . A A . 21 GLY O 1 1 7 2501 1 1 22 ARG C C 4.185 -5.977 3.217 1.00 . A A . 22 ARG C 1 1 7 2502 1 1 22 ARG CA C 4.082 -6.161 1.701 1.00 . A A . 22 ARG CA 1 1 7 2503 1 1 22 ARG CB C 5.114 -7.231 1.264 1.00 . A A . 22 ARG CB 1 1 7 2504 1 1 22 ARG CD C 5.265 -6.481 -1.219 1.00 . A A . 22 ARG CD 1 1 7 2505 1 1 22 ARG CG C 5.007 -7.648 -0.233 1.00 . A A . 22 ARG CG 1 1 7 2506 1 1 22 ARG CZ C 7.727 -6.436 -1.147 1.00 . A A . 22 ARG CZ 1 1 7 2507 1 1 22 ARG H H 5.164 -4.751 0.483 1.00 . A A . 22 ARG H 1 1 7 2508 1 1 22 ARG HA H 3.084 -6.506 1.465 1.00 . A A . 22 ARG HA 1 1 7 2509 1 1 22 ARG HB2 H 6.110 -6.859 1.456 1.00 . A A . 22 ARG HB2 1 1 7 2510 1 1 22 ARG HB3 H 4.975 -8.117 1.868 1.00 . A A . 22 ARG HB3 1 1 7 2511 1 1 22 ARG HD2 H 5.303 -6.864 -2.229 1.00 . A A . 22 ARG HD2 1 1 7 2512 1 1 22 ARG HD3 H 4.484 -5.738 -1.175 1.00 . A A . 22 ARG HD3 1 1 7 2513 1 1 22 ARG HE H 6.591 -4.955 -0.489 1.00 . A A . 22 ARG HE 1 1 7 2514 1 1 22 ARG HG2 H 5.709 -8.445 -0.422 1.00 . A A . 22 ARG HG2 1 1 7 2515 1 1 22 ARG HG3 H 4.015 -8.033 -0.412 1.00 . A A . 22 ARG HG3 1 1 7 2516 1 1 22 ARG HH11 H 6.919 -8.093 -1.934 1.00 . A A . 22 ARG HH11 1 1 7 2517 1 1 22 ARG HH12 H 8.649 -8.057 -1.870 1.00 . A A . 22 ARG HH12 1 1 7 2518 1 1 22 ARG HH21 H 8.772 -4.896 -0.413 1.00 . A A . 22 ARG HH21 1 1 7 2519 1 1 22 ARG HH22 H 9.712 -6.228 -1.004 1.00 . A A . 22 ARG HH22 1 1 7 2520 1 1 22 ARG N N 4.329 -4.875 0.972 1.00 . A A . 22 ARG N 1 1 7 2521 1 1 22 ARG NE N 6.583 -5.844 -0.900 1.00 . A A . 22 ARG NE 1 1 7 2522 1 1 22 ARG NH1 N 7.767 -7.622 -1.693 1.00 . A A . 22 ARG NH1 1 1 7 2523 1 1 22 ARG NH2 N 8.823 -5.803 -0.829 1.00 . A A . 22 ARG NH2 1 1 7 2524 1 1 22 ARG O O 3.773 -6.835 3.975 1.00 . A A . 22 ARG O 1 1 7 2525 1 1 23 ARG C C 3.545 -4.057 5.610 1.00 . A A . 23 ARG C 1 1 7 2526 1 1 23 ARG CA C 4.898 -4.540 5.060 1.00 . A A . 23 ARG CA 1 1 7 2527 1 1 23 ARG CB C 5.998 -3.447 5.167 1.00 . A A . 23 ARG CB 1 1 7 2528 1 1 23 ARG CD C 6.674 -4.146 7.519 1.00 . A A . 23 ARG CD 1 1 7 2529 1 1 23 ARG CG C 6.270 -2.971 6.620 1.00 . A A . 23 ARG CG 1 1 7 2530 1 1 23 ARG CZ C 7.038 -4.367 9.937 1.00 . A A . 23 ARG CZ 1 1 7 2531 1 1 23 ARG H H 5.042 -4.209 2.941 1.00 . A A . 23 ARG H 1 1 7 2532 1 1 23 ARG HA H 5.195 -5.437 5.584 1.00 . A A . 23 ARG HA 1 1 7 2533 1 1 23 ARG HB2 H 6.914 -3.831 4.746 1.00 . A A . 23 ARG HB2 1 1 7 2534 1 1 23 ARG HB3 H 5.695 -2.592 4.579 1.00 . A A . 23 ARG HB3 1 1 7 2535 1 1 23 ARG HD2 H 5.865 -4.858 7.600 1.00 . A A . 23 ARG HD2 1 1 7 2536 1 1 23 ARG HD3 H 7.549 -4.636 7.125 1.00 . A A . 23 ARG HD3 1 1 7 2537 1 1 23 ARG HE H 7.129 -2.635 8.981 1.00 . A A . 23 ARG HE 1 1 7 2538 1 1 23 ARG HG2 H 7.082 -2.259 6.598 1.00 . A A . 23 ARG HG2 1 1 7 2539 1 1 23 ARG HG3 H 5.405 -2.472 7.029 1.00 . A A . 23 ARG HG3 1 1 7 2540 1 1 23 ARG HH11 H 6.637 -6.071 8.955 1.00 . A A . 23 ARG HH11 1 1 7 2541 1 1 23 ARG HH12 H 6.890 -6.228 10.660 1.00 . A A . 23 ARG HH12 1 1 7 2542 1 1 23 ARG HH21 H 7.456 -2.818 11.135 1.00 . A A . 23 ARG HH21 1 1 7 2543 1 1 23 ARG HH22 H 7.362 -4.362 11.913 1.00 . A A . 23 ARG HH22 1 1 7 2544 1 1 23 ARG N N 4.734 -4.856 3.610 1.00 . A A . 23 ARG N 1 1 7 2545 1 1 23 ARG NE N 6.975 -3.597 8.878 1.00 . A A . 23 ARG NE 1 1 7 2546 1 1 23 ARG NH1 N 6.839 -5.655 9.841 1.00 . A A . 23 ARG NH1 1 1 7 2547 1 1 23 ARG NH2 N 7.306 -3.805 11.085 1.00 . A A . 23 ARG NH2 1 1 7 2548 1 1 23 ARG O O 3.425 -3.718 6.772 1.00 . A A . 23 ARG O 1 1 7 2549 1 1 24 GLY C C 1.197 -2.071 5.160 1.00 . A A . 24 GLY C 1 1 7 2550 1 1 24 GLY CA C 1.200 -3.598 5.155 1.00 . A A . 24 GLY CA 1 1 7 2551 1 1 24 GLY H H 2.706 -4.333 3.819 1.00 . A A . 24 GLY H 1 1 7 2552 1 1 24 GLY HA2 H 0.473 -3.957 4.440 1.00 . A A . 24 GLY HA2 1 1 7 2553 1 1 24 GLY HA3 H 0.964 -3.970 6.141 1.00 . A A . 24 GLY HA3 1 1 7 2554 1 1 24 GLY N N 2.558 -4.047 4.746 1.00 . A A . 24 GLY N 1 1 7 2555 1 1 24 GLY O O 0.279 -1.463 5.672 1.00 . A A . 24 GLY O 1 1 7 2556 1 1 25 LYS C C 2.357 0.368 3.050 1.00 . A A . 25 LYS C 1 1 7 2557 1 1 25 LYS CA C 2.368 -0.019 4.517 1.00 . A A . 25 LYS CA 1 1 7 2558 1 1 25 LYS CB C 3.694 0.438 5.146 1.00 . A A . 25 LYS CB 1 1 7 2559 1 1 25 LYS CD C 2.685 0.742 7.455 1.00 . A A . 25 LYS CD 1 1 7 2560 1 1 25 LYS CE C 2.773 0.332 8.927 1.00 . A A . 25 LYS CE 1 1 7 2561 1 1 25 LYS CG C 3.784 0.026 6.637 1.00 . A A . 25 LYS CG 1 1 7 2562 1 1 25 LYS H H 2.944 -2.070 4.194 1.00 . A A . 25 LYS H 1 1 7 2563 1 1 25 LYS HA H 1.526 0.451 5.001 1.00 . A A . 25 LYS HA 1 1 7 2564 1 1 25 LYS HB2 H 4.510 0.025 4.578 1.00 . A A . 25 LYS HB2 1 1 7 2565 1 1 25 LYS HB3 H 3.759 1.513 5.080 1.00 . A A . 25 LYS HB3 1 1 7 2566 1 1 25 LYS HD2 H 2.809 1.811 7.380 1.00 . A A . 25 LYS HD2 1 1 7 2567 1 1 25 LYS HD3 H 1.710 0.486 7.076 1.00 . A A . 25 LYS HD3 1 1 7 2568 1 1 25 LYS HE2 H 2.631 -0.734 9.035 1.00 . A A . 25 LYS HE2 1 1 7 2569 1 1 25 LYS HE3 H 3.734 0.605 9.339 1.00 . A A . 25 LYS HE3 1 1 7 2570 1 1 25 LYS HG2 H 3.665 -1.044 6.727 1.00 . A A . 25 LYS HG2 1 1 7 2571 1 1 25 LYS HG3 H 4.758 0.296 7.022 1.00 . A A . 25 LYS HG3 1 1 7 2572 1 1 25 LYS HZ1 H 0.850 1.110 9.115 1.00 . A A . 25 LYS HZ1 1 1 7 2573 1 1 25 LYS HZ2 H 1.496 0.499 10.565 1.00 . A A . 25 LYS HZ2 1 1 7 2574 1 1 25 LYS HZ3 H 2.039 1.988 9.952 1.00 . A A . 25 LYS HZ3 1 1 7 2575 1 1 25 LYS N N 2.237 -1.507 4.587 1.00 . A A . 25 LYS N 1 1 7 2576 1 1 25 LYS NZ N 1.709 1.034 9.699 1.00 . A A . 25 LYS NZ 1 1 7 2577 1 1 25 LYS O O 2.588 -0.455 2.189 1.00 . A A . 25 LYS O 1 1 7 2578 1 1 26 CYS C C 3.382 2.547 0.810 1.00 . A A . 26 CYS C 1 1 7 2579 1 1 26 CYS CA C 2.038 2.146 1.422 1.00 . A A . 26 CYS CA 1 1 7 2580 1 1 26 CYS CB C 1.086 3.324 1.423 1.00 . A A . 26 CYS CB 1 1 7 2581 1 1 26 CYS H H 1.917 2.210 3.582 1.00 . A A . 26 CYS H 1 1 7 2582 1 1 26 CYS HA H 1.607 1.387 0.794 1.00 . A A . 26 CYS HA 1 1 7 2583 1 1 26 CYS HB2 H 1.439 4.054 2.129 1.00 . A A . 26 CYS HB2 1 1 7 2584 1 1 26 CYS HB3 H 1.065 3.773 0.445 1.00 . A A . 26 CYS HB3 1 1 7 2585 1 1 26 CYS N N 2.088 1.622 2.818 1.00 . A A . 26 CYS N 1 1 7 2586 1 1 26 CYS O O 4.397 2.624 1.471 1.00 . A A . 26 CYS O 1 1 7 2587 1 1 26 CYS SG S -0.617 2.928 1.861 1.00 . A A . 26 CYS SG 1 1 7 2588 1 1 27 NH2 HN1 H 2.580 2.743 -0.992 1.00 . A A . 27 NH2 HN1 1 1 7 2589 1 1 27 NH2 HN2 H 4.239 3.068 -0.916 1.00 . A A . 27 NH2 HN2 1 1 7 2590 1 1 27 NH2 N N 3.407 2.809 -0.471 1.00 . A A . 27 NH2 N 1 1 8 2591 1 1 1 CYS C C -6.036 6.087 2.026 1.00 . A A . 1 CYS C 1 1 8 2592 1 1 1 CYS CA C -7.094 5.926 0.926 1.00 . A A . 1 CYS CA 1 1 8 2593 1 1 1 CYS CB C -6.559 6.461 -0.410 1.00 . A A . 1 CYS CB 1 1 8 2594 1 1 1 CYS H1 H -8.110 7.670 1.429 1.00 . A A . 1 CYS H1 1 1 8 2595 1 1 1 CYS H2 H -9.026 6.577 0.507 1.00 . A A . 1 CYS H2 1 1 8 2596 1 1 1 CYS H3 H -8.738 6.269 2.154 1.00 . A A . 1 CYS H3 1 1 8 2597 1 1 1 CYS HA H -7.328 4.878 0.837 1.00 . A A . 1 CYS HA 1 1 8 2598 1 1 1 CYS HB2 H -5.669 5.902 -0.657 1.00 . A A . 1 CYS HB2 1 1 8 2599 1 1 1 CYS HB3 H -7.287 6.246 -1.177 1.00 . A A . 1 CYS HB3 1 1 8 2600 1 1 1 CYS N N -8.337 6.666 1.281 1.00 . A A . 1 CYS N 1 1 8 2601 1 1 1 CYS O O -6.268 6.747 3.021 1.00 . A A . 1 CYS O 1 1 8 2602 1 1 1 CYS SG S -6.156 8.223 -0.510 1.00 . A A . 1 CYS SG 1 1 8 2603 1 1 2 LYS C C -2.517 6.137 2.139 1.00 . A A . 2 LYS C 1 1 8 2604 1 1 2 LYS CA C -3.771 5.525 2.780 1.00 . A A . 2 LYS CA 1 1 8 2605 1 1 2 LYS CB C -3.479 4.082 3.266 1.00 . A A . 2 LYS CB 1 1 8 2606 1 1 2 LYS CD C -5.091 4.235 5.248 1.00 . A A . 2 LYS CD 1 1 8 2607 1 1 2 LYS CE C -6.315 3.570 5.906 1.00 . A A . 2 LYS CE 1 1 8 2608 1 1 2 LYS CG C -4.701 3.454 3.973 1.00 . A A . 2 LYS CG 1 1 8 2609 1 1 2 LYS H H -4.789 4.962 0.974 1.00 . A A . 2 LYS H 1 1 8 2610 1 1 2 LYS HA H -4.047 6.143 3.621 1.00 . A A . 2 LYS HA 1 1 8 2611 1 1 2 LYS HB2 H -3.225 3.466 2.416 1.00 . A A . 2 LYS HB2 1 1 8 2612 1 1 2 LYS HB3 H -2.644 4.073 3.945 1.00 . A A . 2 LYS HB3 1 1 8 2613 1 1 2 LYS HD2 H -4.262 4.238 5.943 1.00 . A A . 2 LYS HD2 1 1 8 2614 1 1 2 LYS HD3 H -5.344 5.255 5.006 1.00 . A A . 2 LYS HD3 1 1 8 2615 1 1 2 LYS HE2 H -6.603 4.119 6.792 1.00 . A A . 2 LYS HE2 1 1 8 2616 1 1 2 LYS HE3 H -7.148 3.557 5.219 1.00 . A A . 2 LYS HE3 1 1 8 2617 1 1 2 LYS HG2 H -5.545 3.433 3.300 1.00 . A A . 2 LYS HG2 1 1 8 2618 1 1 2 LYS HG3 H -4.448 2.438 4.237 1.00 . A A . 2 LYS HG3 1 1 8 2619 1 1 2 LYS HZ1 H -5.010 1.956 6.068 1.00 . A A . 2 LYS HZ1 1 1 8 2620 1 1 2 LYS HZ2 H -6.150 2.051 7.323 1.00 . A A . 2 LYS HZ2 1 1 8 2621 1 1 2 LYS HZ3 H -6.624 1.514 5.781 1.00 . A A . 2 LYS HZ3 1 1 8 2622 1 1 2 LYS N N -4.901 5.471 1.803 1.00 . A A . 2 LYS N 1 1 8 2623 1 1 2 LYS NZ N -6.001 2.167 6.300 1.00 . A A . 2 LYS NZ 1 1 8 2624 1 1 2 LYS O O -1.958 5.589 1.209 1.00 . A A . 2 LYS O 1 1 8 2625 1 1 3 GLY C C 0.331 7.083 2.225 1.00 . A A . 3 GLY C 1 1 8 2626 1 1 3 GLY CA C -0.908 7.989 2.153 1.00 . A A . 3 GLY CA 1 1 8 2627 1 1 3 GLY H H -2.631 7.645 3.412 1.00 . A A . 3 GLY H 1 1 8 2628 1 1 3 GLY HA2 H -1.077 8.284 1.127 1.00 . A A . 3 GLY HA2 1 1 8 2629 1 1 3 GLY HA3 H -0.738 8.868 2.757 1.00 . A A . 3 GLY HA3 1 1 8 2630 1 1 3 GLY N N -2.119 7.268 2.667 1.00 . A A . 3 GLY N 1 1 8 2631 1 1 3 GLY O O 0.320 6.102 2.942 1.00 . A A . 3 GLY O 1 1 8 2632 1 1 4 LYS C C 3.142 6.337 2.919 1.00 . A A . 4 LYS C 1 1 8 2633 1 1 4 LYS CA C 2.613 6.607 1.493 1.00 . A A . 4 LYS CA 1 1 8 2634 1 1 4 LYS CB C 3.684 7.344 0.658 1.00 . A A . 4 LYS CB 1 1 8 2635 1 1 4 LYS CD C 6.022 7.182 -0.291 1.00 . A A . 4 LYS CD 1 1 8 2636 1 1 4 LYS CE C 7.290 6.308 -0.368 1.00 . A A . 4 LYS CE 1 1 8 2637 1 1 4 LYS CG C 4.961 6.472 0.573 1.00 . A A . 4 LYS CG 1 1 8 2638 1 1 4 LYS H H 1.310 8.237 0.939 1.00 . A A . 4 LYS H 1 1 8 2639 1 1 4 LYS HA H 2.398 5.666 1.011 1.00 . A A . 4 LYS HA 1 1 8 2640 1 1 4 LYS HB2 H 3.299 7.524 -0.334 1.00 . A A . 4 LYS HB2 1 1 8 2641 1 1 4 LYS HB3 H 3.917 8.294 1.118 1.00 . A A . 4 LYS HB3 1 1 8 2642 1 1 4 LYS HD2 H 5.638 7.345 -1.288 1.00 . A A . 4 LYS HD2 1 1 8 2643 1 1 4 LYS HD3 H 6.269 8.139 0.144 1.00 . A A . 4 LYS HD3 1 1 8 2644 1 1 4 LYS HE2 H 8.038 6.798 -0.975 1.00 . A A . 4 LYS HE2 1 1 8 2645 1 1 4 LYS HE3 H 7.695 6.144 0.620 1.00 . A A . 4 LYS HE3 1 1 8 2646 1 1 4 LYS HG2 H 5.363 6.305 1.562 1.00 . A A . 4 LYS HG2 1 1 8 2647 1 1 4 LYS HG3 H 4.711 5.517 0.135 1.00 . A A . 4 LYS HG3 1 1 8 2648 1 1 4 LYS HZ1 H 6.384 5.127 -1.827 1.00 . A A . 4 LYS HZ1 1 1 8 2649 1 1 4 LYS HZ2 H 7.859 4.510 -1.249 1.00 . A A . 4 LYS HZ2 1 1 8 2650 1 1 4 LYS HZ3 H 6.459 4.400 -0.294 1.00 . A A . 4 LYS HZ3 1 1 8 2651 1 1 4 LYS N N 1.360 7.430 1.492 1.00 . A A . 4 LYS N 1 1 8 2652 1 1 4 LYS NZ N 6.974 4.987 -0.981 1.00 . A A . 4 LYS NZ 1 1 8 2653 1 1 4 LYS O O 3.349 7.250 3.694 1.00 . A A . 4 LYS O 1 1 8 2654 1 1 5 GLY C C 2.722 4.374 5.545 1.00 . A A . 5 GLY C 1 1 8 2655 1 1 5 GLY CA C 3.843 4.612 4.525 1.00 . A A . 5 GLY CA 1 1 8 2656 1 1 5 GLY H H 3.134 4.404 2.512 1.00 . A A . 5 GLY H 1 1 8 2657 1 1 5 GLY HA2 H 4.377 3.686 4.380 1.00 . A A . 5 GLY HA2 1 1 8 2658 1 1 5 GLY HA3 H 4.530 5.341 4.925 1.00 . A A . 5 GLY HA3 1 1 8 2659 1 1 5 GLY N N 3.333 5.072 3.198 1.00 . A A . 5 GLY N 1 1 8 2660 1 1 5 GLY O O 3.002 4.099 6.695 1.00 . A A . 5 GLY O 1 1 8 2661 1 1 6 ALA C C -0.200 2.820 5.884 1.00 . A A . 6 ALA C 1 1 8 2662 1 1 6 ALA CA C 0.316 4.275 6.007 1.00 . A A . 6 ALA CA 1 1 8 2663 1 1 6 ALA CB C -0.777 5.276 5.608 1.00 . A A . 6 ALA CB 1 1 8 2664 1 1 6 ALA H H 1.341 4.714 4.161 1.00 . A A . 6 ALA H 1 1 8 2665 1 1 6 ALA HA H 0.623 4.467 7.024 1.00 . A A . 6 ALA HA 1 1 8 2666 1 1 6 ALA HB1 H -1.061 5.122 4.582 1.00 . A A . 6 ALA HB1 1 1 8 2667 1 1 6 ALA HB2 H -1.650 5.159 6.232 1.00 . A A . 6 ALA HB2 1 1 8 2668 1 1 6 ALA HB3 H -0.407 6.285 5.717 1.00 . A A . 6 ALA HB3 1 1 8 2669 1 1 6 ALA N N 1.493 4.488 5.102 1.00 . A A . 6 ALA N 1 1 8 2670 1 1 6 ALA O O -0.030 2.220 4.839 1.00 . A A . 6 ALA O 1 1 8 2671 1 1 7 PRO C C -2.326 0.484 5.980 1.00 . A A . 7 PRO C 1 1 8 2672 1 1 7 PRO CA C -1.243 0.863 7.008 1.00 . A A . 7 PRO CA 1 1 8 2673 1 1 7 PRO CB C -1.719 0.651 8.455 1.00 . A A . 7 PRO CB 1 1 8 2674 1 1 7 PRO CD C -1.142 3.049 8.184 1.00 . A A . 7 PRO CD 1 1 8 2675 1 1 7 PRO CG C -1.850 2.037 9.095 1.00 . A A . 7 PRO CG 1 1 8 2676 1 1 7 PRO HA H -0.385 0.236 6.840 1.00 . A A . 7 PRO HA 1 1 8 2677 1 1 7 PRO HB2 H -2.668 0.136 8.493 1.00 . A A . 7 PRO HB2 1 1 8 2678 1 1 7 PRO HB3 H -0.992 0.064 8.996 1.00 . A A . 7 PRO HB3 1 1 8 2679 1 1 7 PRO HD2 H -1.794 3.876 7.948 1.00 . A A . 7 PRO HD2 1 1 8 2680 1 1 7 PRO HD3 H -0.234 3.407 8.647 1.00 . A A . 7 PRO HD3 1 1 8 2681 1 1 7 PRO HG2 H -2.894 2.298 9.194 1.00 . A A . 7 PRO HG2 1 1 8 2682 1 1 7 PRO HG3 H -1.395 2.038 10.074 1.00 . A A . 7 PRO HG3 1 1 8 2683 1 1 7 PRO N N -0.808 2.295 6.934 1.00 . A A . 7 PRO N 1 1 8 2684 1 1 7 PRO O O -3.511 0.551 6.249 1.00 . A A . 7 PRO O 1 1 8 2685 1 1 8 CYS C C -2.963 -1.818 3.540 1.00 . A A . 8 CYS C 1 1 8 2686 1 1 8 CYS CA C -2.762 -0.314 3.700 1.00 . A A . 8 CYS CA 1 1 8 2687 1 1 8 CYS CB C -2.204 0.179 2.406 1.00 . A A . 8 CYS CB 1 1 8 2688 1 1 8 CYS H H -0.892 0.080 4.676 1.00 . A A . 8 CYS H 1 1 8 2689 1 1 8 CYS HA H -3.725 0.148 3.847 1.00 . A A . 8 CYS HA 1 1 8 2690 1 1 8 CYS HB2 H -2.763 -0.268 1.596 1.00 . A A . 8 CYS HB2 1 1 8 2691 1 1 8 CYS HB3 H -2.334 1.235 2.303 1.00 . A A . 8 CYS HB3 1 1 8 2692 1 1 8 CYS N N -1.862 0.096 4.822 1.00 . A A . 8 CYS N 1 1 8 2693 1 1 8 CYS O O -2.140 -2.636 3.902 1.00 . A A . 8 CYS O 1 1 8 2694 1 1 8 CYS SG S -0.474 -0.297 2.175 1.00 . A A . 8 CYS SG 1 1 8 2695 1 1 9 ARG C C -4.133 -3.687 1.215 1.00 . A A . 9 ARG C 1 1 8 2696 1 1 9 ARG CA C -4.588 -3.447 2.667 1.00 . A A . 9 ARG CA 1 1 8 2697 1 1 9 ARG CB C -6.123 -3.478 2.748 1.00 . A A . 9 ARG CB 1 1 8 2698 1 1 9 ARG CD C -6.301 -3.904 5.284 1.00 . A A . 9 ARG CD 1 1 8 2699 1 1 9 ARG CG C -6.701 -3.001 4.103 1.00 . A A . 9 ARG CG 1 1 8 2700 1 1 9 ARG CZ C -4.311 -2.821 6.232 1.00 . A A . 9 ARG CZ 1 1 8 2701 1 1 9 ARG H H -4.681 -1.328 2.738 1.00 . A A . 9 ARG H 1 1 8 2702 1 1 9 ARG HA H -4.118 -4.172 3.315 1.00 . A A . 9 ARG HA 1 1 8 2703 1 1 9 ARG HB2 H -6.527 -2.839 1.979 1.00 . A A . 9 ARG HB2 1 1 8 2704 1 1 9 ARG HB3 H -6.465 -4.485 2.556 1.00 . A A . 9 ARG HB3 1 1 8 2705 1 1 9 ARG HD2 H -6.852 -3.621 6.167 1.00 . A A . 9 ARG HD2 1 1 8 2706 1 1 9 ARG HD3 H -6.543 -4.927 5.035 1.00 . A A . 9 ARG HD3 1 1 8 2707 1 1 9 ARG HE H -4.242 -4.536 5.238 1.00 . A A . 9 ARG HE 1 1 8 2708 1 1 9 ARG HG2 H -6.367 -1.992 4.299 1.00 . A A . 9 ARG HG2 1 1 8 2709 1 1 9 ARG HG3 H -7.779 -2.983 4.028 1.00 . A A . 9 ARG HG3 1 1 8 2710 1 1 9 ARG HH11 H -6.050 -1.860 6.505 1.00 . A A . 9 ARG HH11 1 1 8 2711 1 1 9 ARG HH12 H -4.655 -1.096 7.189 1.00 . A A . 9 ARG HH12 1 1 8 2712 1 1 9 ARG HH21 H -2.463 -3.578 6.102 1.00 . A A . 9 ARG HH21 1 1 8 2713 1 1 9 ARG HH22 H -2.598 -2.076 6.956 1.00 . A A . 9 ARG HH22 1 1 8 2714 1 1 9 ARG N N -4.106 -2.079 2.971 1.00 . A A . 9 ARG N 1 1 8 2715 1 1 9 ARG NE N -4.831 -3.822 5.561 1.00 . A A . 9 ARG NE 1 1 8 2716 1 1 9 ARG NH1 N -5.065 -1.850 6.676 1.00 . A A . 9 ARG NH1 1 1 8 2717 1 1 9 ARG NH2 N -3.024 -2.825 6.448 1.00 . A A . 9 ARG NH2 1 1 8 2718 1 1 9 ARG O O -4.735 -3.162 0.295 1.00 . A A . 9 ARG O 1 1 8 2719 1 1 10 LYS C C -3.745 -5.382 -1.085 1.00 . A A . 10 LYS C 1 1 8 2720 1 1 10 LYS CA C -2.556 -4.776 -0.332 1.00 . A A . 10 LYS CA 1 1 8 2721 1 1 10 LYS CB C -1.431 -5.847 -0.313 1.00 . A A . 10 LYS CB 1 1 8 2722 1 1 10 LYS CD C -0.486 -5.363 2.092 1.00 . A A . 10 LYS CD 1 1 8 2723 1 1 10 LYS CE C -1.024 -6.668 2.747 1.00 . A A . 10 LYS CE 1 1 8 2724 1 1 10 LYS CG C -0.208 -5.482 0.564 1.00 . A A . 10 LYS CG 1 1 8 2725 1 1 10 LYS H H -2.663 -4.850 1.837 1.00 . A A . 10 LYS H 1 1 8 2726 1 1 10 LYS HA H -2.242 -3.864 -0.818 1.00 . A A . 10 LYS HA 1 1 8 2727 1 1 10 LYS HB2 H -1.826 -6.807 -0.019 1.00 . A A . 10 LYS HB2 1 1 8 2728 1 1 10 LYS HB3 H -1.072 -5.954 -1.328 1.00 . A A . 10 LYS HB3 1 1 8 2729 1 1 10 LYS HD2 H 0.466 -5.180 2.550 1.00 . A A . 10 LYS HD2 1 1 8 2730 1 1 10 LYS HD3 H -1.101 -4.512 2.329 1.00 . A A . 10 LYS HD3 1 1 8 2731 1 1 10 LYS HE2 H -0.329 -7.475 2.571 1.00 . A A . 10 LYS HE2 1 1 8 2732 1 1 10 LYS HE3 H -1.110 -6.521 3.814 1.00 . A A . 10 LYS HE3 1 1 8 2733 1 1 10 LYS HG2 H 0.557 -6.229 0.410 1.00 . A A . 10 LYS HG2 1 1 8 2734 1 1 10 LYS HG3 H 0.184 -4.537 0.219 1.00 . A A . 10 LYS HG3 1 1 8 2735 1 1 10 LYS HZ1 H -2.747 -6.347 1.604 1.00 . A A . 10 LYS HZ1 1 1 8 2736 1 1 10 LYS HZ2 H -2.259 -7.967 1.689 1.00 . A A . 10 LYS HZ2 1 1 8 2737 1 1 10 LYS HZ3 H -3.009 -7.235 3.023 1.00 . A A . 10 LYS HZ3 1 1 8 2738 1 1 10 LYS N N -3.089 -4.466 1.047 1.00 . A A . 10 LYS N 1 1 8 2739 1 1 10 LYS NZ N -2.359 -7.082 2.225 1.00 . A A . 10 LYS NZ 1 1 8 2740 1 1 10 LYS O O -3.964 -5.167 -2.262 1.00 . A A . 10 LYS O 1 1 8 2741 1 1 11 THR C C -6.552 -6.131 -1.652 1.00 . A A . 11 THR C 1 1 8 2742 1 1 11 THR CA C -5.682 -6.886 -0.639 1.00 . A A . 11 THR CA 1 1 8 2743 1 1 11 THR CB C -6.462 -7.111 0.657 1.00 . A A . 11 THR CB 1 1 8 2744 1 1 11 THR CG2 C -7.677 -8.038 0.451 1.00 . A A . 11 THR CG2 1 1 8 2745 1 1 11 THR H H -4.118 -6.209 0.645 1.00 . A A . 11 THR H 1 1 8 2746 1 1 11 THR HA H -5.391 -7.834 -1.071 1.00 . A A . 11 THR HA 1 1 8 2747 1 1 11 THR HB H -6.704 -6.160 1.128 1.00 . A A . 11 THR HB 1 1 8 2748 1 1 11 THR HG1 H -4.856 -7.268 1.740 1.00 . A A . 11 THR HG1 1 1 8 2749 1 1 11 THR HG21 H -7.360 -9.005 0.089 1.00 . A A . 11 THR HG21 1 1 8 2750 1 1 11 THR HG22 H -8.202 -8.172 1.385 1.00 . A A . 11 THR HG22 1 1 8 2751 1 1 11 THR HG23 H -8.358 -7.607 -0.268 1.00 . A A . 11 THR HG23 1 1 8 2752 1 1 11 THR N N -4.447 -6.136 -0.278 1.00 . A A . 11 THR N 1 1 8 2753 1 1 11 THR O O -6.943 -6.659 -2.674 1.00 . A A . 11 THR O 1 1 8 2754 1 1 11 THR OG1 O -5.577 -7.851 1.488 1.00 . A A . 11 THR OG1 1 1 8 2755 1 1 12 MET C C -6.906 -2.710 -2.551 1.00 . A A . 12 MET C 1 1 8 2756 1 1 12 MET CA C -7.643 -3.984 -2.126 1.00 . A A . 12 MET CA 1 1 8 2757 1 1 12 MET CB C -8.911 -3.638 -1.301 1.00 . A A . 12 MET CB 1 1 8 2758 1 1 12 MET CE C -9.982 -0.818 0.640 1.00 . A A . 12 MET CE 1 1 8 2759 1 1 12 MET CG C -8.531 -3.078 0.096 1.00 . A A . 12 MET CG 1 1 8 2760 1 1 12 MET H H -6.435 -4.564 -0.451 1.00 . A A . 12 MET H 1 1 8 2761 1 1 12 MET HA H -7.949 -4.500 -3.025 1.00 . A A . 12 MET HA 1 1 8 2762 1 1 12 MET HB2 H -9.508 -2.909 -1.829 1.00 . A A . 12 MET HB2 1 1 8 2763 1 1 12 MET HB3 H -9.505 -4.532 -1.173 1.00 . A A . 12 MET HB3 1 1 8 2764 1 1 12 MET HE1 H -9.921 -0.765 -0.436 1.00 . A A . 12 MET HE1 1 1 8 2765 1 1 12 MET HE2 H -10.939 -0.419 0.938 1.00 . A A . 12 MET HE2 1 1 8 2766 1 1 12 MET HE3 H -9.192 -0.242 1.097 1.00 . A A . 12 MET HE3 1 1 8 2767 1 1 12 MET HG2 H -8.026 -3.872 0.628 1.00 . A A . 12 MET HG2 1 1 8 2768 1 1 12 MET HG3 H -7.827 -2.264 0.012 1.00 . A A . 12 MET HG3 1 1 8 2769 1 1 12 MET N N -6.808 -4.899 -1.294 1.00 . A A . 12 MET N 1 1 8 2770 1 1 12 MET O O -7.523 -1.814 -3.095 1.00 . A A . 12 MET O 1 1 8 2771 1 1 12 MET SD S -9.887 -2.547 1.174 1.00 . A A . 12 MET SD 1 1 8 2772 1 1 13 TYR C C -5.478 -0.237 -2.089 1.00 . A A . 13 TYR C 1 1 8 2773 1 1 13 TYR CA C -4.776 -1.475 -2.660 1.00 . A A . 13 TYR CA 1 1 8 2774 1 1 13 TYR CB C -4.655 -1.422 -4.198 1.00 . A A . 13 TYR CB 1 1 8 2775 1 1 13 TYR CD1 C -2.644 -2.931 -4.520 1.00 . A A . 13 TYR CD1 1 1 8 2776 1 1 13 TYR CD2 C -4.780 -3.752 -5.182 1.00 . A A . 13 TYR CD2 1 1 8 2777 1 1 13 TYR CE1 C -2.067 -4.117 -4.918 1.00 . A A . 13 TYR CE1 1 1 8 2778 1 1 13 TYR CE2 C -4.201 -4.937 -5.580 1.00 . A A . 13 TYR CE2 1 1 8 2779 1 1 13 TYR CG C -4.006 -2.738 -4.649 1.00 . A A . 13 TYR CG 1 1 8 2780 1 1 13 TYR CZ C -2.841 -5.128 -5.449 1.00 . A A . 13 TYR CZ 1 1 8 2781 1 1 13 TYR H H -5.192 -3.432 -1.863 1.00 . A A . 13 TYR H 1 1 8 2782 1 1 13 TYR HA H -3.805 -1.578 -2.199 1.00 . A A . 13 TYR HA 1 1 8 2783 1 1 13 TYR HB2 H -5.628 -1.331 -4.657 1.00 . A A . 13 TYR HB2 1 1 8 2784 1 1 13 TYR HB3 H -4.034 -0.594 -4.509 1.00 . A A . 13 TYR HB3 1 1 8 2785 1 1 13 TYR HD1 H -2.026 -2.149 -4.105 1.00 . A A . 13 TYR HD1 1 1 8 2786 1 1 13 TYR HD2 H -5.846 -3.616 -5.289 1.00 . A A . 13 TYR HD2 1 1 8 2787 1 1 13 TYR HE1 H -1.001 -4.255 -4.811 1.00 . A A . 13 TYR HE1 1 1 8 2788 1 1 13 TYR HE2 H -4.818 -5.722 -5.994 1.00 . A A . 13 TYR HE2 1 1 8 2789 1 1 13 TYR HH H -2.509 -6.470 -6.761 1.00 . A A . 13 TYR HH 1 1 8 2790 1 1 13 TYR N N -5.618 -2.666 -2.298 1.00 . A A . 13 TYR N 1 1 8 2791 1 1 13 TYR O O -6.005 0.613 -2.780 1.00 . A A . 13 TYR O 1 1 8 2792 1 1 13 TYR OH O -2.264 -6.316 -5.847 1.00 . A A . 13 TYR OH 1 1 8 2793 1 1 14 ASP C C -5.167 2.118 0.114 1.00 . A A . 14 ASP C 1 1 8 2794 1 1 14 ASP CA C -6.032 0.848 0.051 1.00 . A A . 14 ASP CA 1 1 8 2795 1 1 14 ASP CB C -6.245 0.173 1.419 1.00 . A A . 14 ASP CB 1 1 8 2796 1 1 14 ASP CG C -6.816 1.076 2.530 1.00 . A A . 14 ASP CG 1 1 8 2797 1 1 14 ASP H H -4.962 -0.958 -0.337 1.00 . A A . 14 ASP H 1 1 8 2798 1 1 14 ASP HA H -6.992 1.110 -0.369 1.00 . A A . 14 ASP HA 1 1 8 2799 1 1 14 ASP HB2 H -6.922 -0.650 1.291 1.00 . A A . 14 ASP HB2 1 1 8 2800 1 1 14 ASP HB3 H -5.309 -0.252 1.725 1.00 . A A . 14 ASP HB3 1 1 8 2801 1 1 14 ASP N N -5.427 -0.224 -0.787 1.00 . A A . 14 ASP N 1 1 8 2802 1 1 14 ASP O O -5.446 3.010 0.887 1.00 . A A . 14 ASP O 1 1 8 2803 1 1 14 ASP OD1 O -7.647 1.915 2.220 1.00 . A A . 14 ASP OD1 1 1 8 2804 1 1 14 ASP OD2 O -6.375 0.859 3.648 1.00 . A A . 14 ASP OD2 1 1 8 2805 1 1 15 CYS C C -3.602 4.392 -1.783 1.00 . A A . 15 CYS C 1 1 8 2806 1 1 15 CYS CA C -3.234 3.354 -0.729 1.00 . A A . 15 CYS CA 1 1 8 2807 1 1 15 CYS CB C -1.816 2.904 -1.006 1.00 . A A . 15 CYS CB 1 1 8 2808 1 1 15 CYS H H -3.979 1.406 -1.302 1.00 . A A . 15 CYS H 1 1 8 2809 1 1 15 CYS HA H -3.247 3.832 0.235 1.00 . A A . 15 CYS HA 1 1 8 2810 1 1 15 CYS HB2 H -1.807 2.415 -1.967 1.00 . A A . 15 CYS HB2 1 1 8 2811 1 1 15 CYS HB3 H -1.172 3.769 -1.069 1.00 . A A . 15 CYS HB3 1 1 8 2812 1 1 15 CYS N N -4.145 2.164 -0.703 1.00 . A A . 15 CYS N 1 1 8 2813 1 1 15 CYS O O -4.090 4.064 -2.847 1.00 . A A . 15 CYS O 1 1 8 2814 1 1 15 CYS SG S -1.090 1.764 0.188 1.00 . A A . 15 CYS SG 1 1 8 2815 1 1 16 CYS C C -2.668 6.623 -3.531 1.00 . A A . 16 CYS C 1 1 8 2816 1 1 16 CYS CA C -3.622 6.778 -2.333 1.00 . A A . 16 CYS CA 1 1 8 2817 1 1 16 CYS CB C -3.338 8.064 -1.561 1.00 . A A . 16 CYS CB 1 1 8 2818 1 1 16 CYS H H -2.948 5.815 -0.554 1.00 . A A . 16 CYS H 1 1 8 2819 1 1 16 CYS HA H -4.646 6.734 -2.672 1.00 . A A . 16 CYS HA 1 1 8 2820 1 1 16 CYS HB2 H -2.277 8.122 -1.355 1.00 . A A . 16 CYS HB2 1 1 8 2821 1 1 16 CYS HB3 H -3.593 8.894 -2.194 1.00 . A A . 16 CYS HB3 1 1 8 2822 1 1 16 CYS N N -3.339 5.627 -1.430 1.00 . A A . 16 CYS N 1 1 8 2823 1 1 16 CYS O O -2.973 6.997 -4.648 1.00 . A A . 16 CYS O 1 1 8 2824 1 1 16 CYS SG S -4.207 8.283 0.010 1.00 . A A . 16 CYS SG 1 1 8 2825 1 1 17 SER C C -0.742 4.462 -4.910 1.00 . A A . 17 SER C 1 1 8 2826 1 1 17 SER CA C -0.446 5.796 -4.201 1.00 . A A . 17 SER CA 1 1 8 2827 1 1 17 SER CB C 0.883 5.722 -3.442 1.00 . A A . 17 SER CB 1 1 8 2828 1 1 17 SER H H -1.380 5.795 -2.281 1.00 . A A . 17 SER H 1 1 8 2829 1 1 17 SER HA H -0.425 6.594 -4.931 1.00 . A A . 17 SER HA 1 1 8 2830 1 1 17 SER HB2 H 1.079 6.634 -2.901 1.00 . A A . 17 SER HB2 1 1 8 2831 1 1 17 SER HB3 H 0.899 4.882 -2.760 1.00 . A A . 17 SER HB3 1 1 8 2832 1 1 17 SER HG H 1.792 4.621 -4.760 1.00 . A A . 17 SER HG 1 1 8 2833 1 1 17 SER N N -1.529 6.058 -3.212 1.00 . A A . 17 SER N 1 1 8 2834 1 1 17 SER O O -0.284 4.231 -6.013 1.00 . A A . 17 SER O 1 1 8 2835 1 1 17 SER OG O 1.869 5.526 -4.446 1.00 . A A . 17 SER OG 1 1 8 2836 1 1 18 GLY C C -0.715 1.284 -4.679 1.00 . A A . 18 GLY C 1 1 8 2837 1 1 18 GLY CA C -1.873 2.291 -4.793 1.00 . A A . 18 GLY CA 1 1 8 2838 1 1 18 GLY H H -1.835 3.888 -3.353 1.00 . A A . 18 GLY H 1 1 8 2839 1 1 18 GLY HA2 H -2.721 1.912 -4.243 1.00 . A A . 18 GLY HA2 1 1 8 2840 1 1 18 GLY HA3 H -2.147 2.399 -5.832 1.00 . A A . 18 GLY HA3 1 1 8 2841 1 1 18 GLY N N -1.501 3.628 -4.238 1.00 . A A . 18 GLY N 1 1 8 2842 1 1 18 GLY O O -0.906 0.105 -4.906 1.00 . A A . 18 GLY O 1 1 8 2843 1 1 19 SER C C 1.800 0.419 -2.735 1.00 . A A . 19 SER C 1 1 8 2844 1 1 19 SER CA C 1.663 0.922 -4.184 1.00 . A A . 19 SER CA 1 1 8 2845 1 1 19 SER CB C 2.887 1.770 -4.613 1.00 . A A . 19 SER CB 1 1 8 2846 1 1 19 SER H H 0.536 2.742 -4.157 1.00 . A A . 19 SER H 1 1 8 2847 1 1 19 SER HA H 1.578 0.067 -4.841 1.00 . A A . 19 SER HA 1 1 8 2848 1 1 19 SER HB2 H 3.811 1.226 -4.487 1.00 . A A . 19 SER HB2 1 1 8 2849 1 1 19 SER HB3 H 2.793 2.107 -5.636 1.00 . A A . 19 SER HB3 1 1 8 2850 1 1 19 SER HG H 2.034 3.341 -3.835 1.00 . A A . 19 SER HG 1 1 8 2851 1 1 19 SER N N 0.449 1.782 -4.331 1.00 . A A . 19 SER N 1 1 8 2852 1 1 19 SER O O 2.722 0.781 -2.028 1.00 . A A . 19 SER O 1 1 8 2853 1 1 19 SER OG O 2.882 2.898 -3.746 1.00 . A A . 19 SER OG 1 1 8 2854 1 1 20 CYS C C 1.894 -2.130 -0.827 1.00 . A A . 20 CYS C 1 1 8 2855 1 1 20 CYS CA C 0.914 -0.952 -0.946 1.00 . A A . 20 CYS CA 1 1 8 2856 1 1 20 CYS CB C -0.492 -1.402 -0.534 1.00 . A A . 20 CYS CB 1 1 8 2857 1 1 20 CYS H H 0.147 -0.673 -2.945 1.00 . A A . 20 CYS H 1 1 8 2858 1 1 20 CYS HA H 1.232 -0.168 -0.277 1.00 . A A . 20 CYS HA 1 1 8 2859 1 1 20 CYS HB2 H -1.162 -0.560 -0.613 1.00 . A A . 20 CYS HB2 1 1 8 2860 1 1 20 CYS HB3 H -0.868 -2.159 -1.193 1.00 . A A . 20 CYS HB3 1 1 8 2861 1 1 20 CYS N N 0.868 -0.411 -2.336 1.00 . A A . 20 CYS N 1 1 8 2862 1 1 20 CYS O O 1.652 -3.211 -1.326 1.00 . A A . 20 CYS O 1 1 8 2863 1 1 20 CYS SG S -0.598 -2.032 1.154 1.00 . A A . 20 CYS SG 1 1 8 2864 1 1 21 GLY C C 3.639 -4.087 0.898 1.00 . A A . 21 GLY C 1 1 8 2865 1 1 21 GLY CA C 4.065 -2.857 0.074 1.00 . A A . 21 GLY CA 1 1 8 2866 1 1 21 GLY H H 3.096 -0.948 0.204 1.00 . A A . 21 GLY H 1 1 8 2867 1 1 21 GLY HA2 H 4.421 -3.198 -0.887 1.00 . A A . 21 GLY HA2 1 1 8 2868 1 1 21 GLY HA3 H 4.880 -2.365 0.581 1.00 . A A . 21 GLY HA3 1 1 8 2869 1 1 21 GLY N N 2.984 -1.851 -0.157 1.00 . A A . 21 GLY N 1 1 8 2870 1 1 21 GLY O O 2.557 -4.159 1.448 1.00 . A A . 21 GLY O 1 1 8 2871 1 1 22 ARG C C 4.403 -6.113 3.189 1.00 . A A . 22 ARG C 1 1 8 2872 1 1 22 ARG CA C 4.399 -6.311 1.673 1.00 . A A . 22 ARG CA 1 1 8 2873 1 1 22 ARG CB C 5.549 -7.259 1.285 1.00 . A A . 22 ARG CB 1 1 8 2874 1 1 22 ARG CD C 6.702 -8.473 -0.576 1.00 . A A . 22 ARG CD 1 1 8 2875 1 1 22 ARG CG C 5.527 -7.539 -0.230 1.00 . A A . 22 ARG CG 1 1 8 2876 1 1 22 ARG CZ C 5.871 -9.658 -2.560 1.00 . A A . 22 ARG CZ 1 1 8 2877 1 1 22 ARG H H 5.403 -4.826 0.483 1.00 . A A . 22 ARG H 1 1 8 2878 1 1 22 ARG HA H 3.454 -6.750 1.387 1.00 . A A . 22 ARG HA 1 1 8 2879 1 1 22 ARG HB2 H 6.494 -6.810 1.557 1.00 . A A . 22 ARG HB2 1 1 8 2880 1 1 22 ARG HB3 H 5.446 -8.191 1.822 1.00 . A A . 22 ARG HB3 1 1 8 2881 1 1 22 ARG HD2 H 7.639 -7.989 -0.342 1.00 . A A . 22 ARG HD2 1 1 8 2882 1 1 22 ARG HD3 H 6.641 -9.402 -0.027 1.00 . A A . 22 ARG HD3 1 1 8 2883 1 1 22 ARG HE H 7.270 -8.257 -2.640 1.00 . A A . 22 ARG HE 1 1 8 2884 1 1 22 ARG HG2 H 4.592 -8.008 -0.503 1.00 . A A . 22 ARG HG2 1 1 8 2885 1 1 22 ARG HG3 H 5.626 -6.616 -0.782 1.00 . A A . 22 ARG HG3 1 1 8 2886 1 1 22 ARG HH11 H 5.041 -10.188 -0.813 1.00 . A A . 22 ARG HH11 1 1 8 2887 1 1 22 ARG HH12 H 4.454 -11.028 -2.208 1.00 . A A . 22 ARG HH12 1 1 8 2888 1 1 22 ARG HH21 H 6.535 -9.312 -4.417 1.00 . A A . 22 ARG HH21 1 1 8 2889 1 1 22 ARG HH22 H 5.309 -10.526 -4.271 1.00 . A A . 22 ARG HH22 1 1 8 2890 1 1 22 ARG N N 4.564 -5.010 0.944 1.00 . A A . 22 ARG N 1 1 8 2891 1 1 22 ARG NE N 6.673 -8.757 -2.045 1.00 . A A . 22 ARG NE 1 1 8 2892 1 1 22 ARG NH1 N 5.059 -10.345 -1.800 1.00 . A A . 22 ARG NH1 1 1 8 2893 1 1 22 ARG NH2 N 5.908 -9.847 -3.851 1.00 . A A . 22 ARG NH2 1 1 8 2894 1 1 22 ARG O O 3.876 -6.926 3.925 1.00 . A A . 22 ARG O 1 1 8 2895 1 1 23 ARG C C 3.740 -4.116 5.530 1.00 . A A . 23 ARG C 1 1 8 2896 1 1 23 ARG CA C 5.083 -4.698 5.056 1.00 . A A . 23 ARG CA 1 1 8 2897 1 1 23 ARG CB C 6.226 -3.665 5.291 1.00 . A A . 23 ARG CB 1 1 8 2898 1 1 23 ARG CD C 5.745 -2.261 3.161 1.00 . A A . 23 ARG CD 1 1 8 2899 1 1 23 ARG CG C 5.961 -2.246 4.685 1.00 . A A . 23 ARG CG 1 1 8 2900 1 1 23 ARG CZ C 6.631 -0.082 2.456 1.00 . A A . 23 ARG CZ 1 1 8 2901 1 1 23 ARG H H 5.402 -4.428 2.939 1.00 . A A . 23 ARG H 1 1 8 2902 1 1 23 ARG HA H 5.289 -5.603 5.613 1.00 . A A . 23 ARG HA 1 1 8 2903 1 1 23 ARG HB2 H 6.382 -3.559 6.355 1.00 . A A . 23 ARG HB2 1 1 8 2904 1 1 23 ARG HB3 H 7.138 -4.057 4.864 1.00 . A A . 23 ARG HB3 1 1 8 2905 1 1 23 ARG HD2 H 6.562 -2.742 2.643 1.00 . A A . 23 ARG HD2 1 1 8 2906 1 1 23 ARG HD3 H 4.821 -2.765 2.929 1.00 . A A . 23 ARG HD3 1 1 8 2907 1 1 23 ARG HE H 4.699 -0.494 2.530 1.00 . A A . 23 ARG HE 1 1 8 2908 1 1 23 ARG HG2 H 5.091 -1.820 5.158 1.00 . A A . 23 ARG HG2 1 1 8 2909 1 1 23 ARG HG3 H 6.806 -1.613 4.914 1.00 . A A . 23 ARG HG3 1 1 8 2910 1 1 23 ARG HH11 H 8.001 -1.452 2.970 1.00 . A A . 23 ARG HH11 1 1 8 2911 1 1 23 ARG HH12 H 8.626 0.081 2.465 1.00 . A A . 23 ARG HH12 1 1 8 2912 1 1 23 ARG HH21 H 5.458 1.435 1.902 1.00 . A A . 23 ARG HH21 1 1 8 2913 1 1 23 ARG HH22 H 7.160 1.752 1.851 1.00 . A A . 23 ARG HH22 1 1 8 2914 1 1 23 ARG N N 5.001 -5.026 3.601 1.00 . A A . 23 ARG N 1 1 8 2915 1 1 23 ARG NE N 5.597 -0.853 2.682 1.00 . A A . 23 ARG NE 1 1 8 2916 1 1 23 ARG NH1 N 7.847 -0.520 2.645 1.00 . A A . 23 ARG NH1 1 1 8 2917 1 1 23 ARG NH2 N 6.400 1.131 2.037 1.00 . A A . 23 ARG NH2 1 1 8 2918 1 1 23 ARG O O 3.614 -3.705 6.669 1.00 . A A . 23 ARG O 1 1 8 2919 1 1 24 GLY C C 1.390 -2.039 4.948 1.00 . A A . 24 GLY C 1 1 8 2920 1 1 24 GLY CA C 1.430 -3.563 4.977 1.00 . A A . 24 GLY CA 1 1 8 2921 1 1 24 GLY H H 2.937 -4.439 3.731 1.00 . A A . 24 GLY H 1 1 8 2922 1 1 24 GLY HA2 H 0.714 -3.941 4.265 1.00 . A A . 24 GLY HA2 1 1 8 2923 1 1 24 GLY HA3 H 1.151 -3.903 5.965 1.00 . A A . 24 GLY HA3 1 1 8 2924 1 1 24 GLY N N 2.778 -4.099 4.638 1.00 . A A . 24 GLY N 1 1 8 2925 1 1 24 GLY O O 0.422 -1.469 5.413 1.00 . A A . 24 GLY O 1 1 8 2926 1 1 25 LYS C C 2.443 0.526 2.899 1.00 . A A . 25 LYS C 1 1 8 2927 1 1 25 LYS CA C 2.436 0.078 4.352 1.00 . A A . 25 LYS CA 1 1 8 2928 1 1 25 LYS CB C 3.692 0.641 5.058 1.00 . A A . 25 LYS CB 1 1 8 2929 1 1 25 LYS CD C 2.536 0.807 7.311 1.00 . A A . 25 LYS CD 1 1 8 2930 1 1 25 LYS CE C 2.585 0.393 8.784 1.00 . A A . 25 LYS CE 1 1 8 2931 1 1 25 LYS CG C 3.745 0.219 6.551 1.00 . A A . 25 LYS CG 1 1 8 2932 1 1 25 LYS H H 3.171 -1.944 4.042 1.00 . A A . 25 LYS H 1 1 8 2933 1 1 25 LYS HA H 1.546 0.473 4.811 1.00 . A A . 25 LYS HA 1 1 8 2934 1 1 25 LYS HB2 H 4.582 0.337 4.539 1.00 . A A . 25 LYS HB2 1 1 8 2935 1 1 25 LYS HB3 H 3.648 1.719 5.016 1.00 . A A . 25 LYS HB3 1 1 8 2936 1 1 25 LYS HD2 H 2.544 1.883 7.247 1.00 . A A . 25 LYS HD2 1 1 8 2937 1 1 25 LYS HD3 H 1.621 0.448 6.876 1.00 . A A . 25 LYS HD3 1 1 8 2938 1 1 25 LYS HE2 H 2.544 -0.683 8.875 1.00 . A A . 25 LYS HE2 1 1 8 2939 1 1 25 LYS HE3 H 3.489 0.752 9.252 1.00 . A A . 25 LYS HE3 1 1 8 2940 1 1 25 LYS HG2 H 3.733 -0.858 6.630 1.00 . A A . 25 LYS HG2 1 1 8 2941 1 1 25 LYS HG3 H 4.661 0.586 6.991 1.00 . A A . 25 LYS HG3 1 1 8 2942 1 1 25 LYS HZ1 H 0.691 1.256 8.812 1.00 . A A . 25 LYS HZ1 1 1 8 2943 1 1 25 LYS HZ2 H 1.018 0.264 10.152 1.00 . A A . 25 LYS HZ2 1 1 8 2944 1 1 25 LYS HZ3 H 1.722 1.808 10.044 1.00 . A A . 25 LYS HZ3 1 1 8 2945 1 1 25 LYS N N 2.418 -1.423 4.410 1.00 . A A . 25 LYS N 1 1 8 2946 1 1 25 LYS NZ N 1.415 0.973 9.503 1.00 . A A . 25 LYS NZ 1 1 8 2947 1 1 25 LYS O O 2.750 -0.243 2.010 1.00 . A A . 25 LYS O 1 1 8 2948 1 1 26 CYS C C 3.385 2.880 0.787 1.00 . A A . 26 CYS C 1 1 8 2949 1 1 26 CYS CA C 2.053 2.353 1.335 1.00 . A A . 26 CYS CA 1 1 8 2950 1 1 26 CYS CB C 1.016 3.458 1.363 1.00 . A A . 26 CYS CB 1 1 8 2951 1 1 26 CYS H H 1.869 2.319 3.490 1.00 . A A . 26 CYS H 1 1 8 2952 1 1 26 CYS HA H 1.698 1.595 0.655 1.00 . A A . 26 CYS HA 1 1 8 2953 1 1 26 CYS HB2 H 1.314 4.184 2.097 1.00 . A A . 26 CYS HB2 1 1 8 2954 1 1 26 CYS HB3 H 0.974 3.937 0.402 1.00 . A A . 26 CYS HB3 1 1 8 2955 1 1 26 CYS N N 2.100 1.770 2.710 1.00 . A A . 26 CYS N 1 1 8 2956 1 1 26 CYS O O 4.340 3.101 1.503 1.00 . A A . 26 CYS O 1 1 8 2957 1 1 26 CYS SG S -0.660 2.936 1.774 1.00 . A A . 26 CYS SG 1 1 8 2958 1 1 27 NH2 HN1 H 2.694 2.913 -1.071 1.00 . A A . 27 NH2 HN1 1 1 8 2959 1 1 27 NH2 HN2 H 4.298 3.428 -0.898 1.00 . A A . 27 NH2 HN2 1 1 8 2960 1 1 27 NH2 N N 3.469 3.092 -0.500 1.00 . A A . 27 NH2 N 1 1 9 2961 1 1 1 CYS C C -5.951 6.353 2.100 1.00 . A A . 1 CYS C 1 1 9 2962 1 1 1 CYS CA C -7.081 5.950 1.147 1.00 . A A . 1 CYS CA 1 1 9 2963 1 1 1 CYS CB C -6.716 6.398 -0.271 1.00 . A A . 1 CYS CB 1 1 9 2964 1 1 1 CYS H1 H -8.220 7.626 1.623 1.00 . A A . 1 CYS H1 1 1 9 2965 1 1 1 CYS H2 H -9.105 6.371 0.900 1.00 . A A . 1 CYS H2 1 1 9 2966 1 1 1 CYS H3 H -8.617 6.240 2.521 1.00 . A A . 1 CYS H3 1 1 9 2967 1 1 1 CYS HA H -7.203 4.878 1.187 1.00 . A A . 1 CYS HA 1 1 9 2968 1 1 1 CYS HB2 H -5.831 5.860 -0.574 1.00 . A A . 1 CYS HB2 1 1 9 2969 1 1 1 CYS HB3 H -7.513 6.103 -0.936 1.00 . A A . 1 CYS HB3 1 1 9 2970 1 1 1 CYS N N -8.352 6.595 1.581 1.00 . A A . 1 CYS N 1 1 9 2971 1 1 1 CYS O O -5.966 7.428 2.668 1.00 . A A . 1 CYS O 1 1 9 2972 1 1 1 CYS SG S -6.411 8.165 -0.527 1.00 . A A . 1 CYS SG 1 1 9 2973 1 1 2 LYS C C -2.642 6.254 2.326 1.00 . A A . 2 LYS C 1 1 9 2974 1 1 2 LYS CA C -3.829 5.703 3.129 1.00 . A A . 2 LYS CA 1 1 9 2975 1 1 2 LYS CB C -3.418 4.372 3.819 1.00 . A A . 2 LYS CB 1 1 9 2976 1 1 2 LYS CD C -5.817 3.449 4.188 1.00 . A A . 2 LYS CD 1 1 9 2977 1 1 2 LYS CE C -6.756 2.886 5.270 1.00 . A A . 2 LYS CE 1 1 9 2978 1 1 2 LYS CG C -4.468 3.839 4.832 1.00 . A A . 2 LYS CG 1 1 9 2979 1 1 2 LYS H H -5.060 4.619 1.742 1.00 . A A . 2 LYS H 1 1 9 2980 1 1 2 LYS HA H -4.099 6.423 3.889 1.00 . A A . 2 LYS HA 1 1 9 2981 1 1 2 LYS HB2 H -3.262 3.619 3.058 1.00 . A A . 2 LYS HB2 1 1 9 2982 1 1 2 LYS HB3 H -2.489 4.504 4.344 1.00 . A A . 2 LYS HB3 1 1 9 2983 1 1 2 LYS HD2 H -6.301 4.308 3.751 1.00 . A A . 2 LYS HD2 1 1 9 2984 1 1 2 LYS HD3 H -5.653 2.706 3.424 1.00 . A A . 2 LYS HD3 1 1 9 2985 1 1 2 LYS HE2 H -6.923 3.622 6.043 1.00 . A A . 2 LYS HE2 1 1 9 2986 1 1 2 LYS HE3 H -7.707 2.619 4.833 1.00 . A A . 2 LYS HE3 1 1 9 2987 1 1 2 LYS HG2 H -4.046 2.977 5.321 1.00 . A A . 2 LYS HG2 1 1 9 2988 1 1 2 LYS HG3 H -4.641 4.597 5.584 1.00 . A A . 2 LYS HG3 1 1 9 2989 1 1 2 LYS HZ1 H -5.564 1.179 5.193 1.00 . A A . 2 LYS HZ1 1 1 9 2990 1 1 2 LYS HZ2 H -5.578 1.947 6.708 1.00 . A A . 2 LYS HZ2 1 1 9 2991 1 1 2 LYS HZ3 H -6.918 1.031 6.206 1.00 . A A . 2 LYS HZ3 1 1 9 2992 1 1 2 LYS N N -5.001 5.463 2.237 1.00 . A A . 2 LYS N 1 1 9 2993 1 1 2 LYS NZ N -6.159 1.669 5.892 1.00 . A A . 2 LYS NZ 1 1 9 2994 1 1 2 LYS O O -2.238 5.667 1.342 1.00 . A A . 2 LYS O 1 1 9 2995 1 1 3 GLY C C 0.258 7.067 2.019 1.00 . A A . 3 GLY C 1 1 9 2996 1 1 3 GLY CA C -0.949 8.019 2.083 1.00 . A A . 3 GLY CA 1 1 9 2997 1 1 3 GLY H H -2.500 7.786 3.572 1.00 . A A . 3 GLY H 1 1 9 2998 1 1 3 GLY HA2 H -1.236 8.295 1.080 1.00 . A A . 3 GLY HA2 1 1 9 2999 1 1 3 GLY HA3 H -0.668 8.906 2.632 1.00 . A A . 3 GLY HA3 1 1 9 3000 1 1 3 GLY N N -2.117 7.370 2.772 1.00 . A A . 3 GLY N 1 1 9 3001 1 1 3 GLY O O 0.194 5.975 2.545 1.00 . A A . 3 GLY O 1 1 9 3002 1 1 4 LYS C C 3.050 6.216 2.698 1.00 . A A . 4 LYS C 1 1 9 3003 1 1 4 LYS CA C 2.523 6.593 1.298 1.00 . A A . 4 LYS CA 1 1 9 3004 1 1 4 LYS CB C 3.570 7.352 0.410 1.00 . A A . 4 LYS CB 1 1 9 3005 1 1 4 LYS CD C 5.168 8.495 2.079 1.00 . A A . 4 LYS CD 1 1 9 3006 1 1 4 LYS CE C 5.696 9.865 2.529 1.00 . A A . 4 LYS CE 1 1 9 3007 1 1 4 LYS CG C 4.128 8.699 0.953 1.00 . A A . 4 LYS CG 1 1 9 3008 1 1 4 LYS H H 1.362 8.371 0.976 1.00 . A A . 4 LYS H 1 1 9 3009 1 1 4 LYS HA H 2.236 5.695 0.775 1.00 . A A . 4 LYS HA 1 1 9 3010 1 1 4 LYS HB2 H 4.397 6.684 0.242 1.00 . A A . 4 LYS HB2 1 1 9 3011 1 1 4 LYS HB3 H 3.116 7.542 -0.551 1.00 . A A . 4 LYS HB3 1 1 9 3012 1 1 4 LYS HD2 H 4.761 7.995 2.935 1.00 . A A . 4 LYS HD2 1 1 9 3013 1 1 4 LYS HD3 H 5.983 7.897 1.697 1.00 . A A . 4 LYS HD3 1 1 9 3014 1 1 4 LYS HE2 H 6.176 10.374 1.706 1.00 . A A . 4 LYS HE2 1 1 9 3015 1 1 4 LYS HE3 H 4.889 10.479 2.901 1.00 . A A . 4 LYS HE3 1 1 9 3016 1 1 4 LYS HG2 H 4.587 9.237 0.138 1.00 . A A . 4 LYS HG2 1 1 9 3017 1 1 4 LYS HG3 H 3.307 9.294 1.329 1.00 . A A . 4 LYS HG3 1 1 9 3018 1 1 4 LYS HZ1 H 7.278 8.847 3.423 1.00 . A A . 4 LYS HZ1 1 1 9 3019 1 1 4 LYS HZ2 H 7.307 10.526 3.671 1.00 . A A . 4 LYS HZ2 1 1 9 3020 1 1 4 LYS HZ3 H 6.201 9.561 4.525 1.00 . A A . 4 LYS HZ3 1 1 9 3021 1 1 4 LYS N N 1.330 7.484 1.389 1.00 . A A . 4 LYS N 1 1 9 3022 1 1 4 LYS NZ N 6.697 9.687 3.619 1.00 . A A . 4 LYS NZ 1 1 9 3023 1 1 4 LYS O O 2.955 6.986 3.635 1.00 . A A . 4 LYS O 1 1 9 3024 1 1 5 GLY C C 3.082 4.350 5.183 1.00 . A A . 5 GLY C 1 1 9 3025 1 1 5 GLY CA C 4.130 4.475 4.066 1.00 . A A . 5 GLY CA 1 1 9 3026 1 1 5 GLY H H 3.582 4.453 1.989 1.00 . A A . 5 GLY H 1 1 9 3027 1 1 5 GLY HA2 H 4.544 3.498 3.868 1.00 . A A . 5 GLY HA2 1 1 9 3028 1 1 5 GLY HA3 H 4.922 5.123 4.408 1.00 . A A . 5 GLY HA3 1 1 9 3029 1 1 5 GLY N N 3.568 5.016 2.787 1.00 . A A . 5 GLY N 1 1 9 3030 1 1 5 GLY O O 3.432 4.062 6.311 1.00 . A A . 5 GLY O 1 1 9 3031 1 1 6 ALA C C 0.065 3.075 5.847 1.00 . A A . 6 ALA C 1 1 9 3032 1 1 6 ALA CA C 0.730 4.473 5.856 1.00 . A A . 6 ALA CA 1 1 9 3033 1 1 6 ALA CB C -0.302 5.562 5.534 1.00 . A A . 6 ALA CB 1 1 9 3034 1 1 6 ALA H H 1.631 4.789 3.907 1.00 . A A . 6 ALA H 1 1 9 3035 1 1 6 ALA HA H 1.142 4.664 6.835 1.00 . A A . 6 ALA HA 1 1 9 3036 1 1 6 ALA HB1 H 0.168 6.533 5.575 1.00 . A A . 6 ALA HB1 1 1 9 3037 1 1 6 ALA HB2 H -0.700 5.413 4.547 1.00 . A A . 6 ALA HB2 1 1 9 3038 1 1 6 ALA HB3 H -1.119 5.546 6.237 1.00 . A A . 6 ALA HB3 1 1 9 3039 1 1 6 ALA N N 1.834 4.567 4.842 1.00 . A A . 6 ALA N 1 1 9 3040 1 1 6 ALA O O 0.088 2.410 4.831 1.00 . A A . 6 ALA O 1 1 9 3041 1 1 7 PRO C C -2.209 0.916 6.237 1.00 . A A . 7 PRO C 1 1 9 3042 1 1 7 PRO CA C -1.022 1.274 7.160 1.00 . A A . 7 PRO CA 1 1 9 3043 1 1 7 PRO CB C -1.390 1.184 8.649 1.00 . A A . 7 PRO CB 1 1 9 3044 1 1 7 PRO CD C -0.722 3.518 8.177 1.00 . A A . 7 PRO CD 1 1 9 3045 1 1 7 PRO CG C -1.463 2.620 9.176 1.00 . A A . 7 PRO CG 1 1 9 3046 1 1 7 PRO HA H -0.211 0.591 6.969 1.00 . A A . 7 PRO HA 1 1 9 3047 1 1 7 PRO HB2 H -2.335 0.680 8.796 1.00 . A A . 7 PRO HB2 1 1 9 3048 1 1 7 PRO HB3 H -0.625 0.639 9.183 1.00 . A A . 7 PRO HB3 1 1 9 3049 1 1 7 PRO HD2 H -1.318 4.380 7.922 1.00 . A A . 7 PRO HD2 1 1 9 3050 1 1 7 PRO HD3 H 0.233 3.827 8.579 1.00 . A A . 7 PRO HD3 1 1 9 3051 1 1 7 PRO HG2 H -2.495 2.931 9.255 1.00 . A A . 7 PRO HG2 1 1 9 3052 1 1 7 PRO HG3 H -1.001 2.684 10.151 1.00 . A A . 7 PRO HG3 1 1 9 3053 1 1 7 PRO N N -0.508 2.665 6.966 1.00 . A A . 7 PRO N 1 1 9 3054 1 1 7 PRO O O -3.361 1.081 6.588 1.00 . A A . 7 PRO O 1 1 9 3055 1 1 8 CYS C C -3.135 -1.489 4.056 1.00 . A A . 8 CYS C 1 1 9 3056 1 1 8 CYS CA C -2.855 0.016 4.029 1.00 . A A . 8 CYS CA 1 1 9 3057 1 1 8 CYS CB C -2.297 0.414 2.673 1.00 . A A . 8 CYS CB 1 1 9 3058 1 1 8 CYS H H -0.905 0.334 4.873 1.00 . A A . 8 CYS H 1 1 9 3059 1 1 8 CYS HA H -3.785 0.540 4.197 1.00 . A A . 8 CYS HA 1 1 9 3060 1 1 8 CYS HB2 H -2.892 -0.021 1.888 1.00 . A A . 8 CYS HB2 1 1 9 3061 1 1 8 CYS HB3 H -2.400 1.467 2.524 1.00 . A A . 8 CYS HB3 1 1 9 3062 1 1 8 CYS N N -1.859 0.430 5.073 1.00 . A A . 8 CYS N 1 1 9 3063 1 1 8 CYS O O -2.835 -2.173 5.014 1.00 . A A . 8 CYS O 1 1 9 3064 1 1 8 CYS SG S -0.600 -0.133 2.372 1.00 . A A . 8 CYS SG 1 1 9 3065 1 1 9 ARG C C -3.647 -3.729 1.335 1.00 . A A . 9 ARG C 1 1 9 3066 1 1 9 ARG CA C -4.076 -3.350 2.770 1.00 . A A . 9 ARG CA 1 1 9 3067 1 1 9 ARG CB C -5.578 -3.441 2.961 1.00 . A A . 9 ARG CB 1 1 9 3068 1 1 9 ARG CD C -7.608 -4.906 3.030 1.00 . A A . 9 ARG CD 1 1 9 3069 1 1 9 ARG CG C -6.060 -4.892 3.004 1.00 . A A . 9 ARG CG 1 1 9 3070 1 1 9 ARG CZ C -8.402 -2.808 4.053 1.00 . A A . 9 ARG CZ 1 1 9 3071 1 1 9 ARG H H -3.921 -1.316 2.244 1.00 . A A . 9 ARG H 1 1 9 3072 1 1 9 ARG HA H -3.546 -3.971 3.480 1.00 . A A . 9 ARG HA 1 1 9 3073 1 1 9 ARG HB2 H -5.826 -2.951 3.891 1.00 . A A . 9 ARG HB2 1 1 9 3074 1 1 9 ARG HB3 H -6.067 -2.920 2.154 1.00 . A A . 9 ARG HB3 1 1 9 3075 1 1 9 ARG HD2 H -8.012 -4.523 2.105 1.00 . A A . 9 ARG HD2 1 1 9 3076 1 1 9 ARG HD3 H -7.960 -5.917 3.166 1.00 . A A . 9 ARG HD3 1 1 9 3077 1 1 9 ARG HE H -8.171 -4.495 5.069 1.00 . A A . 9 ARG HE 1 1 9 3078 1 1 9 ARG HG2 H -5.681 -5.425 2.150 1.00 . A A . 9 ARG HG2 1 1 9 3079 1 1 9 ARG HG3 H -5.682 -5.365 3.898 1.00 . A A . 9 ARG HG3 1 1 9 3080 1 1 9 ARG HH11 H -8.007 -2.707 2.085 1.00 . A A . 9 ARG HH11 1 1 9 3081 1 1 9 ARG HH12 H -8.551 -1.239 2.817 1.00 . A A . 9 ARG HH12 1 1 9 3082 1 1 9 ARG HH21 H -8.859 -2.629 5.991 1.00 . A A . 9 ARG HH21 1 1 9 3083 1 1 9 ARG HH22 H -9.037 -1.191 5.041 1.00 . A A . 9 ARG HH22 1 1 9 3084 1 1 9 ARG N N -3.711 -1.933 2.967 1.00 . A A . 9 ARG N 1 1 9 3085 1 1 9 ARG NE N -8.090 -4.079 4.187 1.00 . A A . 9 ARG NE 1 1 9 3086 1 1 9 ARG NH1 N -8.313 -2.207 2.895 1.00 . A A . 9 ARG NH1 1 1 9 3087 1 1 9 ARG NH2 N -8.797 -2.159 5.111 1.00 . A A . 9 ARG NH2 1 1 9 3088 1 1 9 ARG O O -4.276 -3.348 0.358 1.00 . A A . 9 ARG O 1 1 9 3089 1 1 10 LYS C C -3.030 -5.471 -0.935 1.00 . A A . 10 LYS C 1 1 9 3090 1 1 10 LYS CA C -1.945 -4.984 0.035 1.00 . A A . 10 LYS CA 1 1 9 3091 1 1 10 LYS CB C -0.984 -6.117 0.459 1.00 . A A . 10 LYS CB 1 1 9 3092 1 1 10 LYS CD C 0.152 -6.245 -1.856 1.00 . A A . 10 LYS CD 1 1 9 3093 1 1 10 LYS CE C 1.507 -5.725 -1.372 1.00 . A A . 10 LYS CE 1 1 9 3094 1 1 10 LYS CG C -0.559 -6.994 -0.730 1.00 . A A . 10 LYS CG 1 1 9 3095 1 1 10 LYS H H -2.137 -4.703 2.151 1.00 . A A . 10 LYS H 1 1 9 3096 1 1 10 LYS HA H -1.389 -4.184 -0.429 1.00 . A A . 10 LYS HA 1 1 9 3097 1 1 10 LYS HB2 H -0.111 -5.686 0.926 1.00 . A A . 10 LYS HB2 1 1 9 3098 1 1 10 LYS HB3 H -1.476 -6.743 1.190 1.00 . A A . 10 LYS HB3 1 1 9 3099 1 1 10 LYS HD2 H 0.252 -6.933 -2.677 1.00 . A A . 10 LYS HD2 1 1 9 3100 1 1 10 LYS HD3 H -0.452 -5.414 -2.187 1.00 . A A . 10 LYS HD3 1 1 9 3101 1 1 10 LYS HE2 H 1.353 -4.972 -0.614 1.00 . A A . 10 LYS HE2 1 1 9 3102 1 1 10 LYS HE3 H 2.098 -6.529 -0.963 1.00 . A A . 10 LYS HE3 1 1 9 3103 1 1 10 LYS HG2 H 0.111 -7.751 -0.353 1.00 . A A . 10 LYS HG2 1 1 9 3104 1 1 10 LYS HG3 H -1.427 -7.489 -1.135 1.00 . A A . 10 LYS HG3 1 1 9 3105 1 1 10 LYS HZ1 H 1.618 -4.490 -3.042 1.00 . A A . 10 LYS HZ1 1 1 9 3106 1 1 10 LYS HZ2 H 3.043 -4.546 -2.124 1.00 . A A . 10 LYS HZ2 1 1 9 3107 1 1 10 LYS HZ3 H 2.624 -5.855 -3.122 1.00 . A A . 10 LYS HZ3 1 1 9 3108 1 1 10 LYS N N -2.565 -4.472 1.300 1.00 . A A . 10 LYS N 1 1 9 3109 1 1 10 LYS NZ N 2.255 -5.108 -2.501 1.00 . A A . 10 LYS NZ 1 1 9 3110 1 1 10 LYS O O -3.078 -5.098 -2.091 1.00 . A A . 10 LYS O 1 1 9 3111 1 1 11 THR C C -5.615 -6.236 -2.184 1.00 . A A . 11 THR C 1 1 9 3112 1 1 11 THR CA C -5.019 -6.976 -0.983 1.00 . A A . 11 THR CA 1 1 9 3113 1 1 11 THR CB C -6.111 -7.134 0.085 1.00 . A A . 11 THR CB 1 1 9 3114 1 1 11 THR CG2 C -7.284 -8.014 -0.403 1.00 . A A . 11 THR CG2 1 1 9 3115 1 1 11 THR H H -3.640 -6.512 0.584 1.00 . A A . 11 THR H 1 1 9 3116 1 1 11 THR HA H -4.701 -7.955 -1.314 1.00 . A A . 11 THR HA 1 1 9 3117 1 1 11 THR HB H -6.434 -6.168 0.461 1.00 . A A . 11 THR HB 1 1 9 3118 1 1 11 THR HG1 H -5.151 -8.700 0.730 1.00 . A A . 11 THR HG1 1 1 9 3119 1 1 11 THR HG21 H -6.931 -9.003 -0.659 1.00 . A A . 11 THR HG21 1 1 9 3120 1 1 11 THR HG22 H -8.027 -8.102 0.376 1.00 . A A . 11 THR HG22 1 1 9 3121 1 1 11 THR HG23 H -7.748 -7.574 -1.273 1.00 . A A . 11 THR HG23 1 1 9 3122 1 1 11 THR N N -3.841 -6.308 -0.349 1.00 . A A . 11 THR N 1 1 9 3123 1 1 11 THR O O -5.851 -6.830 -3.218 1.00 . A A . 11 THR O 1 1 9 3124 1 1 11 THR OG1 O -5.509 -7.899 1.120 1.00 . A A . 11 THR OG1 1 1 9 3125 1 1 12 MET C C -5.774 -2.756 -3.201 1.00 . A A . 12 MET C 1 1 9 3126 1 1 12 MET CA C -6.429 -4.128 -3.093 1.00 . A A . 12 MET CA 1 1 9 3127 1 1 12 MET CB C -7.938 -3.988 -2.805 1.00 . A A . 12 MET CB 1 1 9 3128 1 1 12 MET CE C -10.179 -4.715 -0.238 1.00 . A A . 12 MET CE 1 1 9 3129 1 1 12 MET CG C -8.179 -3.294 -1.442 1.00 . A A . 12 MET CG 1 1 9 3130 1 1 12 MET H H -5.614 -4.543 -1.135 1.00 . A A . 12 MET H 1 1 9 3131 1 1 12 MET HA H -6.294 -4.631 -4.039 1.00 . A A . 12 MET HA 1 1 9 3132 1 1 12 MET HB2 H -8.424 -3.436 -3.595 1.00 . A A . 12 MET HB2 1 1 9 3133 1 1 12 MET HB3 H -8.367 -4.974 -2.758 1.00 . A A . 12 MET HB3 1 1 9 3134 1 1 12 MET HE1 H -9.433 -4.931 0.511 1.00 . A A . 12 MET HE1 1 1 9 3135 1 1 12 MET HE2 H -11.150 -4.730 0.234 1.00 . A A . 12 MET HE2 1 1 9 3136 1 1 12 MET HE3 H -10.159 -5.455 -1.024 1.00 . A A . 12 MET HE3 1 1 9 3137 1 1 12 MET HG2 H -7.678 -3.855 -0.667 1.00 . A A . 12 MET HG2 1 1 9 3138 1 1 12 MET HG3 H -7.727 -2.312 -1.469 1.00 . A A . 12 MET HG3 1 1 9 3139 1 1 12 MET N N -5.837 -4.958 -1.996 1.00 . A A . 12 MET N 1 1 9 3140 1 1 12 MET O O -6.337 -1.860 -3.802 1.00 . A A . 12 MET O 1 1 9 3141 1 1 12 MET SD S -9.901 -3.065 -0.933 1.00 . A A . 12 MET SD 1 1 9 3142 1 1 13 TYR C C -4.790 -0.296 -2.063 1.00 . A A . 13 TYR C 1 1 9 3143 1 1 13 TYR CA C -3.846 -1.358 -2.635 1.00 . A A . 13 TYR CA 1 1 9 3144 1 1 13 TYR CB C -3.432 -1.033 -4.089 1.00 . A A . 13 TYR CB 1 1 9 3145 1 1 13 TYR CD1 C -1.474 -2.665 -4.004 1.00 . A A . 13 TYR CD1 1 1 9 3146 1 1 13 TYR CD2 C -2.899 -2.710 -5.907 1.00 . A A . 13 TYR CD2 1 1 9 3147 1 1 13 TYR CE1 C -0.717 -3.679 -4.545 1.00 . A A . 13 TYR CE1 1 1 9 3148 1 1 13 TYR CE2 C -2.140 -3.726 -6.449 1.00 . A A . 13 TYR CE2 1 1 9 3149 1 1 13 TYR CG C -2.574 -2.167 -4.677 1.00 . A A . 13 TYR CG 1 1 9 3150 1 1 13 TYR CZ C -1.044 -4.218 -5.771 1.00 . A A . 13 TYR CZ 1 1 9 3151 1 1 13 TYR H H -4.219 -3.410 -2.165 1.00 . A A . 13 TYR H 1 1 9 3152 1 1 13 TYR HA H -2.987 -1.450 -1.992 1.00 . A A . 13 TYR HA 1 1 9 3153 1 1 13 TYR HB2 H -4.316 -0.917 -4.694 1.00 . A A . 13 TYR HB2 1 1 9 3154 1 1 13 TYR HB3 H -2.863 -0.117 -4.112 1.00 . A A . 13 TYR HB3 1 1 9 3155 1 1 13 TYR HD1 H -1.200 -2.260 -3.043 1.00 . A A . 13 TYR HD1 1 1 9 3156 1 1 13 TYR HD2 H -3.755 -2.337 -6.451 1.00 . A A . 13 TYR HD2 1 1 9 3157 1 1 13 TYR HE1 H 0.138 -4.055 -4.007 1.00 . A A . 13 TYR HE1 1 1 9 3158 1 1 13 TYR HE2 H -2.407 -4.139 -7.410 1.00 . A A . 13 TYR HE2 1 1 9 3159 1 1 13 TYR HH H -0.248 -5.948 -5.669 1.00 . A A . 13 TYR HH 1 1 9 3160 1 1 13 TYR N N -4.606 -2.639 -2.621 1.00 . A A . 13 TYR N 1 1 9 3161 1 1 13 TYR O O -5.340 0.535 -2.763 1.00 . A A . 13 TYR O 1 1 9 3162 1 1 13 TYR OH O -0.284 -5.234 -6.311 1.00 . A A . 13 TYR OH 1 1 9 3163 1 1 14 ASP C C -5.134 1.929 0.194 1.00 . A A . 14 ASP C 1 1 9 3164 1 1 14 ASP CA C -5.818 0.560 -0.009 1.00 . A A . 14 ASP CA 1 1 9 3165 1 1 14 ASP CB C -6.135 -0.154 1.321 1.00 . A A . 14 ASP CB 1 1 9 3166 1 1 14 ASP CG C -7.075 0.609 2.277 1.00 . A A . 14 ASP CG 1 1 9 3167 1 1 14 ASP H H -4.446 -1.085 -0.288 1.00 . A A . 14 ASP H 1 1 9 3168 1 1 14 ASP HA H -6.731 0.707 -0.570 1.00 . A A . 14 ASP HA 1 1 9 3169 1 1 14 ASP HB2 H -6.579 -1.100 1.097 1.00 . A A . 14 ASP HB2 1 1 9 3170 1 1 14 ASP HB3 H -5.215 -0.368 1.831 1.00 . A A . 14 ASP HB3 1 1 9 3171 1 1 14 ASP N N -4.932 -0.382 -0.767 1.00 . A A . 14 ASP N 1 1 9 3172 1 1 14 ASP O O -5.530 2.722 1.025 1.00 . A A . 14 ASP O 1 1 9 3173 1 1 14 ASP OD1 O -7.890 1.383 1.801 1.00 . A A . 14 ASP OD1 1 1 9 3174 1 1 14 ASP OD2 O -6.914 0.356 3.459 1.00 . A A . 14 ASP OD2 1 1 9 3175 1 1 15 CYS C C -3.755 4.433 -1.614 1.00 . A A . 15 CYS C 1 1 9 3176 1 1 15 CYS CA C -3.334 3.425 -0.547 1.00 . A A . 15 CYS CA 1 1 9 3177 1 1 15 CYS CB C -1.874 3.106 -0.749 1.00 . A A . 15 CYS CB 1 1 9 3178 1 1 15 CYS H H -3.864 1.455 -1.238 1.00 . A A . 15 CYS H 1 1 9 3179 1 1 15 CYS HA H -3.460 3.877 0.423 1.00 . A A . 15 CYS HA 1 1 9 3180 1 1 15 CYS HB2 H -1.742 2.689 -1.738 1.00 . A A . 15 CYS HB2 1 1 9 3181 1 1 15 CYS HB3 H -1.298 4.018 -0.697 1.00 . A A . 15 CYS HB3 1 1 9 3182 1 1 15 CYS N N -4.118 2.151 -0.599 1.00 . A A . 15 CYS N 1 1 9 3183 1 1 15 CYS O O -4.314 4.073 -2.632 1.00 . A A . 15 CYS O 1 1 9 3184 1 1 15 CYS SG S -1.175 1.943 0.436 1.00 . A A . 15 CYS SG 1 1 9 3185 1 1 16 CYS C C -2.826 6.623 -3.446 1.00 . A A . 16 CYS C 1 1 9 3186 1 1 16 CYS CA C -3.791 6.788 -2.261 1.00 . A A . 16 CYS CA 1 1 9 3187 1 1 16 CYS CB C -3.559 8.109 -1.538 1.00 . A A . 16 CYS CB 1 1 9 3188 1 1 16 CYS H H -3.015 5.902 -0.488 1.00 . A A . 16 CYS H 1 1 9 3189 1 1 16 CYS HA H -4.811 6.692 -2.603 1.00 . A A . 16 CYS HA 1 1 9 3190 1 1 16 CYS HB2 H -2.507 8.195 -1.306 1.00 . A A . 16 CYS HB2 1 1 9 3191 1 1 16 CYS HB3 H -3.811 8.907 -2.212 1.00 . A A . 16 CYS HB3 1 1 9 3192 1 1 16 CYS N N -3.461 5.678 -1.328 1.00 . A A . 16 CYS N 1 1 9 3193 1 1 16 CYS O O -3.150 6.927 -4.577 1.00 . A A . 16 CYS O 1 1 9 3194 1 1 16 CYS SG S -4.473 8.378 0.000 1.00 . A A . 16 CYS SG 1 1 9 3195 1 1 17 SER C C -1.002 4.673 -4.958 1.00 . A A . 17 SER C 1 1 9 3196 1 1 17 SER CA C -0.578 5.882 -4.105 1.00 . A A . 17 SER CA 1 1 9 3197 1 1 17 SER CB C 0.723 5.581 -3.348 1.00 . A A . 17 SER CB 1 1 9 3198 1 1 17 SER H H -1.486 5.918 -2.166 1.00 . A A . 17 SER H 1 1 9 3199 1 1 17 SER HA H -0.468 6.751 -4.739 1.00 . A A . 17 SER HA 1 1 9 3200 1 1 17 SER HB2 H 1.009 6.409 -2.716 1.00 . A A . 17 SER HB2 1 1 9 3201 1 1 17 SER HB3 H 0.640 4.680 -2.759 1.00 . A A . 17 SER HB3 1 1 9 3202 1 1 17 SER HG H 1.492 4.572 -4.823 1.00 . A A . 17 SER HG 1 1 9 3203 1 1 17 SER N N -1.657 6.131 -3.107 1.00 . A A . 17 SER N 1 1 9 3204 1 1 17 SER O O -0.562 4.516 -6.081 1.00 . A A . 17 SER O 1 1 9 3205 1 1 17 SER OG O 1.697 5.390 -4.365 1.00 . A A . 17 SER OG 1 1 9 3206 1 1 18 GLY C C -1.271 1.588 -5.263 1.00 . A A . 18 GLY C 1 1 9 3207 1 1 18 GLY CA C -2.360 2.641 -5.071 1.00 . A A . 18 GLY CA 1 1 9 3208 1 1 18 GLY H H -2.160 4.050 -3.467 1.00 . A A . 18 GLY H 1 1 9 3209 1 1 18 GLY HA2 H -3.161 2.216 -4.486 1.00 . A A . 18 GLY HA2 1 1 9 3210 1 1 18 GLY HA3 H -2.727 2.931 -6.038 1.00 . A A . 18 GLY HA3 1 1 9 3211 1 1 18 GLY N N -1.851 3.858 -4.377 1.00 . A A . 18 GLY N 1 1 9 3212 1 1 18 GLY O O -1.322 0.805 -6.192 1.00 . A A . 18 GLY O 1 1 9 3213 1 1 19 SER C C 1.164 0.222 -2.991 1.00 . A A . 19 SER C 1 1 9 3214 1 1 19 SER CA C 0.812 0.644 -4.421 1.00 . A A . 19 SER CA 1 1 9 3215 1 1 19 SER CB C 1.999 1.349 -5.130 1.00 . A A . 19 SER CB 1 1 9 3216 1 1 19 SER H H -0.352 2.273 -3.647 1.00 . A A . 19 SER H 1 1 9 3217 1 1 19 SER HA H 0.517 -0.236 -4.973 1.00 . A A . 19 SER HA 1 1 9 3218 1 1 19 SER HB2 H 2.878 0.721 -5.153 1.00 . A A . 19 SER HB2 1 1 9 3219 1 1 19 SER HB3 H 1.734 1.648 -6.134 1.00 . A A . 19 SER HB3 1 1 9 3220 1 1 19 SER HG H 1.478 3.056 -4.353 1.00 . A A . 19 SER HG 1 1 9 3221 1 1 19 SER N N -0.321 1.609 -4.367 1.00 . A A . 19 SER N 1 1 9 3222 1 1 19 SER O O 2.277 0.405 -2.531 1.00 . A A . 19 SER O 1 1 9 3223 1 1 19 SER OG O 2.265 2.505 -4.348 1.00 . A A . 19 SER OG 1 1 9 3224 1 1 20 CYS C C 1.475 -1.897 -0.880 1.00 . A A . 20 CYS C 1 1 9 3225 1 1 20 CYS CA C 0.414 -0.793 -0.921 1.00 . A A . 20 CYS CA 1 1 9 3226 1 1 20 CYS CB C -0.905 -1.306 -0.321 1.00 . A A . 20 CYS CB 1 1 9 3227 1 1 20 CYS H H -0.693 -0.460 -2.743 1.00 . A A . 20 CYS H 1 1 9 3228 1 1 20 CYS HA H 0.762 0.046 -0.347 1.00 . A A . 20 CYS HA 1 1 9 3229 1 1 20 CYS HB2 H -1.627 -0.505 -0.359 1.00 . A A . 20 CYS HB2 1 1 9 3230 1 1 20 CYS HB3 H -1.299 -2.111 -0.907 1.00 . A A . 20 CYS HB3 1 1 9 3231 1 1 20 CYS N N 0.184 -0.340 -2.323 1.00 . A A . 20 CYS N 1 1 9 3232 1 1 20 CYS O O 1.634 -2.653 -1.817 1.00 . A A . 20 CYS O 1 1 9 3233 1 1 20 CYS SG S -0.823 -1.881 1.390 1.00 . A A . 20 CYS SG 1 1 9 3234 1 1 21 GLY C C 2.816 -4.143 1.292 1.00 . A A . 21 GLY C 1 1 9 3235 1 1 21 GLY CA C 3.253 -2.901 0.511 1.00 . A A . 21 GLY CA 1 1 9 3236 1 1 21 GLY H H 1.916 -1.261 0.905 1.00 . A A . 21 GLY H 1 1 9 3237 1 1 21 GLY HA2 H 3.687 -3.213 -0.428 1.00 . A A . 21 GLY HA2 1 1 9 3238 1 1 21 GLY HA3 H 4.017 -2.396 1.084 1.00 . A A . 21 GLY HA3 1 1 9 3239 1 1 21 GLY N N 2.156 -1.922 0.232 1.00 . A A . 21 GLY N 1 1 9 3240 1 1 21 GLY O O 1.906 -4.110 2.098 1.00 . A A . 21 GLY O 1 1 9 3241 1 1 22 ARG C C 3.591 -6.566 3.130 1.00 . A A . 22 ARG C 1 1 9 3242 1 1 22 ARG CA C 3.295 -6.541 1.630 1.00 . A A . 22 ARG CA 1 1 9 3243 1 1 22 ARG CB C 4.169 -7.589 0.857 1.00 . A A . 22 ARG CB 1 1 9 3244 1 1 22 ARG CD C 6.432 -7.218 2.099 1.00 . A A . 22 ARG CD 1 1 9 3245 1 1 22 ARG CG C 5.692 -7.254 0.745 1.00 . A A . 22 ARG CG 1 1 9 3246 1 1 22 ARG CZ C 8.714 -7.907 1.495 1.00 . A A . 22 ARG CZ 1 1 9 3247 1 1 22 ARG H H 4.248 -5.090 0.352 1.00 . A A . 22 ARG H 1 1 9 3248 1 1 22 ARG HA H 2.254 -6.795 1.493 1.00 . A A . 22 ARG HA 1 1 9 3249 1 1 22 ARG HB2 H 4.063 -8.550 1.340 1.00 . A A . 22 ARG HB2 1 1 9 3250 1 1 22 ARG HB3 H 3.776 -7.687 -0.143 1.00 . A A . 22 ARG HB3 1 1 9 3251 1 1 22 ARG HD2 H 6.078 -6.408 2.709 1.00 . A A . 22 ARG HD2 1 1 9 3252 1 1 22 ARG HD3 H 6.322 -8.147 2.640 1.00 . A A . 22 ARG HD3 1 1 9 3253 1 1 22 ARG HE H 8.217 -6.035 1.910 1.00 . A A . 22 ARG HE 1 1 9 3254 1 1 22 ARG HG2 H 6.156 -7.998 0.114 1.00 . A A . 22 ARG HG2 1 1 9 3255 1 1 22 ARG HG3 H 5.806 -6.294 0.261 1.00 . A A . 22 ARG HG3 1 1 9 3256 1 1 22 ARG HH11 H 7.349 -9.378 1.545 1.00 . A A . 22 ARG HH11 1 1 9 3257 1 1 22 ARG HH12 H 8.957 -9.858 1.122 1.00 . A A . 22 ARG HH12 1 1 9 3258 1 1 22 ARG HH21 H 10.248 -6.628 1.376 1.00 . A A . 22 ARG HH21 1 1 9 3259 1 1 22 ARG HH22 H 10.623 -8.281 1.023 1.00 . A A . 22 ARG HH22 1 1 9 3260 1 1 22 ARG N N 3.530 -5.201 1.002 1.00 . A A . 22 ARG N 1 1 9 3261 1 1 22 ARG NE N 7.880 -6.953 1.831 1.00 . A A . 22 ARG NE 1 1 9 3262 1 1 22 ARG NH1 N 8.306 -9.143 1.379 1.00 . A A . 22 ARG NH1 1 1 9 3263 1 1 22 ARG NH2 N 9.959 -7.580 1.281 1.00 . A A . 22 ARG NH2 1 1 9 3264 1 1 22 ARG O O 3.269 -7.516 3.817 1.00 . A A . 22 ARG O 1 1 9 3265 1 1 23 ARG C C 3.198 -4.910 5.586 1.00 . A A . 23 ARG C 1 1 9 3266 1 1 23 ARG CA C 4.562 -5.346 5.017 1.00 . A A . 23 ARG CA 1 1 9 3267 1 1 23 ARG CB C 5.656 -4.248 5.086 1.00 . A A . 23 ARG CB 1 1 9 3268 1 1 23 ARG CD C 5.507 -3.644 7.649 1.00 . A A . 23 ARG CD 1 1 9 3269 1 1 23 ARG CG C 6.393 -4.038 6.450 1.00 . A A . 23 ARG CG 1 1 9 3270 1 1 23 ARG CZ C 3.893 -4.745 9.120 1.00 . A A . 23 ARG CZ 1 1 9 3271 1 1 23 ARG H H 4.428 -4.782 2.955 1.00 . A A . 23 ARG H 1 1 9 3272 1 1 23 ARG HA H 4.871 -6.293 5.437 1.00 . A A . 23 ARG HA 1 1 9 3273 1 1 23 ARG HB2 H 6.407 -4.485 4.346 1.00 . A A . 23 ARG HB2 1 1 9 3274 1 1 23 ARG HB3 H 5.213 -3.306 4.798 1.00 . A A . 23 ARG HB3 1 1 9 3275 1 1 23 ARG HD2 H 6.126 -3.330 8.479 1.00 . A A . 23 ARG HD2 1 1 9 3276 1 1 23 ARG HD3 H 4.846 -2.836 7.376 1.00 . A A . 23 ARG HD3 1 1 9 3277 1 1 23 ARG HE H 4.738 -5.650 7.569 1.00 . A A . 23 ARG HE 1 1 9 3278 1 1 23 ARG HG2 H 6.916 -4.950 6.698 1.00 . A A . 23 ARG HG2 1 1 9 3279 1 1 23 ARG HG3 H 7.135 -3.264 6.315 1.00 . A A . 23 ARG HG3 1 1 9 3280 1 1 23 ARG HH11 H 4.336 -2.839 9.558 1.00 . A A . 23 ARG HH11 1 1 9 3281 1 1 23 ARG HH12 H 3.193 -3.604 10.609 1.00 . A A . 23 ARG HH12 1 1 9 3282 1 1 23 ARG HH21 H 3.292 -6.638 8.886 1.00 . A A . 23 ARG HH21 1 1 9 3283 1 1 23 ARG HH22 H 2.591 -5.790 10.225 1.00 . A A . 23 ARG HH22 1 1 9 3284 1 1 23 ARG N N 4.200 -5.501 3.579 1.00 . A A . 23 ARG N 1 1 9 3285 1 1 23 ARG NE N 4.684 -4.813 8.077 1.00 . A A . 23 ARG NE 1 1 9 3286 1 1 23 ARG NH1 N 3.801 -3.643 9.816 1.00 . A A . 23 ARG NH1 1 1 9 3287 1 1 23 ARG NH2 N 3.205 -5.807 9.436 1.00 . A A . 23 ARG NH2 1 1 9 3288 1 1 23 ARG O O 2.717 -5.426 6.575 1.00 . A A . 23 ARG O 1 1 9 3289 1 1 24 GLY C C 1.378 -1.868 5.217 1.00 . A A . 24 GLY C 1 1 9 3290 1 1 24 GLY CA C 1.297 -3.394 5.264 1.00 . A A . 24 GLY CA 1 1 9 3291 1 1 24 GLY H H 3.065 -3.619 4.085 1.00 . A A . 24 GLY H 1 1 9 3292 1 1 24 GLY HA2 H 0.552 -3.732 4.559 1.00 . A A . 24 GLY HA2 1 1 9 3293 1 1 24 GLY HA3 H 1.023 -3.705 6.261 1.00 . A A . 24 GLY HA3 1 1 9 3294 1 1 24 GLY N N 2.619 -3.964 4.888 1.00 . A A . 24 GLY N 1 1 9 3295 1 1 24 GLY O O 0.496 -1.208 5.727 1.00 . A A . 24 GLY O 1 1 9 3296 1 1 25 LYS C C 2.535 0.494 3.041 1.00 . A A . 25 LYS C 1 1 9 3297 1 1 25 LYS CA C 2.595 0.135 4.511 1.00 . A A . 25 LYS CA 1 1 9 3298 1 1 25 LYS CB C 3.952 0.580 5.055 1.00 . A A . 25 LYS CB 1 1 9 3299 1 1 25 LYS CD C 3.094 0.746 7.440 1.00 . A A . 25 LYS CD 1 1 9 3300 1 1 25 LYS CE C 3.271 0.212 8.867 1.00 . A A . 25 LYS CE 1 1 9 3301 1 1 25 LYS CG C 4.148 0.097 6.511 1.00 . A A . 25 LYS CG 1 1 9 3302 1 1 25 LYS H H 3.095 -1.955 4.203 1.00 . A A . 25 LYS H 1 1 9 3303 1 1 25 LYS HA H 1.790 0.639 5.022 1.00 . A A . 25 LYS HA 1 1 9 3304 1 1 25 LYS HB2 H 4.719 0.237 4.387 1.00 . A A . 25 LYS HB2 1 1 9 3305 1 1 25 LYS HB3 H 3.981 1.659 5.053 1.00 . A A . 25 LYS HB3 1 1 9 3306 1 1 25 LYS HD2 H 3.231 1.817 7.447 1.00 . A A . 25 LYS HD2 1 1 9 3307 1 1 25 LYS HD3 H 2.095 0.533 7.096 1.00 . A A . 25 LYS HD3 1 1 9 3308 1 1 25 LYS HE2 H 3.134 -0.859 8.886 1.00 . A A . 25 LYS HE2 1 1 9 3309 1 1 25 LYS HE3 H 4.256 0.450 9.240 1.00 . A A . 25 LYS HE3 1 1 9 3310 1 1 25 LYS HG2 H 4.055 -0.979 6.549 1.00 . A A . 25 LYS HG2 1 1 9 3311 1 1 25 LYS HG3 H 5.140 0.366 6.844 1.00 . A A . 25 LYS HG3 1 1 9 3312 1 1 25 LYS HZ1 H 1.313 0.736 9.336 1.00 . A A . 25 LYS HZ1 1 1 9 3313 1 1 25 LYS HZ2 H 2.274 0.369 10.688 1.00 . A A . 25 LYS HZ2 1 1 9 3314 1 1 25 LYS HZ3 H 2.477 1.848 9.877 1.00 . A A . 25 LYS HZ3 1 1 9 3315 1 1 25 LYS N N 2.424 -1.356 4.607 1.00 . A A . 25 LYS N 1 1 9 3316 1 1 25 LYS NZ N 2.257 0.838 9.760 1.00 . A A . 25 LYS NZ 1 1 9 3317 1 1 25 LYS O O 2.869 -0.304 2.194 1.00 . A A . 25 LYS O 1 1 9 3318 1 1 26 CYS C C 3.289 2.486 0.628 1.00 . A A . 26 CYS C 1 1 9 3319 1 1 26 CYS CA C 2.003 2.189 1.388 1.00 . A A . 26 CYS CA 1 1 9 3320 1 1 26 CYS CB C 1.122 3.422 1.423 1.00 . A A . 26 CYS CB 1 1 9 3321 1 1 26 CYS H H 1.920 2.277 3.557 1.00 . A A . 26 CYS H 1 1 9 3322 1 1 26 CYS HA H 1.471 1.437 0.835 1.00 . A A . 26 CYS HA 1 1 9 3323 1 1 26 CYS HB2 H 1.550 4.121 2.116 1.00 . A A . 26 CYS HB2 1 1 9 3324 1 1 26 CYS HB3 H 1.080 3.879 0.446 1.00 . A A . 26 CYS HB3 1 1 9 3325 1 1 26 CYS N N 2.128 1.703 2.794 1.00 . A A . 26 CYS N 1 1 9 3326 1 1 26 CYS O O 4.370 2.547 1.179 1.00 . A A . 26 CYS O 1 1 9 3327 1 1 26 CYS SG S -0.571 3.116 1.961 1.00 . A A . 26 CYS SG 1 1 9 3328 1 1 27 NH2 HN1 H 2.304 2.613 -1.097 1.00 . A A . 27 NH2 HN1 1 1 9 3329 1 1 27 NH2 HN2 H 3.977 2.842 -1.203 1.00 . A A . 27 NH2 HN2 1 1 9 3330 1 1 27 NH2 N N 3.184 2.663 -0.662 1.00 . A A . 27 NH2 N 1 1 10 3331 1 1 1 CYS C C -6.231 6.304 1.755 1.00 . A A . 1 CYS C 1 1 10 3332 1 1 1 CYS CA C -7.153 5.897 0.606 1.00 . A A . 1 CYS CA 1 1 10 3333 1 1 1 CYS CB C -6.527 6.332 -0.718 1.00 . A A . 1 CYS CB 1 1 10 3334 1 1 1 CYS H1 H -8.369 7.574 0.798 1.00 . A A . 1 CYS H1 1 1 10 3335 1 1 1 CYS H2 H -9.103 6.276 -0.017 1.00 . A A . 1 CYS H2 1 1 10 3336 1 1 1 CYS H3 H -8.911 6.221 1.670 1.00 . A A . 1 CYS H3 1 1 10 3337 1 1 1 CYS HA H -7.265 4.826 0.639 1.00 . A A . 1 CYS HA 1 1 10 3338 1 1 1 CYS HB2 H -5.605 5.787 -0.843 1.00 . A A . 1 CYS HB2 1 1 10 3339 1 1 1 CYS HB3 H -7.186 6.031 -1.519 1.00 . A A . 1 CYS HB3 1 1 10 3340 1 1 1 CYS N N -8.486 6.541 0.777 1.00 . A A . 1 CYS N 1 1 10 3341 1 1 1 CYS O O -6.531 7.216 2.501 1.00 . A A . 1 CYS O 1 1 10 3342 1 1 1 CYS SG S -6.166 8.093 -0.936 1.00 . A A . 1 CYS SG 1 1 10 3343 1 1 2 LYS C C -2.815 6.328 2.271 1.00 . A A . 2 LYS C 1 1 10 3344 1 1 2 LYS CA C -4.130 5.879 2.921 1.00 . A A . 2 LYS CA 1 1 10 3345 1 1 2 LYS CB C -3.912 4.592 3.748 1.00 . A A . 2 LYS CB 1 1 10 3346 1 1 2 LYS CD C -6.023 5.064 5.261 1.00 . A A . 2 LYS CD 1 1 10 3347 1 1 2 LYS CE C -5.253 5.460 6.542 1.00 . A A . 2 LYS CE 1 1 10 3348 1 1 2 LYS CG C -5.253 4.064 4.341 1.00 . A A . 2 LYS CG 1 1 10 3349 1 1 2 LYS H H -4.958 4.886 1.204 1.00 . A A . 2 LYS H 1 1 10 3350 1 1 2 LYS HA H -4.488 6.675 3.556 1.00 . A A . 2 LYS HA 1 1 10 3351 1 1 2 LYS HB2 H -3.504 3.827 3.103 1.00 . A A . 2 LYS HB2 1 1 10 3352 1 1 2 LYS HB3 H -3.198 4.764 4.535 1.00 . A A . 2 LYS HB3 1 1 10 3353 1 1 2 LYS HD2 H -6.263 5.959 4.707 1.00 . A A . 2 LYS HD2 1 1 10 3354 1 1 2 LYS HD3 H -6.955 4.603 5.555 1.00 . A A . 2 LYS HD3 1 1 10 3355 1 1 2 LYS HE2 H -5.879 6.079 7.168 1.00 . A A . 2 LYS HE2 1 1 10 3356 1 1 2 LYS HE3 H -4.981 4.573 7.095 1.00 . A A . 2 LYS HE3 1 1 10 3357 1 1 2 LYS HG2 H -5.908 3.779 3.531 1.00 . A A . 2 LYS HG2 1 1 10 3358 1 1 2 LYS HG3 H -5.039 3.175 4.916 1.00 . A A . 2 LYS HG3 1 1 10 3359 1 1 2 LYS HZ1 H -4.125 6.722 5.328 1.00 . A A . 2 LYS HZ1 1 1 10 3360 1 1 2 LYS HZ2 H -3.822 6.902 6.988 1.00 . A A . 2 LYS HZ2 1 1 10 3361 1 1 2 LYS HZ3 H -3.218 5.551 6.159 1.00 . A A . 2 LYS HZ3 1 1 10 3362 1 1 2 LYS N N -5.130 5.603 1.849 1.00 . A A . 2 LYS N 1 1 10 3363 1 1 2 LYS NZ N -4.011 6.217 6.229 1.00 . A A . 2 LYS NZ 1 1 10 3364 1 1 2 LYS O O -2.275 5.649 1.420 1.00 . A A . 2 LYS O 1 1 10 3365 1 1 3 GLY C C 0.126 7.094 2.222 1.00 . A A . 3 GLY C 1 1 10 3366 1 1 3 GLY CA C -1.070 8.064 2.183 1.00 . A A . 3 GLY CA 1 1 10 3367 1 1 3 GLY H H -2.863 7.943 3.391 1.00 . A A . 3 GLY H 1 1 10 3368 1 1 3 GLY HA2 H -1.229 8.379 1.161 1.00 . A A . 3 GLY HA2 1 1 10 3369 1 1 3 GLY HA3 H -0.828 8.932 2.777 1.00 . A A . 3 GLY HA3 1 1 10 3370 1 1 3 GLY N N -2.348 7.471 2.705 1.00 . A A . 3 GLY N 1 1 10 3371 1 1 3 GLY O O 0.051 6.036 2.817 1.00 . A A . 3 GLY O 1 1 10 3372 1 1 4 LYS C C 2.962 6.335 2.959 1.00 . A A . 4 LYS C 1 1 10 3373 1 1 4 LYS CA C 2.433 6.640 1.543 1.00 . A A . 4 LYS CA 1 1 10 3374 1 1 4 LYS CB C 3.507 7.380 0.714 1.00 . A A . 4 LYS CB 1 1 10 3375 1 1 4 LYS CD C 5.867 7.196 -0.273 1.00 . A A . 4 LYS CD 1 1 10 3376 1 1 4 LYS CE C 6.325 8.530 0.352 1.00 . A A . 4 LYS CE 1 1 10 3377 1 1 4 LYS CG C 4.786 6.504 0.596 1.00 . A A . 4 LYS CG 1 1 10 3378 1 1 4 LYS H H 1.197 8.357 1.128 1.00 . A A . 4 LYS H 1 1 10 3379 1 1 4 LYS HA H 2.189 5.712 1.048 1.00 . A A . 4 LYS HA 1 1 10 3380 1 1 4 LYS HB2 H 3.116 7.588 -0.272 1.00 . A A . 4 LYS HB2 1 1 10 3381 1 1 4 LYS HB3 H 3.735 8.318 1.198 1.00 . A A . 4 LYS HB3 1 1 10 3382 1 1 4 LYS HD2 H 6.719 6.537 -0.365 1.00 . A A . 4 LYS HD2 1 1 10 3383 1 1 4 LYS HD3 H 5.472 7.378 -1.262 1.00 . A A . 4 LYS HD3 1 1 10 3384 1 1 4 LYS HE2 H 5.504 9.227 0.416 1.00 . A A . 4 LYS HE2 1 1 10 3385 1 1 4 LYS HE3 H 6.730 8.366 1.339 1.00 . A A . 4 LYS HE3 1 1 10 3386 1 1 4 LYS HG2 H 5.198 6.315 1.577 1.00 . A A . 4 LYS HG2 1 1 10 3387 1 1 4 LYS HG3 H 4.531 5.555 0.148 1.00 . A A . 4 LYS HG3 1 1 10 3388 1 1 4 LYS HZ1 H 7.193 8.928 -1.500 1.00 . A A . 4 LYS HZ1 1 1 10 3389 1 1 4 LYS HZ2 H 7.387 10.174 -0.362 1.00 . A A . 4 LYS HZ2 1 1 10 3390 1 1 4 LYS HZ3 H 8.311 8.755 -0.232 1.00 . A A . 4 LYS HZ3 1 1 10 3391 1 1 4 LYS N N 1.200 7.491 1.584 1.00 . A A . 4 LYS N 1 1 10 3392 1 1 4 LYS NZ N 7.383 9.143 -0.500 1.00 . A A . 4 LYS NZ 1 1 10 3393 1 1 4 LYS O O 3.014 7.204 3.809 1.00 . A A . 4 LYS O 1 1 10 3394 1 1 5 GLY C C 2.774 4.356 5.493 1.00 . A A . 5 GLY C 1 1 10 3395 1 1 5 GLY CA C 3.874 4.616 4.458 1.00 . A A . 5 GLY CA 1 1 10 3396 1 1 5 GLY H H 3.253 4.461 2.405 1.00 . A A . 5 GLY H 1 1 10 3397 1 1 5 GLY HA2 H 4.410 3.696 4.289 1.00 . A A . 5 GLY HA2 1 1 10 3398 1 1 5 GLY HA3 H 4.562 5.341 4.861 1.00 . A A . 5 GLY HA3 1 1 10 3399 1 1 5 GLY N N 3.334 5.094 3.147 1.00 . A A . 5 GLY N 1 1 10 3400 1 1 5 GLY O O 3.070 3.943 6.598 1.00 . A A . 5 GLY O 1 1 10 3401 1 1 6 ALA C C -0.084 2.919 5.889 1.00 . A A . 6 ALA C 1 1 10 3402 1 1 6 ALA CA C 0.406 4.371 6.057 1.00 . A A . 6 ALA CA 1 1 10 3403 1 1 6 ALA CB C -0.719 5.348 5.722 1.00 . A A . 6 ALA CB 1 1 10 3404 1 1 6 ALA H H 1.368 4.927 4.209 1.00 . A A . 6 ALA H 1 1 10 3405 1 1 6 ALA HA H 0.745 4.534 7.068 1.00 . A A . 6 ALA HA 1 1 10 3406 1 1 6 ALA HB1 H -0.369 6.366 5.813 1.00 . A A . 6 ALA HB1 1 1 10 3407 1 1 6 ALA HB2 H -1.073 5.187 4.716 1.00 . A A . 6 ALA HB2 1 1 10 3408 1 1 6 ALA HB3 H -1.535 5.198 6.409 1.00 . A A . 6 ALA HB3 1 1 10 3409 1 1 6 ALA N N 1.544 4.598 5.115 1.00 . A A . 6 ALA N 1 1 10 3410 1 1 6 ALA O O 0.005 2.384 4.800 1.00 . A A . 6 ALA O 1 1 10 3411 1 1 7 PRO C C -2.029 0.505 5.979 1.00 . A A . 7 PRO C 1 1 10 3412 1 1 7 PRO CA C -0.893 0.856 6.960 1.00 . A A . 7 PRO CA 1 1 10 3413 1 1 7 PRO CB C -1.249 0.523 8.413 1.00 . A A . 7 PRO CB 1 1 10 3414 1 1 7 PRO CD C -0.911 2.978 8.247 1.00 . A A . 7 PRO CD 1 1 10 3415 1 1 7 PRO CG C -1.496 1.860 9.128 1.00 . A A . 7 PRO CG 1 1 10 3416 1 1 7 PRO HA H 0.004 0.328 6.678 1.00 . A A . 7 PRO HA 1 1 10 3417 1 1 7 PRO HB2 H -2.131 -0.098 8.469 1.00 . A A . 7 PRO HB2 1 1 10 3418 1 1 7 PRO HB3 H -0.428 0.002 8.882 1.00 . A A . 7 PRO HB3 1 1 10 3419 1 1 7 PRO HD2 H -1.634 3.764 8.087 1.00 . A A . 7 PRO HD2 1 1 10 3420 1 1 7 PRO HD3 H -0.010 3.380 8.688 1.00 . A A . 7 PRO HD3 1 1 10 3421 1 1 7 PRO HG2 H -2.557 2.013 9.263 1.00 . A A . 7 PRO HG2 1 1 10 3422 1 1 7 PRO HG3 H -1.016 1.858 10.095 1.00 . A A . 7 PRO HG3 1 1 10 3423 1 1 7 PRO N N -0.585 2.315 6.946 1.00 . A A . 7 PRO N 1 1 10 3424 1 1 7 PRO O O -3.184 0.770 6.248 1.00 . A A . 7 PRO O 1 1 10 3425 1 1 8 CYS C C -3.012 -1.971 3.809 1.00 . A A . 8 CYS C 1 1 10 3426 1 1 8 CYS CA C -2.648 -0.482 3.816 1.00 . A A . 8 CYS CA 1 1 10 3427 1 1 8 CYS CB C -2.080 -0.114 2.474 1.00 . A A . 8 CYS CB 1 1 10 3428 1 1 8 CYS H H -0.693 -0.252 4.719 1.00 . A A . 8 CYS H 1 1 10 3429 1 1 8 CYS HA H -3.553 0.088 3.959 1.00 . A A . 8 CYS HA 1 1 10 3430 1 1 8 CYS HB2 H -2.699 -0.526 1.692 1.00 . A A . 8 CYS HB2 1 1 10 3431 1 1 8 CYS HB3 H -2.117 0.945 2.339 1.00 . A A . 8 CYS HB3 1 1 10 3432 1 1 8 CYS N N -1.651 -0.079 4.868 1.00 . A A . 8 CYS N 1 1 10 3433 1 1 8 CYS O O -2.583 -2.739 4.649 1.00 . A A . 8 CYS O 1 1 10 3434 1 1 8 CYS SG S -0.407 -0.732 2.197 1.00 . A A . 8 CYS SG 1 1 10 3435 1 1 9 ARG C C -4.224 -3.949 1.075 1.00 . A A . 9 ARG C 1 1 10 3436 1 1 9 ARG CA C -4.308 -3.680 2.599 1.00 . A A . 9 ARG CA 1 1 10 3437 1 1 9 ARG CB C -5.733 -3.707 3.101 1.00 . A A . 9 ARG CB 1 1 10 3438 1 1 9 ARG CD C -7.802 -5.070 3.478 1.00 . A A . 9 ARG CD 1 1 10 3439 1 1 9 ARG CG C -6.297 -5.125 3.112 1.00 . A A . 9 ARG CG 1 1 10 3440 1 1 9 ARG CZ C -8.178 -3.065 4.862 1.00 . A A . 9 ARG CZ 1 1 10 3441 1 1 9 ARG H H -4.106 -1.607 2.201 1.00 . A A . 9 ARG H 1 1 10 3442 1 1 9 ARG HA H -3.685 -4.387 3.130 1.00 . A A . 9 ARG HA 1 1 10 3443 1 1 9 ARG HB2 H -5.741 -3.305 4.104 1.00 . A A . 9 ARG HB2 1 1 10 3444 1 1 9 ARG HB3 H -6.336 -3.074 2.469 1.00 . A A . 9 ARG HB3 1 1 10 3445 1 1 9 ARG HD2 H -8.371 -4.568 2.710 1.00 . A A . 9 ARG HD2 1 1 10 3446 1 1 9 ARG HD3 H -8.183 -6.075 3.584 1.00 . A A . 9 ARG HD3 1 1 10 3447 1 1 9 ARG HE H -7.911 -4.878 5.620 1.00 . A A . 9 ARG HE 1 1 10 3448 1 1 9 ARG HG2 H -6.141 -5.571 2.146 1.00 . A A . 9 ARG HG2 1 1 10 3449 1 1 9 ARG HG3 H -5.770 -5.713 3.849 1.00 . A A . 9 ARG HG3 1 1 10 3450 1 1 9 ARG HH11 H -8.171 -2.744 2.877 1.00 . A A . 9 ARG HH11 1 1 10 3451 1 1 9 ARG HH12 H -8.417 -1.345 3.861 1.00 . A A . 9 ARG HH12 1 1 10 3452 1 1 9 ARG HH21 H -8.224 -3.106 6.860 1.00 . A A . 9 ARG HH21 1 1 10 3453 1 1 9 ARG HH22 H -8.452 -1.549 6.133 1.00 . A A . 9 ARG HH22 1 1 10 3454 1 1 9 ARG N N -3.812 -2.299 2.823 1.00 . A A . 9 ARG N 1 1 10 3455 1 1 9 ARG NE N -7.967 -4.361 4.790 1.00 . A A . 9 ARG NE 1 1 10 3456 1 1 9 ARG NH1 N -8.262 -2.330 3.782 1.00 . A A . 9 ARG NH1 1 1 10 3457 1 1 9 ARG NH2 N -8.294 -2.533 6.045 1.00 . A A . 9 ARG NH2 1 1 10 3458 1 1 9 ARG O O -4.933 -3.341 0.291 1.00 . A A . 9 ARG O 1 1 10 3459 1 1 10 LYS C C -4.468 -5.657 -1.362 1.00 . A A . 10 LYS C 1 1 10 3460 1 1 10 LYS CA C -3.140 -5.244 -0.718 1.00 . A A . 10 LYS CA 1 1 10 3461 1 1 10 LYS CB C -2.183 -6.453 -0.861 1.00 . A A . 10 LYS CB 1 1 10 3462 1 1 10 LYS CD C -0.647 -5.894 1.124 1.00 . A A . 10 LYS CD 1 1 10 3463 1 1 10 LYS CE C 0.826 -5.817 1.500 1.00 . A A . 10 LYS CE 1 1 10 3464 1 1 10 LYS CG C -0.734 -6.209 -0.381 1.00 . A A . 10 LYS CG 1 1 10 3465 1 1 10 LYS H H -2.827 -5.306 1.420 1.00 . A A . 10 LYS H 1 1 10 3466 1 1 10 LYS HA H -2.736 -4.386 -1.245 1.00 . A A . 10 LYS HA 1 1 10 3467 1 1 10 LYS HB2 H -2.591 -7.287 -0.310 1.00 . A A . 10 LYS HB2 1 1 10 3468 1 1 10 LYS HB3 H -2.142 -6.738 -1.903 1.00 . A A . 10 LYS HB3 1 1 10 3469 1 1 10 LYS HD2 H -1.086 -4.933 1.338 1.00 . A A . 10 LYS HD2 1 1 10 3470 1 1 10 LYS HD3 H -1.146 -6.655 1.707 1.00 . A A . 10 LYS HD3 1 1 10 3471 1 1 10 LYS HE2 H 1.294 -6.776 1.331 1.00 . A A . 10 LYS HE2 1 1 10 3472 1 1 10 LYS HE3 H 1.320 -5.071 0.898 1.00 . A A . 10 LYS HE3 1 1 10 3473 1 1 10 LYS HG2 H -0.149 -7.092 -0.596 1.00 . A A . 10 LYS HG2 1 1 10 3474 1 1 10 LYS HG3 H -0.315 -5.385 -0.940 1.00 . A A . 10 LYS HG3 1 1 10 3475 1 1 10 LYS HZ1 H 0.502 -6.187 3.522 1.00 . A A . 10 LYS HZ1 1 1 10 3476 1 1 10 LYS HZ2 H 1.987 -5.434 3.184 1.00 . A A . 10 LYS HZ2 1 1 10 3477 1 1 10 LYS HZ3 H 0.547 -4.538 3.114 1.00 . A A . 10 LYS HZ3 1 1 10 3478 1 1 10 LYS N N -3.350 -4.862 0.721 1.00 . A A . 10 LYS N 1 1 10 3479 1 1 10 LYS NZ N 0.977 -5.468 2.939 1.00 . A A . 10 LYS NZ 1 1 10 3480 1 1 10 LYS O O -4.675 -5.450 -2.544 1.00 . A A . 10 LYS O 1 1 10 3481 1 1 11 THR C C -7.336 -5.843 -1.960 1.00 . A A . 11 THR C 1 1 10 3482 1 1 11 THR CA C -6.668 -6.728 -0.912 1.00 . A A . 11 THR CA 1 1 10 3483 1 1 11 THR CB C -7.552 -6.765 0.343 1.00 . A A . 11 THR CB 1 1 10 3484 1 1 11 THR CG2 C -8.911 -7.444 0.083 1.00 . A A . 11 THR CG2 1 1 10 3485 1 1 11 THR H H -5.018 -6.346 0.401 1.00 . A A . 11 THR H 1 1 10 3486 1 1 11 THR HA H -6.562 -7.724 -1.318 1.00 . A A . 11 THR HA 1 1 10 3487 1 1 11 THR HB H -7.648 -5.779 0.789 1.00 . A A . 11 THR HB 1 1 10 3488 1 1 11 THR HG1 H -7.133 -7.420 2.125 1.00 . A A . 11 THR HG1 1 1 10 3489 1 1 11 THR HG21 H -8.768 -8.464 -0.244 1.00 . A A . 11 THR HG21 1 1 10 3490 1 1 11 THR HG22 H -9.498 -7.449 0.990 1.00 . A A . 11 THR HG22 1 1 10 3491 1 1 11 THR HG23 H -9.459 -6.908 -0.678 1.00 . A A . 11 THR HG23 1 1 10 3492 1 1 11 THR N N -5.304 -6.233 -0.529 1.00 . A A . 11 THR N 1 1 10 3493 1 1 11 THR O O -7.961 -6.327 -2.883 1.00 . A A . 11 THR O 1 1 10 3494 1 1 11 THR OG1 O -6.887 -7.655 1.228 1.00 . A A . 11 THR OG1 1 1 10 3495 1 1 12 MET C C -6.822 -2.381 -2.875 1.00 . A A . 12 MET C 1 1 10 3496 1 1 12 MET CA C -7.762 -3.567 -2.697 1.00 . A A . 12 MET CA 1 1 10 3497 1 1 12 MET CB C -9.113 -3.109 -2.106 1.00 . A A . 12 MET CB 1 1 10 3498 1 1 12 MET CE C -10.793 -3.383 1.054 1.00 . A A . 12 MET CE 1 1 10 3499 1 1 12 MET CG C -8.909 -2.459 -0.713 1.00 . A A . 12 MET CG 1 1 10 3500 1 1 12 MET H H -6.641 -4.253 -0.992 1.00 . A A . 12 MET H 1 1 10 3501 1 1 12 MET HA H -7.916 -4.024 -3.664 1.00 . A A . 12 MET HA 1 1 10 3502 1 1 12 MET HB2 H -9.591 -2.407 -2.774 1.00 . A A . 12 MET HB2 1 1 10 3503 1 1 12 MET HB3 H -9.754 -3.968 -1.996 1.00 . A A . 12 MET HB3 1 1 10 3504 1 1 12 MET HE1 H -10.642 -4.242 0.418 1.00 . A A . 12 MET HE1 1 1 10 3505 1 1 12 MET HE2 H -10.186 -3.455 1.944 1.00 . A A . 12 MET HE2 1 1 10 3506 1 1 12 MET HE3 H -11.837 -3.353 1.328 1.00 . A A . 12 MET HE3 1 1 10 3507 1 1 12 MET HG2 H -8.415 -3.170 -0.066 1.00 . A A . 12 MET HG2 1 1 10 3508 1 1 12 MET HG3 H -8.248 -1.612 -0.819 1.00 . A A . 12 MET HG3 1 1 10 3509 1 1 12 MET N N -7.167 -4.563 -1.761 1.00 . A A . 12 MET N 1 1 10 3510 1 1 12 MET O O -7.205 -1.393 -3.471 1.00 . A A . 12 MET O 1 1 10 3511 1 1 12 MET SD S -10.390 -1.868 0.146 1.00 . A A . 12 MET SD 1 1 10 3512 1 1 13 TYR C C -5.270 -0.214 -1.839 1.00 . A A . 13 TYR C 1 1 10 3513 1 1 13 TYR CA C -4.593 -1.444 -2.443 1.00 . A A . 13 TYR CA 1 1 10 3514 1 1 13 TYR CB C -4.198 -1.251 -3.927 1.00 . A A . 13 TYR CB 1 1 10 3515 1 1 13 TYR CD1 C -2.280 -2.899 -4.070 1.00 . A A . 13 TYR CD1 1 1 10 3516 1 1 13 TYR CD2 C -4.324 -3.473 -5.148 1.00 . A A . 13 TYR CD2 1 1 10 3517 1 1 13 TYR CE1 C -1.727 -4.092 -4.480 1.00 . A A . 13 TYR CE1 1 1 10 3518 1 1 13 TYR CE2 C -3.769 -4.667 -5.559 1.00 . A A . 13 TYR CE2 1 1 10 3519 1 1 13 TYR CG C -3.584 -2.578 -4.400 1.00 . A A . 13 TYR CG 1 1 10 3520 1 1 13 TYR CZ C -2.469 -4.984 -5.227 1.00 . A A . 13 TYR CZ 1 1 10 3521 1 1 13 TYR H H -5.390 -3.359 -1.906 1.00 . A A . 13 TYR H 1 1 10 3522 1 1 13 TYR HA H -3.738 -1.718 -1.840 1.00 . A A . 13 TYR HA 1 1 10 3523 1 1 13 TYR HB2 H -5.062 -1.024 -4.532 1.00 . A A . 13 TYR HB2 1 1 10 3524 1 1 13 TYR HB3 H -3.469 -0.461 -4.032 1.00 . A A . 13 TYR HB3 1 1 10 3525 1 1 13 TYR HD1 H -1.687 -2.210 -3.485 1.00 . A A . 13 TYR HD1 1 1 10 3526 1 1 13 TYR HD2 H -5.344 -3.239 -5.415 1.00 . A A . 13 TYR HD2 1 1 10 3527 1 1 13 TYR HE1 H -0.708 -4.330 -4.214 1.00 . A A . 13 TYR HE1 1 1 10 3528 1 1 13 TYR HE2 H -4.359 -5.359 -6.143 1.00 . A A . 13 TYR HE2 1 1 10 3529 1 1 13 TYR HH H -1.443 -6.018 -6.458 1.00 . A A . 13 TYR HH 1 1 10 3530 1 1 13 TYR N N -5.621 -2.523 -2.357 1.00 . A A . 13 TYR N 1 1 10 3531 1 1 13 TYR O O -5.745 0.684 -2.508 1.00 . A A . 13 TYR O 1 1 10 3532 1 1 13 TYR OH O -1.914 -6.179 -5.638 1.00 . A A . 13 TYR OH 1 1 10 3533 1 1 14 ASP C C -4.951 2.033 0.423 1.00 . A A . 14 ASP C 1 1 10 3534 1 1 14 ASP CA C -5.864 0.799 0.322 1.00 . A A . 14 ASP CA 1 1 10 3535 1 1 14 ASP CB C -6.130 0.111 1.688 1.00 . A A . 14 ASP CB 1 1 10 3536 1 1 14 ASP CG C -6.704 1.067 2.751 1.00 . A A . 14 ASP CG 1 1 10 3537 1 1 14 ASP H H -4.837 -1.031 -0.109 1.00 . A A . 14 ASP H 1 1 10 3538 1 1 14 ASP HA H -6.804 1.104 -0.115 1.00 . A A . 14 ASP HA 1 1 10 3539 1 1 14 ASP HB2 H -6.839 -0.683 1.538 1.00 . A A . 14 ASP HB2 1 1 10 3540 1 1 14 ASP HB3 H -5.230 -0.350 2.055 1.00 . A A . 14 ASP HB3 1 1 10 3541 1 1 14 ASP N N -5.262 -0.261 -0.534 1.00 . A A . 14 ASP N 1 1 10 3542 1 1 14 ASP O O -5.060 2.832 1.332 1.00 . A A . 14 ASP O 1 1 10 3543 1 1 14 ASP OD1 O -7.659 1.755 2.426 1.00 . A A . 14 ASP OD1 1 1 10 3544 1 1 14 ASP OD2 O -6.145 1.050 3.835 1.00 . A A . 14 ASP OD2 1 1 10 3545 1 1 15 CYS C C -3.460 4.247 -1.732 1.00 . A A . 15 CYS C 1 1 10 3546 1 1 15 CYS CA C -3.103 3.260 -0.624 1.00 . A A . 15 CYS CA 1 1 10 3547 1 1 15 CYS CB C -1.714 2.728 -0.906 1.00 . A A . 15 CYS CB 1 1 10 3548 1 1 15 CYS H H -4.059 1.421 -1.222 1.00 . A A . 15 CYS H 1 1 10 3549 1 1 15 CYS HA H -3.098 3.786 0.316 1.00 . A A . 15 CYS HA 1 1 10 3550 1 1 15 CYS HB2 H -1.719 2.211 -1.855 1.00 . A A . 15 CYS HB2 1 1 10 3551 1 1 15 CYS HB3 H -1.029 3.560 -0.989 1.00 . A A . 15 CYS HB3 1 1 10 3552 1 1 15 CYS N N -4.074 2.127 -0.543 1.00 . A A . 15 CYS N 1 1 10 3553 1 1 15 CYS O O -3.945 3.859 -2.778 1.00 . A A . 15 CYS O 1 1 10 3554 1 1 15 CYS SG S -1.051 1.594 0.326 1.00 . A A . 15 CYS SG 1 1 10 3555 1 1 16 CYS C C -2.508 6.386 -3.610 1.00 . A A . 16 CYS C 1 1 10 3556 1 1 16 CYS CA C -3.488 6.580 -2.442 1.00 . A A . 16 CYS CA 1 1 10 3557 1 1 16 CYS CB C -3.271 7.922 -1.750 1.00 . A A . 16 CYS CB 1 1 10 3558 1 1 16 CYS H H -2.814 5.752 -0.593 1.00 . A A . 16 CYS H 1 1 10 3559 1 1 16 CYS HA H -4.501 6.485 -2.802 1.00 . A A . 16 CYS HA 1 1 10 3560 1 1 16 CYS HB2 H -2.232 8.003 -1.467 1.00 . A A . 16 CYS HB2 1 1 10 3561 1 1 16 CYS HB3 H -3.479 8.703 -2.459 1.00 . A A . 16 CYS HB3 1 1 10 3562 1 1 16 CYS N N -3.201 5.502 -1.456 1.00 . A A . 16 CYS N 1 1 10 3563 1 1 16 CYS O O -2.803 6.697 -4.747 1.00 . A A . 16 CYS O 1 1 10 3564 1 1 16 CYS SG S -4.265 8.242 -0.272 1.00 . A A . 16 CYS SG 1 1 10 3565 1 1 17 SER C C -0.610 4.283 -4.982 1.00 . A A . 17 SER C 1 1 10 3566 1 1 17 SER CA C -0.271 5.585 -4.234 1.00 . A A . 17 SER CA 1 1 10 3567 1 1 17 SER CB C 1.048 5.436 -3.461 1.00 . A A . 17 SER CB 1 1 10 3568 1 1 17 SER H H -1.211 5.645 -2.309 1.00 . A A . 17 SER H 1 1 10 3569 1 1 17 SER HA H -0.209 6.400 -4.940 1.00 . A A . 17 SER HA 1 1 10 3570 1 1 17 SER HB2 H 1.288 6.334 -2.912 1.00 . A A . 17 SER HB2 1 1 10 3571 1 1 17 SER HB3 H 1.021 4.590 -2.790 1.00 . A A . 17 SER HB3 1 1 10 3572 1 1 17 SER HG H 1.910 4.318 -4.798 1.00 . A A . 17 SER HG 1 1 10 3573 1 1 17 SER N N -1.360 5.862 -3.253 1.00 . A A . 17 SER N 1 1 10 3574 1 1 17 SER O O -0.149 4.066 -6.087 1.00 . A A . 17 SER O 1 1 10 3575 1 1 17 SER OG O 2.031 5.210 -4.462 1.00 . A A . 17 SER OG 1 1 10 3576 1 1 18 GLY C C -0.733 1.079 -4.785 1.00 . A A . 18 GLY C 1 1 10 3577 1 1 18 GLY CA C -1.822 2.153 -4.945 1.00 . A A . 18 GLY CA 1 1 10 3578 1 1 18 GLY H H -1.739 3.700 -3.455 1.00 . A A . 18 GLY H 1 1 10 3579 1 1 18 GLY HA2 H -2.721 1.816 -4.450 1.00 . A A . 18 GLY HA2 1 1 10 3580 1 1 18 GLY HA3 H -2.032 2.291 -5.996 1.00 . A A . 18 GLY HA3 1 1 10 3581 1 1 18 GLY N N -1.407 3.458 -4.345 1.00 . A A . 18 GLY N 1 1 10 3582 1 1 18 GLY O O -1.008 -0.097 -4.931 1.00 . A A . 18 GLY O 1 1 10 3583 1 1 19 SER C C 1.742 0.190 -2.823 1.00 . A A . 19 SER C 1 1 10 3584 1 1 19 SER CA C 1.619 0.585 -4.304 1.00 . A A . 19 SER CA 1 1 10 3585 1 1 19 SER CB C 2.890 1.310 -4.814 1.00 . A A . 19 SER CB 1 1 10 3586 1 1 19 SER H H 0.621 2.479 -4.380 1.00 . A A . 19 SER H 1 1 10 3587 1 1 19 SER HA H 1.457 -0.308 -4.891 1.00 . A A . 19 SER HA 1 1 10 3588 1 1 19 SER HB2 H 3.777 0.711 -4.667 1.00 . A A . 19 SER HB2 1 1 10 3589 1 1 19 SER HB3 H 2.796 1.581 -5.856 1.00 . A A . 19 SER HB3 1 1 10 3590 1 1 19 SER HG H 3.016 3.244 -4.624 1.00 . A A . 19 SER HG 1 1 10 3591 1 1 19 SER N N 0.466 1.518 -4.488 1.00 . A A . 19 SER N 1 1 10 3592 1 1 19 SER O O 2.695 0.539 -2.151 1.00 . A A . 19 SER O 1 1 10 3593 1 1 19 SER OG O 2.983 2.492 -4.029 1.00 . A A . 19 SER OG 1 1 10 3594 1 1 20 CYS C C 1.916 -1.948 -0.589 1.00 . A A . 20 CYS C 1 1 10 3595 1 1 20 CYS CA C 0.773 -0.979 -0.931 1.00 . A A . 20 CYS CA 1 1 10 3596 1 1 20 CYS CB C -0.586 -1.638 -0.592 1.00 . A A . 20 CYS CB 1 1 10 3597 1 1 20 CYS H H 0.014 -0.794 -2.941 1.00 . A A . 20 CYS H 1 1 10 3598 1 1 20 CYS HA H 0.875 -0.101 -0.313 1.00 . A A . 20 CYS HA 1 1 10 3599 1 1 20 CYS HB2 H -1.352 -0.882 -0.661 1.00 . A A . 20 CYS HB2 1 1 10 3600 1 1 20 CYS HB3 H -0.842 -2.404 -1.294 1.00 . A A . 20 CYS HB3 1 1 10 3601 1 1 20 CYS N N 0.758 -0.539 -2.356 1.00 . A A . 20 CYS N 1 1 10 3602 1 1 20 CYS O O 1.898 -3.107 -0.957 1.00 . A A . 20 CYS O 1 1 10 3603 1 1 20 CYS SG S -0.698 -2.367 1.057 1.00 . A A . 20 CYS SG 1 1 10 3604 1 1 21 GLY C C 3.717 -3.477 1.223 1.00 . A A . 21 GLY C 1 1 10 3605 1 1 21 GLY CA C 4.096 -2.138 0.574 1.00 . A A . 21 GLY CA 1 1 10 3606 1 1 21 GLY H H 2.793 -0.448 0.348 1.00 . A A . 21 GLY H 1 1 10 3607 1 1 21 GLY HA2 H 4.737 -2.316 -0.278 1.00 . A A . 21 GLY HA2 1 1 10 3608 1 1 21 GLY HA3 H 4.625 -1.535 1.295 1.00 . A A . 21 GLY HA3 1 1 10 3609 1 1 21 GLY N N 2.877 -1.396 0.114 1.00 . A A . 21 GLY N 1 1 10 3610 1 1 21 GLY O O 2.762 -3.569 1.969 1.00 . A A . 21 GLY O 1 1 10 3611 1 1 22 ARG C C 4.761 -5.930 2.889 1.00 . A A . 22 ARG C 1 1 10 3612 1 1 22 ARG CA C 4.356 -5.865 1.397 1.00 . A A . 22 ARG CA 1 1 10 3613 1 1 22 ARG CB C 5.257 -6.756 0.492 1.00 . A A . 22 ARG CB 1 1 10 3614 1 1 22 ARG CD C 4.614 -9.039 1.630 1.00 . A A . 22 ARG CD 1 1 10 3615 1 1 22 ARG CG C 4.754 -8.230 0.330 1.00 . A A . 22 ARG CG 1 1 10 3616 1 1 22 ARG CZ C 6.875 -9.934 1.975 1.00 . A A . 22 ARG CZ 1 1 10 3617 1 1 22 ARG H H 5.268 -4.231 0.324 1.00 . A A . 22 ARG H 1 1 10 3618 1 1 22 ARG HA H 3.326 -6.157 1.299 1.00 . A A . 22 ARG HA 1 1 10 3619 1 1 22 ARG HB2 H 5.309 -6.313 -0.492 1.00 . A A . 22 ARG HB2 1 1 10 3620 1 1 22 ARG HB3 H 6.259 -6.773 0.897 1.00 . A A . 22 ARG HB3 1 1 10 3621 1 1 22 ARG HD2 H 3.867 -8.612 2.278 1.00 . A A . 22 ARG HD2 1 1 10 3622 1 1 22 ARG HD3 H 4.302 -10.046 1.394 1.00 . A A . 22 ARG HD3 1 1 10 3623 1 1 22 ARG HE H 6.105 -8.478 3.075 1.00 . A A . 22 ARG HE 1 1 10 3624 1 1 22 ARG HG2 H 3.789 -8.205 -0.157 1.00 . A A . 22 ARG HG2 1 1 10 3625 1 1 22 ARG HG3 H 5.435 -8.749 -0.328 1.00 . A A . 22 ARG HG3 1 1 10 3626 1 1 22 ARG HH11 H 5.821 -10.768 0.484 1.00 . A A . 22 ARG HH11 1 1 10 3627 1 1 22 ARG HH12 H 7.411 -11.407 0.726 1.00 . A A . 22 ARG HH12 1 1 10 3628 1 1 22 ARG HH21 H 8.119 -9.271 3.396 1.00 . A A . 22 ARG HH21 1 1 10 3629 1 1 22 ARG HH22 H 8.732 -10.547 2.396 1.00 . A A . 22 ARG HH22 1 1 10 3630 1 1 22 ARG N N 4.521 -4.455 0.905 1.00 . A A . 22 ARG N 1 1 10 3631 1 1 22 ARG NE N 5.936 -9.091 2.330 1.00 . A A . 22 ARG NE 1 1 10 3632 1 1 22 ARG NH1 N 6.686 -10.768 0.985 1.00 . A A . 22 ARG NH1 1 1 10 3633 1 1 22 ARG NH2 N 7.996 -9.917 2.641 1.00 . A A . 22 ARG NH2 1 1 10 3634 1 1 22 ARG O O 4.660 -6.948 3.544 1.00 . A A . 22 ARG O 1 1 10 3635 1 1 23 ARG C C 4.318 -4.590 5.594 1.00 . A A . 23 ARG C 1 1 10 3636 1 1 23 ARG CA C 5.640 -4.701 4.818 1.00 . A A . 23 ARG CA 1 1 10 3637 1 1 23 ARG CB C 6.522 -3.435 4.896 1.00 . A A . 23 ARG CB 1 1 10 3638 1 1 23 ARG CD C 6.135 -2.781 7.366 1.00 . A A . 23 ARG CD 1 1 10 3639 1 1 23 ARG CG C 7.168 -3.117 6.271 1.00 . A A . 23 ARG CG 1 1 10 3640 1 1 23 ARG CZ C 7.318 -1.116 8.726 1.00 . A A . 23 ARG CZ 1 1 10 3641 1 1 23 ARG H H 5.268 -4.016 2.823 1.00 . A A . 23 ARG H 1 1 10 3642 1 1 23 ARG HA H 6.177 -5.591 5.115 1.00 . A A . 23 ARG HA 1 1 10 3643 1 1 23 ARG HB2 H 7.312 -3.523 4.163 1.00 . A A . 23 ARG HB2 1 1 10 3644 1 1 23 ARG HB3 H 5.907 -2.594 4.612 1.00 . A A . 23 ARG HB3 1 1 10 3645 1 1 23 ARG HD2 H 5.455 -2.004 7.053 1.00 . A A . 23 ARG HD2 1 1 10 3646 1 1 23 ARG HD3 H 5.575 -3.656 7.641 1.00 . A A . 23 ARG HD3 1 1 10 3647 1 1 23 ARG HE H 7.048 -2.994 9.303 1.00 . A A . 23 ARG HE 1 1 10 3648 1 1 23 ARG HG2 H 7.749 -3.970 6.589 1.00 . A A . 23 ARG HG2 1 1 10 3649 1 1 23 ARG HG3 H 7.843 -2.281 6.150 1.00 . A A . 23 ARG HG3 1 1 10 3650 1 1 23 ARG HH11 H 6.620 -0.474 6.957 1.00 . A A . 23 ARG HH11 1 1 10 3651 1 1 23 ARG HH12 H 7.451 0.708 7.911 1.00 . A A . 23 ARG HH12 1 1 10 3652 1 1 23 ARG HH21 H 8.107 -1.510 10.522 1.00 . A A . 23 ARG HH21 1 1 10 3653 1 1 23 ARG HH22 H 8.306 0.114 9.955 1.00 . A A . 23 ARG HH22 1 1 10 3654 1 1 23 ARG N N 5.210 -4.811 3.392 1.00 . A A . 23 ARG N 1 1 10 3655 1 1 23 ARG NE N 6.882 -2.346 8.588 1.00 . A A . 23 ARG NE 1 1 10 3656 1 1 23 ARG NH1 N 7.113 -0.226 7.791 1.00 . A A . 23 ARG NH1 1 1 10 3657 1 1 23 ARG NH2 N 7.961 -0.814 9.820 1.00 . A A . 23 ARG NH2 1 1 10 3658 1 1 23 ARG O O 4.164 -5.141 6.666 1.00 . A A . 23 ARG O 1 1 10 3659 1 1 24 GLY C C 1.698 -2.164 5.457 1.00 . A A . 24 GLY C 1 1 10 3660 1 1 24 GLY CA C 2.054 -3.645 5.572 1.00 . A A . 24 GLY CA 1 1 10 3661 1 1 24 GLY H H 3.614 -3.477 4.116 1.00 . A A . 24 GLY H 1 1 10 3662 1 1 24 GLY HA2 H 1.325 -4.231 5.034 1.00 . A A . 24 GLY HA2 1 1 10 3663 1 1 24 GLY HA3 H 2.046 -3.928 6.615 1.00 . A A . 24 GLY HA3 1 1 10 3664 1 1 24 GLY N N 3.405 -3.875 4.987 1.00 . A A . 24 GLY N 1 1 10 3665 1 1 24 GLY O O 0.649 -1.756 5.917 1.00 . A A . 24 GLY O 1 1 10 3666 1 1 25 LYS C C 2.278 0.443 3.205 1.00 . A A . 25 LYS C 1 1 10 3667 1 1 25 LYS CA C 2.327 0.059 4.674 1.00 . A A . 25 LYS CA 1 1 10 3668 1 1 25 LYS CB C 3.448 0.837 5.441 1.00 . A A . 25 LYS CB 1 1 10 3669 1 1 25 LYS CD C 5.206 0.761 3.601 1.00 . A A . 25 LYS CD 1 1 10 3670 1 1 25 LYS CE C 6.707 0.618 3.298 1.00 . A A . 25 LYS CE 1 1 10 3671 1 1 25 LYS CG C 4.913 0.464 5.076 1.00 . A A . 25 LYS CG 1 1 10 3672 1 1 25 LYS H H 3.396 -1.812 4.461 1.00 . A A . 25 LYS H 1 1 10 3673 1 1 25 LYS HA H 1.375 0.314 5.107 1.00 . A A . 25 LYS HA 1 1 10 3674 1 1 25 LYS HB2 H 3.321 1.881 5.212 1.00 . A A . 25 LYS HB2 1 1 10 3675 1 1 25 LYS HB3 H 3.305 0.738 6.503 1.00 . A A . 25 LYS HB3 1 1 10 3676 1 1 25 LYS HD2 H 4.694 0.045 2.979 1.00 . A A . 25 LYS HD2 1 1 10 3677 1 1 25 LYS HD3 H 4.839 1.746 3.374 1.00 . A A . 25 LYS HD3 1 1 10 3678 1 1 25 LYS HE2 H 6.893 0.837 2.256 1.00 . A A . 25 LYS HE2 1 1 10 3679 1 1 25 LYS HE3 H 7.279 1.305 3.904 1.00 . A A . 25 LYS HE3 1 1 10 3680 1 1 25 LYS HG2 H 5.586 1.032 5.702 1.00 . A A . 25 LYS HG2 1 1 10 3681 1 1 25 LYS HG3 H 5.072 -0.586 5.273 1.00 . A A . 25 LYS HG3 1 1 10 3682 1 1 25 LYS HZ1 H 6.563 -1.445 3.081 1.00 . A A . 25 LYS HZ1 1 1 10 3683 1 1 25 LYS HZ2 H 8.155 -0.877 3.251 1.00 . A A . 25 LYS HZ2 1 1 10 3684 1 1 25 LYS HZ3 H 7.128 -0.946 4.603 1.00 . A A . 25 LYS HZ3 1 1 10 3685 1 1 25 LYS N N 2.575 -1.409 4.835 1.00 . A A . 25 LYS N 1 1 10 3686 1 1 25 LYS NZ N 7.174 -0.767 3.579 1.00 . A A . 25 LYS NZ 1 1 10 3687 1 1 25 LYS O O 2.396 -0.421 2.365 1.00 . A A . 25 LYS O 1 1 10 3688 1 1 26 CYS C C 3.352 2.646 0.860 1.00 . A A . 26 CYS C 1 1 10 3689 1 1 26 CYS CA C 2.041 2.181 1.510 1.00 . A A . 26 CYS CA 1 1 10 3690 1 1 26 CYS CB C 1.023 3.300 1.464 1.00 . A A . 26 CYS CB 1 1 10 3691 1 1 26 CYS H H 2.018 2.353 3.667 1.00 . A A . 26 CYS H 1 1 10 3692 1 1 26 CYS HA H 1.651 1.374 0.907 1.00 . A A . 26 CYS HA 1 1 10 3693 1 1 26 CYS HB2 H 1.320 4.070 2.156 1.00 . A A . 26 CYS HB2 1 1 10 3694 1 1 26 CYS HB3 H 0.996 3.718 0.473 1.00 . A A . 26 CYS HB3 1 1 10 3695 1 1 26 CYS N N 2.107 1.710 2.930 1.00 . A A . 26 CYS N 1 1 10 3696 1 1 26 CYS O O 4.328 2.960 1.509 1.00 . A A . 26 CYS O 1 1 10 3697 1 1 26 CYS SG S -0.664 2.820 1.881 1.00 . A A . 26 CYS SG 1 1 10 3698 1 1 27 NH2 HN1 H 2.606 2.449 -0.967 1.00 . A A . 27 NH2 HN1 1 1 10 3699 1 1 27 NH2 HN2 H 4.210 2.995 -0.904 1.00 . A A . 27 NH2 HN2 1 1 10 3700 1 1 27 NH2 N N 3.395 2.702 -0.445 1.00 . A A . 27 NH2 N 1 1 11 3701 1 1 1 CYS C C -5.872 6.442 1.834 1.00 . A A . 1 CYS C 1 1 11 3702 1 1 1 CYS CA C -7.043 6.082 0.911 1.00 . A A . 1 CYS CA 1 1 11 3703 1 1 1 CYS CB C -6.684 6.480 -0.524 1.00 . A A . 1 CYS CB 1 1 11 3704 1 1 1 CYS H1 H -8.075 7.828 1.376 1.00 . A A . 1 CYS H1 1 1 11 3705 1 1 1 CYS H2 H -9.047 6.610 0.700 1.00 . A A . 1 CYS H2 1 1 11 3706 1 1 1 CYS H3 H -8.528 6.485 2.313 1.00 . A A . 1 CYS H3 1 1 11 3707 1 1 1 CYS HA H -7.227 5.018 0.972 1.00 . A A . 1 CYS HA 1 1 11 3708 1 1 1 CYS HB2 H -5.824 5.903 -0.822 1.00 . A A . 1 CYS HB2 1 1 11 3709 1 1 1 CYS HB3 H -7.500 6.194 -1.171 1.00 . A A . 1 CYS HB3 1 1 11 3710 1 1 1 CYS N N -8.267 6.806 1.358 1.00 . A A . 1 CYS N 1 1 11 3711 1 1 1 CYS O O -5.731 7.572 2.262 1.00 . A A . 1 CYS O 1 1 11 3712 1 1 1 CYS SG S -6.322 8.228 -0.832 1.00 . A A . 1 CYS SG 1 1 11 3713 1 1 2 LYS C C -2.694 6.223 2.247 1.00 . A A . 2 LYS C 1 1 11 3714 1 1 2 LYS CA C -3.872 5.597 2.988 1.00 . A A . 2 LYS CA 1 1 11 3715 1 1 2 LYS CB C -3.486 4.206 3.522 1.00 . A A . 2 LYS CB 1 1 11 3716 1 1 2 LYS CD C -5.926 3.670 4.338 1.00 . A A . 2 LYS CD 1 1 11 3717 1 1 2 LYS CE C -6.584 5.042 4.621 1.00 . A A . 2 LYS CE 1 1 11 3718 1 1 2 LYS CG C -4.411 3.644 4.646 1.00 . A A . 2 LYS CG 1 1 11 3719 1 1 2 LYS H H -5.261 4.573 1.713 1.00 . A A . 2 LYS H 1 1 11 3720 1 1 2 LYS HA H -4.124 6.236 3.821 1.00 . A A . 2 LYS HA 1 1 11 3721 1 1 2 LYS HB2 H -3.500 3.509 2.698 1.00 . A A . 2 LYS HB2 1 1 11 3722 1 1 2 LYS HB3 H -2.478 4.231 3.905 1.00 . A A . 2 LYS HB3 1 1 11 3723 1 1 2 LYS HD2 H -6.102 3.388 3.312 1.00 . A A . 2 LYS HD2 1 1 11 3724 1 1 2 LYS HD3 H -6.392 2.947 4.978 1.00 . A A . 2 LYS HD3 1 1 11 3725 1 1 2 LYS HE2 H -6.591 5.200 5.690 1.00 . A A . 2 LYS HE2 1 1 11 3726 1 1 2 LYS HE3 H -6.088 5.881 4.177 1.00 . A A . 2 LYS HE3 1 1 11 3727 1 1 2 LYS HG2 H -4.122 2.620 4.833 1.00 . A A . 2 LYS HG2 1 1 11 3728 1 1 2 LYS HG3 H -4.228 4.203 5.553 1.00 . A A . 2 LYS HG3 1 1 11 3729 1 1 2 LYS HZ1 H -8.114 4.307 3.414 1.00 . A A . 2 LYS HZ1 1 1 11 3730 1 1 2 LYS HZ2 H -8.622 4.778 4.966 1.00 . A A . 2 LYS HZ2 1 1 11 3731 1 1 2 LYS HZ3 H -8.262 5.956 3.795 1.00 . A A . 2 LYS HZ3 1 1 11 3732 1 1 2 LYS N N -5.070 5.447 2.105 1.00 . A A . 2 LYS N 1 1 11 3733 1 1 2 LYS NZ N -8.003 5.019 4.166 1.00 . A A . 2 LYS NZ 1 1 11 3734 1 1 2 LYS O O -2.301 5.784 1.184 1.00 . A A . 2 LYS O 1 1 11 3735 1 1 3 GLY C C 0.246 7.091 2.267 1.00 . A A . 3 GLY C 1 1 11 3736 1 1 3 GLY CA C -1.002 7.984 2.277 1.00 . A A . 3 GLY CA 1 1 11 3737 1 1 3 GLY H H -2.564 7.515 3.721 1.00 . A A . 3 GLY H 1 1 11 3738 1 1 3 GLY HA2 H -1.239 8.273 1.263 1.00 . A A . 3 GLY HA2 1 1 11 3739 1 1 3 GLY HA3 H -0.810 8.871 2.861 1.00 . A A . 3 GLY HA3 1 1 11 3740 1 1 3 GLY N N -2.170 7.248 2.863 1.00 . A A . 3 GLY N 1 1 11 3741 1 1 3 GLY O O 0.217 6.001 2.801 1.00 . A A . 3 GLY O 1 1 11 3742 1 1 4 LYS C C 3.097 6.334 2.970 1.00 . A A . 4 LYS C 1 1 11 3743 1 1 4 LYS CA C 2.578 6.783 1.590 1.00 . A A . 4 LYS CA 1 1 11 3744 1 1 4 LYS CB C 3.622 7.656 0.882 1.00 . A A . 4 LYS CB 1 1 11 3745 1 1 4 LYS CD C 4.195 8.804 -1.336 1.00 . A A . 4 LYS CD 1 1 11 3746 1 1 4 LYS CE C 4.386 10.187 -0.678 1.00 . A A . 4 LYS CE 1 1 11 3747 1 1 4 LYS CG C 3.155 7.945 -0.570 1.00 . A A . 4 LYS CG 1 1 11 3748 1 1 4 LYS H H 1.284 8.453 1.250 1.00 . A A . 4 LYS H 1 1 11 3749 1 1 4 LYS HA H 2.393 5.903 0.989 1.00 . A A . 4 LYS HA 1 1 11 3750 1 1 4 LYS HB2 H 3.736 8.578 1.431 1.00 . A A . 4 LYS HB2 1 1 11 3751 1 1 4 LYS HB3 H 4.566 7.142 0.868 1.00 . A A . 4 LYS HB3 1 1 11 3752 1 1 4 LYS HD2 H 5.143 8.285 -1.357 1.00 . A A . 4 LYS HD2 1 1 11 3753 1 1 4 LYS HD3 H 3.862 8.938 -2.355 1.00 . A A . 4 LYS HD3 1 1 11 3754 1 1 4 LYS HE2 H 4.761 10.092 0.330 1.00 . A A . 4 LYS HE2 1 1 11 3755 1 1 4 LYS HE3 H 5.091 10.766 -1.255 1.00 . A A . 4 LYS HE3 1 1 11 3756 1 1 4 LYS HG2 H 3.022 7.010 -1.094 1.00 . A A . 4 LYS HG2 1 1 11 3757 1 1 4 LYS HG3 H 2.207 8.461 -0.558 1.00 . A A . 4 LYS HG3 1 1 11 3758 1 1 4 LYS HZ1 H 2.633 10.858 -1.577 1.00 . A A . 4 LYS HZ1 1 1 11 3759 1 1 4 LYS HZ2 H 2.471 10.501 0.075 1.00 . A A . 4 LYS HZ2 1 1 11 3760 1 1 4 LYS HZ3 H 3.263 11.922 -0.413 1.00 . A A . 4 LYS HZ3 1 1 11 3761 1 1 4 LYS N N 1.306 7.567 1.665 1.00 . A A . 4 LYS N 1 1 11 3762 1 1 4 LYS NZ N 3.090 10.923 -0.645 1.00 . A A . 4 LYS NZ 1 1 11 3763 1 1 4 LYS O O 3.150 7.111 3.904 1.00 . A A . 4 LYS O 1 1 11 3764 1 1 5 GLY C C 2.915 4.266 5.371 1.00 . A A . 5 GLY C 1 1 11 3765 1 1 5 GLY CA C 3.988 4.456 4.288 1.00 . A A . 5 GLY CA 1 1 11 3766 1 1 5 GLY H H 3.378 4.521 2.231 1.00 . A A . 5 GLY H 1 1 11 3767 1 1 5 GLY HA2 H 4.403 3.490 4.042 1.00 . A A . 5 GLY HA2 1 1 11 3768 1 1 5 GLY HA3 H 4.776 5.074 4.689 1.00 . A A . 5 GLY HA3 1 1 11 3769 1 1 5 GLY N N 3.458 5.076 3.034 1.00 . A A . 5 GLY N 1 1 11 3770 1 1 5 GLY O O 3.235 3.851 6.468 1.00 . A A . 5 GLY O 1 1 11 3771 1 1 6 ALA C C -0.002 2.980 5.994 1.00 . A A . 6 ALA C 1 1 11 3772 1 1 6 ALA CA C 0.566 4.417 6.034 1.00 . A A . 6 ALA CA 1 1 11 3773 1 1 6 ALA CB C -0.529 5.435 5.687 1.00 . A A . 6 ALA CB 1 1 11 3774 1 1 6 ALA H H 1.491 4.895 4.140 1.00 . A A . 6 ALA H 1 1 11 3775 1 1 6 ALA HA H 0.951 4.627 7.020 1.00 . A A . 6 ALA HA 1 1 11 3776 1 1 6 ALA HB1 H -0.123 6.435 5.733 1.00 . A A . 6 ALA HB1 1 1 11 3777 1 1 6 ALA HB2 H -0.899 5.257 4.693 1.00 . A A . 6 ALA HB2 1 1 11 3778 1 1 6 ALA HB3 H -1.354 5.364 6.378 1.00 . A A . 6 ALA HB3 1 1 11 3779 1 1 6 ALA N N 1.682 4.568 5.044 1.00 . A A . 6 ALA N 1 1 11 3780 1 1 6 ALA O O 0.066 2.340 4.962 1.00 . A A . 6 ALA O 1 1 11 3781 1 1 7 PRO C C -2.111 0.680 6.317 1.00 . A A . 7 PRO C 1 1 11 3782 1 1 7 PRO CA C -0.959 1.082 7.262 1.00 . A A . 7 PRO CA 1 1 11 3783 1 1 7 PRO CB C -1.335 0.931 8.744 1.00 . A A . 7 PRO CB 1 1 11 3784 1 1 7 PRO CD C -0.811 3.316 8.334 1.00 . A A . 7 PRO CD 1 1 11 3785 1 1 7 PRO CG C -1.484 2.347 9.314 1.00 . A A . 7 PRO CG 1 1 11 3786 1 1 7 PRO HA H -0.107 0.455 7.055 1.00 . A A . 7 PRO HA 1 1 11 3787 1 1 7 PRO HB2 H -2.256 0.378 8.866 1.00 . A A . 7 PRO HB2 1 1 11 3788 1 1 7 PRO HB3 H -0.549 0.409 9.269 1.00 . A A . 7 PRO HB3 1 1 11 3789 1 1 7 PRO HD2 H -1.467 4.139 8.096 1.00 . A A . 7 PRO HD2 1 1 11 3790 1 1 7 PRO HD3 H 0.120 3.684 8.739 1.00 . A A . 7 PRO HD3 1 1 11 3791 1 1 7 PRO HG2 H -2.531 2.594 9.420 1.00 . A A . 7 PRO HG2 1 1 11 3792 1 1 7 PRO HG3 H -1.012 2.408 10.284 1.00 . A A . 7 PRO HG3 1 1 11 3793 1 1 7 PRO N N -0.543 2.509 7.103 1.00 . A A . 7 PRO N 1 1 11 3794 1 1 7 PRO O O -3.275 0.783 6.655 1.00 . A A . 7 PRO O 1 1 11 3795 1 1 8 CYS C C -2.837 -1.723 3.937 1.00 . A A . 8 CYS C 1 1 11 3796 1 1 8 CYS CA C -2.695 -0.211 4.100 1.00 . A A . 8 CYS CA 1 1 11 3797 1 1 8 CYS CB C -2.269 0.350 2.767 1.00 . A A . 8 CYS CB 1 1 11 3798 1 1 8 CYS H H -0.764 0.190 4.947 1.00 . A A . 8 CYS H 1 1 11 3799 1 1 8 CYS HA H -3.664 0.196 4.340 1.00 . A A . 8 CYS HA 1 1 11 3800 1 1 8 CYS HB2 H -2.811 -0.162 1.986 1.00 . A A . 8 CYS HB2 1 1 11 3801 1 1 8 CYS HB3 H -2.537 1.384 2.664 1.00 . A A . 8 CYS HB3 1 1 11 3802 1 1 8 CYS N N -1.724 0.233 5.149 1.00 . A A . 8 CYS N 1 1 11 3803 1 1 8 CYS O O -2.079 -2.522 4.453 1.00 . A A . 8 CYS O 1 1 11 3804 1 1 8 CYS SG S -0.514 0.069 2.432 1.00 . A A . 8 CYS SG 1 1 11 3805 1 1 9 ARG C C -4.109 -3.445 1.277 1.00 . A A . 9 ARG C 1 1 11 3806 1 1 9 ARG CA C -4.290 -3.370 2.803 1.00 . A A . 9 ARG CA 1 1 11 3807 1 1 9 ARG CB C -5.747 -3.504 3.248 1.00 . A A . 9 ARG CB 1 1 11 3808 1 1 9 ARG CD C -7.793 -4.978 3.350 1.00 . A A . 9 ARG CD 1 1 11 3809 1 1 9 ARG CG C -6.315 -4.888 2.909 1.00 . A A . 9 ARG CG 1 1 11 3810 1 1 9 ARG CZ C -8.104 -3.545 5.334 1.00 . A A . 9 ARG CZ 1 1 11 3811 1 1 9 ARG H H -4.389 -1.250 2.848 1.00 . A A . 9 ARG H 1 1 11 3812 1 1 9 ARG HA H -3.637 -4.105 3.260 1.00 . A A . 9 ARG HA 1 1 11 3813 1 1 9 ARG HB2 H -5.776 -3.350 4.317 1.00 . A A . 9 ARG HB2 1 1 11 3814 1 1 9 ARG HB3 H -6.342 -2.737 2.773 1.00 . A A . 9 ARG HB3 1 1 11 3815 1 1 9 ARG HD2 H -8.403 -4.263 2.818 1.00 . A A . 9 ARG HD2 1 1 11 3816 1 1 9 ARG HD3 H -8.170 -5.969 3.145 1.00 . A A . 9 ARG HD3 1 1 11 3817 1 1 9 ARG HE H -7.777 -5.495 5.439 1.00 . A A . 9 ARG HE 1 1 11 3818 1 1 9 ARG HG2 H -6.265 -5.021 1.841 1.00 . A A . 9 ARG HG2 1 1 11 3819 1 1 9 ARG HG3 H -5.735 -5.663 3.387 1.00 . A A . 9 ARG HG3 1 1 11 3820 1 1 9 ARG HH11 H -8.209 -2.592 3.568 1.00 . A A . 9 ARG HH11 1 1 11 3821 1 1 9 ARG HH12 H -8.421 -1.602 4.970 1.00 . A A . 9 ARG HH12 1 1 11 3822 1 1 9 ARG HH21 H -8.041 -4.247 7.205 1.00 . A A . 9 ARG HH21 1 1 11 3823 1 1 9 ARG HH22 H -8.325 -2.545 7.051 1.00 . A A . 9 ARG HH22 1 1 11 3824 1 1 9 ARG N N -3.863 -2.002 3.181 1.00 . A A . 9 ARG N 1 1 11 3825 1 1 9 ARG NE N -7.886 -4.737 4.828 1.00 . A A . 9 ARG NE 1 1 11 3826 1 1 9 ARG NH1 N -8.257 -2.500 4.563 1.00 . A A . 9 ARG NH1 1 1 11 3827 1 1 9 ARG NH2 N -8.162 -3.437 6.631 1.00 . A A . 9 ARG NH2 1 1 11 3828 1 1 9 ARG O O -4.988 -3.136 0.492 1.00 . A A . 9 ARG O 1 1 11 3829 1 1 10 LYS C C -3.389 -4.959 -1.274 1.00 . A A . 10 LYS C 1 1 11 3830 1 1 10 LYS CA C -2.463 -4.036 -0.478 1.00 . A A . 10 LYS CA 1 1 11 3831 1 1 10 LYS CB C -1.051 -4.608 -0.418 1.00 . A A . 10 LYS CB 1 1 11 3832 1 1 10 LYS CD C 0.248 -6.589 0.527 1.00 . A A . 10 LYS CD 1 1 11 3833 1 1 10 LYS CE C 1.052 -6.696 -0.772 1.00 . A A . 10 LYS CE 1 1 11 3834 1 1 10 LYS CG C -1.129 -5.998 0.278 1.00 . A A . 10 LYS CG 1 1 11 3835 1 1 10 LYS H H -2.287 -4.078 1.657 1.00 . A A . 10 LYS H 1 1 11 3836 1 1 10 LYS HA H -2.473 -3.072 -0.959 1.00 . A A . 10 LYS HA 1 1 11 3837 1 1 10 LYS HB2 H -0.667 -4.704 -1.423 1.00 . A A . 10 LYS HB2 1 1 11 3838 1 1 10 LYS HB3 H -0.404 -3.953 0.144 1.00 . A A . 10 LYS HB3 1 1 11 3839 1 1 10 LYS HD2 H 0.760 -5.970 1.244 1.00 . A A . 10 LYS HD2 1 1 11 3840 1 1 10 LYS HD3 H 0.113 -7.572 0.952 1.00 . A A . 10 LYS HD3 1 1 11 3841 1 1 10 LYS HE2 H 1.214 -5.715 -1.189 1.00 . A A . 10 LYS HE2 1 1 11 3842 1 1 10 LYS HE3 H 2.005 -7.151 -0.559 1.00 . A A . 10 LYS HE3 1 1 11 3843 1 1 10 LYS HG2 H -1.630 -5.906 1.231 1.00 . A A . 10 LYS HG2 1 1 11 3844 1 1 10 LYS HG3 H -1.689 -6.688 -0.335 1.00 . A A . 10 LYS HG3 1 1 11 3845 1 1 10 LYS HZ1 H 0.056 -8.440 -1.327 1.00 . A A . 10 LYS HZ1 1 1 11 3846 1 1 10 LYS HZ2 H -0.519 -7.038 -2.092 1.00 . A A . 10 LYS HZ2 1 1 11 3847 1 1 10 LYS HZ3 H 0.954 -7.726 -2.582 1.00 . A A . 10 LYS HZ3 1 1 11 3848 1 1 10 LYS N N -2.919 -3.863 0.940 1.00 . A A . 10 LYS N 1 1 11 3849 1 1 10 LYS NZ N 0.332 -7.540 -1.769 1.00 . A A . 10 LYS NZ 1 1 11 3850 1 1 10 LYS O O -3.485 -4.866 -2.483 1.00 . A A . 10 LYS O 1 1 11 3851 1 1 11 THR C C -5.926 -6.140 -2.065 1.00 . A A . 11 THR C 1 1 11 3852 1 1 11 THR CA C -4.990 -6.824 -1.060 1.00 . A A . 11 THR CA 1 1 11 3853 1 1 11 THR CB C -5.767 -7.370 0.137 1.00 . A A . 11 THR CB 1 1 11 3854 1 1 11 THR CG2 C -6.634 -8.588 -0.227 1.00 . A A . 11 THR CG2 1 1 11 3855 1 1 11 THR H H -3.863 -5.801 0.441 1.00 . A A . 11 THR H 1 1 11 3856 1 1 11 THR HA H -4.438 -7.608 -1.558 1.00 . A A . 11 THR HA 1 1 11 3857 1 1 11 THR HB H -6.303 -6.570 0.636 1.00 . A A . 11 THR HB 1 1 11 3858 1 1 11 THR HG1 H -4.196 -8.471 0.486 1.00 . A A . 11 THR HG1 1 1 11 3859 1 1 11 THR HG21 H -6.017 -9.391 -0.605 1.00 . A A . 11 THR HG21 1 1 11 3860 1 1 11 THR HG22 H -7.162 -8.938 0.647 1.00 . A A . 11 THR HG22 1 1 11 3861 1 1 11 THR HG23 H -7.356 -8.325 -0.982 1.00 . A A . 11 THR HG23 1 1 11 3862 1 1 11 THR N N -4.027 -5.818 -0.525 1.00 . A A . 11 THR N 1 1 11 3863 1 1 11 THR O O -6.178 -6.628 -3.149 1.00 . A A . 11 THR O 1 1 11 3864 1 1 11 THR OG1 O -4.774 -7.905 1.003 1.00 . A A . 11 THR OG1 1 1 11 3865 1 1 12 MET C C -6.637 -2.815 -2.804 1.00 . A A . 12 MET C 1 1 11 3866 1 1 12 MET CA C -7.319 -4.121 -2.381 1.00 . A A . 12 MET CA 1 1 11 3867 1 1 12 MET CB C -8.532 -3.799 -1.491 1.00 . A A . 12 MET CB 1 1 11 3868 1 1 12 MET CE C -9.154 -7.026 -3.179 1.00 . A A . 12 MET CE 1 1 11 3869 1 1 12 MET CG C -9.391 -5.042 -1.215 1.00 . A A . 12 MET CG 1 1 11 3870 1 1 12 MET H H -6.083 -4.725 -0.720 1.00 . A A . 12 MET H 1 1 11 3871 1 1 12 MET HA H -7.646 -4.633 -3.274 1.00 . A A . 12 MET HA 1 1 11 3872 1 1 12 MET HB2 H -8.185 -3.394 -0.551 1.00 . A A . 12 MET HB2 1 1 11 3873 1 1 12 MET HB3 H -9.149 -3.054 -1.972 1.00 . A A . 12 MET HB3 1 1 11 3874 1 1 12 MET HE1 H -8.533 -7.346 -2.358 1.00 . A A . 12 MET HE1 1 1 11 3875 1 1 12 MET HE2 H -9.715 -7.884 -3.518 1.00 . A A . 12 MET HE2 1 1 11 3876 1 1 12 MET HE3 H -8.546 -6.638 -3.982 1.00 . A A . 12 MET HE3 1 1 11 3877 1 1 12 MET HG2 H -8.766 -5.811 -0.785 1.00 . A A . 12 MET HG2 1 1 11 3878 1 1 12 MET HG3 H -10.113 -4.764 -0.464 1.00 . A A . 12 MET HG3 1 1 11 3879 1 1 12 MET N N -6.384 -5.003 -1.612 1.00 . A A . 12 MET N 1 1 11 3880 1 1 12 MET O O -7.271 -1.985 -3.428 1.00 . A A . 12 MET O 1 1 11 3881 1 1 12 MET SD S -10.311 -5.760 -2.603 1.00 . A A . 12 MET SD 1 1 11 3882 1 1 13 TYR C C -5.374 -0.275 -2.203 1.00 . A A . 13 TYR C 1 1 11 3883 1 1 13 TYR CA C -4.588 -1.444 -2.801 1.00 . A A . 13 TYR CA 1 1 11 3884 1 1 13 TYR CB C -4.465 -1.368 -4.338 1.00 . A A . 13 TYR CB 1 1 11 3885 1 1 13 TYR CD1 C -2.379 -2.774 -4.622 1.00 . A A . 13 TYR CD1 1 1 11 3886 1 1 13 TYR CD2 C -4.453 -3.699 -5.336 1.00 . A A . 13 TYR CD2 1 1 11 3887 1 1 13 TYR CE1 C -1.731 -3.927 -5.009 1.00 . A A . 13 TYR CE1 1 1 11 3888 1 1 13 TYR CE2 C -3.804 -4.853 -5.723 1.00 . A A . 13 TYR CE2 1 1 11 3889 1 1 13 TYR CG C -3.745 -2.650 -4.782 1.00 . A A . 13 TYR CG 1 1 11 3890 1 1 13 TYR CZ C -2.439 -4.973 -5.562 1.00 . A A . 13 TYR CZ 1 1 11 3891 1 1 13 TYR H H -4.937 -3.390 -1.963 1.00 . A A . 13 TYR H 1 1 11 3892 1 1 13 TYR HA H -3.618 -1.502 -2.331 1.00 . A A . 13 TYR HA 1 1 11 3893 1 1 13 TYR HB2 H -5.437 -1.328 -4.801 1.00 . A A . 13 TYR HB2 1 1 11 3894 1 1 13 TYR HB3 H -3.885 -0.508 -4.639 1.00 . A A . 13 TYR HB3 1 1 11 3895 1 1 13 TYR HD1 H -1.815 -1.962 -4.188 1.00 . A A . 13 TYR HD1 1 1 11 3896 1 1 13 TYR HD2 H -5.524 -3.620 -5.467 1.00 . A A . 13 TYR HD2 1 1 11 3897 1 1 13 TYR HE1 H -0.661 -4.009 -4.878 1.00 . A A . 13 TYR HE1 1 1 11 3898 1 1 13 TYR HE2 H -4.368 -5.666 -6.155 1.00 . A A . 13 TYR HE2 1 1 11 3899 1 1 13 TYR HH H -1.702 -6.111 -6.903 1.00 . A A . 13 TYR HH 1 1 11 3900 1 1 13 TYR N N -5.377 -2.672 -2.459 1.00 . A A . 13 TYR N 1 1 11 3901 1 1 13 TYR O O -5.955 0.563 -2.865 1.00 . A A . 13 TYR O 1 1 11 3902 1 1 13 TYR OH O -1.790 -6.127 -5.948 1.00 . A A . 13 TYR OH 1 1 11 3903 1 1 14 ASP C C -5.218 1.980 0.143 1.00 . A A . 14 ASP C 1 1 11 3904 1 1 14 ASP CA C -5.982 0.655 0.005 1.00 . A A . 14 ASP CA 1 1 11 3905 1 1 14 ASP CB C -6.133 -0.125 1.329 1.00 . A A . 14 ASP CB 1 1 11 3906 1 1 14 ASP CG C -6.647 0.717 2.509 1.00 . A A . 14 ASP CG 1 1 11 3907 1 1 14 ASP H H -4.803 -1.047 -0.494 1.00 . A A . 14 ASP H 1 1 11 3908 1 1 14 ASP HA H -6.964 0.872 -0.388 1.00 . A A . 14 ASP HA 1 1 11 3909 1 1 14 ASP HB2 H -6.843 -0.912 1.171 1.00 . A A . 14 ASP HB2 1 1 11 3910 1 1 14 ASP HB3 H -5.208 -0.620 1.565 1.00 . A A . 14 ASP HB3 1 1 11 3911 1 1 14 ASP N N -5.319 -0.321 -0.901 1.00 . A A . 14 ASP N 1 1 11 3912 1 1 14 ASP O O -5.550 2.794 0.981 1.00 . A A . 14 ASP O 1 1 11 3913 1 1 14 ASP OD1 O -7.670 1.363 2.337 1.00 . A A . 14 ASP OD1 1 1 11 3914 1 1 14 ASP OD2 O -5.976 0.661 3.526 1.00 . A A . 14 ASP OD2 1 1 11 3915 1 1 15 CYS C C -3.746 4.385 -1.772 1.00 . A A . 15 CYS C 1 1 11 3916 1 1 15 CYS CA C -3.405 3.415 -0.647 1.00 . A A . 15 CYS CA 1 1 11 3917 1 1 15 CYS CB C -1.941 3.065 -0.762 1.00 . A A . 15 CYS CB 1 1 11 3918 1 1 15 CYS H H -4.015 1.452 -1.334 1.00 . A A . 15 CYS H 1 1 11 3919 1 1 15 CYS HA H -3.556 3.919 0.294 1.00 . A A . 15 CYS HA 1 1 11 3920 1 1 15 CYS HB2 H -1.786 2.582 -1.714 1.00 . A A . 15 CYS HB2 1 1 11 3921 1 1 15 CYS HB3 H -1.354 3.973 -0.752 1.00 . A A . 15 CYS HB3 1 1 11 3922 1 1 15 CYS N N -4.223 2.158 -0.685 1.00 . A A . 15 CYS N 1 1 11 3923 1 1 15 CYS O O -4.224 3.995 -2.820 1.00 . A A . 15 CYS O 1 1 11 3924 1 1 15 CYS SG S -1.291 1.979 0.521 1.00 . A A . 15 CYS SG 1 1 11 3925 1 1 16 CYS C C -2.760 6.498 -3.642 1.00 . A A . 16 CYS C 1 1 11 3926 1 1 16 CYS CA C -3.729 6.730 -2.469 1.00 . A A . 16 CYS CA 1 1 11 3927 1 1 16 CYS CB C -3.450 8.057 -1.770 1.00 . A A . 16 CYS CB 1 1 11 3928 1 1 16 CYS H H -3.093 5.875 -0.627 1.00 . A A . 16 CYS H 1 1 11 3929 1 1 16 CYS HA H -4.750 6.670 -2.816 1.00 . A A . 16 CYS HA 1 1 11 3930 1 1 16 CYS HB2 H -2.403 8.091 -1.505 1.00 . A A . 16 CYS HB2 1 1 11 3931 1 1 16 CYS HB3 H -3.631 8.860 -2.461 1.00 . A A . 16 CYS HB3 1 1 11 3932 1 1 16 CYS N N -3.474 5.636 -1.494 1.00 . A A . 16 CYS N 1 1 11 3933 1 1 16 CYS O O -3.038 6.830 -4.778 1.00 . A A . 16 CYS O 1 1 11 3934 1 1 16 CYS SG S -4.392 8.409 -0.266 1.00 . A A . 16 CYS SG 1 1 11 3935 1 1 17 SER C C -0.921 4.287 -4.977 1.00 . A A . 17 SER C 1 1 11 3936 1 1 17 SER CA C -0.551 5.591 -4.246 1.00 . A A . 17 SER CA 1 1 11 3937 1 1 17 SER CB C 0.748 5.420 -3.451 1.00 . A A . 17 SER CB 1 1 11 3938 1 1 17 SER H H -1.508 5.693 -2.339 1.00 . A A . 17 SER H 1 1 11 3939 1 1 17 SER HA H -0.457 6.392 -4.967 1.00 . A A . 17 SER HA 1 1 11 3940 1 1 17 SER HB2 H 0.982 6.309 -2.887 1.00 . A A . 17 SER HB2 1 1 11 3941 1 1 17 SER HB3 H 0.692 4.570 -2.786 1.00 . A A . 17 SER HB3 1 1 11 3942 1 1 17 SER HG H 1.545 4.343 -4.861 1.00 . A A . 17 SER HG 1 1 11 3943 1 1 17 SER N N -1.639 5.920 -3.283 1.00 . A A . 17 SER N 1 1 11 3944 1 1 17 SER O O -0.498 4.058 -6.093 1.00 . A A . 17 SER O 1 1 11 3945 1 1 17 SER OG O 1.746 5.179 -4.434 1.00 . A A . 17 SER OG 1 1 11 3946 1 1 18 GLY C C -1.018 1.143 -4.984 1.00 . A A . 18 GLY C 1 1 11 3947 1 1 18 GLY CA C -2.155 2.171 -4.879 1.00 . A A . 18 GLY CA 1 1 11 3948 1 1 18 GLY H H -2.005 3.733 -3.408 1.00 . A A . 18 GLY H 1 1 11 3949 1 1 18 GLY HA2 H -2.924 1.767 -4.238 1.00 . A A . 18 GLY HA2 1 1 11 3950 1 1 18 GLY HA3 H -2.566 2.342 -5.861 1.00 . A A . 18 GLY HA3 1 1 11 3951 1 1 18 GLY N N -1.705 3.477 -4.306 1.00 . A A . 18 GLY N 1 1 11 3952 1 1 18 GLY O O -1.200 0.093 -5.569 1.00 . A A . 18 GLY O 1 1 11 3953 1 1 19 SER C C 1.669 0.198 -2.992 1.00 . A A . 19 SER C 1 1 11 3954 1 1 19 SER CA C 1.307 0.577 -4.437 1.00 . A A . 19 SER CA 1 1 11 3955 1 1 19 SER CB C 2.462 1.336 -5.140 1.00 . A A . 19 SER CB 1 1 11 3956 1 1 19 SER H H 0.182 2.345 -3.962 1.00 . A A . 19 SER H 1 1 11 3957 1 1 19 SER HA H 1.079 -0.326 -4.984 1.00 . A A . 19 SER HA 1 1 11 3958 1 1 19 SER HB2 H 3.372 0.753 -5.149 1.00 . A A . 19 SER HB2 1 1 11 3959 1 1 19 SER HB3 H 2.192 1.615 -6.148 1.00 . A A . 19 SER HB3 1 1 11 3960 1 1 19 SER HG H 3.153 2.271 -3.577 1.00 . A A . 19 SER HG 1 1 11 3961 1 1 19 SER N N 0.113 1.480 -4.414 1.00 . A A . 19 SER N 1 1 11 3962 1 1 19 SER O O 2.757 0.459 -2.511 1.00 . A A . 19 SER O 1 1 11 3963 1 1 19 SER OG O 2.660 2.512 -4.365 1.00 . A A . 19 SER OG 1 1 11 3964 1 1 20 CYS C C 1.824 -2.089 -0.827 1.00 . A A . 20 CYS C 1 1 11 3965 1 1 20 CYS CA C 0.928 -0.847 -0.924 1.00 . A A . 20 CYS CA 1 1 11 3966 1 1 20 CYS CB C -0.436 -1.130 -0.297 1.00 . A A . 20 CYS CB 1 1 11 3967 1 1 20 CYS H H -0.137 -0.604 -2.780 1.00 . A A . 20 CYS H 1 1 11 3968 1 1 20 CYS HA H 1.401 -0.039 -0.391 1.00 . A A . 20 CYS HA 1 1 11 3969 1 1 20 CYS HB2 H -1.030 -0.233 -0.360 1.00 . A A . 20 CYS HB2 1 1 11 3970 1 1 20 CYS HB3 H -0.943 -1.869 -0.881 1.00 . A A . 20 CYS HB3 1 1 11 3971 1 1 20 CYS N N 0.718 -0.420 -2.338 1.00 . A A . 20 CYS N 1 1 11 3972 1 1 20 CYS O O 1.550 -3.118 -1.412 1.00 . A A . 20 CYS O 1 1 11 3973 1 1 20 CYS SG S -0.436 -1.677 1.426 1.00 . A A . 20 CYS SG 1 1 11 3974 1 1 21 GLY C C 3.359 -4.184 0.980 1.00 . A A . 21 GLY C 1 1 11 3975 1 1 21 GLY CA C 3.885 -2.998 0.160 1.00 . A A . 21 GLY CA 1 1 11 3976 1 1 21 GLY H H 3.011 -1.053 0.357 1.00 . A A . 21 GLY H 1 1 11 3977 1 1 21 GLY HA2 H 4.226 -3.363 -0.798 1.00 . A A . 21 GLY HA2 1 1 11 3978 1 1 21 GLY HA3 H 4.728 -2.569 0.683 1.00 . A A . 21 GLY HA3 1 1 11 3979 1 1 21 GLY N N 2.879 -1.921 -0.071 1.00 . A A . 21 GLY N 1 1 11 3980 1 1 21 GLY O O 2.293 -4.146 1.563 1.00 . A A . 21 GLY O 1 1 11 3981 1 1 22 ARG C C 4.033 -6.272 3.213 1.00 . A A . 22 ARG C 1 1 11 3982 1 1 22 ARG CA C 3.908 -6.485 1.700 1.00 . A A . 22 ARG CA 1 1 11 3983 1 1 22 ARG CB C 4.925 -7.533 1.194 1.00 . A A . 22 ARG CB 1 1 11 3984 1 1 22 ARG CD C 5.687 -9.927 1.283 1.00 . A A . 22 ARG CD 1 1 11 3985 1 1 22 ARG CG C 4.669 -8.914 1.839 1.00 . A A . 22 ARG CG 1 1 11 3986 1 1 22 ARG CZ C 4.440 -12.035 1.488 1.00 . A A . 22 ARG CZ 1 1 11 3987 1 1 22 ARG H H 5.020 -5.096 0.489 1.00 . A A . 22 ARG H 1 1 11 3988 1 1 22 ARG HA H 2.902 -6.803 1.476 1.00 . A A . 22 ARG HA 1 1 11 3989 1 1 22 ARG HB2 H 4.839 -7.617 0.120 1.00 . A A . 22 ARG HB2 1 1 11 3990 1 1 22 ARG HB3 H 5.926 -7.204 1.430 1.00 . A A . 22 ARG HB3 1 1 11 3991 1 1 22 ARG HD2 H 5.612 -10.006 0.208 1.00 . A A . 22 ARG HD2 1 1 11 3992 1 1 22 ARG HD3 H 6.692 -9.628 1.543 1.00 . A A . 22 ARG HD3 1 1 11 3993 1 1 22 ARG HE H 5.989 -11.576 2.635 1.00 . A A . 22 ARG HE 1 1 11 3994 1 1 22 ARG HG2 H 4.788 -8.858 2.910 1.00 . A A . 22 ARG HG2 1 1 11 3995 1 1 22 ARG HG3 H 3.662 -9.240 1.620 1.00 . A A . 22 ARG HG3 1 1 11 3996 1 1 22 ARG HH11 H 3.798 -10.768 0.071 1.00 . A A . 22 ARG HH11 1 1 11 3997 1 1 22 ARG HH12 H 2.917 -12.252 0.206 1.00 . A A . 22 ARG HH12 1 1 11 3998 1 1 22 ARG HH21 H 4.885 -13.459 2.823 1.00 . A A . 22 ARG HH21 1 1 11 3999 1 1 22 ARG HH22 H 3.538 -13.797 1.785 1.00 . A A . 22 ARG HH22 1 1 11 4000 1 1 22 ARG N N 4.183 -5.199 0.980 1.00 . A A . 22 ARG N 1 1 11 4001 1 1 22 ARG NE N 5.418 -11.265 1.902 1.00 . A A . 22 ARG NE 1 1 11 4002 1 1 22 ARG NH1 N 3.658 -11.654 0.512 1.00 . A A . 22 ARG NH1 1 1 11 4003 1 1 22 ARG NH2 N 4.275 -13.186 2.079 1.00 . A A . 22 ARG NH2 1 1 11 4004 1 1 22 ARG O O 3.542 -7.058 4.001 1.00 . A A . 22 ARG O 1 1 11 4005 1 1 23 ARG C C 3.604 -4.208 5.556 1.00 . A A . 23 ARG C 1 1 11 4006 1 1 23 ARG CA C 4.893 -4.842 4.998 1.00 . A A . 23 ARG CA 1 1 11 4007 1 1 23 ARG CB C 6.086 -3.858 5.086 1.00 . A A . 23 ARG CB 1 1 11 4008 1 1 23 ARG CD C 6.995 -1.626 4.331 1.00 . A A . 23 ARG CD 1 1 11 4009 1 1 23 ARG CG C 5.811 -2.598 4.228 1.00 . A A . 23 ARG CG 1 1 11 4010 1 1 23 ARG CZ C 7.330 0.692 3.594 1.00 . A A . 23 ARG CZ 1 1 11 4011 1 1 23 ARG H H 5.052 -4.609 2.868 1.00 . A A . 23 ARG H 1 1 11 4012 1 1 23 ARG HA H 5.114 -5.740 5.559 1.00 . A A . 23 ARG HA 1 1 11 4013 1 1 23 ARG HB2 H 6.242 -3.571 6.117 1.00 . A A . 23 ARG HB2 1 1 11 4014 1 1 23 ARG HB3 H 6.981 -4.350 4.731 1.00 . A A . 23 ARG HB3 1 1 11 4015 1 1 23 ARG HD2 H 7.129 -1.307 5.355 1.00 . A A . 23 ARG HD2 1 1 11 4016 1 1 23 ARG HD3 H 7.905 -2.086 3.972 1.00 . A A . 23 ARG HD3 1 1 11 4017 1 1 23 ARG HE H 5.961 -0.506 2.814 1.00 . A A . 23 ARG HE 1 1 11 4018 1 1 23 ARG HG2 H 5.672 -2.873 3.193 1.00 . A A . 23 ARG HG2 1 1 11 4019 1 1 23 ARG HG3 H 4.914 -2.109 4.575 1.00 . A A . 23 ARG HG3 1 1 11 4020 1 1 23 ARG HH11 H 8.548 0.053 5.055 1.00 . A A . 23 ARG HH11 1 1 11 4021 1 1 23 ARG HH12 H 8.782 1.691 4.545 1.00 . A A . 23 ARG HH12 1 1 11 4022 1 1 23 ARG HH21 H 6.239 1.557 2.156 1.00 . A A . 23 ARG HH21 1 1 11 4023 1 1 23 ARG HH22 H 7.457 2.556 2.876 1.00 . A A . 23 ARG HH22 1 1 11 4024 1 1 23 ARG N N 4.687 -5.196 3.562 1.00 . A A . 23 ARG N 1 1 11 4025 1 1 23 ARG NE N 6.680 -0.439 3.477 1.00 . A A . 23 ARG NE 1 1 11 4026 1 1 23 ARG NH1 N 8.295 0.821 4.466 1.00 . A A . 23 ARG NH1 1 1 11 4027 1 1 23 ARG NH2 N 6.981 1.678 2.814 1.00 . A A . 23 ARG NH2 1 1 11 4028 1 1 23 ARG O O 3.566 -3.775 6.691 1.00 . A A . 23 ARG O 1 1 11 4029 1 1 24 GLY C C 1.324 -2.069 5.158 1.00 . A A . 24 GLY C 1 1 11 4030 1 1 24 GLY CA C 1.275 -3.595 5.124 1.00 . A A . 24 GLY CA 1 1 11 4031 1 1 24 GLY H H 2.685 -4.538 3.819 1.00 . A A . 24 GLY H 1 1 11 4032 1 1 24 GLY HA2 H 0.528 -3.902 4.406 1.00 . A A . 24 GLY HA2 1 1 11 4033 1 1 24 GLY HA3 H 1.000 -3.965 6.100 1.00 . A A . 24 GLY HA3 1 1 11 4034 1 1 24 GLY N N 2.588 -4.177 4.725 1.00 . A A . 24 GLY N 1 1 11 4035 1 1 24 GLY O O 0.469 -1.456 5.766 1.00 . A A . 24 GLY O 1 1 11 4036 1 1 25 LYS C C 2.349 0.436 3.031 1.00 . A A . 25 LYS C 1 1 11 4037 1 1 25 LYS CA C 2.451 -0.008 4.483 1.00 . A A . 25 LYS CA 1 1 11 4038 1 1 25 LYS CB C 3.816 0.429 5.034 1.00 . A A . 25 LYS CB 1 1 11 4039 1 1 25 LYS CD C 3.019 0.533 7.446 1.00 . A A . 25 LYS CD 1 1 11 4040 1 1 25 LYS CE C 3.239 -0.025 8.863 1.00 . A A . 25 LYS CE 1 1 11 4041 1 1 25 LYS CG C 4.050 -0.084 6.473 1.00 . A A . 25 LYS CG 1 1 11 4042 1 1 25 LYS H H 2.970 -2.066 4.032 1.00 . A A . 25 LYS H 1 1 11 4043 1 1 25 LYS HA H 1.648 0.451 5.038 1.00 . A A . 25 LYS HA 1 1 11 4044 1 1 25 LYS HB2 H 4.584 0.082 4.369 1.00 . A A . 25 LYS HB2 1 1 11 4045 1 1 25 LYS HB3 H 3.857 1.508 5.043 1.00 . A A . 25 LYS HB3 1 1 11 4046 1 1 25 LYS HD2 H 3.140 1.605 7.469 1.00 . A A . 25 LYS HD2 1 1 11 4047 1 1 25 LYS HD3 H 2.015 0.310 7.125 1.00 . A A . 25 LYS HD3 1 1 11 4048 1 1 25 LYS HE2 H 2.514 0.398 9.544 1.00 . A A . 25 LYS HE2 1 1 11 4049 1 1 25 LYS HE3 H 3.133 -1.100 8.864 1.00 . A A . 25 LYS HE3 1 1 11 4050 1 1 25 LYS HG2 H 3.973 -1.161 6.495 1.00 . A A . 25 LYS HG2 1 1 11 4051 1 1 25 LYS HG3 H 5.048 0.189 6.781 1.00 . A A . 25 LYS HG3 1 1 11 4052 1 1 25 LYS HZ1 H 4.808 1.317 9.136 1.00 . A A . 25 LYS HZ1 1 1 11 4053 1 1 25 LYS HZ2 H 4.656 0.169 10.378 1.00 . A A . 25 LYS HZ2 1 1 11 4054 1 1 25 LYS HZ3 H 5.305 -0.285 8.874 1.00 . A A . 25 LYS HZ3 1 1 11 4055 1 1 25 LYS N N 2.315 -1.504 4.509 1.00 . A A . 25 LYS N 1 1 11 4056 1 1 25 LYS NZ N 4.606 0.320 9.349 1.00 . A A . 25 LYS NZ 1 1 11 4057 1 1 25 LYS O O 2.534 -0.359 2.133 1.00 . A A . 25 LYS O 1 1 11 4058 1 1 26 CYS C C 3.271 2.579 0.793 1.00 . A A . 26 CYS C 1 1 11 4059 1 1 26 CYS CA C 1.937 2.234 1.457 1.00 . A A . 26 CYS CA 1 1 11 4060 1 1 26 CYS CB C 1.046 3.466 1.509 1.00 . A A . 26 CYS CB 1 1 11 4061 1 1 26 CYS H H 1.934 2.279 3.620 1.00 . A A . 26 CYS H 1 1 11 4062 1 1 26 CYS HA H 1.435 1.500 0.849 1.00 . A A . 26 CYS HA 1 1 11 4063 1 1 26 CYS HB2 H 1.477 4.159 2.206 1.00 . A A . 26 CYS HB2 1 1 11 4064 1 1 26 CYS HB3 H 1.021 3.929 0.539 1.00 . A A . 26 CYS HB3 1 1 11 4065 1 1 26 CYS N N 2.063 1.696 2.844 1.00 . A A . 26 CYS N 1 1 11 4066 1 1 26 CYS O O 4.296 2.715 1.432 1.00 . A A . 26 CYS O 1 1 11 4067 1 1 26 CYS SG S -0.666 3.189 2.012 1.00 . A A . 26 CYS SG 1 1 11 4068 1 1 27 NH2 HN1 H 2.451 2.614 -1.013 1.00 . A A . 27 NH2 HN1 1 1 11 4069 1 1 27 NH2 HN2 H 4.112 2.944 -0.975 1.00 . A A . 27 NH2 HN2 1 1 11 4070 1 1 27 NH2 N N 3.282 2.725 -0.505 1.00 . A A . 27 NH2 N 1 1 12 4071 1 1 1 CYS C C -6.082 6.237 1.964 1.00 . A A . 1 CYS C 1 1 12 4072 1 1 1 CYS CA C -7.153 5.954 0.902 1.00 . A A . 1 CYS CA 1 1 12 4073 1 1 1 CYS CB C -6.684 6.484 -0.455 1.00 . A A . 1 CYS CB 1 1 12 4074 1 1 1 CYS H1 H -8.271 7.647 1.365 1.00 . A A . 1 CYS H1 1 1 12 4075 1 1 1 CYS H2 H -9.149 6.436 0.557 1.00 . A A . 1 CYS H2 1 1 12 4076 1 1 1 CYS H3 H -8.750 6.247 2.199 1.00 . A A . 1 CYS H3 1 1 12 4077 1 1 1 CYS HA H -7.315 4.889 0.854 1.00 . A A . 1 CYS HA 1 1 12 4078 1 1 1 CYS HB2 H -5.799 5.937 -0.736 1.00 . A A . 1 CYS HB2 1 1 12 4079 1 1 1 CYS HB3 H -7.445 6.258 -1.187 1.00 . A A . 1 CYS HB3 1 1 12 4080 1 1 1 CYS N N -8.428 6.622 1.284 1.00 . A A . 1 CYS N 1 1 12 4081 1 1 1 CYS O O -6.261 7.092 2.811 1.00 . A A . 1 CYS O 1 1 12 4082 1 1 1 CYS SG S -6.312 8.250 -0.587 1.00 . A A . 1 CYS SG 1 1 12 4083 1 1 2 LYS C C -2.612 6.215 2.154 1.00 . A A . 2 LYS C 1 1 12 4084 1 1 2 LYS CA C -3.870 5.668 2.850 1.00 . A A . 2 LYS CA 1 1 12 4085 1 1 2 LYS CB C -3.576 4.286 3.488 1.00 . A A . 2 LYS CB 1 1 12 4086 1 1 2 LYS CD C -5.290 4.635 5.358 1.00 . A A . 2 LYS CD 1 1 12 4087 1 1 2 LYS CE C -6.516 4.002 6.034 1.00 . A A . 2 LYS CE 1 1 12 4088 1 1 2 LYS CG C -4.818 3.709 4.215 1.00 . A A . 2 LYS CG 1 1 12 4089 1 1 2 LYS H H -4.927 4.836 1.165 1.00 . A A . 2 LYS H 1 1 12 4090 1 1 2 LYS HA H -4.153 6.367 3.621 1.00 . A A . 2 LYS HA 1 1 12 4091 1 1 2 LYS HB2 H -3.274 3.592 2.718 1.00 . A A . 2 LYS HB2 1 1 12 4092 1 1 2 LYS HB3 H -2.772 4.372 4.199 1.00 . A A . 2 LYS HB3 1 1 12 4093 1 1 2 LYS HD2 H -4.499 4.762 6.083 1.00 . A A . 2 LYS HD2 1 1 12 4094 1 1 2 LYS HD3 H -5.570 5.603 4.972 1.00 . A A . 2 LYS HD3 1 1 12 4095 1 1 2 LYS HE2 H -7.316 3.873 5.319 1.00 . A A . 2 LYS HE2 1 1 12 4096 1 1 2 LYS HE3 H -6.261 3.040 6.455 1.00 . A A . 2 LYS HE3 1 1 12 4097 1 1 2 LYS HG2 H -5.625 3.573 3.512 1.00 . A A . 2 LYS HG2 1 1 12 4098 1 1 2 LYS HG3 H -4.556 2.745 4.624 1.00 . A A . 2 LYS HG3 1 1 12 4099 1 1 2 LYS HZ1 H -7.048 5.867 6.783 1.00 . A A . 2 LYS HZ1 1 1 12 4100 1 1 2 LYS HZ2 H -7.945 4.579 7.432 1.00 . A A . 2 LYS HZ2 1 1 12 4101 1 1 2 LYS HZ3 H -6.343 4.836 7.934 1.00 . A A . 2 LYS HZ3 1 1 12 4102 1 1 2 LYS N N -4.999 5.505 1.878 1.00 . A A . 2 LYS N 1 1 12 4103 1 1 2 LYS NZ N -6.999 4.887 7.129 1.00 . A A . 2 LYS NZ 1 1 12 4104 1 1 2 LYS O O -2.079 5.599 1.252 1.00 . A A . 2 LYS O 1 1 12 4105 1 1 3 GLY C C 0.280 7.116 2.102 1.00 . A A . 3 GLY C 1 1 12 4106 1 1 3 GLY CA C -0.957 8.028 2.018 1.00 . A A . 3 GLY CA 1 1 12 4107 1 1 3 GLY H H -2.662 7.807 3.328 1.00 . A A . 3 GLY H 1 1 12 4108 1 1 3 GLY HA2 H -1.147 8.269 0.982 1.00 . A A . 3 GLY HA2 1 1 12 4109 1 1 3 GLY HA3 H -0.758 8.939 2.562 1.00 . A A . 3 GLY HA3 1 1 12 4110 1 1 3 GLY N N -2.176 7.369 2.599 1.00 . A A . 3 GLY N 1 1 12 4111 1 1 3 GLY O O 0.245 6.105 2.770 1.00 . A A . 3 GLY O 1 1 12 4112 1 1 4 LYS C C 3.089 6.283 2.845 1.00 . A A . 4 LYS C 1 1 12 4113 1 1 4 LYS CA C 2.595 6.685 1.437 1.00 . A A . 4 LYS CA 1 1 12 4114 1 1 4 LYS CB C 3.673 7.501 0.691 1.00 . A A . 4 LYS CB 1 1 12 4115 1 1 4 LYS CD C 5.014 9.611 0.538 1.00 . A A . 4 LYS CD 1 1 12 4116 1 1 4 LYS CE C 5.298 10.978 1.183 1.00 . A A . 4 LYS CE 1 1 12 4117 1 1 4 LYS CG C 3.938 8.872 1.358 1.00 . A A . 4 LYS CG 1 1 12 4118 1 1 4 LYS H H 1.323 8.323 0.907 1.00 . A A . 4 LYS H 1 1 12 4119 1 1 4 LYS HA H 2.410 5.786 0.868 1.00 . A A . 4 LYS HA 1 1 12 4120 1 1 4 LYS HB2 H 4.584 6.930 0.667 1.00 . A A . 4 LYS HB2 1 1 12 4121 1 1 4 LYS HB3 H 3.348 7.657 -0.328 1.00 . A A . 4 LYS HB3 1 1 12 4122 1 1 4 LYS HD2 H 5.919 9.022 0.512 1.00 . A A . 4 LYS HD2 1 1 12 4123 1 1 4 LYS HD3 H 4.665 9.750 -0.475 1.00 . A A . 4 LYS HD3 1 1 12 4124 1 1 4 LYS HE2 H 4.403 11.581 1.197 1.00 . A A . 4 LYS HE2 1 1 12 4125 1 1 4 LYS HE3 H 5.655 10.852 2.195 1.00 . A A . 4 LYS HE3 1 1 12 4126 1 1 4 LYS HG2 H 3.031 9.458 1.378 1.00 . A A . 4 LYS HG2 1 1 12 4127 1 1 4 LYS HG3 H 4.292 8.739 2.368 1.00 . A A . 4 LYS HG3 1 1 12 4128 1 1 4 LYS HZ1 H 6.048 11.757 -0.595 1.00 . A A . 4 LYS HZ1 1 1 12 4129 1 1 4 LYS HZ2 H 6.457 12.657 0.787 1.00 . A A . 4 LYS HZ2 1 1 12 4130 1 1 4 LYS HZ3 H 7.241 11.185 0.469 1.00 . A A . 4 LYS HZ3 1 1 12 4131 1 1 4 LYS N N 1.338 7.495 1.429 1.00 . A A . 4 LYS N 1 1 12 4132 1 1 4 LYS NZ N 6.339 11.699 0.401 1.00 . A A . 4 LYS NZ 1 1 12 4133 1 1 4 LYS O O 3.130 7.087 3.756 1.00 . A A . 4 LYS O 1 1 12 4134 1 1 5 GLY C C 2.855 4.258 5.301 1.00 . A A . 5 GLY C 1 1 12 4135 1 1 5 GLY CA C 3.950 4.440 4.236 1.00 . A A . 5 GLY CA 1 1 12 4136 1 1 5 GLY H H 3.370 4.448 2.169 1.00 . A A . 5 GLY H 1 1 12 4137 1 1 5 GLY HA2 H 4.378 3.474 4.017 1.00 . A A . 5 GLY HA2 1 1 12 4138 1 1 5 GLY HA3 H 4.724 5.076 4.636 1.00 . A A . 5 GLY HA3 1 1 12 4139 1 1 5 GLY N N 3.443 5.026 2.955 1.00 . A A . 5 GLY N 1 1 12 4140 1 1 5 GLY O O 3.145 3.816 6.396 1.00 . A A . 5 GLY O 1 1 12 4141 1 1 6 ALA C C -0.036 3.017 5.914 1.00 . A A . 6 ALA C 1 1 12 4142 1 1 6 ALA CA C 0.498 4.464 5.917 1.00 . A A . 6 ALA CA 1 1 12 4143 1 1 6 ALA CB C -0.610 5.438 5.498 1.00 . A A . 6 ALA CB 1 1 12 4144 1 1 6 ALA H H 1.479 4.943 4.051 1.00 . A A . 6 ALA H 1 1 12 4145 1 1 6 ALA HA H 0.846 4.719 6.906 1.00 . A A . 6 ALA HA 1 1 12 4146 1 1 6 ALA HB1 H -0.235 6.451 5.507 1.00 . A A . 6 ALA HB1 1 1 12 4147 1 1 6 ALA HB2 H -0.946 5.198 4.504 1.00 . A A . 6 ALA HB2 1 1 12 4148 1 1 6 ALA HB3 H -1.454 5.378 6.167 1.00 . A A . 6 ALA HB3 1 1 12 4149 1 1 6 ALA N N 1.639 4.599 4.954 1.00 . A A . 6 ALA N 1 1 12 4150 1 1 6 ALA O O 0.111 2.332 4.920 1.00 . A A . 6 ALA O 1 1 12 4151 1 1 7 PRO C C -2.187 0.751 6.230 1.00 . A A . 7 PRO C 1 1 12 4152 1 1 7 PRO CA C -1.061 1.170 7.196 1.00 . A A . 7 PRO CA 1 1 12 4153 1 1 7 PRO CB C -1.478 1.061 8.666 1.00 . A A . 7 PRO CB 1 1 12 4154 1 1 7 PRO CD C -0.971 3.438 8.195 1.00 . A A . 7 PRO CD 1 1 12 4155 1 1 7 PRO CG C -1.688 2.493 9.173 1.00 . A A . 7 PRO CG 1 1 12 4156 1 1 7 PRO HA H -0.203 0.535 7.028 1.00 . A A . 7 PRO HA 1 1 12 4157 1 1 7 PRO HB2 H -2.385 0.483 8.780 1.00 . A A . 7 PRO HB2 1 1 12 4158 1 1 7 PRO HB3 H -0.693 0.584 9.235 1.00 . A A . 7 PRO HB3 1 1 12 4159 1 1 7 PRO HD2 H -1.623 4.245 7.898 1.00 . A A . 7 PRO HD2 1 1 12 4160 1 1 7 PRO HD3 H -0.064 3.827 8.634 1.00 . A A . 7 PRO HD3 1 1 12 4161 1 1 7 PRO HG2 H -2.742 2.723 9.204 1.00 . A A . 7 PRO HG2 1 1 12 4162 1 1 7 PRO HG3 H -1.276 2.602 10.166 1.00 . A A . 7 PRO HG3 1 1 12 4163 1 1 7 PRO N N -0.636 2.589 7.008 1.00 . A A . 7 PRO N 1 1 12 4164 1 1 7 PRO O O -3.361 0.865 6.528 1.00 . A A . 7 PRO O 1 1 12 4165 1 1 8 CYS C C -2.792 -1.713 3.952 1.00 . A A . 8 CYS C 1 1 12 4166 1 1 8 CYS CA C -2.686 -0.191 4.015 1.00 . A A . 8 CYS CA 1 1 12 4167 1 1 8 CYS CB C -2.180 0.316 2.691 1.00 . A A . 8 CYS CB 1 1 12 4168 1 1 8 CYS H H -0.794 0.232 4.926 1.00 . A A . 8 CYS H 1 1 12 4169 1 1 8 CYS HA H -3.663 0.227 4.189 1.00 . A A . 8 CYS HA 1 1 12 4170 1 1 8 CYS HB2 H -2.696 -0.195 1.891 1.00 . A A . 8 CYS HB2 1 1 12 4171 1 1 8 CYS HB3 H -2.424 1.353 2.570 1.00 . A A . 8 CYS HB3 1 1 12 4172 1 1 8 CYS N N -1.760 0.278 5.089 1.00 . A A . 8 CYS N 1 1 12 4173 1 1 8 CYS O O -2.201 -2.438 4.729 1.00 . A A . 8 CYS O 1 1 12 4174 1 1 8 CYS SG S -0.417 0.011 2.443 1.00 . A A . 8 CYS SG 1 1 12 4175 1 1 9 ARG C C -3.738 -3.644 1.156 1.00 . A A . 9 ARG C 1 1 12 4176 1 1 9 ARG CA C -3.853 -3.534 2.694 1.00 . A A . 9 ARG CA 1 1 12 4177 1 1 9 ARG CB C -5.256 -3.812 3.194 1.00 . A A . 9 ARG CB 1 1 12 4178 1 1 9 ARG CD C -7.073 -5.514 3.496 1.00 . A A . 9 ARG CD 1 1 12 4179 1 1 9 ARG CG C -5.586 -5.301 3.122 1.00 . A A . 9 ARG CG 1 1 12 4180 1 1 9 ARG CZ C -7.732 -3.702 5.034 1.00 . A A . 9 ARG CZ 1 1 12 4181 1 1 9 ARG H H -4.004 -1.440 2.427 1.00 . A A . 9 ARG H 1 1 12 4182 1 1 9 ARG HA H -3.116 -4.167 3.168 1.00 . A A . 9 ARG HA 1 1 12 4183 1 1 9 ARG HB2 H -5.317 -3.474 4.219 1.00 . A A . 9 ARG HB2 1 1 12 4184 1 1 9 ARG HB3 H -5.958 -3.244 2.602 1.00 . A A . 9 ARG HB3 1 1 12 4185 1 1 9 ARG HD2 H -7.726 -5.051 2.771 1.00 . A A . 9 ARG HD2 1 1 12 4186 1 1 9 ARG HD3 H -7.289 -6.571 3.530 1.00 . A A . 9 ARG HD3 1 1 12 4187 1 1 9 ARG HE H -7.172 -5.502 5.648 1.00 . A A . 9 ARG HE 1 1 12 4188 1 1 9 ARG HG2 H -5.376 -5.660 2.131 1.00 . A A . 9 ARG HG2 1 1 12 4189 1 1 9 ARG HG3 H -4.963 -5.841 3.820 1.00 . A A . 9 ARG HG3 1 1 12 4190 1 1 9 ARG HH11 H -7.810 -3.237 3.081 1.00 . A A . 9 ARG HH11 1 1 12 4191 1 1 9 ARG HH12 H -8.256 -1.971 4.169 1.00 . A A . 9 ARG HH12 1 1 12 4192 1 1 9 ARG HH21 H -7.735 -3.904 7.022 1.00 . A A . 9 ARG HH21 1 1 12 4193 1 1 9 ARG HH22 H -8.216 -2.350 6.424 1.00 . A A . 9 ARG HH22 1 1 12 4194 1 1 9 ARG N N -3.574 -2.112 2.986 1.00 . A A . 9 ARG N 1 1 12 4195 1 1 9 ARG NE N -7.322 -4.939 4.860 1.00 . A A . 9 ARG NE 1 1 12 4196 1 1 9 ARG NH1 N -7.950 -2.911 4.016 1.00 . A A . 9 ARG NH1 1 1 12 4197 1 1 9 ARG NH2 N -7.908 -3.286 6.255 1.00 . A A . 9 ARG NH2 1 1 12 4198 1 1 9 ARG O O -4.642 -3.268 0.428 1.00 . A A . 9 ARG O 1 1 12 4199 1 1 10 LYS C C -3.424 -5.182 -1.421 1.00 . A A . 10 LYS C 1 1 12 4200 1 1 10 LYS CA C -2.346 -4.324 -0.747 1.00 . A A . 10 LYS CA 1 1 12 4201 1 1 10 LYS CB C -0.951 -4.985 -0.949 1.00 . A A . 10 LYS CB 1 1 12 4202 1 1 10 LYS CD C -1.055 -6.580 1.094 1.00 . A A . 10 LYS CD 1 1 12 4203 1 1 10 LYS CE C -0.838 -8.042 1.512 1.00 . A A . 10 LYS CE 1 1 12 4204 1 1 10 LYS CG C -0.832 -6.452 -0.431 1.00 . A A . 10 LYS CG 1 1 12 4205 1 1 10 LYS H H -1.927 -4.423 1.366 1.00 . A A . 10 LYS H 1 1 12 4206 1 1 10 LYS HA H -2.357 -3.351 -1.214 1.00 . A A . 10 LYS HA 1 1 12 4207 1 1 10 LYS HB2 H -0.697 -4.963 -1.999 1.00 . A A . 10 LYS HB2 1 1 12 4208 1 1 10 LYS HB3 H -0.226 -4.388 -0.419 1.00 . A A . 10 LYS HB3 1 1 12 4209 1 1 10 LYS HD2 H -0.379 -5.934 1.632 1.00 . A A . 10 LYS HD2 1 1 12 4210 1 1 10 LYS HD3 H -2.072 -6.322 1.348 1.00 . A A . 10 LYS HD3 1 1 12 4211 1 1 10 LYS HE2 H -1.539 -8.690 1.006 1.00 . A A . 10 LYS HE2 1 1 12 4212 1 1 10 LYS HE3 H 0.169 -8.357 1.274 1.00 . A A . 10 LYS HE3 1 1 12 4213 1 1 10 LYS HG2 H -1.548 -7.071 -0.952 1.00 . A A . 10 LYS HG2 1 1 12 4214 1 1 10 LYS HG3 H 0.158 -6.813 -0.672 1.00 . A A . 10 LYS HG3 1 1 12 4215 1 1 10 LYS HZ1 H -1.983 -7.819 3.236 1.00 . A A . 10 LYS HZ1 1 1 12 4216 1 1 10 LYS HZ2 H -0.969 -9.182 3.247 1.00 . A A . 10 LYS HZ2 1 1 12 4217 1 1 10 LYS HZ3 H -0.312 -7.633 3.481 1.00 . A A . 10 LYS HZ3 1 1 12 4218 1 1 10 LYS N N -2.611 -4.152 0.719 1.00 . A A . 10 LYS N 1 1 12 4219 1 1 10 LYS NZ N -1.042 -8.179 2.981 1.00 . A A . 10 LYS NZ 1 1 12 4220 1 1 10 LYS O O -3.578 -5.146 -2.627 1.00 . A A . 10 LYS O 1 1 12 4221 1 1 11 THR C C -6.121 -6.104 -2.067 1.00 . A A . 11 THR C 1 1 12 4222 1 1 11 THR CA C -5.233 -6.828 -1.050 1.00 . A A . 11 THR CA 1 1 12 4223 1 1 11 THR CB C -6.068 -7.218 0.168 1.00 . A A . 11 THR CB 1 1 12 4224 1 1 11 THR CG2 C -7.122 -8.292 -0.171 1.00 . A A . 11 THR CG2 1 1 12 4225 1 1 11 THR H H -3.922 -5.884 0.358 1.00 . A A . 11 THR H 1 1 12 4226 1 1 11 THR HA H -4.798 -7.700 -1.518 1.00 . A A . 11 THR HA 1 1 12 4227 1 1 11 THR HB H -6.489 -6.333 0.640 1.00 . A A . 11 THR HB 1 1 12 4228 1 1 11 THR HG1 H -4.694 -8.545 0.547 1.00 . A A . 11 THR HG1 1 1 12 4229 1 1 11 THR HG21 H -6.642 -9.186 -0.540 1.00 . A A . 11 THR HG21 1 1 12 4230 1 1 11 THR HG22 H -7.693 -8.542 0.712 1.00 . A A . 11 THR HG22 1 1 12 4231 1 1 11 THR HG23 H -7.802 -7.925 -0.926 1.00 . A A . 11 THR HG23 1 1 12 4232 1 1 11 THR N N -4.129 -5.923 -0.599 1.00 . A A . 11 THR N 1 1 12 4233 1 1 11 THR O O -6.463 -6.628 -3.109 1.00 . A A . 11 THR O 1 1 12 4234 1 1 11 THR OG1 O -5.160 -7.870 1.045 1.00 . A A . 11 THR OG1 1 1 12 4235 1 1 12 MET C C -6.577 -2.685 -2.785 1.00 . A A . 12 MET C 1 1 12 4236 1 1 12 MET CA C -7.308 -4.003 -2.510 1.00 . A A . 12 MET CA 1 1 12 4237 1 1 12 MET CB C -8.622 -3.740 -1.733 1.00 . A A . 12 MET CB 1 1 12 4238 1 1 12 MET CE C -9.888 -0.946 0.249 1.00 . A A . 12 MET CE 1 1 12 4239 1 1 12 MET CG C -8.309 -3.099 -0.354 1.00 . A A . 12 MET CG 1 1 12 4240 1 1 12 MET H H -6.112 -4.568 -0.823 1.00 . A A . 12 MET H 1 1 12 4241 1 1 12 MET HA H -7.530 -4.477 -3.455 1.00 . A A . 12 MET HA 1 1 12 4242 1 1 12 MET HB2 H -9.260 -3.077 -2.299 1.00 . A A . 12 MET HB2 1 1 12 4243 1 1 12 MET HB3 H -9.147 -4.672 -1.583 1.00 . A A . 12 MET HB3 1 1 12 4244 1 1 12 MET HE1 H -10.023 -0.861 -0.820 1.00 . A A . 12 MET HE1 1 1 12 4245 1 1 12 MET HE2 H -10.766 -0.546 0.735 1.00 . A A . 12 MET HE2 1 1 12 4246 1 1 12 MET HE3 H -9.026 -0.385 0.574 1.00 . A A . 12 MET HE3 1 1 12 4247 1 1 12 MET HG2 H -7.685 -3.784 0.203 1.00 . A A . 12 MET HG2 1 1 12 4248 1 1 12 MET HG3 H -7.736 -2.196 -0.506 1.00 . A A . 12 MET HG3 1 1 12 4249 1 1 12 MET N N -6.447 -4.899 -1.684 1.00 . A A . 12 MET N 1 1 12 4250 1 1 12 MET O O -7.159 -1.781 -3.352 1.00 . A A . 12 MET O 1 1 12 4251 1 1 12 MET SD S -9.711 -2.686 0.716 1.00 . A A . 12 MET SD 1 1 12 4252 1 1 13 TYR C C -5.284 -0.246 -1.954 1.00 . A A . 13 TYR C 1 1 12 4253 1 1 13 TYR CA C -4.490 -1.398 -2.571 1.00 . A A . 13 TYR CA 1 1 12 4254 1 1 13 TYR CB C -4.240 -1.197 -4.083 1.00 . A A . 13 TYR CB 1 1 12 4255 1 1 13 TYR CD1 C -2.101 -2.532 -4.313 1.00 . A A . 13 TYR CD1 1 1 12 4256 1 1 13 TYR CD2 C -4.077 -3.415 -5.304 1.00 . A A . 13 TYR CD2 1 1 12 4257 1 1 13 TYR CE1 C -1.391 -3.628 -4.752 1.00 . A A . 13 TYR CE1 1 1 12 4258 1 1 13 TYR CE2 C -3.365 -4.511 -5.744 1.00 . A A . 13 TYR CE2 1 1 12 4259 1 1 13 TYR CG C -3.451 -2.416 -4.585 1.00 . A A . 13 TYR CG 1 1 12 4260 1 1 13 TYR CZ C -2.017 -4.624 -5.470 1.00 . A A . 13 TYR CZ 1 1 12 4261 1 1 13 TYR H H -4.928 -3.401 -1.940 1.00 . A A . 13 TYR H 1 1 12 4262 1 1 13 TYR HA H -3.561 -1.516 -2.035 1.00 . A A . 13 TYR HA 1 1 12 4263 1 1 13 TYR HB2 H -5.171 -1.129 -4.623 1.00 . A A . 13 TYR HB2 1 1 12 4264 1 1 13 TYR HB3 H -3.661 -0.302 -4.257 1.00 . A A . 13 TYR HB3 1 1 12 4265 1 1 13 TYR HD1 H -1.595 -1.760 -3.752 1.00 . A A . 13 TYR HD1 1 1 12 4266 1 1 13 TYR HD2 H -5.131 -3.339 -5.525 1.00 . A A . 13 TYR HD2 1 1 12 4267 1 1 13 TYR HE1 H -0.336 -3.704 -4.532 1.00 . A A . 13 TYR HE1 1 1 12 4268 1 1 13 TYR HE2 H -3.867 -5.285 -6.305 1.00 . A A . 13 TYR HE2 1 1 12 4269 1 1 13 TYR HH H -0.959 -5.519 -6.781 1.00 . A A . 13 TYR HH 1 1 12 4270 1 1 13 TYR N N -5.327 -2.624 -2.379 1.00 . A A . 13 TYR N 1 1 12 4271 1 1 13 TYR O O -5.851 0.604 -2.614 1.00 . A A . 13 TYR O 1 1 12 4272 1 1 13 TYR OH O -1.304 -5.722 -5.909 1.00 . A A . 13 TYR OH 1 1 12 4273 1 1 14 ASP C C -5.170 1.999 0.347 1.00 . A A . 14 ASP C 1 1 12 4274 1 1 14 ASP CA C -5.962 0.688 0.219 1.00 . A A . 14 ASP CA 1 1 12 4275 1 1 14 ASP CB C -6.172 -0.048 1.567 1.00 . A A . 14 ASP CB 1 1 12 4276 1 1 14 ASP CG C -6.799 0.834 2.661 1.00 . A A . 14 ASP CG 1 1 12 4277 1 1 14 ASP H H -4.762 -1.028 -0.226 1.00 . A A . 14 ASP H 1 1 12 4278 1 1 14 ASP HA H -6.925 0.913 -0.220 1.00 . A A . 14 ASP HA 1 1 12 4279 1 1 14 ASP HB2 H -6.840 -0.867 1.393 1.00 . A A . 14 ASP HB2 1 1 12 4280 1 1 14 ASP HB3 H -5.254 -0.491 1.911 1.00 . A A . 14 ASP HB3 1 1 12 4281 1 1 14 ASP N N -5.264 -0.302 -0.650 1.00 . A A . 14 ASP N 1 1 12 4282 1 1 14 ASP O O -5.419 2.799 1.227 1.00 . A A . 14 ASP O 1 1 12 4283 1 1 14 ASP OD1 O -7.842 1.405 2.386 1.00 . A A . 14 ASP OD1 1 1 12 4284 1 1 14 ASP OD2 O -6.191 0.887 3.719 1.00 . A A . 14 ASP OD2 1 1 12 4285 1 1 15 CYS C C -3.753 4.412 -1.647 1.00 . A A . 15 CYS C 1 1 12 4286 1 1 15 CYS CA C -3.378 3.399 -0.567 1.00 . A A . 15 CYS CA 1 1 12 4287 1 1 15 CYS CB C -1.936 3.002 -0.792 1.00 . A A . 15 CYS CB 1 1 12 4288 1 1 15 CYS H H -4.101 1.472 -1.228 1.00 . A A . 15 CYS H 1 1 12 4289 1 1 15 CYS HA H -3.450 3.884 0.392 1.00 . A A . 15 CYS HA 1 1 12 4290 1 1 15 CYS HB2 H -1.853 2.529 -1.760 1.00 . A A . 15 CYS HB2 1 1 12 4291 1 1 15 CYS HB3 H -1.322 3.891 -0.804 1.00 . A A . 15 CYS HB3 1 1 12 4292 1 1 15 CYS N N -4.235 2.172 -0.554 1.00 . A A . 15 CYS N 1 1 12 4293 1 1 15 CYS O O -4.298 4.065 -2.677 1.00 . A A . 15 CYS O 1 1 12 4294 1 1 15 CYS SG S -1.239 1.878 0.431 1.00 . A A . 15 CYS SG 1 1 12 4295 1 1 16 CYS C C -2.724 6.599 -3.454 1.00 . A A . 16 CYS C 1 1 12 4296 1 1 16 CYS CA C -3.706 6.775 -2.286 1.00 . A A . 16 CYS CA 1 1 12 4297 1 1 16 CYS CB C -3.453 8.081 -1.538 1.00 . A A . 16 CYS CB 1 1 12 4298 1 1 16 CYS H H -2.996 5.854 -0.504 1.00 . A A . 16 CYS H 1 1 12 4299 1 1 16 CYS HA H -4.721 6.713 -2.648 1.00 . A A . 16 CYS HA 1 1 12 4300 1 1 16 CYS HB2 H -2.402 8.144 -1.294 1.00 . A A . 16 CYS HB2 1 1 12 4301 1 1 16 CYS HB3 H -3.683 8.895 -2.201 1.00 . A A . 16 CYS HB3 1 1 12 4302 1 1 16 CYS N N -3.430 5.648 -1.355 1.00 . A A . 16 CYS N 1 1 12 4303 1 1 16 CYS O O -3.024 6.910 -4.591 1.00 . A A . 16 CYS O 1 1 12 4304 1 1 16 CYS SG S -4.380 8.339 -0.006 1.00 . A A . 16 CYS SG 1 1 12 4305 1 1 17 SER C C -0.867 4.626 -4.945 1.00 . A A . 17 SER C 1 1 12 4306 1 1 17 SER CA C -0.473 5.832 -4.075 1.00 . A A . 17 SER CA 1 1 12 4307 1 1 17 SER CB C 0.812 5.534 -3.285 1.00 . A A . 17 SER CB 1 1 12 4308 1 1 17 SER H H -1.419 5.876 -2.154 1.00 . A A . 17 SER H 1 1 12 4309 1 1 17 SER HA H -0.342 6.701 -4.704 1.00 . A A . 17 SER HA 1 1 12 4310 1 1 17 SER HB2 H 1.094 6.370 -2.662 1.00 . A A . 17 SER HB2 1 1 12 4311 1 1 17 SER HB3 H 0.709 4.644 -2.681 1.00 . A A . 17 SER HB3 1 1 12 4312 1 1 17 SER HG H 1.597 4.502 -4.733 1.00 . A A . 17 SER HG 1 1 12 4313 1 1 17 SER N N -1.569 6.092 -3.097 1.00 . A A . 17 SER N 1 1 12 4314 1 1 17 SER O O -0.348 4.446 -6.029 1.00 . A A . 17 SER O 1 1 12 4315 1 1 17 SER OG O 1.808 5.318 -4.275 1.00 . A A . 17 SER OG 1 1 12 4316 1 1 18 GLY C C -1.281 1.459 -5.030 1.00 . A A . 18 GLY C 1 1 12 4317 1 1 18 GLY CA C -2.265 2.626 -5.155 1.00 . A A . 18 GLY CA 1 1 12 4318 1 1 18 GLY H H -2.157 4.046 -3.547 1.00 . A A . 18 GLY H 1 1 12 4319 1 1 18 GLY HA2 H -3.210 2.328 -4.728 1.00 . A A . 18 GLY HA2 1 1 12 4320 1 1 18 GLY HA3 H -2.397 2.867 -6.198 1.00 . A A . 18 GLY HA3 1 1 12 4321 1 1 18 GLY N N -1.781 3.838 -4.428 1.00 . A A . 18 GLY N 1 1 12 4322 1 1 18 GLY O O -1.553 0.370 -5.499 1.00 . A A . 18 GLY O 1 1 12 4323 1 1 19 SER C C 1.108 0.502 -2.688 1.00 . A A . 19 SER C 1 1 12 4324 1 1 19 SER CA C 0.896 0.706 -4.192 1.00 . A A . 19 SER CA 1 1 12 4325 1 1 19 SER CB C 2.189 1.203 -4.874 1.00 . A A . 19 SER CB 1 1 12 4326 1 1 19 SER H H -0.020 2.634 -4.049 1.00 . A A . 19 SER H 1 1 12 4327 1 1 19 SER HA H 0.593 -0.233 -4.636 1.00 . A A . 19 SER HA 1 1 12 4328 1 1 19 SER HB2 H 3.010 0.521 -4.705 1.00 . A A . 19 SER HB2 1 1 12 4329 1 1 19 SER HB3 H 2.042 1.346 -5.935 1.00 . A A . 19 SER HB3 1 1 12 4330 1 1 19 SER HG H 1.690 2.998 -4.302 1.00 . A A . 19 SER HG 1 1 12 4331 1 1 19 SER N N -0.167 1.732 -4.399 1.00 . A A . 19 SER N 1 1 12 4332 1 1 19 SER O O 1.387 1.444 -1.970 1.00 . A A . 19 SER O 1 1 12 4333 1 1 19 SER OG O 2.481 2.454 -4.263 1.00 . A A . 19 SER OG 1 1 12 4334 1 1 20 CYS C C 2.031 -2.314 -0.695 1.00 . A A . 20 CYS C 1 1 12 4335 1 1 20 CYS CA C 1.139 -1.073 -0.823 1.00 . A A . 20 CYS CA 1 1 12 4336 1 1 20 CYS CB C -0.246 -1.332 -0.205 1.00 . A A . 20 CYS CB 1 1 12 4337 1 1 20 CYS H H 0.731 -1.434 -2.903 1.00 . A A . 20 CYS H 1 1 12 4338 1 1 20 CYS HA H 1.619 -0.247 -0.317 1.00 . A A . 20 CYS HA 1 1 12 4339 1 1 20 CYS HB2 H -0.829 -0.432 -0.315 1.00 . A A . 20 CYS HB2 1 1 12 4340 1 1 20 CYS HB3 H -0.762 -2.097 -0.752 1.00 . A A . 20 CYS HB3 1 1 12 4341 1 1 20 CYS N N 0.962 -0.728 -2.265 1.00 . A A . 20 CYS N 1 1 12 4342 1 1 20 CYS O O 1.757 -3.348 -1.273 1.00 . A A . 20 CYS O 1 1 12 4343 1 1 20 CYS SG S -0.290 -1.790 1.543 1.00 . A A . 20 CYS SG 1 1 12 4344 1 1 21 GLY C C 3.487 -4.446 1.086 1.00 . A A . 21 GLY C 1 1 12 4345 1 1 21 GLY CA C 4.062 -3.256 0.307 1.00 . A A . 21 GLY CA 1 1 12 4346 1 1 21 GLY H H 3.232 -1.287 0.492 1.00 . A A . 21 GLY H 1 1 12 4347 1 1 21 GLY HA2 H 4.427 -3.608 -0.647 1.00 . A A . 21 GLY HA2 1 1 12 4348 1 1 21 GLY HA3 H 4.895 -2.853 0.864 1.00 . A A . 21 GLY HA3 1 1 12 4349 1 1 21 GLY N N 3.082 -2.154 0.067 1.00 . A A . 21 GLY N 1 1 12 4350 1 1 21 GLY O O 2.353 -4.443 1.526 1.00 . A A . 21 GLY O 1 1 12 4351 1 1 22 ARG C C 4.029 -6.456 3.458 1.00 . A A . 22 ARG C 1 1 12 4352 1 1 22 ARG CA C 3.998 -6.697 1.942 1.00 . A A . 22 ARG CA 1 1 12 4353 1 1 22 ARG CB C 5.026 -7.784 1.553 1.00 . A A . 22 ARG CB 1 1 12 4354 1 1 22 ARG CD C 3.670 -8.499 -0.501 1.00 . A A . 22 ARG CD 1 1 12 4355 1 1 22 ARG CG C 5.045 -8.017 0.017 1.00 . A A . 22 ARG CG 1 1 12 4356 1 1 22 ARG CZ C 4.299 -9.771 -2.511 1.00 . A A . 22 ARG CZ 1 1 12 4357 1 1 22 ARG H H 5.231 -5.323 0.835 1.00 . A A . 22 ARG H 1 1 12 4358 1 1 22 ARG HA H 2.998 -7.004 1.670 1.00 . A A . 22 ARG HA 1 1 12 4359 1 1 22 ARG HB2 H 6.011 -7.478 1.875 1.00 . A A . 22 ARG HB2 1 1 12 4360 1 1 22 ARG HB3 H 4.779 -8.710 2.051 1.00 . A A . 22 ARG HB3 1 1 12 4361 1 1 22 ARG HD2 H 3.379 -9.427 -0.030 1.00 . A A . 22 ARG HD2 1 1 12 4362 1 1 22 ARG HD3 H 2.909 -7.756 -0.314 1.00 . A A . 22 ARG HD3 1 1 12 4363 1 1 22 ARG HE H 3.408 -8.004 -2.578 1.00 . A A . 22 ARG HE 1 1 12 4364 1 1 22 ARG HG2 H 5.317 -7.101 -0.488 1.00 . A A . 22 ARG HG2 1 1 12 4365 1 1 22 ARG HG3 H 5.793 -8.760 -0.213 1.00 . A A . 22 ARG HG3 1 1 12 4366 1 1 22 ARG HH11 H 4.746 -10.637 -0.758 1.00 . A A . 22 ARG HH11 1 1 12 4367 1 1 22 ARG HH12 H 5.186 -11.532 -2.172 1.00 . A A . 22 ARG HH12 1 1 12 4368 1 1 22 ARG HH21 H 3.960 -9.121 -4.372 1.00 . A A . 22 ARG HH21 1 1 12 4369 1 1 22 ARG HH22 H 4.737 -10.664 -4.247 1.00 . A A . 22 ARG HH22 1 1 12 4370 1 1 22 ARG N N 4.339 -5.430 1.220 1.00 . A A . 22 ARG N 1 1 12 4371 1 1 22 ARG NE N 3.762 -8.697 -1.982 1.00 . A A . 22 ARG NE 1 1 12 4372 1 1 22 ARG NH1 N 4.781 -10.720 -1.753 1.00 . A A . 22 ARG NH1 1 1 12 4373 1 1 22 ARG NH2 N 4.334 -9.859 -3.812 1.00 . A A . 22 ARG NH2 1 1 12 4374 1 1 22 ARG O O 3.538 -7.258 4.229 1.00 . A A . 22 ARG O 1 1 12 4375 1 1 23 ARG C C 3.363 -4.369 5.690 1.00 . A A . 23 ARG C 1 1 12 4376 1 1 23 ARG CA C 4.726 -4.952 5.264 1.00 . A A . 23 ARG CA 1 1 12 4377 1 1 23 ARG CB C 5.847 -3.896 5.388 1.00 . A A . 23 ARG CB 1 1 12 4378 1 1 23 ARG CD C 7.155 -2.398 6.921 1.00 . A A . 23 ARG CD 1 1 12 4379 1 1 23 ARG CG C 6.047 -3.460 6.858 1.00 . A A . 23 ARG CG 1 1 12 4380 1 1 23 ARG CZ C 7.893 -0.842 8.670 1.00 . A A . 23 ARG CZ 1 1 12 4381 1 1 23 ARG H H 4.986 -4.748 3.142 1.00 . A A . 23 ARG H 1 1 12 4382 1 1 23 ARG HA H 4.948 -5.824 5.860 1.00 . A A . 23 ARG HA 1 1 12 4383 1 1 23 ARG HB2 H 6.769 -4.314 5.009 1.00 . A A . 23 ARG HB2 1 1 12 4384 1 1 23 ARG HB3 H 5.592 -3.035 4.786 1.00 . A A . 23 ARG HB3 1 1 12 4385 1 1 23 ARG HD2 H 8.096 -2.802 6.575 1.00 . A A . 23 ARG HD2 1 1 12 4386 1 1 23 ARG HD3 H 6.887 -1.543 6.319 1.00 . A A . 23 ARG HD3 1 1 12 4387 1 1 23 ARG HE H 6.962 -2.548 9.060 1.00 . A A . 23 ARG HE 1 1 12 4388 1 1 23 ARG HG2 H 5.139 -3.038 7.261 1.00 . A A . 23 ARG HG2 1 1 12 4389 1 1 23 ARG HG3 H 6.328 -4.314 7.457 1.00 . A A . 23 ARG HG3 1 1 12 4390 1 1 23 ARG HH11 H 8.289 -0.291 6.781 1.00 . A A . 23 ARG HH11 1 1 12 4391 1 1 23 ARG HH12 H 8.809 0.810 8.010 1.00 . A A . 23 ARG HH12 1 1 12 4392 1 1 23 ARG HH21 H 7.618 -1.164 10.626 1.00 . A A . 23 ARG HH21 1 1 12 4393 1 1 23 ARG HH22 H 8.428 0.311 10.216 1.00 . A A . 23 ARG HH22 1 1 12 4394 1 1 23 ARG N N 4.613 -5.343 3.826 1.00 . A A . 23 ARG N 1 1 12 4395 1 1 23 ARG NE N 7.308 -1.970 8.348 1.00 . A A . 23 ARG NE 1 1 12 4396 1 1 23 ARG NH1 N 8.366 -0.047 7.748 1.00 . A A . 23 ARG NH1 1 1 12 4397 1 1 23 ARG NH2 N 7.986 -0.541 9.936 1.00 . A A . 23 ARG NH2 1 1 12 4398 1 1 23 ARG O O 3.096 -4.196 6.864 1.00 . A A . 23 ARG O 1 1 12 4399 1 1 24 GLY C C 1.282 -1.990 5.019 1.00 . A A . 24 GLY C 1 1 12 4400 1 1 24 GLY CA C 1.192 -3.515 4.960 1.00 . A A . 24 GLY CA 1 1 12 4401 1 1 24 GLY H H 2.820 -4.253 3.780 1.00 . A A . 24 GLY H 1 1 12 4402 1 1 24 GLY HA2 H 0.532 -3.799 4.154 1.00 . A A . 24 GLY HA2 1 1 12 4403 1 1 24 GLY HA3 H 0.802 -3.893 5.896 1.00 . A A . 24 GLY HA3 1 1 12 4404 1 1 24 GLY N N 2.544 -4.087 4.705 1.00 . A A . 24 GLY N 1 1 12 4405 1 1 24 GLY O O 0.432 -1.354 5.610 1.00 . A A . 24 GLY O 1 1 12 4406 1 1 25 LYS C C 2.378 0.489 2.939 1.00 . A A . 25 LYS C 1 1 12 4407 1 1 25 LYS CA C 2.513 0.032 4.388 1.00 . A A . 25 LYS CA 1 1 12 4408 1 1 25 LYS CB C 3.915 0.402 4.882 1.00 . A A . 25 LYS CB 1 1 12 4409 1 1 25 LYS CD C 3.239 0.387 7.346 1.00 . A A . 25 LYS CD 1 1 12 4410 1 1 25 LYS CE C 3.529 -0.268 8.711 1.00 . A A . 25 LYS CE 1 1 12 4411 1 1 25 LYS CG C 4.201 -0.195 6.280 1.00 . A A . 25 LYS CG 1 1 12 4412 1 1 25 LYS H H 2.959 -2.038 3.947 1.00 . A A . 25 LYS H 1 1 12 4413 1 1 25 LYS HA H 1.754 0.520 4.980 1.00 . A A . 25 LYS HA 1 1 12 4414 1 1 25 LYS HB2 H 4.644 0.087 4.156 1.00 . A A . 25 LYS HB2 1 1 12 4415 1 1 25 LYS HB3 H 3.977 1.477 4.955 1.00 . A A . 25 LYS HB3 1 1 12 4416 1 1 25 LYS HD2 H 3.385 1.454 7.425 1.00 . A A . 25 LYS HD2 1 1 12 4417 1 1 25 LYS HD3 H 2.212 0.200 7.076 1.00 . A A . 25 LYS HD3 1 1 12 4418 1 1 25 LYS HE2 H 2.870 0.142 9.462 1.00 . A A . 25 LYS HE2 1 1 12 4419 1 1 25 LYS HE3 H 3.372 -1.336 8.656 1.00 . A A . 25 LYS HE3 1 1 12 4420 1 1 25 LYS HG2 H 4.100 -1.269 6.242 1.00 . A A . 25 LYS HG2 1 1 12 4421 1 1 25 LYS HG3 H 5.221 0.040 6.550 1.00 . A A . 25 LYS HG3 1 1 12 4422 1 1 25 LYS HZ1 H 5.389 0.644 8.461 1.00 . A A . 25 LYS HZ1 1 1 12 4423 1 1 25 LYS HZ2 H 4.942 0.403 10.082 1.00 . A A . 25 LYS HZ2 1 1 12 4424 1 1 25 LYS HZ3 H 5.460 -0.911 9.137 1.00 . A A . 25 LYS HZ3 1 1 12 4425 1 1 25 LYS N N 2.312 -1.455 4.404 1.00 . A A . 25 LYS N 1 1 12 4426 1 1 25 LYS NZ N 4.936 -0.012 9.129 1.00 . A A . 25 LYS NZ 1 1 12 4427 1 1 25 LYS O O 2.543 -0.297 2.028 1.00 . A A . 25 LYS O 1 1 12 4428 1 1 26 CYS C C 3.210 2.737 0.682 1.00 . A A . 26 CYS C 1 1 12 4429 1 1 26 CYS CA C 1.922 2.306 1.385 1.00 . A A . 26 CYS CA 1 1 12 4430 1 1 26 CYS CB C 0.969 3.479 1.473 1.00 . A A . 26 CYS CB 1 1 12 4431 1 1 26 CYS H H 1.970 2.318 3.554 1.00 . A A . 26 CYS H 1 1 12 4432 1 1 26 CYS HA H 1.449 1.555 0.771 1.00 . A A . 26 CYS HA 1 1 12 4433 1 1 26 CYS HB2 H 1.362 4.167 2.200 1.00 . A A . 26 CYS HB2 1 1 12 4434 1 1 26 CYS HB3 H 0.910 3.981 0.521 1.00 . A A . 26 CYS HB3 1 1 12 4435 1 1 26 CYS N N 2.083 1.748 2.766 1.00 . A A . 26 CYS N 1 1 12 4436 1 1 26 CYS O O 4.292 2.712 1.233 1.00 . A A . 26 CYS O 1 1 12 4437 1 1 26 CYS SG S -0.714 3.072 1.972 1.00 . A A . 26 CYS SG 1 1 12 4438 1 1 27 NH2 HN1 H 2.226 3.151 -0.984 1.00 . A A . 27 NH2 HN1 1 1 12 4439 1 1 27 NH2 HN2 H 3.890 3.423 -1.069 1.00 . A A . 27 NH2 HN2 1 1 12 4440 1 1 27 NH2 N N 3.107 3.138 -0.558 1.00 . A A . 27 NH2 N 1 1 13 4441 1 1 1 CYS C C -6.087 6.590 1.614 1.00 . A A . 1 CYS C 1 1 13 4442 1 1 1 CYS CA C -7.141 5.963 0.708 1.00 . A A . 1 CYS CA 1 1 13 4443 1 1 1 CYS CB C -6.808 6.294 -0.746 1.00 . A A . 1 CYS CB 1 1 13 4444 1 1 1 CYS H1 H -8.464 7.546 0.986 1.00 . A A . 1 CYS H1 1 1 13 4445 1 1 1 CYS H2 H -9.198 6.120 0.426 1.00 . A A . 1 CYS H2 1 1 13 4446 1 1 1 CYS H3 H -8.710 6.245 2.048 1.00 . A A . 1 CYS H3 1 1 13 4447 1 1 1 CYS HA H -7.119 4.901 0.882 1.00 . A A . 1 CYS HA 1 1 13 4448 1 1 1 CYS HB2 H -5.905 5.771 -1.014 1.00 . A A . 1 CYS HB2 1 1 13 4449 1 1 1 CYS HB3 H -7.602 5.898 -1.363 1.00 . A A . 1 CYS HB3 1 1 13 4450 1 1 1 CYS N N -8.480 6.510 1.069 1.00 . A A . 1 CYS N 1 1 13 4451 1 1 1 CYS O O -6.261 7.695 2.092 1.00 . A A . 1 CYS O 1 1 13 4452 1 1 1 CYS SG S -6.610 8.040 -1.183 1.00 . A A . 1 CYS SG 1 1 13 4453 1 1 2 LYS C C -2.577 6.544 1.975 1.00 . A A . 2 LYS C 1 1 13 4454 1 1 2 LYS CA C -3.921 6.359 2.688 1.00 . A A . 2 LYS CA 1 1 13 4455 1 1 2 LYS CB C -3.738 5.410 3.844 1.00 . A A . 2 LYS CB 1 1 13 4456 1 1 2 LYS CD C -4.788 4.816 6.009 1.00 . A A . 2 LYS CD 1 1 13 4457 1 1 2 LYS CE C -4.201 3.391 6.001 1.00 . A A . 2 LYS CE 1 1 13 4458 1 1 2 LYS CG C -5.072 5.349 4.620 1.00 . A A . 2 LYS CG 1 1 13 4459 1 1 2 LYS H H -4.950 4.971 1.397 1.00 . A A . 2 LYS H 1 1 13 4460 1 1 2 LYS HA H -4.204 7.278 3.183 1.00 . A A . 2 LYS HA 1 1 13 4461 1 1 2 LYS HB2 H -3.462 4.429 3.479 1.00 . A A . 2 LYS HB2 1 1 13 4462 1 1 2 LYS HB3 H -2.958 5.790 4.482 1.00 . A A . 2 LYS HB3 1 1 13 4463 1 1 2 LYS HD2 H -4.069 5.529 6.388 1.00 . A A . 2 LYS HD2 1 1 13 4464 1 1 2 LYS HD3 H -5.680 4.859 6.617 1.00 . A A . 2 LYS HD3 1 1 13 4465 1 1 2 LYS HE2 H -4.900 2.701 5.553 1.00 . A A . 2 LYS HE2 1 1 13 4466 1 1 2 LYS HE3 H -3.269 3.352 5.458 1.00 . A A . 2 LYS HE3 1 1 13 4467 1 1 2 LYS HG2 H -5.520 6.330 4.700 1.00 . A A . 2 LYS HG2 1 1 13 4468 1 1 2 LYS HG3 H -5.765 4.693 4.113 1.00 . A A . 2 LYS HG3 1 1 13 4469 1 1 2 LYS HZ1 H -4.052 3.767 8.047 1.00 . A A . 2 LYS HZ1 1 1 13 4470 1 1 2 LYS HZ2 H -4.620 2.213 7.665 1.00 . A A . 2 LYS HZ2 1 1 13 4471 1 1 2 LYS HZ3 H -2.977 2.586 7.473 1.00 . A A . 2 LYS HZ3 1 1 13 4472 1 1 2 LYS N N -5.022 5.854 1.817 1.00 . A A . 2 LYS N 1 1 13 4473 1 1 2 LYS NZ N -3.945 2.958 7.403 1.00 . A A . 2 LYS NZ 1 1 13 4474 1 1 2 LYS O O -2.130 5.712 1.211 1.00 . A A . 2 LYS O 1 1 13 4475 1 1 3 GLY C C 0.468 7.070 2.065 1.00 . A A . 3 GLY C 1 1 13 4476 1 1 3 GLY CA C -0.657 8.056 1.695 1.00 . A A . 3 GLY CA 1 1 13 4477 1 1 3 GLY H H -2.451 8.261 2.898 1.00 . A A . 3 GLY H 1 1 13 4478 1 1 3 GLY HA2 H -0.743 8.098 0.619 1.00 . A A . 3 GLY HA2 1 1 13 4479 1 1 3 GLY HA3 H -0.392 9.036 2.063 1.00 . A A . 3 GLY HA3 1 1 13 4480 1 1 3 GLY N N -1.985 7.668 2.275 1.00 . A A . 3 GLY N 1 1 13 4481 1 1 3 GLY O O 0.291 6.213 2.909 1.00 . A A . 3 GLY O 1 1 13 4482 1 1 4 LYS C C 3.171 6.074 3.090 1.00 . A A . 4 LYS C 1 1 13 4483 1 1 4 LYS CA C 2.800 6.384 1.622 1.00 . A A . 4 LYS CA 1 1 13 4484 1 1 4 LYS CB C 4.006 7.066 0.922 1.00 . A A . 4 LYS CB 1 1 13 4485 1 1 4 LYS CD C 3.359 9.513 1.488 1.00 . A A . 4 LYS CD 1 1 13 4486 1 1 4 LYS CE C 3.917 10.834 2.048 1.00 . A A . 4 LYS CE 1 1 13 4487 1 1 4 LYS CG C 4.457 8.424 1.542 1.00 . A A . 4 LYS CG 1 1 13 4488 1 1 4 LYS H H 1.657 7.958 0.751 1.00 . A A . 4 LYS H 1 1 13 4489 1 1 4 LYS HA H 2.632 5.451 1.109 1.00 . A A . 4 LYS HA 1 1 13 4490 1 1 4 LYS HB2 H 4.836 6.381 0.937 1.00 . A A . 4 LYS HB2 1 1 13 4491 1 1 4 LYS HB3 H 3.747 7.235 -0.113 1.00 . A A . 4 LYS HB3 1 1 13 4492 1 1 4 LYS HD2 H 3.016 9.654 0.474 1.00 . A A . 4 LYS HD2 1 1 13 4493 1 1 4 LYS HD3 H 2.522 9.233 2.108 1.00 . A A . 4 LYS HD3 1 1 13 4494 1 1 4 LYS HE2 H 3.153 11.597 2.021 1.00 . A A . 4 LYS HE2 1 1 13 4495 1 1 4 LYS HE3 H 4.244 10.701 3.069 1.00 . A A . 4 LYS HE3 1 1 13 4496 1 1 4 LYS HG2 H 4.753 8.265 2.568 1.00 . A A . 4 LYS HG2 1 1 13 4497 1 1 4 LYS HG3 H 5.326 8.766 0.998 1.00 . A A . 4 LYS HG3 1 1 13 4498 1 1 4 LYS HZ1 H 4.906 11.077 0.230 1.00 . A A . 4 LYS HZ1 1 1 13 4499 1 1 4 LYS HZ2 H 5.194 12.324 1.348 1.00 . A A . 4 LYS HZ2 1 1 13 4500 1 1 4 LYS HZ3 H 5.941 10.813 1.550 1.00 . A A . 4 LYS HZ3 1 1 13 4501 1 1 4 LYS N N 1.592 7.240 1.412 1.00 . A A . 4 LYS N 1 1 13 4502 1 1 4 LYS NZ N 5.077 11.297 1.232 1.00 . A A . 4 LYS NZ 1 1 13 4503 1 1 4 LYS O O 3.133 6.932 3.951 1.00 . A A . 4 LYS O 1 1 13 4504 1 1 5 GLY C C 2.750 4.100 5.619 1.00 . A A . 5 GLY C 1 1 13 4505 1 1 5 GLY CA C 3.914 4.303 4.645 1.00 . A A . 5 GLY CA 1 1 13 4506 1 1 5 GLY H H 3.498 4.208 2.546 1.00 . A A . 5 GLY H 1 1 13 4507 1 1 5 GLY HA2 H 4.400 3.351 4.496 1.00 . A A . 5 GLY HA2 1 1 13 4508 1 1 5 GLY HA3 H 4.626 4.977 5.094 1.00 . A A . 5 GLY HA3 1 1 13 4509 1 1 5 GLY N N 3.512 4.826 3.301 1.00 . A A . 5 GLY N 1 1 13 4510 1 1 5 GLY O O 2.962 3.662 6.733 1.00 . A A . 5 GLY O 1 1 13 4511 1 1 6 ALA C C -0.100 2.778 6.093 1.00 . A A . 6 ALA C 1 1 13 4512 1 1 6 ALA CA C 0.360 4.252 6.070 1.00 . A A . 6 ALA CA 1 1 13 4513 1 1 6 ALA CB C -0.759 5.135 5.543 1.00 . A A . 6 ALA CB 1 1 13 4514 1 1 6 ALA H H 1.452 4.760 4.269 1.00 . A A . 6 ALA H 1 1 13 4515 1 1 6 ALA HA H 0.630 4.571 7.064 1.00 . A A . 6 ALA HA 1 1 13 4516 1 1 6 ALA HB1 H -0.444 6.168 5.540 1.00 . A A . 6 ALA HB1 1 1 13 4517 1 1 6 ALA HB2 H -1.011 4.839 4.536 1.00 . A A . 6 ALA HB2 1 1 13 4518 1 1 6 ALA HB3 H -1.634 5.039 6.168 1.00 . A A . 6 ALA HB3 1 1 13 4519 1 1 6 ALA N N 1.556 4.416 5.183 1.00 . A A . 6 ALA N 1 1 13 4520 1 1 6 ALA O O 0.025 2.114 5.082 1.00 . A A . 6 ALA O 1 1 13 4521 1 1 7 PRO C C -2.176 0.464 6.465 1.00 . A A . 7 PRO C 1 1 13 4522 1 1 7 PRO CA C -1.017 0.877 7.400 1.00 . A A . 7 PRO CA 1 1 13 4523 1 1 7 PRO CB C -1.378 0.744 8.891 1.00 . A A . 7 PRO CB 1 1 13 4524 1 1 7 PRO CD C -0.853 3.128 8.447 1.00 . A A . 7 PRO CD 1 1 13 4525 1 1 7 PRO CG C -1.472 2.163 9.466 1.00 . A A . 7 PRO CG 1 1 13 4526 1 1 7 PRO HA H -0.161 0.254 7.191 1.00 . A A . 7 PRO HA 1 1 13 4527 1 1 7 PRO HB2 H -2.313 0.222 9.033 1.00 . A A . 7 PRO HB2 1 1 13 4528 1 1 7 PRO HB3 H -0.599 0.196 9.403 1.00 . A A . 7 PRO HB3 1 1 13 4529 1 1 7 PRO HD2 H -1.527 3.940 8.217 1.00 . A A . 7 PRO HD2 1 1 13 4530 1 1 7 PRO HD3 H 0.087 3.513 8.813 1.00 . A A . 7 PRO HD3 1 1 13 4531 1 1 7 PRO HG2 H -2.506 2.423 9.642 1.00 . A A . 7 PRO HG2 1 1 13 4532 1 1 7 PRO HG3 H -0.936 2.219 10.402 1.00 . A A . 7 PRO HG3 1 1 13 4533 1 1 7 PRO N N -0.613 2.307 7.218 1.00 . A A . 7 PRO N 1 1 13 4534 1 1 7 PRO O O -3.327 0.399 6.852 1.00 . A A . 7 PRO O 1 1 13 4535 1 1 8 CYS C C -2.930 -1.744 4.100 1.00 . A A . 8 CYS C 1 1 13 4536 1 1 8 CYS CA C -2.771 -0.225 4.182 1.00 . A A . 8 CYS CA 1 1 13 4537 1 1 8 CYS CB C -2.266 0.311 2.852 1.00 . A A . 8 CYS CB 1 1 13 4538 1 1 8 CYS H H -0.855 0.261 5.013 1.00 . A A . 8 CYS H 1 1 13 4539 1 1 8 CYS HA H -3.731 0.216 4.395 1.00 . A A . 8 CYS HA 1 1 13 4540 1 1 8 CYS HB2 H -2.870 -0.081 2.048 1.00 . A A . 8 CYS HB2 1 1 13 4541 1 1 8 CYS HB3 H -2.386 1.375 2.810 1.00 . A A . 8 CYS HB3 1 1 13 4542 1 1 8 CYS N N -1.804 0.191 5.242 1.00 . A A . 8 CYS N 1 1 13 4543 1 1 8 CYS O O -2.453 -2.490 4.934 1.00 . A A . 8 CYS O 1 1 13 4544 1 1 8 CYS SG S -0.552 -0.122 2.476 1.00 . A A . 8 CYS SG 1 1 13 4545 1 1 9 ARG C C -3.685 -3.641 1.228 1.00 . A A . 9 ARG C 1 1 13 4546 1 1 9 ARG CA C -3.915 -3.537 2.738 1.00 . A A . 9 ARG CA 1 1 13 4547 1 1 9 ARG CB C -5.387 -3.850 3.082 1.00 . A A . 9 ARG CB 1 1 13 4548 1 1 9 ARG CD C -7.141 -3.852 4.902 1.00 . A A . 9 ARG CD 1 1 13 4549 1 1 9 ARG CG C -5.659 -3.567 4.574 1.00 . A A . 9 ARG CG 1 1 13 4550 1 1 9 ARG CZ C -8.130 -1.701 4.214 1.00 . A A . 9 ARG CZ 1 1 13 4551 1 1 9 ARG H H -3.957 -1.437 2.446 1.00 . A A . 9 ARG H 1 1 13 4552 1 1 9 ARG HA H -3.230 -4.190 3.260 1.00 . A A . 9 ARG HA 1 1 13 4553 1 1 9 ARG HB2 H -6.039 -3.240 2.473 1.00 . A A . 9 ARG HB2 1 1 13 4554 1 1 9 ARG HB3 H -5.589 -4.890 2.867 1.00 . A A . 9 ARG HB3 1 1 13 4555 1 1 9 ARG HD2 H -7.377 -4.889 4.710 1.00 . A A . 9 ARG HD2 1 1 13 4556 1 1 9 ARG HD3 H -7.345 -3.633 5.940 1.00 . A A . 9 ARG HD3 1 1 13 4557 1 1 9 ARG HE H -8.538 -3.417 3.323 1.00 . A A . 9 ARG HE 1 1 13 4558 1 1 9 ARG HG2 H -5.033 -4.205 5.181 1.00 . A A . 9 ARG HG2 1 1 13 4559 1 1 9 ARG HG3 H -5.427 -2.540 4.804 1.00 . A A . 9 ARG HG3 1 1 13 4560 1 1 9 ARG HH11 H -6.859 -1.608 5.765 1.00 . A A . 9 ARG HH11 1 1 13 4561 1 1 9 ARG HH12 H -7.555 -0.101 5.273 1.00 . A A . 9 ARG HH12 1 1 13 4562 1 1 9 ARG HH21 H -9.425 -1.533 2.700 1.00 . A A . 9 ARG HH21 1 1 13 4563 1 1 9 ARG HH22 H -9.035 -0.057 3.518 1.00 . A A . 9 ARG HH22 1 1 13 4564 1 1 9 ARG N N -3.619 -2.120 3.056 1.00 . A A . 9 ARG N 1 1 13 4565 1 1 9 ARG NE N -8.022 -2.995 4.041 1.00 . A A . 9 ARG NE 1 1 13 4566 1 1 9 ARG NH1 N -7.463 -1.090 5.158 1.00 . A A . 9 ARG NH1 1 1 13 4567 1 1 9 ARG NH2 N -8.925 -1.046 3.416 1.00 . A A . 9 ARG NH2 1 1 13 4568 1 1 9 ARG O O -4.532 -3.244 0.449 1.00 . A A . 9 ARG O 1 1 13 4569 1 1 10 LYS C C -3.263 -5.211 -1.258 1.00 . A A . 10 LYS C 1 1 13 4570 1 1 10 LYS CA C -2.207 -4.316 -0.597 1.00 . A A . 10 LYS CA 1 1 13 4571 1 1 10 LYS CB C -0.786 -4.941 -0.742 1.00 . A A . 10 LYS CB 1 1 13 4572 1 1 10 LYS CD C -0.873 -6.479 1.342 1.00 . A A . 10 LYS CD 1 1 13 4573 1 1 10 LYS CE C -0.562 -7.901 1.843 1.00 . A A . 10 LYS CE 1 1 13 4574 1 1 10 LYS CG C -0.613 -6.385 -0.182 1.00 . A A . 10 LYS CG 1 1 13 4575 1 1 10 LYS H H -1.894 -4.441 1.539 1.00 . A A . 10 LYS H 1 1 13 4576 1 1 10 LYS HA H -2.247 -3.350 -1.071 1.00 . A A . 10 LYS HA 1 1 13 4577 1 1 10 LYS HB2 H -0.512 -4.941 -1.787 1.00 . A A . 10 LYS HB2 1 1 13 4578 1 1 10 LYS HB3 H -0.090 -4.302 -0.220 1.00 . A A . 10 LYS HB3 1 1 13 4579 1 1 10 LYS HD2 H -0.272 -5.756 1.874 1.00 . A A . 10 LYS HD2 1 1 13 4580 1 1 10 LYS HD3 H -1.915 -6.295 1.551 1.00 . A A . 10 LYS HD3 1 1 13 4581 1 1 10 LYS HE2 H -0.784 -7.978 2.898 1.00 . A A . 10 LYS HE2 1 1 13 4582 1 1 10 LYS HE3 H -1.158 -8.627 1.308 1.00 . A A . 10 LYS HE3 1 1 13 4583 1 1 10 LYS HG2 H -1.288 -7.049 -0.702 1.00 . A A . 10 LYS HG2 1 1 13 4584 1 1 10 LYS HG3 H 0.398 -6.702 -0.392 1.00 . A A . 10 LYS HG3 1 1 13 4585 1 1 10 LYS HZ1 H 1.465 -7.549 2.168 1.00 . A A . 10 LYS HZ1 1 1 13 4586 1 1 10 LYS HZ2 H 1.069 -9.189 1.987 1.00 . A A . 10 LYS HZ2 1 1 13 4587 1 1 10 LYS HZ3 H 1.112 -8.171 0.629 1.00 . A A . 10 LYS HZ3 1 1 13 4588 1 1 10 LYS N N -2.537 -4.159 0.858 1.00 . A A . 10 LYS N 1 1 13 4589 1 1 10 LYS NZ N 0.879 -8.226 1.640 1.00 . A A . 10 LYS NZ 1 1 13 4590 1 1 10 LYS O O -3.427 -5.213 -2.463 1.00 . A A . 10 LYS O 1 1 13 4591 1 1 11 THR C C -5.952 -6.238 -1.800 1.00 . A A . 11 THR C 1 1 13 4592 1 1 11 THR CA C -5.030 -6.883 -0.756 1.00 . A A . 11 THR CA 1 1 13 4593 1 1 11 THR CB C -5.788 -7.185 0.539 1.00 . A A . 11 THR CB 1 1 13 4594 1 1 11 THR CG2 C -6.854 -8.278 0.344 1.00 . A A . 11 THR CG2 1 1 13 4595 1 1 11 THR H H -3.710 -5.849 0.550 1.00 . A A . 11 THR H 1 1 13 4596 1 1 11 THR HA H -4.592 -7.780 -1.170 1.00 . A A . 11 THR HA 1 1 13 4597 1 1 11 THR HB H -6.162 -6.270 0.993 1.00 . A A . 11 THR HB 1 1 13 4598 1 1 11 THR HG1 H -4.133 -7.120 1.559 1.00 . A A . 11 THR HG1 1 1 13 4599 1 1 11 THR HG21 H -6.394 -9.197 0.010 1.00 . A A . 11 THR HG21 1 1 13 4600 1 1 11 THR HG22 H -7.366 -8.465 1.277 1.00 . A A . 11 THR HG22 1 1 13 4601 1 1 11 THR HG23 H -7.579 -7.965 -0.392 1.00 . A A . 11 THR HG23 1 1 13 4602 1 1 11 THR N N -3.937 -5.933 -0.399 1.00 . A A . 11 THR N 1 1 13 4603 1 1 11 THR O O -6.330 -6.841 -2.786 1.00 . A A . 11 THR O 1 1 13 4604 1 1 11 THR OG1 O -4.816 -7.775 1.392 1.00 . A A . 11 THR OG1 1 1 13 4605 1 1 12 MET C C -6.482 -2.800 -2.597 1.00 . A A . 12 MET C 1 1 13 4606 1 1 12 MET CA C -7.150 -4.162 -2.352 1.00 . A A . 12 MET CA 1 1 13 4607 1 1 12 MET CB C -8.501 -3.990 -1.616 1.00 . A A . 12 MET CB 1 1 13 4608 1 1 12 MET CE C -10.102 -1.347 0.291 1.00 . A A . 12 MET CE 1 1 13 4609 1 1 12 MET CG C -8.286 -3.337 -0.224 1.00 . A A . 12 MET CG 1 1 13 4610 1 1 12 MET H H -5.902 -4.620 -0.677 1.00 . A A . 12 MET H 1 1 13 4611 1 1 12 MET HA H -7.306 -4.644 -3.307 1.00 . A A . 12 MET HA 1 1 13 4612 1 1 12 MET HB2 H -9.167 -3.379 -2.208 1.00 . A A . 12 MET HB2 1 1 13 4613 1 1 12 MET HB3 H -8.955 -4.959 -1.481 1.00 . A A . 12 MET HB3 1 1 13 4614 1 1 12 MET HE1 H -10.273 -1.302 -0.774 1.00 . A A . 12 MET HE1 1 1 13 4615 1 1 12 MET HE2 H -10.997 -1.017 0.797 1.00 . A A . 12 MET HE2 1 1 13 4616 1 1 12 MET HE3 H -9.285 -0.704 0.581 1.00 . A A . 12 MET HE3 1 1 13 4617 1 1 12 MET HG2 H -7.629 -3.971 0.352 1.00 . A A . 12 MET HG2 1 1 13 4618 1 1 12 MET HG3 H -7.785 -2.389 -0.351 1.00 . A A . 12 MET HG3 1 1 13 4619 1 1 12 MET N N -6.266 -5.006 -1.500 1.00 . A A . 12 MET N 1 1 13 4620 1 1 12 MET O O -7.105 -1.905 -3.133 1.00 . A A . 12 MET O 1 1 13 4621 1 1 12 MET SD S -9.758 -3.052 0.792 1.00 . A A . 12 MET SD 1 1 13 4622 1 1 13 TYR C C -5.256 -0.271 -1.766 1.00 . A A . 13 TYR C 1 1 13 4623 1 1 13 TYR CA C -4.446 -1.433 -2.359 1.00 . A A . 13 TYR CA 1 1 13 4624 1 1 13 TYR CB C -4.156 -1.233 -3.865 1.00 . A A . 13 TYR CB 1 1 13 4625 1 1 13 TYR CD1 C -1.983 -2.524 -4.005 1.00 . A A . 13 TYR CD1 1 1 13 4626 1 1 13 TYR CD2 C -3.895 -3.444 -5.085 1.00 . A A . 13 TYR CD2 1 1 13 4627 1 1 13 TYR CE1 C -1.229 -3.601 -4.416 1.00 . A A . 13 TYR CE1 1 1 13 4628 1 1 13 TYR CE2 C -3.140 -4.522 -5.496 1.00 . A A . 13 TYR CE2 1 1 13 4629 1 1 13 TYR CG C -3.323 -2.435 -4.335 1.00 . A A . 13 TYR CG 1 1 13 4630 1 1 13 TYR CZ C -1.803 -4.607 -5.164 1.00 . A A . 13 TYR CZ 1 1 13 4631 1 1 13 TYR H H -4.799 -3.471 -1.782 1.00 . A A . 13 TYR H 1 1 13 4632 1 1 13 TYR HA H -3.521 -1.527 -1.808 1.00 . A A . 13 TYR HA 1 1 13 4633 1 1 13 TYR HB2 H -5.073 -1.189 -4.436 1.00 . A A . 13 TYR HB2 1 1 13 4634 1 1 13 TYR HB3 H -3.593 -0.326 -4.028 1.00 . A A . 13 TYR HB3 1 1 13 4635 1 1 13 TYR HD1 H -1.521 -1.743 -3.419 1.00 . A A . 13 TYR HD1 1 1 13 4636 1 1 13 TYR HD2 H -4.940 -3.392 -5.351 1.00 . A A . 13 TYR HD2 1 1 13 4637 1 1 13 TYR HE1 H -0.184 -3.657 -4.150 1.00 . A A . 13 TYR HE1 1 1 13 4638 1 1 13 TYR HE2 H -3.600 -5.306 -6.082 1.00 . A A . 13 TYR HE2 1 1 13 4639 1 1 13 TYR HH H -0.559 -5.422 -6.359 1.00 . A A . 13 TYR HH 1 1 13 4640 1 1 13 TYR N N -5.233 -2.697 -2.197 1.00 . A A . 13 TYR N 1 1 13 4641 1 1 13 TYR O O -5.848 0.541 -2.452 1.00 . A A . 13 TYR O 1 1 13 4642 1 1 13 TYR OH O -1.049 -5.686 -5.576 1.00 . A A . 13 TYR OH 1 1 13 4643 1 1 14 ASP C C -5.164 2.084 0.449 1.00 . A A . 14 ASP C 1 1 13 4644 1 1 14 ASP CA C -5.935 0.750 0.369 1.00 . A A . 14 ASP CA 1 1 13 4645 1 1 14 ASP CB C -6.139 0.075 1.752 1.00 . A A . 14 ASP CB 1 1 13 4646 1 1 14 ASP CG C -6.764 1.021 2.791 1.00 . A A . 14 ASP CG 1 1 13 4647 1 1 14 ASP H H -4.708 -0.966 -0.011 1.00 . A A . 14 ASP H 1 1 13 4648 1 1 14 ASP HA H -6.901 0.943 -0.076 1.00 . A A . 14 ASP HA 1 1 13 4649 1 1 14 ASP HB2 H -6.814 -0.750 1.617 1.00 . A A . 14 ASP HB2 1 1 13 4650 1 1 14 ASP HB3 H -5.220 -0.350 2.122 1.00 . A A . 14 ASP HB3 1 1 13 4651 1 1 14 ASP N N -5.225 -0.268 -0.461 1.00 . A A . 14 ASP N 1 1 13 4652 1 1 14 ASP O O -5.433 2.919 1.292 1.00 . A A . 14 ASP O 1 1 13 4653 1 1 14 ASP OD1 O -7.845 1.513 2.510 1.00 . A A . 14 ASP OD1 1 1 13 4654 1 1 14 ASP OD2 O -6.123 1.198 3.813 1.00 . A A . 14 ASP OD2 1 1 13 4655 1 1 15 CYS C C -3.748 4.368 -1.695 1.00 . A A . 15 CYS C 1 1 13 4656 1 1 15 CYS CA C -3.388 3.477 -0.506 1.00 . A A . 15 CYS CA 1 1 13 4657 1 1 15 CYS CB C -1.931 3.085 -0.621 1.00 . A A . 15 CYS CB 1 1 13 4658 1 1 15 CYS H H -4.070 1.506 -1.091 1.00 . A A . 15 CYS H 1 1 13 4659 1 1 15 CYS HA H -3.527 4.039 0.402 1.00 . A A . 15 CYS HA 1 1 13 4660 1 1 15 CYS HB2 H -1.779 2.563 -1.554 1.00 . A A . 15 CYS HB2 1 1 13 4661 1 1 15 CYS HB3 H -1.324 3.978 -0.638 1.00 . A A . 15 CYS HB3 1 1 13 4662 1 1 15 CYS N N -4.224 2.234 -0.450 1.00 . A A . 15 CYS N 1 1 13 4663 1 1 15 CYS O O -4.187 3.884 -2.720 1.00 . A A . 15 CYS O 1 1 13 4664 1 1 15 CYS SG S -1.313 2.028 0.703 1.00 . A A . 15 CYS SG 1 1 13 4665 1 1 16 CYS C C -2.837 6.397 -3.721 1.00 . A A . 16 CYS C 1 1 13 4666 1 1 16 CYS CA C -3.844 6.638 -2.589 1.00 . A A . 16 CYS CA 1 1 13 4667 1 1 16 CYS CB C -3.695 8.040 -2.005 1.00 . A A . 16 CYS CB 1 1 13 4668 1 1 16 CYS H H -3.189 5.985 -0.663 1.00 . A A . 16 CYS H 1 1 13 4669 1 1 16 CYS HA H -4.846 6.478 -2.959 1.00 . A A . 16 CYS HA 1 1 13 4670 1 1 16 CYS HB2 H -2.664 8.188 -1.714 1.00 . A A . 16 CYS HB2 1 1 13 4671 1 1 16 CYS HB3 H -3.921 8.750 -2.779 1.00 . A A . 16 CYS HB3 1 1 13 4672 1 1 16 CYS N N -3.544 5.651 -1.512 1.00 . A A . 16 CYS N 1 1 13 4673 1 1 16 CYS O O -3.131 6.595 -4.884 1.00 . A A . 16 CYS O 1 1 13 4674 1 1 16 CYS SG S -4.726 8.441 -0.573 1.00 . A A . 16 CYS SG 1 1 13 4675 1 1 17 SER C C -0.925 4.388 -5.028 1.00 . A A . 17 SER C 1 1 13 4676 1 1 17 SER CA C -0.558 5.670 -4.259 1.00 . A A . 17 SER CA 1 1 13 4677 1 1 17 SER CB C 0.727 5.466 -3.447 1.00 . A A . 17 SER CB 1 1 13 4678 1 1 17 SER H H -1.520 5.841 -2.350 1.00 . A A . 17 SER H 1 1 13 4679 1 1 17 SER HA H -0.452 6.490 -4.954 1.00 . A A . 17 SER HA 1 1 13 4680 1 1 17 SER HB2 H 0.972 6.341 -2.863 1.00 . A A . 17 SER HB2 1 1 13 4681 1 1 17 SER HB3 H 0.654 4.602 -2.800 1.00 . A A . 17 SER HB3 1 1 13 4682 1 1 17 SER HG H 1.521 4.425 -4.886 1.00 . A A . 17 SER HG 1 1 13 4683 1 1 17 SER N N -1.669 5.969 -3.309 1.00 . A A . 17 SER N 1 1 13 4684 1 1 17 SER O O -0.499 4.191 -6.150 1.00 . A A . 17 SER O 1 1 13 4685 1 1 17 SER OG O 1.735 5.238 -4.421 1.00 . A A . 17 SER OG 1 1 13 4686 1 1 18 GLY C C -1.045 1.217 -4.990 1.00 . A A . 18 GLY C 1 1 13 4687 1 1 18 GLY CA C -2.159 2.271 -4.988 1.00 . A A . 18 GLY CA 1 1 13 4688 1 1 18 GLY H H -2.010 3.791 -3.476 1.00 . A A . 18 GLY H 1 1 13 4689 1 1 18 GLY HA2 H -2.996 1.896 -4.417 1.00 . A A . 18 GLY HA2 1 1 13 4690 1 1 18 GLY HA3 H -2.477 2.449 -6.005 1.00 . A A . 18 GLY HA3 1 1 13 4691 1 1 18 GLY N N -1.710 3.561 -4.380 1.00 . A A . 18 GLY N 1 1 13 4692 1 1 18 GLY O O -1.271 0.092 -5.394 1.00 . A A . 18 GLY O 1 1 13 4693 1 1 19 SER C C 1.584 0.294 -3.030 1.00 . A A . 19 SER C 1 1 13 4694 1 1 19 SER CA C 1.294 0.694 -4.486 1.00 . A A . 19 SER CA 1 1 13 4695 1 1 19 SER CB C 2.495 1.428 -5.128 1.00 . A A . 19 SER CB 1 1 13 4696 1 1 19 SER H H 0.231 2.535 -4.226 1.00 . A A . 19 SER H 1 1 13 4697 1 1 19 SER HA H 1.082 -0.203 -5.053 1.00 . A A . 19 SER HA 1 1 13 4698 1 1 19 SER HB2 H 3.396 0.833 -5.084 1.00 . A A . 19 SER HB2 1 1 13 4699 1 1 19 SER HB3 H 2.285 1.706 -6.150 1.00 . A A . 19 SER HB3 1 1 13 4700 1 1 19 SER HG H 3.124 2.363 -3.539 1.00 . A A . 19 SER HG 1 1 13 4701 1 1 19 SER N N 0.120 1.614 -4.540 1.00 . A A . 19 SER N 1 1 13 4702 1 1 19 SER O O 2.681 0.465 -2.531 1.00 . A A . 19 SER O 1 1 13 4703 1 1 19 SER OG O 2.666 2.605 -4.348 1.00 . A A . 19 SER OG 1 1 13 4704 1 1 20 CYS C C 1.690 -1.858 -0.861 1.00 . A A . 20 CYS C 1 1 13 4705 1 1 20 CYS CA C 0.735 -0.663 -0.967 1.00 . A A . 20 CYS CA 1 1 13 4706 1 1 20 CYS CB C -0.643 -1.035 -0.388 1.00 . A A . 20 CYS CB 1 1 13 4707 1 1 20 CYS H H -0.291 -0.348 -2.837 1.00 . A A . 20 CYS H 1 1 13 4708 1 1 20 CYS HA H 1.145 0.162 -0.412 1.00 . A A . 20 CYS HA 1 1 13 4709 1 1 20 CYS HB2 H -1.243 -0.141 -0.363 1.00 . A A . 20 CYS HB2 1 1 13 4710 1 1 20 CYS HB3 H -1.149 -1.713 -1.041 1.00 . A A . 20 CYS HB3 1 1 13 4711 1 1 20 CYS N N 0.571 -0.235 -2.387 1.00 . A A . 20 CYS N 1 1 13 4712 1 1 20 CYS O O 1.461 -2.908 -1.430 1.00 . A A . 20 CYS O 1 1 13 4713 1 1 20 CYS SG S -0.660 -1.740 1.278 1.00 . A A . 20 CYS SG 1 1 13 4714 1 1 21 GLY C C 3.290 -3.915 0.827 1.00 . A A . 21 GLY C 1 1 13 4715 1 1 21 GLY CA C 3.800 -2.656 0.115 1.00 . A A . 21 GLY CA 1 1 13 4716 1 1 21 GLY H H 2.844 -0.745 0.289 1.00 . A A . 21 GLY H 1 1 13 4717 1 1 21 GLY HA2 H 4.225 -2.939 -0.838 1.00 . A A . 21 GLY HA2 1 1 13 4718 1 1 21 GLY HA3 H 4.577 -2.212 0.720 1.00 . A A . 21 GLY HA3 1 1 13 4719 1 1 21 GLY N N 2.745 -1.628 -0.121 1.00 . A A . 21 GLY N 1 1 13 4720 1 1 21 GLY O O 2.207 -3.949 1.381 1.00 . A A . 21 GLY O 1 1 13 4721 1 1 22 ARG C C 3.946 -6.187 2.925 1.00 . A A . 22 ARG C 1 1 13 4722 1 1 22 ARG CA C 3.848 -6.245 1.394 1.00 . A A . 22 ARG CA 1 1 13 4723 1 1 22 ARG CB C 4.858 -7.270 0.828 1.00 . A A . 22 ARG CB 1 1 13 4724 1 1 22 ARG CD C 7.326 -7.866 0.593 1.00 . A A . 22 ARG CD 1 1 13 4725 1 1 22 ARG CG C 6.316 -6.850 1.168 1.00 . A A . 22 ARG CG 1 1 13 4726 1 1 22 ARG CZ C 6.494 -8.790 -1.541 1.00 . A A . 22 ARG CZ 1 1 13 4727 1 1 22 ARG H H 4.982 -4.773 0.310 1.00 . A A . 22 ARG H 1 1 13 4728 1 1 22 ARG HA H 2.846 -6.544 1.123 1.00 . A A . 22 ARG HA 1 1 13 4729 1 1 22 ARG HB2 H 4.653 -8.246 1.244 1.00 . A A . 22 ARG HB2 1 1 13 4730 1 1 22 ARG HB3 H 4.729 -7.320 -0.242 1.00 . A A . 22 ARG HB3 1 1 13 4731 1 1 22 ARG HD2 H 8.329 -7.557 0.848 1.00 . A A . 22 ARG HD2 1 1 13 4732 1 1 22 ARG HD3 H 7.158 -8.853 0.999 1.00 . A A . 22 ARG HD3 1 1 13 4733 1 1 22 ARG HE H 7.689 -7.218 -1.425 1.00 . A A . 22 ARG HE 1 1 13 4734 1 1 22 ARG HG2 H 6.528 -5.875 0.756 1.00 . A A . 22 ARG HG2 1 1 13 4735 1 1 22 ARG HG3 H 6.444 -6.803 2.239 1.00 . A A . 22 ARG HG3 1 1 13 4736 1 1 22 ARG HH11 H 5.860 -9.757 0.102 1.00 . A A . 22 ARG HH11 1 1 13 4737 1 1 22 ARG HH12 H 5.299 -10.387 -1.407 1.00 . A A . 22 ARG HH12 1 1 13 4738 1 1 22 ARG HH21 H 6.974 -8.010 -3.319 1.00 . A A . 22 ARG HH21 1 1 13 4739 1 1 22 ARG HH22 H 5.929 -9.390 -3.363 1.00 . A A . 22 ARG HH22 1 1 13 4740 1 1 22 ARG N N 4.132 -4.914 0.773 1.00 . A A . 22 ARG N 1 1 13 4741 1 1 22 ARG NE N 7.210 -7.895 -0.903 1.00 . A A . 22 ARG NE 1 1 13 4742 1 1 22 ARG NH1 N 5.834 -9.715 -0.897 1.00 . A A . 22 ARG NH1 1 1 13 4743 1 1 22 ARG NH2 N 6.463 -8.724 -2.843 1.00 . A A . 22 ARG NH2 1 1 13 4744 1 1 22 ARG O O 3.476 -7.073 3.613 1.00 . A A . 22 ARG O 1 1 13 4745 1 1 23 ARG C C 3.407 -4.382 5.445 1.00 . A A . 23 ARG C 1 1 13 4746 1 1 23 ARG CA C 4.737 -4.919 4.871 1.00 . A A . 23 ARG CA 1 1 13 4747 1 1 23 ARG CB C 5.893 -3.904 5.052 1.00 . A A . 23 ARG CB 1 1 13 4748 1 1 23 ARG CD C 7.369 -2.627 6.664 1.00 . A A . 23 ARG CD 1 1 13 4749 1 1 23 ARG CG C 6.219 -3.646 6.548 1.00 . A A . 23 ARG CG 1 1 13 4750 1 1 23 ARG CZ C 9.659 -2.459 5.805 1.00 . A A . 23 ARG CZ 1 1 13 4751 1 1 23 ARG H H 4.908 -4.462 2.776 1.00 . A A . 23 ARG H 1 1 13 4752 1 1 23 ARG HA H 4.977 -5.860 5.343 1.00 . A A . 23 ARG HA 1 1 13 4753 1 1 23 ARG HB2 H 6.771 -4.293 4.555 1.00 . A A . 23 ARG HB2 1 1 13 4754 1 1 23 ARG HB3 H 5.623 -2.971 4.579 1.00 . A A . 23 ARG HB3 1 1 13 4755 1 1 23 ARG HD2 H 7.094 -1.695 6.190 1.00 . A A . 23 ARG HD2 1 1 13 4756 1 1 23 ARG HD3 H 7.602 -2.443 7.703 1.00 . A A . 23 ARG HD3 1 1 13 4757 1 1 23 ARG HE H 8.572 -4.111 5.668 1.00 . A A . 23 ARG HE 1 1 13 4758 1 1 23 ARG HG2 H 5.362 -3.237 7.059 1.00 . A A . 23 ARG HG2 1 1 13 4759 1 1 23 ARG HG3 H 6.502 -4.571 7.031 1.00 . A A . 23 ARG HG3 1 1 13 4760 1 1 23 ARG HH11 H 8.917 -0.813 6.678 1.00 . A A . 23 ARG HH11 1 1 13 4761 1 1 23 ARG HH12 H 10.532 -0.678 6.073 1.00 . A A . 23 ARG HH12 1 1 13 4762 1 1 23 ARG HH21 H 10.617 -3.962 4.898 1.00 . A A . 23 ARG HH21 1 1 13 4763 1 1 23 ARG HH22 H 11.512 -2.487 5.051 1.00 . A A . 23 ARG HH22 1 1 13 4764 1 1 23 ARG N N 4.558 -5.131 3.400 1.00 . A A . 23 ARG N 1 1 13 4765 1 1 23 ARG NE N 8.582 -3.183 5.986 1.00 . A A . 23 ARG NE 1 1 13 4766 1 1 23 ARG NH1 N 9.706 -1.220 6.218 1.00 . A A . 23 ARG NH1 1 1 13 4767 1 1 23 ARG NH2 N 10.676 -3.013 5.204 1.00 . A A . 23 ARG NH2 1 1 13 4768 1 1 23 ARG O O 3.276 -4.174 6.635 1.00 . A A . 23 ARG O 1 1 13 4769 1 1 24 GLY C C 1.181 -2.137 5.089 1.00 . A A . 24 GLY C 1 1 13 4770 1 1 24 GLY CA C 1.121 -3.662 4.976 1.00 . A A . 24 GLY CA 1 1 13 4771 1 1 24 GLY H H 2.619 -4.369 3.616 1.00 . A A . 24 GLY H 1 1 13 4772 1 1 24 GLY HA2 H 0.392 -3.933 4.226 1.00 . A A . 24 GLY HA2 1 1 13 4773 1 1 24 GLY HA3 H 0.837 -4.087 5.928 1.00 . A A . 24 GLY HA3 1 1 13 4774 1 1 24 GLY N N 2.457 -4.180 4.564 1.00 . A A . 24 GLY N 1 1 13 4775 1 1 24 GLY O O 0.303 -1.538 5.677 1.00 . A A . 24 GLY O 1 1 13 4776 1 1 25 LYS C C 2.272 0.421 3.119 1.00 . A A . 25 LYS C 1 1 13 4777 1 1 25 LYS CA C 2.397 -0.073 4.558 1.00 . A A . 25 LYS CA 1 1 13 4778 1 1 25 LYS CB C 3.791 0.292 5.094 1.00 . A A . 25 LYS CB 1 1 13 4779 1 1 25 LYS CD C 3.033 0.159 7.519 1.00 . A A . 25 LYS CD 1 1 13 4780 1 1 25 LYS CE C 3.266 -0.548 8.861 1.00 . A A . 25 LYS CE 1 1 13 4781 1 1 25 LYS CG C 4.044 -0.363 6.470 1.00 . A A . 25 LYS CG 1 1 13 4782 1 1 25 LYS H H 2.886 -2.115 4.060 1.00 . A A . 25 LYS H 1 1 13 4783 1 1 25 LYS HA H 1.622 0.383 5.153 1.00 . A A . 25 LYS HA 1 1 13 4784 1 1 25 LYS HB2 H 4.544 0.011 4.377 1.00 . A A . 25 LYS HB2 1 1 13 4785 1 1 25 LYS HB3 H 3.839 1.363 5.215 1.00 . A A . 25 LYS HB3 1 1 13 4786 1 1 25 LYS HD2 H 3.162 1.223 7.652 1.00 . A A . 25 LYS HD2 1 1 13 4787 1 1 25 LYS HD3 H 2.022 -0.024 7.194 1.00 . A A . 25 LYS HD3 1 1 13 4788 1 1 25 LYS HE2 H 4.269 -0.368 9.218 1.00 . A A . 25 LYS HE2 1 1 13 4789 1 1 25 LYS HE3 H 2.562 -0.184 9.595 1.00 . A A . 25 LYS HE3 1 1 13 4790 1 1 25 LYS HG2 H 3.961 -1.436 6.375 1.00 . A A . 25 LYS HG2 1 1 13 4791 1 1 25 LYS HG3 H 5.050 -0.129 6.790 1.00 . A A . 25 LYS HG3 1 1 13 4792 1 1 25 LYS HZ1 H 2.270 -2.193 8.060 1.00 . A A . 25 LYS HZ1 1 1 13 4793 1 1 25 LYS HZ2 H 3.931 -2.442 8.309 1.00 . A A . 25 LYS HZ2 1 1 13 4794 1 1 25 LYS HZ3 H 2.867 -2.442 9.632 1.00 . A A . 25 LYS HZ3 1 1 13 4795 1 1 25 LYS N N 2.216 -1.561 4.522 1.00 . A A . 25 LYS N 1 1 13 4796 1 1 25 LYS NZ N 3.069 -2.017 8.705 1.00 . A A . 25 LYS NZ 1 1 13 4797 1 1 25 LYS O O 2.424 -0.354 2.198 1.00 . A A . 25 LYS O 1 1 13 4798 1 1 26 CYS C C 3.181 2.577 0.876 1.00 . A A . 26 CYS C 1 1 13 4799 1 1 26 CYS CA C 1.862 2.257 1.585 1.00 . A A . 26 CYS CA 1 1 13 4800 1 1 26 CYS CB C 1.002 3.518 1.675 1.00 . A A . 26 CYS CB 1 1 13 4801 1 1 26 CYS H H 1.901 2.257 3.754 1.00 . A A . 26 CYS H 1 1 13 4802 1 1 26 CYS HA H 1.324 1.547 0.982 1.00 . A A . 26 CYS HA 1 1 13 4803 1 1 26 CYS HB2 H 1.442 4.175 2.402 1.00 . A A . 26 CYS HB2 1 1 13 4804 1 1 26 CYS HB3 H 0.994 4.024 0.721 1.00 . A A . 26 CYS HB3 1 1 13 4805 1 1 26 CYS N N 2.005 1.691 2.962 1.00 . A A . 26 CYS N 1 1 13 4806 1 1 26 CYS O O 4.244 2.604 1.465 1.00 . A A . 26 CYS O 1 1 13 4807 1 1 26 CYS SG S -0.711 3.266 2.179 1.00 . A A . 26 CYS SG 1 1 13 4808 1 1 27 NH2 HN1 H 2.279 2.802 -0.876 1.00 . A A . 27 NH2 HN1 1 1 13 4809 1 1 27 NH2 HN2 H 3.957 3.031 -0.904 1.00 . A A . 27 NH2 HN2 1 1 13 4810 1 1 27 NH2 N N 3.139 2.824 -0.407 1.00 . A A . 27 NH2 N 1 1 14 4811 1 1 1 CYS C C -6.069 6.691 1.795 1.00 . A A . 1 CYS C 1 1 14 4812 1 1 1 CYS CA C -7.126 6.308 0.754 1.00 . A A . 1 CYS CA 1 1 14 4813 1 1 1 CYS CB C -6.569 6.610 -0.643 1.00 . A A . 1 CYS CB 1 1 14 4814 1 1 1 CYS H1 H -8.153 8.098 1.022 1.00 . A A . 1 CYS H1 1 1 14 4815 1 1 1 CYS H2 H -9.053 6.896 0.226 1.00 . A A . 1 CYS H2 1 1 14 4816 1 1 1 CYS H3 H -8.792 6.794 1.902 1.00 . A A . 1 CYS H3 1 1 14 4817 1 1 1 CYS HA H -7.344 5.253 0.851 1.00 . A A . 1 CYS HA 1 1 14 4818 1 1 1 CYS HB2 H -5.689 6.002 -0.791 1.00 . A A . 1 CYS HB2 1 1 14 4819 1 1 1 CYS HB3 H -7.298 6.305 -1.379 1.00 . A A . 1 CYS HB3 1 1 14 4820 1 1 1 CYS N N -8.376 7.082 0.993 1.00 . A A . 1 CYS N 1 1 14 4821 1 1 1 CYS O O -6.047 7.799 2.296 1.00 . A A . 1 CYS O 1 1 14 4822 1 1 1 CYS SG S -6.116 8.329 -0.986 1.00 . A A . 1 CYS SG 1 1 14 4823 1 1 2 LYS C C -2.858 6.420 2.355 1.00 . A A . 2 LYS C 1 1 14 4824 1 1 2 LYS CA C -4.120 5.915 3.068 1.00 . A A . 2 LYS CA 1 1 14 4825 1 1 2 LYS CB C -3.869 4.552 3.759 1.00 . A A . 2 LYS CB 1 1 14 4826 1 1 2 LYS CD C -6.410 4.141 4.092 1.00 . A A . 2 LYS CD 1 1 14 4827 1 1 2 LYS CE C -7.447 3.638 5.108 1.00 . A A . 2 LYS CE 1 1 14 4828 1 1 2 LYS CG C -5.010 4.158 4.742 1.00 . A A . 2 LYS CG 1 1 14 4829 1 1 2 LYS H H -5.315 4.874 1.623 1.00 . A A . 2 LYS H 1 1 14 4830 1 1 2 LYS HA H -4.421 6.644 3.807 1.00 . A A . 2 LYS HA 1 1 14 4831 1 1 2 LYS HB2 H -3.764 3.781 3.011 1.00 . A A . 2 LYS HB2 1 1 14 4832 1 1 2 LYS HB3 H -2.952 4.595 4.320 1.00 . A A . 2 LYS HB3 1 1 14 4833 1 1 2 LYS HD2 H -6.694 5.149 3.835 1.00 . A A . 2 LYS HD2 1 1 14 4834 1 1 2 LYS HD3 H -6.421 3.543 3.197 1.00 . A A . 2 LYS HD3 1 1 14 4835 1 1 2 LYS HE2 H -7.189 2.657 5.475 1.00 . A A . 2 LYS HE2 1 1 14 4836 1 1 2 LYS HE3 H -7.507 4.320 5.945 1.00 . A A . 2 LYS HE3 1 1 14 4837 1 1 2 LYS HG2 H -4.789 3.174 5.128 1.00 . A A . 2 LYS HG2 1 1 14 4838 1 1 2 LYS HG3 H -5.006 4.853 5.568 1.00 . A A . 2 LYS HG3 1 1 14 4839 1 1 2 LYS HZ1 H -8.872 4.332 3.757 1.00 . A A . 2 LYS HZ1 1 1 14 4840 1 1 2 LYS HZ2 H -8.891 2.650 3.986 1.00 . A A . 2 LYS HZ2 1 1 14 4841 1 1 2 LYS HZ3 H -9.527 3.675 5.181 1.00 . A A . 2 LYS HZ3 1 1 14 4842 1 1 2 LYS N N -5.223 5.736 2.078 1.00 . A A . 2 LYS N 1 1 14 4843 1 1 2 LYS NZ N -8.785 3.570 4.459 1.00 . A A . 2 LYS NZ 1 1 14 4844 1 1 2 LYS O O -2.424 5.845 1.377 1.00 . A A . 2 LYS O 1 1 14 4845 1 1 3 GLY C C 0.112 7.149 2.191 1.00 . A A . 3 GLY C 1 1 14 4846 1 1 3 GLY CA C -1.078 8.114 2.309 1.00 . A A . 3 GLY CA 1 1 14 4847 1 1 3 GLY H H -2.731 7.889 3.673 1.00 . A A . 3 GLY H 1 1 14 4848 1 1 3 GLY HA2 H -1.312 8.498 1.326 1.00 . A A . 3 GLY HA2 1 1 14 4849 1 1 3 GLY HA3 H -0.789 8.940 2.941 1.00 . A A . 3 GLY HA3 1 1 14 4850 1 1 3 GLY N N -2.314 7.488 2.882 1.00 . A A . 3 GLY N 1 1 14 4851 1 1 3 GLY O O 0.035 6.000 2.578 1.00 . A A . 3 GLY O 1 1 14 4852 1 1 4 LYS C C 2.952 6.343 2.832 1.00 . A A . 4 LYS C 1 1 14 4853 1 1 4 LYS CA C 2.427 6.838 1.472 1.00 . A A . 4 LYS CA 1 1 14 4854 1 1 4 LYS CB C 3.490 7.712 0.762 1.00 . A A . 4 LYS CB 1 1 14 4855 1 1 4 LYS CD C 4.540 5.729 -0.448 1.00 . A A . 4 LYS CD 1 1 14 4856 1 1 4 LYS CE C 5.856 4.984 -0.709 1.00 . A A . 4 LYS CE 1 1 14 4857 1 1 4 LYS CG C 4.803 6.928 0.494 1.00 . A A . 4 LYS CG 1 1 14 4858 1 1 4 LYS H H 1.186 8.597 1.362 1.00 . A A . 4 LYS H 1 1 14 4859 1 1 4 LYS HA H 2.172 5.986 0.859 1.00 . A A . 4 LYS HA 1 1 14 4860 1 1 4 LYS HB2 H 3.089 8.066 -0.177 1.00 . A A . 4 LYS HB2 1 1 14 4861 1 1 4 LYS HB3 H 3.714 8.572 1.377 1.00 . A A . 4 LYS HB3 1 1 14 4862 1 1 4 LYS HD2 H 3.841 5.046 0.008 1.00 . A A . 4 LYS HD2 1 1 14 4863 1 1 4 LYS HD3 H 4.125 6.078 -1.383 1.00 . A A . 4 LYS HD3 1 1 14 4864 1 1 4 LYS HE2 H 6.581 5.643 -1.165 1.00 . A A . 4 LYS HE2 1 1 14 4865 1 1 4 LYS HE3 H 6.261 4.601 0.217 1.00 . A A . 4 LYS HE3 1 1 14 4866 1 1 4 LYS HG2 H 5.519 7.593 0.035 1.00 . A A . 4 LYS HG2 1 1 14 4867 1 1 4 LYS HG3 H 5.219 6.577 1.428 1.00 . A A . 4 LYS HG3 1 1 14 4868 1 1 4 LYS HZ1 H 4.694 3.953 -2.096 1.00 . A A . 4 LYS HZ1 1 1 14 4869 1 1 4 LYS HZ2 H 6.366 3.801 -2.346 1.00 . A A . 4 LYS HZ2 1 1 14 4870 1 1 4 LYS HZ3 H 5.612 2.951 -1.082 1.00 . A A . 4 LYS HZ3 1 1 14 4871 1 1 4 LYS N N 1.190 7.662 1.652 1.00 . A A . 4 LYS N 1 1 14 4872 1 1 4 LYS NZ N 5.615 3.836 -1.628 1.00 . A A . 4 LYS NZ 1 1 14 4873 1 1 4 LYS O O 2.995 7.090 3.790 1.00 . A A . 4 LYS O 1 1 14 4874 1 1 5 GLY C C 2.806 4.299 5.211 1.00 . A A . 5 GLY C 1 1 14 4875 1 1 5 GLY CA C 3.865 4.463 4.110 1.00 . A A . 5 GLY CA 1 1 14 4876 1 1 5 GLY H H 3.265 4.552 2.045 1.00 . A A . 5 GLY H 1 1 14 4877 1 1 5 GLY HA2 H 4.254 3.487 3.859 1.00 . A A . 5 GLY HA2 1 1 14 4878 1 1 5 GLY HA3 H 4.672 5.067 4.496 1.00 . A A . 5 GLY HA3 1 1 14 4879 1 1 5 GLY N N 3.332 5.091 2.861 1.00 . A A . 5 GLY N 1 1 14 4880 1 1 5 GLY O O 3.157 4.057 6.349 1.00 . A A . 5 GLY O 1 1 14 4881 1 1 6 ALA C C -0.123 2.855 5.814 1.00 . A A . 6 ALA C 1 1 14 4882 1 1 6 ALA CA C 0.439 4.297 5.843 1.00 . A A . 6 ALA CA 1 1 14 4883 1 1 6 ALA CB C -0.648 5.308 5.477 1.00 . A A . 6 ALA CB 1 1 14 4884 1 1 6 ALA H H 1.339 4.639 3.916 1.00 . A A . 6 ALA H 1 1 14 4885 1 1 6 ALA HA H 0.817 4.519 6.830 1.00 . A A . 6 ALA HA 1 1 14 4886 1 1 6 ALA HB1 H -1.003 5.107 4.479 1.00 . A A . 6 ALA HB1 1 1 14 4887 1 1 6 ALA HB2 H -1.480 5.246 6.161 1.00 . A A . 6 ALA HB2 1 1 14 4888 1 1 6 ALA HB3 H -0.247 6.310 5.509 1.00 . A A . 6 ALA HB3 1 1 14 4889 1 1 6 ALA N N 1.553 4.439 4.850 1.00 . A A . 6 ALA N 1 1 14 4890 1 1 6 ALA O O -0.029 2.200 4.795 1.00 . A A . 6 ALA O 1 1 14 4891 1 1 7 PRO C C -2.242 0.603 5.998 1.00 . A A . 7 PRO C 1 1 14 4892 1 1 7 PRO CA C -1.164 0.976 7.034 1.00 . A A . 7 PRO CA 1 1 14 4893 1 1 7 PRO CB C -1.675 0.835 8.476 1.00 . A A . 7 PRO CB 1 1 14 4894 1 1 7 PRO CD C -0.928 3.185 8.153 1.00 . A A . 7 PRO CD 1 1 14 4895 1 1 7 PRO CG C -1.666 2.234 9.108 1.00 . A A . 7 PRO CG 1 1 14 4896 1 1 7 PRO HA H -0.320 0.322 6.899 1.00 . A A . 7 PRO HA 1 1 14 4897 1 1 7 PRO HB2 H -2.673 0.423 8.503 1.00 . A A . 7 PRO HB2 1 1 14 4898 1 1 7 PRO HB3 H -1.018 0.182 9.031 1.00 . A A . 7 PRO HB3 1 1 14 4899 1 1 7 PRO HD2 H -1.535 4.049 7.927 1.00 . A A . 7 PRO HD2 1 1 14 4900 1 1 7 PRO HD3 H 0.017 3.493 8.575 1.00 . A A . 7 PRO HD3 1 1 14 4901 1 1 7 PRO HG2 H -2.680 2.577 9.259 1.00 . A A . 7 PRO HG2 1 1 14 4902 1 1 7 PRO HG3 H -1.163 2.205 10.063 1.00 . A A . 7 PRO HG3 1 1 14 4903 1 1 7 PRO N N -0.689 2.389 6.910 1.00 . A A . 7 PRO N 1 1 14 4904 1 1 7 PRO O O -3.394 0.966 6.133 1.00 . A A . 7 PRO O 1 1 14 4905 1 1 8 CYS C C -2.813 -2.102 3.736 1.00 . A A . 8 CYS C 1 1 14 4906 1 1 8 CYS CA C -2.697 -0.579 3.877 1.00 . A A . 8 CYS CA 1 1 14 4907 1 1 8 CYS CB C -2.158 -0.020 2.597 1.00 . A A . 8 CYS CB 1 1 14 4908 1 1 8 CYS H H -0.848 -0.340 4.946 1.00 . A A . 8 CYS H 1 1 14 4909 1 1 8 CYS HA H -3.687 -0.182 4.021 1.00 . A A . 8 CYS HA 1 1 14 4910 1 1 8 CYS HB2 H -2.675 -0.470 1.761 1.00 . A A . 8 CYS HB2 1 1 14 4911 1 1 8 CYS HB3 H -2.347 1.030 2.533 1.00 . A A . 8 CYS HB3 1 1 14 4912 1 1 8 CYS N N -1.804 -0.110 4.989 1.00 . A A . 8 CYS N 1 1 14 4913 1 1 8 CYS O O -2.210 -2.866 4.465 1.00 . A A . 8 CYS O 1 1 14 4914 1 1 8 CYS SG S -0.394 -0.334 2.365 1.00 . A A . 8 CYS SG 1 1 14 4915 1 1 9 ARG C C -3.972 -3.973 0.867 1.00 . A A . 9 ARG C 1 1 14 4916 1 1 9 ARG CA C -3.901 -3.865 2.400 1.00 . A A . 9 ARG CA 1 1 14 4917 1 1 9 ARG CB C -5.255 -4.375 3.025 1.00 . A A . 9 ARG CB 1 1 14 4918 1 1 9 ARG CD C -6.476 -2.224 3.671 1.00 . A A . 9 ARG CD 1 1 14 4919 1 1 9 ARG CG C -6.510 -3.487 2.786 1.00 . A A . 9 ARG CG 1 1 14 4920 1 1 9 ARG CZ C -5.988 -1.928 6.065 1.00 . A A . 9 ARG CZ 1 1 14 4921 1 1 9 ARG H H -4.058 -1.748 2.245 1.00 . A A . 9 ARG H 1 1 14 4922 1 1 9 ARG HA H -3.091 -4.485 2.758 1.00 . A A . 9 ARG HA 1 1 14 4923 1 1 9 ARG HB2 H -5.461 -5.355 2.619 1.00 . A A . 9 ARG HB2 1 1 14 4924 1 1 9 ARG HB3 H -5.107 -4.497 4.087 1.00 . A A . 9 ARG HB3 1 1 14 4925 1 1 9 ARG HD2 H -5.612 -1.617 3.477 1.00 . A A . 9 ARG HD2 1 1 14 4926 1 1 9 ARG HD3 H -7.367 -1.636 3.507 1.00 . A A . 9 ARG HD3 1 1 14 4927 1 1 9 ARG HE H -6.824 -3.558 5.322 1.00 . A A . 9 ARG HE 1 1 14 4928 1 1 9 ARG HG2 H -6.571 -3.193 1.750 1.00 . A A . 9 ARG HG2 1 1 14 4929 1 1 9 ARG HG3 H -7.396 -4.059 3.022 1.00 . A A . 9 ARG HG3 1 1 14 4930 1 1 9 ARG HH11 H -5.473 -0.395 4.885 1.00 . A A . 9 ARG HH11 1 1 14 4931 1 1 9 ARG HH12 H -5.144 -0.189 6.571 1.00 . A A . 9 ARG HH12 1 1 14 4932 1 1 9 ARG HH21 H -6.399 -3.315 7.447 1.00 . A A . 9 ARG HH21 1 1 14 4933 1 1 9 ARG HH22 H -5.666 -1.862 8.038 1.00 . A A . 9 ARG HH22 1 1 14 4934 1 1 9 ARG N N -3.618 -2.453 2.763 1.00 . A A . 9 ARG N 1 1 14 4935 1 1 9 ARG NE N -6.464 -2.673 5.100 1.00 . A A . 9 ARG NE 1 1 14 4936 1 1 9 ARG NH1 N -5.497 -0.745 5.819 1.00 . A A . 9 ARG NH1 1 1 14 4937 1 1 9 ARG NH2 N -6.020 -2.405 7.278 1.00 . A A . 9 ARG NH2 1 1 14 4938 1 1 9 ARG O O -4.746 -3.313 0.190 1.00 . A A . 9 ARG O 1 1 14 4939 1 1 10 LYS C C -4.307 -5.641 -1.585 1.00 . A A . 10 LYS C 1 1 14 4940 1 1 10 LYS CA C -2.958 -5.154 -1.055 1.00 . A A . 10 LYS CA 1 1 14 4941 1 1 10 LYS CB C -1.932 -6.290 -1.300 1.00 . A A . 10 LYS CB 1 1 14 4942 1 1 10 LYS CD C -0.409 -5.848 0.729 1.00 . A A . 10 LYS CD 1 1 14 4943 1 1 10 LYS CE C 1.054 -5.797 1.155 1.00 . A A . 10 LYS CE 1 1 14 4944 1 1 10 LYS CG C -0.486 -6.014 -0.806 1.00 . A A . 10 LYS CG 1 1 14 4945 1 1 10 LYS H H -2.545 -5.309 1.053 1.00 . A A . 10 LYS H 1 1 14 4946 1 1 10 LYS HA H -2.671 -4.256 -1.582 1.00 . A A . 10 LYS HA 1 1 14 4947 1 1 10 LYS HB2 H -2.288 -7.189 -0.817 1.00 . A A . 10 LYS HB2 1 1 14 4948 1 1 10 LYS HB3 H -1.889 -6.486 -2.361 1.00 . A A . 10 LYS HB3 1 1 14 4949 1 1 10 LYS HD2 H -0.846 -4.906 1.022 1.00 . A A . 10 LYS HD2 1 1 14 4950 1 1 10 LYS HD3 H -0.921 -6.655 1.232 1.00 . A A . 10 LYS HD3 1 1 14 4951 1 1 10 LYS HE2 H 1.544 -6.720 0.882 1.00 . A A . 10 LYS HE2 1 1 14 4952 1 1 10 LYS HE3 H 1.557 -4.975 0.673 1.00 . A A . 10 LYS HE3 1 1 14 4953 1 1 10 LYS HG2 H 0.145 -6.837 -1.110 1.00 . A A . 10 LYS HG2 1 1 14 4954 1 1 10 LYS HG3 H -0.118 -5.116 -1.280 1.00 . A A . 10 LYS HG3 1 1 14 4955 1 1 10 LYS HZ1 H 0.530 -6.317 3.103 1.00 . A A . 10 LYS HZ1 1 1 14 4956 1 1 10 LYS HZ2 H 2.132 -5.780 2.936 1.00 . A A . 10 LYS HZ2 1 1 14 4957 1 1 10 LYS HZ3 H 0.855 -4.663 2.890 1.00 . A A . 10 LYS HZ3 1 1 14 4958 1 1 10 LYS N N -3.108 -4.844 0.403 1.00 . A A . 10 LYS N 1 1 14 4959 1 1 10 LYS NZ N 1.149 -5.627 2.633 1.00 . A A . 10 LYS NZ 1 1 14 4960 1 1 10 LYS O O -4.616 -5.470 -2.749 1.00 . A A . 10 LYS O 1 1 14 4961 1 1 11 THR C C -7.193 -5.954 -1.906 1.00 . A A . 11 THR C 1 1 14 4962 1 1 11 THR CA C -6.404 -6.803 -0.908 1.00 . A A . 11 THR CA 1 1 14 4963 1 1 11 THR CB C -7.139 -6.855 0.444 1.00 . A A . 11 THR CB 1 1 14 4964 1 1 11 THR CG2 C -8.472 -7.623 0.349 1.00 . A A . 11 THR CG2 1 1 14 4965 1 1 11 THR H H -4.669 -6.309 0.235 1.00 . A A . 11 THR H 1 1 14 4966 1 1 11 THR HA H -6.292 -7.800 -1.311 1.00 . A A . 11 THR HA 1 1 14 4967 1 1 11 THR HB H -7.245 -5.877 0.896 1.00 . A A . 11 THR HB 1 1 14 4968 1 1 11 THR HG1 H -5.461 -7.262 1.340 1.00 . A A . 11 THR HG1 1 1 14 4969 1 1 11 THR HG21 H -8.300 -8.641 0.030 1.00 . A A . 11 THR HG21 1 1 14 4970 1 1 11 THR HG22 H -8.956 -7.638 1.314 1.00 . A A . 11 THR HG22 1 1 14 4971 1 1 11 THR HG23 H -9.131 -7.144 -0.360 1.00 . A A . 11 THR HG23 1 1 14 4972 1 1 11 THR N N -5.041 -6.233 -0.669 1.00 . A A . 11 THR N 1 1 14 4973 1 1 11 THR O O -7.940 -6.468 -2.717 1.00 . A A . 11 THR O 1 1 14 4974 1 1 11 THR OG1 O -6.321 -7.679 1.263 1.00 . A A . 11 THR OG1 1 1 14 4975 1 1 12 MET C C -6.793 -2.463 -2.890 1.00 . A A . 12 MET C 1 1 14 4976 1 1 12 MET CA C -7.670 -3.700 -2.693 1.00 . A A . 12 MET CA 1 1 14 4977 1 1 12 MET CB C -9.024 -3.307 -2.049 1.00 . A A . 12 MET CB 1 1 14 4978 1 1 12 MET CE C -10.210 -0.379 -0.259 1.00 . A A . 12 MET CE 1 1 14 4979 1 1 12 MET CG C -8.793 -2.685 -0.648 1.00 . A A . 12 MET CG 1 1 14 4980 1 1 12 MET H H -6.361 -4.338 -1.111 1.00 . A A . 12 MET H 1 1 14 4981 1 1 12 MET HA H -7.834 -4.158 -3.658 1.00 . A A . 12 MET HA 1 1 14 4982 1 1 12 MET HB2 H -9.539 -2.597 -2.680 1.00 . A A . 12 MET HB2 1 1 14 4983 1 1 12 MET HB3 H -9.643 -4.186 -1.951 1.00 . A A . 12 MET HB3 1 1 14 4984 1 1 12 MET HE1 H -10.204 -0.316 -1.337 1.00 . A A . 12 MET HE1 1 1 14 4985 1 1 12 MET HE2 H -11.101 0.110 0.106 1.00 . A A . 12 MET HE2 1 1 14 4986 1 1 12 MET HE3 H -9.345 0.112 0.162 1.00 . A A . 12 MET HE3 1 1 14 4987 1 1 12 MET HG2 H -8.309 -3.424 -0.027 1.00 . A A . 12 MET HG2 1 1 14 4988 1 1 12 MET HG3 H -8.114 -1.850 -0.738 1.00 . A A . 12 MET HG3 1 1 14 4989 1 1 12 MET N N -6.981 -4.669 -1.794 1.00 . A A . 12 MET N 1 1 14 4990 1 1 12 MET O O -7.256 -1.488 -3.450 1.00 . A A . 12 MET O 1 1 14 4991 1 1 12 MET SD S -10.253 -2.114 0.258 1.00 . A A . 12 MET SD 1 1 14 4992 1 1 13 TYR C C -5.331 -0.196 -1.958 1.00 . A A . 13 TYR C 1 1 14 4993 1 1 13 TYR CA C -4.600 -1.400 -2.549 1.00 . A A . 13 TYR CA 1 1 14 4994 1 1 13 TYR CB C -4.237 -1.201 -4.039 1.00 . A A . 13 TYR CB 1 1 14 4995 1 1 13 TYR CD1 C -2.169 -2.649 -4.171 1.00 . A A . 13 TYR CD1 1 1 14 4996 1 1 13 TYR CD2 C -4.156 -3.458 -5.202 1.00 . A A . 13 TYR CD2 1 1 14 4997 1 1 13 TYR CE1 C -1.501 -3.790 -4.558 1.00 . A A . 13 TYR CE1 1 1 14 4998 1 1 13 TYR CE2 C -3.487 -4.599 -5.590 1.00 . A A . 13 TYR CE2 1 1 14 4999 1 1 13 TYR CG C -3.503 -2.472 -4.489 1.00 . A A . 13 TYR CG 1 1 14 5000 1 1 13 TYR CZ C -2.155 -4.773 -5.271 1.00 . A A . 13 TYR CZ 1 1 14 5001 1 1 13 TYR H H -5.260 -3.374 -2.005 1.00 . A A . 13 TYR H 1 1 14 5002 1 1 13 TYR HA H -3.720 -1.614 -1.957 1.00 . A A . 13 TYR HA 1 1 14 5003 1 1 13 TYR HB2 H -5.121 -1.062 -4.644 1.00 . A A . 13 TYR HB2 1 1 14 5004 1 1 13 TYR HB3 H -3.586 -0.348 -4.156 1.00 . A A . 13 TYR HB3 1 1 14 5005 1 1 13 TYR HD1 H -1.642 -1.887 -3.615 1.00 . A A . 13 TYR HD1 1 1 14 5006 1 1 13 TYR HD2 H -5.199 -3.336 -5.459 1.00 . A A . 13 TYR HD2 1 1 14 5007 1 1 13 TYR HE1 H -0.458 -3.914 -4.303 1.00 . A A . 13 TYR HE1 1 1 14 5008 1 1 13 TYR HE2 H -4.010 -5.363 -6.148 1.00 . A A . 13 TYR HE2 1 1 14 5009 1 1 13 TYR HH H -2.114 -6.508 -6.074 1.00 . A A . 13 TYR HH 1 1 14 5010 1 1 13 TYR N N -5.560 -2.544 -2.431 1.00 . A A . 13 TYR N 1 1 14 5011 1 1 13 TYR O O -5.831 0.682 -2.634 1.00 . A A . 13 TYR O 1 1 14 5012 1 1 13 TYR OH O -1.485 -5.916 -5.657 1.00 . A A . 13 TYR OH 1 1 14 5013 1 1 14 ASP C C -5.146 2.076 0.309 1.00 . A A . 14 ASP C 1 1 14 5014 1 1 14 ASP CA C -5.993 0.803 0.183 1.00 . A A . 14 ASP CA 1 1 14 5015 1 1 14 ASP CB C -6.250 0.114 1.530 1.00 . A A . 14 ASP CB 1 1 14 5016 1 1 14 ASP CG C -6.904 1.026 2.577 1.00 . A A . 14 ASP CG 1 1 14 5017 1 1 14 ASP H H -4.882 -0.990 -0.216 1.00 . A A . 14 ASP H 1 1 14 5018 1 1 14 ASP HA H -6.938 1.064 -0.271 1.00 . A A . 14 ASP HA 1 1 14 5019 1 1 14 ASP HB2 H -6.904 -0.725 1.364 1.00 . A A . 14 ASP HB2 1 1 14 5020 1 1 14 ASP HB3 H -5.312 -0.265 1.908 1.00 . A A . 14 ASP HB3 1 1 14 5021 1 1 14 ASP N N -5.335 -0.241 -0.655 1.00 . A A . 14 ASP N 1 1 14 5022 1 1 14 ASP O O -5.375 2.898 1.174 1.00 . A A . 14 ASP O 1 1 14 5023 1 1 14 ASP OD1 O -7.934 1.599 2.258 1.00 . A A . 14 ASP OD1 1 1 14 5024 1 1 14 ASP OD2 O -6.323 1.092 3.648 1.00 . A A . 14 ASP OD2 1 1 14 5025 1 1 15 CYS C C -3.577 4.372 -1.706 1.00 . A A . 15 CYS C 1 1 14 5026 1 1 15 CYS CA C -3.286 3.386 -0.575 1.00 . A A . 15 CYS CA 1 1 14 5027 1 1 15 CYS CB C -1.866 2.930 -0.726 1.00 . A A . 15 CYS CB 1 1 14 5028 1 1 15 CYS H H -4.075 1.478 -1.235 1.00 . A A . 15 CYS H 1 1 14 5029 1 1 15 CYS HA H -3.384 3.903 0.368 1.00 . A A . 15 CYS HA 1 1 14 5030 1 1 15 CYS HB2 H -1.737 2.514 -1.713 1.00 . A A . 15 CYS HB2 1 1 14 5031 1 1 15 CYS HB3 H -1.228 3.797 -0.639 1.00 . A A . 15 CYS HB3 1 1 14 5032 1 1 15 CYS N N -4.192 2.194 -0.574 1.00 . A A . 15 CYS N 1 1 14 5033 1 1 15 CYS O O -4.082 4.001 -2.748 1.00 . A A . 15 CYS O 1 1 14 5034 1 1 15 CYS SG S -1.283 1.726 0.481 1.00 . A A . 15 CYS SG 1 1 14 5035 1 1 16 CYS C C -2.393 6.460 -3.548 1.00 . A A . 16 CYS C 1 1 14 5036 1 1 16 CYS CA C -3.437 6.698 -2.443 1.00 . A A . 16 CYS CA 1 1 14 5037 1 1 16 CYS CB C -3.202 8.038 -1.755 1.00 . A A . 16 CYS CB 1 1 14 5038 1 1 16 CYS H H -2.834 5.846 -0.588 1.00 . A A . 16 CYS H 1 1 14 5039 1 1 16 CYS HA H -4.432 6.634 -2.859 1.00 . A A . 16 CYS HA 1 1 14 5040 1 1 16 CYS HB2 H -2.168 8.083 -1.441 1.00 . A A . 16 CYS HB2 1 1 14 5041 1 1 16 CYS HB3 H -3.352 8.813 -2.484 1.00 . A A . 16 CYS HB3 1 1 14 5042 1 1 16 CYS N N -3.233 5.611 -1.449 1.00 . A A . 16 CYS N 1 1 14 5043 1 1 16 CYS O O -2.620 6.746 -4.708 1.00 . A A . 16 CYS O 1 1 14 5044 1 1 16 CYS SG S -4.215 8.440 -0.312 1.00 . A A . 16 CYS SG 1 1 14 5045 1 1 17 SER C C -0.536 4.481 -4.980 1.00 . A A . 17 SER C 1 1 14 5046 1 1 17 SER CA C -0.130 5.614 -4.021 1.00 . A A . 17 SER CA 1 1 14 5047 1 1 17 SER CB C 1.070 5.188 -3.151 1.00 . A A . 17 SER CB 1 1 14 5048 1 1 17 SER H H -1.182 5.739 -2.158 1.00 . A A . 17 SER H 1 1 14 5049 1 1 17 SER HA H 0.117 6.496 -4.597 1.00 . A A . 17 SER HA 1 1 14 5050 1 1 17 SER HB2 H 1.379 5.983 -2.489 1.00 . A A . 17 SER HB2 1 1 14 5051 1 1 17 SER HB3 H 0.846 4.297 -2.580 1.00 . A A . 17 SER HB3 1 1 14 5052 1 1 17 SER HG H 2.205 3.955 -4.136 1.00 . A A . 17 SER HG 1 1 14 5053 1 1 17 SER N N -1.273 5.932 -3.114 1.00 . A A . 17 SER N 1 1 14 5054 1 1 17 SER O O 0.066 4.311 -6.023 1.00 . A A . 17 SER O 1 1 14 5055 1 1 17 SER OG O 2.114 4.909 -4.072 1.00 . A A . 17 SER OG 1 1 14 5056 1 1 18 GLY C C -1.227 1.332 -5.213 1.00 . A A . 18 GLY C 1 1 14 5057 1 1 18 GLY CA C -2.044 2.609 -5.426 1.00 . A A . 18 GLY CA 1 1 14 5058 1 1 18 GLY H H -1.988 3.936 -3.734 1.00 . A A . 18 GLY H 1 1 14 5059 1 1 18 GLY HA2 H -3.071 2.413 -5.161 1.00 . A A . 18 GLY HA2 1 1 14 5060 1 1 18 GLY HA3 H -1.988 2.887 -6.466 1.00 . A A . 18 GLY HA3 1 1 14 5061 1 1 18 GLY N N -1.547 3.743 -4.589 1.00 . A A . 18 GLY N 1 1 14 5062 1 1 18 GLY O O -1.666 0.256 -5.572 1.00 . A A . 18 GLY O 1 1 14 5063 1 1 19 SER C C 1.057 0.235 -2.852 1.00 . A A . 19 SER C 1 1 14 5064 1 1 19 SER CA C 0.844 0.340 -4.364 1.00 . A A . 19 SER CA 1 1 14 5065 1 1 19 SER CB C 2.181 0.582 -5.096 1.00 . A A . 19 SER CB 1 1 14 5066 1 1 19 SER H H 0.229 2.391 -4.374 1.00 . A A . 19 SER H 1 1 14 5067 1 1 19 SER HA H 0.395 -0.576 -4.720 1.00 . A A . 19 SER HA 1 1 14 5068 1 1 19 SER HB2 H 2.897 -0.198 -4.881 1.00 . A A . 19 SER HB2 1 1 14 5069 1 1 19 SER HB3 H 2.034 0.663 -6.162 1.00 . A A . 19 SER HB3 1 1 14 5070 1 1 19 SER HG H 3.012 1.669 -3.710 1.00 . A A . 19 SER HG 1 1 14 5071 1 1 19 SER N N -0.063 1.492 -4.637 1.00 . A A . 19 SER N 1 1 14 5072 1 1 19 SER O O 1.455 1.196 -2.224 1.00 . A A . 19 SER O 1 1 14 5073 1 1 19 SER OG O 2.668 1.820 -4.593 1.00 . A A . 19 SER OG 1 1 14 5074 1 1 20 CYS C C 2.089 -2.118 -0.526 1.00 . A A . 20 CYS C 1 1 14 5075 1 1 20 CYS CA C 0.949 -1.145 -0.849 1.00 . A A . 20 CYS CA 1 1 14 5076 1 1 20 CYS CB C -0.379 -1.669 -0.268 1.00 . A A . 20 CYS CB 1 1 14 5077 1 1 20 CYS H H 0.457 -1.661 -2.881 1.00 . A A . 20 CYS H 1 1 14 5078 1 1 20 CYS HA H 1.164 -0.202 -0.374 1.00 . A A . 20 CYS HA 1 1 14 5079 1 1 20 CYS HB2 H -1.102 -0.872 -0.359 1.00 . A A . 20 CYS HB2 1 1 14 5080 1 1 20 CYS HB3 H -0.770 -2.497 -0.823 1.00 . A A . 20 CYS HB3 1 1 14 5081 1 1 20 CYS N N 0.778 -0.927 -2.316 1.00 . A A . 20 CYS N 1 1 14 5082 1 1 20 CYS O O 2.081 -3.265 -0.929 1.00 . A A . 20 CYS O 1 1 14 5083 1 1 20 CYS SG S -0.344 -2.142 1.476 1.00 . A A . 20 CYS SG 1 1 14 5084 1 1 21 GLY C C 3.890 -3.627 1.403 1.00 . A A . 21 GLY C 1 1 14 5085 1 1 21 GLY CA C 4.253 -2.337 0.651 1.00 . A A . 21 GLY CA 1 1 14 5086 1 1 21 GLY H H 2.947 -0.646 0.466 1.00 . A A . 21 GLY H 1 1 14 5087 1 1 21 GLY HA2 H 4.847 -2.584 -0.218 1.00 . A A . 21 GLY HA2 1 1 14 5088 1 1 21 GLY HA3 H 4.832 -1.704 1.306 1.00 . A A . 21 GLY HA3 1 1 14 5089 1 1 21 GLY N N 3.038 -1.586 0.204 1.00 . A A . 21 GLY N 1 1 14 5090 1 1 21 GLY O O 2.949 -3.670 2.171 1.00 . A A . 21 GLY O 1 1 14 5091 1 1 22 ARG C C 4.761 -6.051 3.235 1.00 . A A . 22 ARG C 1 1 14 5092 1 1 22 ARG CA C 4.564 -5.995 1.720 1.00 . A A . 22 ARG CA 1 1 14 5093 1 1 22 ARG CB C 5.599 -6.942 1.050 1.00 . A A . 22 ARG CB 1 1 14 5094 1 1 22 ARG CD C 7.533 -5.194 0.974 1.00 . A A . 22 ARG CD 1 1 14 5095 1 1 22 ARG CG C 7.092 -6.616 1.393 1.00 . A A . 22 ARG CG 1 1 14 5096 1 1 22 ARG CZ C 8.066 -5.539 -1.402 1.00 . A A . 22 ARG CZ 1 1 14 5097 1 1 22 ARG H H 5.417 -4.427 0.514 1.00 . A A . 22 ARG H 1 1 14 5098 1 1 22 ARG HA H 3.577 -6.366 1.497 1.00 . A A . 22 ARG HA 1 1 14 5099 1 1 22 ARG HB2 H 5.391 -7.956 1.359 1.00 . A A . 22 ARG HB2 1 1 14 5100 1 1 22 ARG HB3 H 5.469 -6.894 -0.021 1.00 . A A . 22 ARG HB3 1 1 14 5101 1 1 22 ARG HD2 H 7.004 -4.434 1.527 1.00 . A A . 22 ARG HD2 1 1 14 5102 1 1 22 ARG HD3 H 8.589 -5.070 1.165 1.00 . A A . 22 ARG HD3 1 1 14 5103 1 1 22 ARG HE H 6.505 -4.491 -0.780 1.00 . A A . 22 ARG HE 1 1 14 5104 1 1 22 ARG HG2 H 7.244 -6.726 2.457 1.00 . A A . 22 ARG HG2 1 1 14 5105 1 1 22 ARG HG3 H 7.722 -7.339 0.899 1.00 . A A . 22 ARG HG3 1 1 14 5106 1 1 22 ARG HH11 H 9.322 -6.392 -0.091 1.00 . A A . 22 ARG HH11 1 1 14 5107 1 1 22 ARG HH12 H 9.700 -6.638 -1.762 1.00 . A A . 22 ARG HH12 1 1 14 5108 1 1 22 ARG HH21 H 6.967 -4.792 -2.896 1.00 . A A . 22 ARG HH21 1 1 14 5109 1 1 22 ARG HH22 H 8.349 -5.721 -3.373 1.00 . A A . 22 ARG HH22 1 1 14 5110 1 1 22 ARG N N 4.693 -4.620 1.133 1.00 . A A . 22 ARG N 1 1 14 5111 1 1 22 ARG NE N 7.281 -5.016 -0.492 1.00 . A A . 22 ARG NE 1 1 14 5112 1 1 22 ARG NH1 N 9.111 -6.244 -1.056 1.00 . A A . 22 ARG NH1 1 1 14 5113 1 1 22 ARG NH2 N 7.771 -5.334 -2.655 1.00 . A A . 22 ARG NH2 1 1 14 5114 1 1 22 ARG O O 4.403 -7.028 3.864 1.00 . A A . 22 ARG O 1 1 14 5115 1 1 23 ARG C C 4.230 -4.593 5.929 1.00 . A A . 23 ARG C 1 1 14 5116 1 1 23 ARG CA C 5.562 -4.940 5.244 1.00 . A A . 23 ARG CA 1 1 14 5117 1 1 23 ARG CB C 6.708 -3.889 5.415 1.00 . A A . 23 ARG CB 1 1 14 5118 1 1 23 ARG CD C 6.185 -2.650 7.617 1.00 . A A . 23 ARG CD 1 1 14 5119 1 1 23 ARG CG C 7.144 -3.612 6.883 1.00 . A A . 23 ARG CG 1 1 14 5120 1 1 23 ARG CZ C 7.155 -0.454 7.079 1.00 . A A . 23 ARG CZ 1 1 14 5121 1 1 23 ARG H H 5.579 -4.245 3.205 1.00 . A A . 23 ARG H 1 1 14 5122 1 1 23 ARG HA H 5.896 -5.908 5.590 1.00 . A A . 23 ARG HA 1 1 14 5123 1 1 23 ARG HB2 H 7.573 -4.244 4.873 1.00 . A A . 23 ARG HB2 1 1 14 5124 1 1 23 ARG HB3 H 6.398 -2.961 4.955 1.00 . A A . 23 ARG HB3 1 1 14 5125 1 1 23 ARG HD2 H 5.169 -2.999 7.639 1.00 . A A . 23 ARG HD2 1 1 14 5126 1 1 23 ARG HD3 H 6.513 -2.493 8.634 1.00 . A A . 23 ARG HD3 1 1 14 5127 1 1 23 ARG HE H 5.511 -1.154 6.226 1.00 . A A . 23 ARG HE 1 1 14 5128 1 1 23 ARG HG2 H 7.179 -4.547 7.424 1.00 . A A . 23 ARG HG2 1 1 14 5129 1 1 23 ARG HG3 H 8.140 -3.191 6.882 1.00 . A A . 23 ARG HG3 1 1 14 5130 1 1 23 ARG HH11 H 8.142 -1.523 8.461 1.00 . A A . 23 ARG HH11 1 1 14 5131 1 1 23 ARG HH12 H 8.820 0.023 8.081 1.00 . A A . 23 ARG HH12 1 1 14 5132 1 1 23 ARG HH21 H 6.362 0.799 5.735 1.00 . A A . 23 ARG HH21 1 1 14 5133 1 1 23 ARG HH22 H 7.805 1.354 6.519 1.00 . A A . 23 ARG HH22 1 1 14 5134 1 1 23 ARG N N 5.318 -5.000 3.772 1.00 . A A . 23 ARG N 1 1 14 5135 1 1 23 ARG NE N 6.216 -1.346 6.879 1.00 . A A . 23 ARG NE 1 1 14 5136 1 1 23 ARG NH1 N 8.113 -0.670 7.941 1.00 . A A . 23 ARG NH1 1 1 14 5137 1 1 23 ARG NH2 N 7.104 0.653 6.390 1.00 . A A . 23 ARG NH2 1 1 14 5138 1 1 23 ARG O O 4.049 -4.869 7.099 1.00 . A A . 23 ARG O 1 1 14 5139 1 1 24 GLY C C 1.762 -2.109 5.566 1.00 . A A . 24 GLY C 1 1 14 5140 1 1 24 GLY CA C 1.992 -3.614 5.678 1.00 . A A . 24 GLY CA 1 1 14 5141 1 1 24 GLY H H 3.562 -3.827 4.228 1.00 . A A . 24 GLY H 1 1 14 5142 1 1 24 GLY HA2 H 1.239 -4.122 5.094 1.00 . A A . 24 GLY HA2 1 1 14 5143 1 1 24 GLY HA3 H 1.888 -3.904 6.713 1.00 . A A . 24 GLY HA3 1 1 14 5144 1 1 24 GLY N N 3.339 -4.009 5.164 1.00 . A A . 24 GLY N 1 1 14 5145 1 1 24 GLY O O 0.768 -1.613 6.061 1.00 . A A . 24 GLY O 1 1 14 5146 1 1 25 LYS C C 2.442 0.389 3.286 1.00 . A A . 25 LYS C 1 1 14 5147 1 1 25 LYS CA C 2.533 0.055 4.760 1.00 . A A . 25 LYS CA 1 1 14 5148 1 1 25 LYS CB C 3.750 0.757 5.387 1.00 . A A . 25 LYS CB 1 1 14 5149 1 1 25 LYS CD C 2.615 1.043 7.665 1.00 . A A . 25 LYS CD 1 1 14 5150 1 1 25 LYS CE C 2.728 0.708 9.161 1.00 . A A . 25 LYS CE 1 1 14 5151 1 1 25 LYS CG C 3.836 0.469 6.909 1.00 . A A . 25 LYS CG 1 1 14 5152 1 1 25 LYS H H 3.449 -1.896 4.517 1.00 . A A . 25 LYS H 1 1 14 5153 1 1 25 LYS HA H 1.622 0.391 5.229 1.00 . A A . 25 LYS HA 1 1 14 5154 1 1 25 LYS HB2 H 4.644 0.419 4.887 1.00 . A A . 25 LYS HB2 1 1 14 5155 1 1 25 LYS HB3 H 3.667 1.820 5.232 1.00 . A A . 25 LYS HB3 1 1 14 5156 1 1 25 LYS HD2 H 2.573 2.113 7.547 1.00 . A A . 25 LYS HD2 1 1 14 5157 1 1 25 LYS HD3 H 1.704 0.623 7.276 1.00 . A A . 25 LYS HD3 1 1 14 5158 1 1 25 LYS HE2 H 1.877 1.109 9.693 1.00 . A A . 25 LYS HE2 1 1 14 5159 1 1 25 LYS HE3 H 2.758 -0.361 9.307 1.00 . A A . 25 LYS HE3 1 1 14 5160 1 1 25 LYS HG2 H 3.883 -0.596 7.078 1.00 . A A . 25 LYS HG2 1 1 14 5161 1 1 25 LYS HG3 H 4.737 0.920 7.299 1.00 . A A . 25 LYS HG3 1 1 14 5162 1 1 25 LYS HZ1 H 4.062 2.287 9.408 1.00 . A A . 25 LYS HZ1 1 1 14 5163 1 1 25 LYS HZ2 H 3.919 1.282 10.771 1.00 . A A . 25 LYS HZ2 1 1 14 5164 1 1 25 LYS HZ3 H 4.793 0.754 9.414 1.00 . A A . 25 LYS HZ3 1 1 14 5165 1 1 25 LYS N N 2.675 -1.430 4.915 1.00 . A A . 25 LYS N 1 1 14 5166 1 1 25 LYS NZ N 3.969 1.303 9.732 1.00 . A A . 25 LYS NZ 1 1 14 5167 1 1 25 LYS O O 2.728 -0.445 2.454 1.00 . A A . 25 LYS O 1 1 14 5168 1 1 26 CYS C C 3.187 2.449 0.859 1.00 . A A . 26 CYS C 1 1 14 5169 1 1 26 CYS CA C 1.905 2.052 1.593 1.00 . A A . 26 CYS CA 1 1 14 5170 1 1 26 CYS CB C 0.933 3.214 1.579 1.00 . A A . 26 CYS CB 1 1 14 5171 1 1 26 CYS H H 1.839 2.212 3.746 1.00 . A A . 26 CYS H 1 1 14 5172 1 1 26 CYS HA H 1.448 1.251 1.037 1.00 . A A . 26 CYS HA 1 1 14 5173 1 1 26 CYS HB2 H 1.308 4.006 2.201 1.00 . A A . 26 CYS HB2 1 1 14 5174 1 1 26 CYS HB3 H 0.866 3.575 0.573 1.00 . A A . 26 CYS HB3 1 1 14 5175 1 1 26 CYS N N 2.044 1.600 3.009 1.00 . A A . 26 CYS N 1 1 14 5176 1 1 26 CYS O O 4.255 2.570 1.426 1.00 . A A . 26 CYS O 1 1 14 5177 1 1 26 CYS SG S -0.764 2.858 2.069 1.00 . A A . 26 CYS SG 1 1 14 5178 1 1 27 NH2 HN1 H 2.220 2.554 -0.866 1.00 . A A . 27 NH2 HN1 1 1 14 5179 1 1 27 NH2 HN2 H 3.869 2.911 -0.964 1.00 . A A . 27 NH2 HN2 1 1 14 5180 1 1 27 NH2 N N 3.091 2.657 -0.429 1.00 . A A . 27 NH2 N 1 1 15 5181 1 1 1 CYS C C -6.059 6.584 1.940 1.00 . A A . 1 CYS C 1 1 15 5182 1 1 1 CYS CA C -7.174 6.172 0.972 1.00 . A A . 1 CYS CA 1 1 15 5183 1 1 1 CYS CB C -6.764 6.535 -0.455 1.00 . A A . 1 CYS CB 1 1 15 5184 1 1 1 CYS H1 H -8.271 7.899 1.341 1.00 . A A . 1 CYS H1 1 1 15 5185 1 1 1 CYS H2 H -9.172 6.648 0.628 1.00 . A A . 1 CYS H2 1 1 15 5186 1 1 1 CYS H3 H -8.752 6.563 2.272 1.00 . A A . 1 CYS H3 1 1 15 5187 1 1 1 CYS HA H -7.329 5.105 1.058 1.00 . A A . 1 CYS HA 1 1 15 5188 1 1 1 CYS HB2 H -5.874 5.975 -0.698 1.00 . A A . 1 CYS HB2 1 1 15 5189 1 1 1 CYS HB3 H -7.541 6.207 -1.129 1.00 . A A . 1 CYS HB3 1 1 15 5190 1 1 1 CYS N N -8.438 6.873 1.330 1.00 . A A . 1 CYS N 1 1 15 5191 1 1 1 CYS O O -6.061 7.677 2.473 1.00 . A A . 1 CYS O 1 1 15 5192 1 1 1 CYS SG S -6.438 8.282 -0.800 1.00 . A A . 1 CYS SG 1 1 15 5193 1 1 2 LYS C C -2.727 6.336 2.250 1.00 . A A . 2 LYS C 1 1 15 5194 1 1 2 LYS CA C -3.973 5.890 3.034 1.00 . A A . 2 LYS CA 1 1 15 5195 1 1 2 LYS CB C -3.700 4.560 3.794 1.00 . A A . 2 LYS CB 1 1 15 5196 1 1 2 LYS CD C -6.225 4.063 4.219 1.00 . A A . 2 LYS CD 1 1 15 5197 1 1 2 LYS CE C -7.226 3.591 5.291 1.00 . A A . 2 LYS CE 1 1 15 5198 1 1 2 LYS CG C -4.810 4.193 4.832 1.00 . A A . 2 LYS CG 1 1 15 5199 1 1 2 LYS H H -5.215 4.822 1.650 1.00 . A A . 2 LYS H 1 1 15 5200 1 1 2 LYS HA H -4.224 6.658 3.754 1.00 . A A . 2 LYS HA 1 1 15 5201 1 1 2 LYS HB2 H -3.616 3.756 3.077 1.00 . A A . 2 LYS HB2 1 1 15 5202 1 1 2 LYS HB3 H -2.764 4.634 4.320 1.00 . A A . 2 LYS HB3 1 1 15 5203 1 1 2 LYS HD2 H -6.566 5.030 3.886 1.00 . A A . 2 LYS HD2 1 1 15 5204 1 1 2 LYS HD3 H -6.222 3.389 3.382 1.00 . A A . 2 LYS HD3 1 1 15 5205 1 1 2 LYS HE2 H -8.210 3.486 4.855 1.00 . A A . 2 LYS HE2 1 1 15 5206 1 1 2 LYS HE3 H -6.924 2.637 5.698 1.00 . A A . 2 LYS HE3 1 1 15 5207 1 1 2 LYS HG2 H -4.542 3.253 5.292 1.00 . A A . 2 LYS HG2 1 1 15 5208 1 1 2 LYS HG3 H -4.823 4.951 5.602 1.00 . A A . 2 LYS HG3 1 1 15 5209 1 1 2 LYS HZ1 H -7.352 5.541 6.006 1.00 . A A . 2 LYS HZ1 1 1 15 5210 1 1 2 LYS HZ2 H -8.147 4.397 6.977 1.00 . A A . 2 LYS HZ2 1 1 15 5211 1 1 2 LYS HZ3 H -6.452 4.497 6.997 1.00 . A A . 2 LYS HZ3 1 1 15 5212 1 1 2 LYS N N -5.139 5.674 2.124 1.00 . A A . 2 LYS N 1 1 15 5213 1 1 2 LYS NZ N -7.301 4.581 6.402 1.00 . A A . 2 LYS NZ 1 1 15 5214 1 1 2 LYS O O -2.307 5.679 1.318 1.00 . A A . 2 LYS O 1 1 15 5215 1 1 3 GLY C C 0.242 7.033 2.062 1.00 . A A . 3 GLY C 1 1 15 5216 1 1 3 GLY CA C -0.947 8.007 1.988 1.00 . A A . 3 GLY CA 1 1 15 5217 1 1 3 GLY H H -2.566 7.928 3.417 1.00 . A A . 3 GLY H 1 1 15 5218 1 1 3 GLY HA2 H -1.172 8.210 0.951 1.00 . A A . 3 GLY HA2 1 1 15 5219 1 1 3 GLY HA3 H -0.671 8.929 2.477 1.00 . A A . 3 GLY HA3 1 1 15 5220 1 1 3 GLY N N -2.171 7.451 2.658 1.00 . A A . 3 GLY N 1 1 15 5221 1 1 3 GLY O O 0.164 6.027 2.737 1.00 . A A . 3 GLY O 1 1 15 5222 1 1 4 LYS C C 3.065 6.164 2.784 1.00 . A A . 4 LYS C 1 1 15 5223 1 1 4 LYS CA C 2.520 6.476 1.374 1.00 . A A . 4 LYS CA 1 1 15 5224 1 1 4 LYS CB C 3.594 7.164 0.515 1.00 . A A . 4 LYS CB 1 1 15 5225 1 1 4 LYS CD C 5.020 9.226 0.140 1.00 . A A . 4 LYS CD 1 1 15 5226 1 1 4 LYS CE C 6.342 8.426 0.128 1.00 . A A . 4 LYS CE 1 1 15 5227 1 1 4 LYS CG C 3.957 8.567 1.052 1.00 . A A . 4 LYS CG 1 1 15 5228 1 1 4 LYS H H 1.332 8.177 0.845 1.00 . A A . 4 LYS H 1 1 15 5229 1 1 4 LYS HA H 2.266 5.550 0.885 1.00 . A A . 4 LYS HA 1 1 15 5230 1 1 4 LYS HB2 H 4.463 6.530 0.512 1.00 . A A . 4 LYS HB2 1 1 15 5231 1 1 4 LYS HB3 H 3.233 7.249 -0.501 1.00 . A A . 4 LYS HB3 1 1 15 5232 1 1 4 LYS HD2 H 4.632 9.273 -0.867 1.00 . A A . 4 LYS HD2 1 1 15 5233 1 1 4 LYS HD3 H 5.207 10.230 0.484 1.00 . A A . 4 LYS HD3 1 1 15 5234 1 1 4 LYS HE2 H 6.201 7.433 -0.274 1.00 . A A . 4 LYS HE2 1 1 15 5235 1 1 4 LYS HE3 H 7.067 8.944 -0.483 1.00 . A A . 4 LYS HE3 1 1 15 5236 1 1 4 LYS HG2 H 3.076 9.192 1.069 1.00 . A A . 4 LYS HG2 1 1 15 5237 1 1 4 LYS HG3 H 4.342 8.498 2.058 1.00 . A A . 4 LYS HG3 1 1 15 5238 1 1 4 LYS HZ1 H 6.841 9.243 1.978 1.00 . A A . 4 LYS HZ1 1 1 15 5239 1 1 4 LYS HZ2 H 6.331 7.623 2.048 1.00 . A A . 4 LYS HZ2 1 1 15 5240 1 1 4 LYS HZ3 H 7.882 8.001 1.464 1.00 . A A . 4 LYS HZ3 1 1 15 5241 1 1 4 LYS N N 1.311 7.353 1.373 1.00 . A A . 4 LYS N 1 1 15 5242 1 1 4 LYS NZ N 6.891 8.315 1.509 1.00 . A A . 4 LYS NZ 1 1 15 5243 1 1 4 LYS O O 3.115 7.019 3.646 1.00 . A A . 4 LYS O 1 1 15 5244 1 1 5 GLY C C 2.932 4.258 5.337 1.00 . A A . 5 GLY C 1 1 15 5245 1 1 5 GLY CA C 4.004 4.419 4.247 1.00 . A A . 5 GLY CA 1 1 15 5246 1 1 5 GLY H H 3.369 4.303 2.201 1.00 . A A . 5 GLY H 1 1 15 5247 1 1 5 GLY HA2 H 4.458 3.456 4.067 1.00 . A A . 5 GLY HA2 1 1 15 5248 1 1 5 GLY HA3 H 4.767 5.094 4.603 1.00 . A A . 5 GLY HA3 1 1 15 5249 1 1 5 GLY N N 3.449 4.923 2.953 1.00 . A A . 5 GLY N 1 1 15 5250 1 1 5 GLY O O 3.249 3.862 6.442 1.00 . A A . 5 GLY O 1 1 15 5251 1 1 6 ALA C C -0.020 3.019 5.958 1.00 . A A . 6 ALA C 1 1 15 5252 1 1 6 ALA CA C 0.583 4.442 5.996 1.00 . A A . 6 ALA CA 1 1 15 5253 1 1 6 ALA CB C -0.486 5.483 5.645 1.00 . A A . 6 ALA CB 1 1 15 5254 1 1 6 ALA H H 1.511 4.874 4.094 1.00 . A A . 6 ALA H 1 1 15 5255 1 1 6 ALA HA H 0.972 4.645 6.982 1.00 . A A . 6 ALA HA 1 1 15 5256 1 1 6 ALA HB1 H -0.060 6.475 5.681 1.00 . A A . 6 ALA HB1 1 1 15 5257 1 1 6 ALA HB2 H -0.860 5.299 4.653 1.00 . A A . 6 ALA HB2 1 1 15 5258 1 1 6 ALA HB3 H -1.312 5.439 6.336 1.00 . A A . 6 ALA HB3 1 1 15 5259 1 1 6 ALA N N 1.701 4.564 5.003 1.00 . A A . 6 ALA N 1 1 15 5260 1 1 6 ALA O O 0.054 2.368 4.933 1.00 . A A . 6 ALA O 1 1 15 5261 1 1 7 PRO C C -2.197 0.774 6.225 1.00 . A A . 7 PRO C 1 1 15 5262 1 1 7 PRO CA C -1.069 1.161 7.208 1.00 . A A . 7 PRO CA 1 1 15 5263 1 1 7 PRO CB C -1.506 1.032 8.676 1.00 . A A . 7 PRO CB 1 1 15 5264 1 1 7 PRO CD C -0.851 3.391 8.283 1.00 . A A . 7 PRO CD 1 1 15 5265 1 1 7 PRO CG C -1.585 2.452 9.251 1.00 . A A . 7 PRO CG 1 1 15 5266 1 1 7 PRO HA H -0.226 0.508 7.044 1.00 . A A . 7 PRO HA 1 1 15 5267 1 1 7 PRO HB2 H -2.465 0.541 8.765 1.00 . A A . 7 PRO HB2 1 1 15 5268 1 1 7 PRO HB3 H -0.774 0.458 9.225 1.00 . A A . 7 PRO HB3 1 1 15 5269 1 1 7 PRO HD2 H -1.467 4.243 8.039 1.00 . A A . 7 PRO HD2 1 1 15 5270 1 1 7 PRO HD3 H 0.089 3.716 8.707 1.00 . A A . 7 PRO HD3 1 1 15 5271 1 1 7 PRO HG2 H -2.618 2.753 9.347 1.00 . A A . 7 PRO HG2 1 1 15 5272 1 1 7 PRO HG3 H -1.121 2.485 10.226 1.00 . A A . 7 PRO HG3 1 1 15 5273 1 1 7 PRO N N -0.596 2.572 7.056 1.00 . A A . 7 PRO N 1 1 15 5274 1 1 7 PRO O O -3.367 0.967 6.496 1.00 . A A . 7 PRO O 1 1 15 5275 1 1 8 CYS C C -2.864 -1.734 3.943 1.00 . A A . 8 CYS C 1 1 15 5276 1 1 8 CYS CA C -2.725 -0.208 4.027 1.00 . A A . 8 CYS CA 1 1 15 5277 1 1 8 CYS CB C -2.210 0.319 2.711 1.00 . A A . 8 CYS CB 1 1 15 5278 1 1 8 CYS H H -0.820 0.131 4.955 1.00 . A A . 8 CYS H 1 1 15 5279 1 1 8 CYS HA H -3.699 0.214 4.213 1.00 . A A . 8 CYS HA 1 1 15 5280 1 1 8 CYS HB2 H -2.776 -0.101 1.894 1.00 . A A . 8 CYS HB2 1 1 15 5281 1 1 8 CYS HB3 H -2.371 1.376 2.656 1.00 . A A . 8 CYS HB3 1 1 15 5282 1 1 8 CYS N N -1.784 0.239 5.104 1.00 . A A . 8 CYS N 1 1 15 5283 1 1 8 CYS O O -2.402 -2.472 4.791 1.00 . A A . 8 CYS O 1 1 15 5284 1 1 8 CYS SG S -0.474 -0.087 2.404 1.00 . A A . 8 CYS SG 1 1 15 5285 1 1 9 ARG C C -3.676 -3.629 1.026 1.00 . A A . 9 ARG C 1 1 15 5286 1 1 9 ARG CA C -3.796 -3.546 2.548 1.00 . A A . 9 ARG CA 1 1 15 5287 1 1 9 ARG CB C -5.227 -3.919 2.979 1.00 . A A . 9 ARG CB 1 1 15 5288 1 1 9 ARG CD C -6.892 -4.016 4.860 1.00 . A A . 9 ARG CD 1 1 15 5289 1 1 9 ARG CG C -5.429 -3.691 4.490 1.00 . A A . 9 ARG CG 1 1 15 5290 1 1 9 ARG CZ C -7.934 -1.846 4.342 1.00 . A A . 9 ARG CZ 1 1 15 5291 1 1 9 ARG H H -3.848 -1.445 2.260 1.00 . A A . 9 ARG H 1 1 15 5292 1 1 9 ARG HA H -3.039 -4.190 2.982 1.00 . A A . 9 ARG HA 1 1 15 5293 1 1 9 ARG HB2 H -5.937 -3.320 2.426 1.00 . A A . 9 ARG HB2 1 1 15 5294 1 1 9 ARG HB3 H -5.406 -4.960 2.748 1.00 . A A . 9 ARG HB3 1 1 15 5295 1 1 9 ARG HD2 H -7.122 -5.043 4.617 1.00 . A A . 9 ARG HD2 1 1 15 5296 1 1 9 ARG HD3 H -7.062 -3.858 5.915 1.00 . A A . 9 ARG HD3 1 1 15 5297 1 1 9 ARG HE H -8.324 -3.506 3.336 1.00 . A A . 9 ARG HE 1 1 15 5298 1 1 9 ARG HG2 H -4.764 -4.334 5.049 1.00 . A A . 9 ARG HG2 1 1 15 5299 1 1 9 ARG HG3 H -5.209 -2.666 4.747 1.00 . A A . 9 ARG HG3 1 1 15 5300 1 1 9 ARG HH11 H -6.644 -1.845 5.877 1.00 . A A . 9 ARG HH11 1 1 15 5301 1 1 9 ARG HH12 H -7.371 -0.318 5.506 1.00 . A A . 9 ARG HH12 1 1 15 5302 1 1 9 ARG HH21 H -9.256 -1.590 2.861 1.00 . A A . 9 ARG HH21 1 1 15 5303 1 1 9 ARG HH22 H -8.871 -0.171 3.778 1.00 . A A . 9 ARG HH22 1 1 15 5304 1 1 9 ARG N N -3.519 -2.124 2.879 1.00 . A A . 9 ARG N 1 1 15 5305 1 1 9 ARG NE N -7.806 -3.123 4.075 1.00 . A A . 9 ARG NE 1 1 15 5306 1 1 9 ARG NH1 N -7.264 -1.295 5.318 1.00 . A A . 9 ARG NH1 1 1 15 5307 1 1 9 ARG NH2 N -8.750 -1.148 3.603 1.00 . A A . 9 ARG NH2 1 1 15 5308 1 1 9 ARG O O -4.554 -3.208 0.297 1.00 . A A . 9 ARG O 1 1 15 5309 1 1 10 LYS C C -3.350 -5.232 -1.479 1.00 . A A . 10 LYS C 1 1 15 5310 1 1 10 LYS CA C -2.261 -4.352 -0.848 1.00 . A A . 10 LYS CA 1 1 15 5311 1 1 10 LYS CB C -0.884 -4.991 -0.919 1.00 . A A . 10 LYS CB 1 1 15 5312 1 1 10 LYS CD C 0.478 -6.953 -0.083 1.00 . A A . 10 LYS CD 1 1 15 5313 1 1 10 LYS CE C 1.223 -7.032 -1.418 1.00 . A A . 10 LYS CE 1 1 15 5314 1 1 10 LYS CG C -0.933 -6.391 -0.249 1.00 . A A . 10 LYS CG 1 1 15 5315 1 1 10 LYS H H -1.909 -4.477 1.270 1.00 . A A . 10 LYS H 1 1 15 5316 1 1 10 LYS HA H -2.272 -3.390 -1.335 1.00 . A A . 10 LYS HA 1 1 15 5317 1 1 10 LYS HB2 H -0.590 -5.076 -1.955 1.00 . A A . 10 LYS HB2 1 1 15 5318 1 1 10 LYS HB3 H -0.173 -4.365 -0.403 1.00 . A A . 10 LYS HB3 1 1 15 5319 1 1 10 LYS HD2 H 1.015 -6.311 0.596 1.00 . A A . 10 LYS HD2 1 1 15 5320 1 1 10 LYS HD3 H 0.406 -7.938 0.353 1.00 . A A . 10 LYS HD3 1 1 15 5321 1 1 10 LYS HE2 H 1.328 -6.045 -1.841 1.00 . A A . 10 LYS HE2 1 1 15 5322 1 1 10 LYS HE3 H 2.203 -7.445 -1.242 1.00 . A A . 10 LYS HE3 1 1 15 5323 1 1 10 LYS HG2 H -1.393 -6.327 0.725 1.00 . A A . 10 LYS HG2 1 1 15 5324 1 1 10 LYS HG3 H -1.515 -7.069 -0.857 1.00 . A A . 10 LYS HG3 1 1 15 5325 1 1 10 LYS HZ1 H 0.199 -8.778 -1.900 1.00 . A A . 10 LYS HZ1 1 1 15 5326 1 1 10 LYS HZ2 H -0.346 -7.402 -2.733 1.00 . A A . 10 LYS HZ2 1 1 15 5327 1 1 10 LYS HZ3 H 1.118 -8.140 -3.177 1.00 . A A . 10 LYS HZ3 1 1 15 5328 1 1 10 LYS N N -2.565 -4.174 0.609 1.00 . A A . 10 LYS N 1 1 15 5329 1 1 10 LYS NZ N 0.493 -7.905 -2.380 1.00 . A A . 10 LYS NZ 1 1 15 5330 1 1 10 LYS O O -3.569 -5.213 -2.674 1.00 . A A . 10 LYS O 1 1 15 5331 1 1 11 THR C C -6.080 -6.265 -1.884 1.00 . A A . 11 THR C 1 1 15 5332 1 1 11 THR CA C -5.089 -6.918 -0.913 1.00 . A A . 11 THR CA 1 1 15 5333 1 1 11 THR CB C -5.772 -7.257 0.414 1.00 . A A . 11 THR CB 1 1 15 5334 1 1 11 THR CG2 C -6.853 -8.342 0.255 1.00 . A A . 11 THR CG2 1 1 15 5335 1 1 11 THR H H -3.702 -5.902 0.340 1.00 . A A . 11 THR H 1 1 15 5336 1 1 11 THR HA H -4.672 -7.803 -1.372 1.00 . A A . 11 THR HA 1 1 15 5337 1 1 11 THR HB H -6.119 -6.355 0.913 1.00 . A A . 11 THR HB 1 1 15 5338 1 1 11 THR HG1 H -4.354 -8.569 0.672 1.00 . A A . 11 THR HG1 1 1 15 5339 1 1 11 THR HG21 H -6.419 -9.253 -0.132 1.00 . A A . 11 THR HG21 1 1 15 5340 1 1 11 THR HG22 H -7.307 -8.551 1.212 1.00 . A A . 11 THR HG22 1 1 15 5341 1 1 11 THR HG23 H -7.621 -8.007 -0.426 1.00 . A A . 11 THR HG23 1 1 15 5342 1 1 11 THR N N -3.979 -5.970 -0.598 1.00 . A A . 11 THR N 1 1 15 5343 1 1 11 THR O O -6.646 -6.898 -2.755 1.00 . A A . 11 THR O 1 1 15 5344 1 1 11 THR OG1 O -4.757 -7.872 1.197 1.00 . A A . 11 THR OG1 1 1 15 5345 1 1 12 MET C C -6.475 -2.766 -2.736 1.00 . A A . 12 MET C 1 1 15 5346 1 1 12 MET CA C -7.138 -4.122 -2.460 1.00 . A A . 12 MET CA 1 1 15 5347 1 1 12 MET CB C -8.448 -3.937 -1.661 1.00 . A A . 12 MET CB 1 1 15 5348 1 1 12 MET CE C -9.802 -1.265 0.393 1.00 . A A . 12 MET CE 1 1 15 5349 1 1 12 MET CG C -8.144 -3.340 -0.259 1.00 . A A . 12 MET CG 1 1 15 5350 1 1 12 MET H H -5.710 -4.589 -0.927 1.00 . A A . 12 MET H 1 1 15 5351 1 1 12 MET HA H -7.345 -4.597 -3.407 1.00 . A A . 12 MET HA 1 1 15 5352 1 1 12 MET HB2 H -9.116 -3.278 -2.197 1.00 . A A . 12 MET HB2 1 1 15 5353 1 1 12 MET HB3 H -8.934 -4.894 -1.544 1.00 . A A . 12 MET HB3 1 1 15 5354 1 1 12 MET HE1 H -9.978 -1.171 -0.668 1.00 . A A . 12 MET HE1 1 1 15 5355 1 1 12 MET HE2 H -10.674 -0.902 0.919 1.00 . A A . 12 MET HE2 1 1 15 5356 1 1 12 MET HE3 H -8.947 -0.681 0.698 1.00 . A A . 12 MET HE3 1 1 15 5357 1 1 12 MET HG2 H -7.508 -4.036 0.269 1.00 . A A . 12 MET HG2 1 1 15 5358 1 1 12 MET HG3 H -7.586 -2.423 -0.371 1.00 . A A . 12 MET HG3 1 1 15 5359 1 1 12 MET N N -6.227 -4.989 -1.658 1.00 . A A . 12 MET N 1 1 15 5360 1 1 12 MET O O -7.105 -1.887 -3.291 1.00 . A A . 12 MET O 1 1 15 5361 1 1 12 MET SD S -9.554 -3.006 0.825 1.00 . A A . 12 MET SD 1 1 15 5362 1 1 13 TYR C C -5.270 -0.236 -1.939 1.00 . A A . 13 TYR C 1 1 15 5363 1 1 13 TYR CA C -4.446 -1.381 -2.536 1.00 . A A . 13 TYR CA 1 1 15 5364 1 1 13 TYR CB C -4.185 -1.202 -4.051 1.00 . A A . 13 TYR CB 1 1 15 5365 1 1 13 TYR CD1 C -2.014 -2.503 -4.140 1.00 . A A . 13 TYR CD1 1 1 15 5366 1 1 13 TYR CD2 C -3.900 -3.410 -5.276 1.00 . A A . 13 TYR CD2 1 1 15 5367 1 1 13 TYR CE1 C -1.253 -3.582 -4.534 1.00 . A A . 13 TYR CE1 1 1 15 5368 1 1 13 TYR CE2 C -3.137 -4.491 -5.670 1.00 . A A . 13 TYR CE2 1 1 15 5369 1 1 13 TYR CG C -3.344 -2.407 -4.506 1.00 . A A . 13 TYR CG 1 1 15 5370 1 1 13 TYR CZ C -1.810 -4.583 -5.301 1.00 . A A . 13 TYR CZ 1 1 15 5371 1 1 13 TYR H H -4.787 -3.407 -1.911 1.00 . A A . 13 TYR H 1 1 15 5372 1 1 13 TYR HA H -3.513 -1.461 -1.996 1.00 . A A . 13 TYR HA 1 1 15 5373 1 1 13 TYR HB2 H -5.110 -1.181 -4.608 1.00 . A A . 13 TYR HB2 1 1 15 5374 1 1 13 TYR HB3 H -3.633 -0.294 -4.240 1.00 . A A . 13 TYR HB3 1 1 15 5375 1 1 13 TYR HD1 H -1.564 -1.726 -3.539 1.00 . A A . 13 TYR HD1 1 1 15 5376 1 1 13 TYR HD2 H -4.937 -3.354 -5.572 1.00 . A A . 13 TYR HD2 1 1 15 5377 1 1 13 TYR HE1 H -0.215 -3.642 -4.240 1.00 . A A . 13 TYR HE1 1 1 15 5378 1 1 13 TYR HE2 H -3.583 -5.270 -6.271 1.00 . A A . 13 TYR HE2 1 1 15 5379 1 1 13 TYR HH H -0.991 -5.650 -6.654 1.00 . A A . 13 TYR HH 1 1 15 5380 1 1 13 TYR N N -5.226 -2.645 -2.343 1.00 . A A . 13 TYR N 1 1 15 5381 1 1 13 TYR O O -5.869 0.581 -2.612 1.00 . A A . 13 TYR O 1 1 15 5382 1 1 13 TYR OH O -1.050 -5.665 -5.697 1.00 . A A . 13 TYR OH 1 1 15 5383 1 1 14 ASP C C -5.172 2.040 0.350 1.00 . A A . 14 ASP C 1 1 15 5384 1 1 14 ASP CA C -5.942 0.713 0.241 1.00 . A A . 14 ASP CA 1 1 15 5385 1 1 14 ASP CB C -6.112 -0.023 1.598 1.00 . A A . 14 ASP CB 1 1 15 5386 1 1 14 ASP CG C -6.749 0.845 2.697 1.00 . A A . 14 ASP CG 1 1 15 5387 1 1 14 ASP H H -4.706 -0.966 -0.208 1.00 . A A . 14 ASP H 1 1 15 5388 1 1 14 ASP HA H -6.916 0.916 -0.184 1.00 . A A . 14 ASP HA 1 1 15 5389 1 1 14 ASP HB2 H -6.755 -0.867 1.440 1.00 . A A . 14 ASP HB2 1 1 15 5390 1 1 14 ASP HB3 H -5.170 -0.426 1.935 1.00 . A A . 14 ASP HB3 1 1 15 5391 1 1 14 ASP N N -5.235 -0.264 -0.635 1.00 . A A . 14 ASP N 1 1 15 5392 1 1 14 ASP O O -5.432 2.843 1.224 1.00 . A A . 14 ASP O 1 1 15 5393 1 1 14 ASP OD1 O -7.799 1.408 2.428 1.00 . A A . 14 ASP OD1 1 1 15 5394 1 1 14 ASP OD2 O -6.143 0.891 3.755 1.00 . A A . 14 ASP OD2 1 1 15 5395 1 1 15 CYS C C -3.788 4.436 -1.695 1.00 . A A . 15 CYS C 1 1 15 5396 1 1 15 CYS CA C -3.414 3.472 -0.573 1.00 . A A . 15 CYS CA 1 1 15 5397 1 1 15 CYS CB C -1.966 3.091 -0.746 1.00 . A A . 15 CYS CB 1 1 15 5398 1 1 15 CYS H H -4.096 1.527 -1.226 1.00 . A A . 15 CYS H 1 1 15 5399 1 1 15 CYS HA H -3.525 3.985 0.367 1.00 . A A . 15 CYS HA 1 1 15 5400 1 1 15 CYS HB2 H -1.849 2.633 -1.717 1.00 . A A . 15 CYS HB2 1 1 15 5401 1 1 15 CYS HB3 H -1.358 3.984 -0.723 1.00 . A A . 15 CYS HB3 1 1 15 5402 1 1 15 CYS N N -4.245 2.226 -0.554 1.00 . A A . 15 CYS N 1 1 15 5403 1 1 15 CYS O O -4.271 4.028 -2.734 1.00 . A A . 15 CYS O 1 1 15 5404 1 1 15 CYS SG S -1.305 1.948 0.482 1.00 . A A . 15 CYS SG 1 1 15 5405 1 1 16 CYS C C -2.870 6.538 -3.599 1.00 . A A . 16 CYS C 1 1 15 5406 1 1 16 CYS CA C -3.839 6.767 -2.429 1.00 . A A . 16 CYS CA 1 1 15 5407 1 1 16 CYS CB C -3.590 8.120 -1.773 1.00 . A A . 16 CYS CB 1 1 15 5408 1 1 16 CYS H H -3.153 5.961 -0.576 1.00 . A A . 16 CYS H 1 1 15 5409 1 1 16 CYS HA H -4.860 6.672 -2.773 1.00 . A A . 16 CYS HA 1 1 15 5410 1 1 16 CYS HB2 H -2.538 8.204 -1.543 1.00 . A A . 16 CYS HB2 1 1 15 5411 1 1 16 CYS HB3 H -3.828 8.883 -2.492 1.00 . A A . 16 CYS HB3 1 1 15 5412 1 1 16 CYS N N -3.541 5.698 -1.435 1.00 . A A . 16 CYS N 1 1 15 5413 1 1 16 CYS O O -3.186 6.776 -4.748 1.00 . A A . 16 CYS O 1 1 15 5414 1 1 16 CYS SG S -4.505 8.489 -0.257 1.00 . A A . 16 CYS SG 1 1 15 5415 1 1 17 SER C C -0.947 4.451 -4.904 1.00 . A A . 17 SER C 1 1 15 5416 1 1 17 SER CA C -0.608 5.767 -4.181 1.00 . A A . 17 SER CA 1 1 15 5417 1 1 17 SER CB C 0.696 5.627 -3.387 1.00 . A A . 17 SER CB 1 1 15 5418 1 1 17 SER H H -1.549 5.916 -2.266 1.00 . A A . 17 SER H 1 1 15 5419 1 1 17 SER HA H -0.534 6.567 -4.903 1.00 . A A . 17 SER HA 1 1 15 5420 1 1 17 SER HB2 H 0.914 6.520 -2.822 1.00 . A A . 17 SER HB2 1 1 15 5421 1 1 17 SER HB3 H 0.659 4.775 -2.724 1.00 . A A . 17 SER HB3 1 1 15 5422 1 1 17 SER HG H 1.757 6.204 -4.909 1.00 . A A . 17 SER HG 1 1 15 5423 1 1 17 SER N N -1.706 6.071 -3.221 1.00 . A A . 17 SER N 1 1 15 5424 1 1 17 SER O O -0.511 4.221 -6.015 1.00 . A A . 17 SER O 1 1 15 5425 1 1 17 SER OG O 1.697 5.411 -4.371 1.00 . A A . 17 SER OG 1 1 15 5426 1 1 18 GLY C C -0.993 1.297 -4.843 1.00 . A A . 18 GLY C 1 1 15 5427 1 1 18 GLY CA C -2.144 2.313 -4.794 1.00 . A A . 18 GLY CA 1 1 15 5428 1 1 18 GLY H H -2.035 3.890 -3.341 1.00 . A A . 18 GLY H 1 1 15 5429 1 1 18 GLY HA2 H -2.929 1.915 -4.170 1.00 . A A . 18 GLY HA2 1 1 15 5430 1 1 18 GLY HA3 H -2.523 2.461 -5.794 1.00 . A A . 18 GLY HA3 1 1 15 5431 1 1 18 GLY N N -1.723 3.632 -4.233 1.00 . A A . 18 GLY N 1 1 15 5432 1 1 18 GLY O O -1.176 0.191 -5.314 1.00 . A A . 18 GLY O 1 1 15 5433 1 1 19 SER C C 1.662 0.390 -2.889 1.00 . A A . 19 SER C 1 1 15 5434 1 1 19 SER CA C 1.360 0.824 -4.335 1.00 . A A . 19 SER CA 1 1 15 5435 1 1 19 SER CB C 2.531 1.627 -4.953 1.00 . A A . 19 SER CB 1 1 15 5436 1 1 19 SER H H 0.224 2.611 -3.989 1.00 . A A . 19 SER H 1 1 15 5437 1 1 19 SER HA H 1.180 -0.060 -4.930 1.00 . A A . 19 SER HA 1 1 15 5438 1 1 19 SER HB2 H 3.454 1.066 -4.931 1.00 . A A . 19 SER HB2 1 1 15 5439 1 1 19 SER HB3 H 2.306 1.927 -5.967 1.00 . A A . 19 SER HB3 1 1 15 5440 1 1 19 SER HG H 1.792 3.182 -4.042 1.00 . A A . 19 SER HG 1 1 15 5441 1 1 19 SER N N 0.152 1.705 -4.354 1.00 . A A . 19 SER N 1 1 15 5442 1 1 19 SER O O 2.665 0.760 -2.308 1.00 . A A . 19 SER O 1 1 15 5443 1 1 19 SER OG O 2.660 2.785 -4.138 1.00 . A A . 19 SER OG 1 1 15 5444 1 1 20 CYS C C 1.792 -2.160 -0.900 1.00 . A A . 20 CYS C 1 1 15 5445 1 1 20 CYS CA C 0.927 -0.892 -0.955 1.00 . A A . 20 CYS CA 1 1 15 5446 1 1 20 CYS CB C -0.463 -1.177 -0.364 1.00 . A A . 20 CYS CB 1 1 15 5447 1 1 20 CYS H H -0.028 -0.657 -2.874 1.00 . A A . 20 CYS H 1 1 15 5448 1 1 20 CYS HA H 1.406 -0.121 -0.373 1.00 . A A . 20 CYS HA 1 1 15 5449 1 1 20 CYS HB2 H -1.031 -0.264 -0.391 1.00 . A A . 20 CYS HB2 1 1 15 5450 1 1 20 CYS HB3 H -0.989 -1.876 -0.982 1.00 . A A . 20 CYS HB3 1 1 15 5451 1 1 20 CYS N N 0.760 -0.395 -2.354 1.00 . A A . 20 CYS N 1 1 15 5452 1 1 20 CYS O O 1.543 -3.125 -1.596 1.00 . A A . 20 CYS O 1 1 15 5453 1 1 20 CYS SG S -0.509 -1.797 1.334 1.00 . A A . 20 CYS SG 1 1 15 5454 1 1 21 GLY C C 3.216 -4.350 1.035 1.00 . A A . 21 GLY C 1 1 15 5455 1 1 21 GLY CA C 3.751 -3.218 0.143 1.00 . A A . 21 GLY CA 1 1 15 5456 1 1 21 GLY H H 2.919 -1.270 0.454 1.00 . A A . 21 GLY H 1 1 15 5457 1 1 21 GLY HA2 H 4.014 -3.630 -0.820 1.00 . A A . 21 GLY HA2 1 1 15 5458 1 1 21 GLY HA3 H 4.645 -2.820 0.601 1.00 . A A . 21 GLY HA3 1 1 15 5459 1 1 21 GLY N N 2.793 -2.092 -0.058 1.00 . A A . 21 GLY N 1 1 15 5460 1 1 21 GLY O O 2.159 -4.265 1.632 1.00 . A A . 21 GLY O 1 1 15 5461 1 1 22 ARG C C 3.894 -6.363 3.367 1.00 . A A . 22 ARG C 1 1 15 5462 1 1 22 ARG CA C 3.738 -6.622 1.868 1.00 . A A . 22 ARG CA 1 1 15 5463 1 1 22 ARG CB C 4.714 -7.757 1.438 1.00 . A A . 22 ARG CB 1 1 15 5464 1 1 22 ARG CD C 6.808 -6.228 1.208 1.00 . A A . 22 ARG CD 1 1 15 5465 1 1 22 ARG CG C 6.217 -7.514 1.814 1.00 . A A . 22 ARG CG 1 1 15 5466 1 1 22 ARG CZ C 6.638 -5.184 -1.004 1.00 . A A . 22 ARG CZ 1 1 15 5467 1 1 22 ARG H H 4.846 -5.311 0.564 1.00 . A A . 22 ARG H 1 1 15 5468 1 1 22 ARG HA H 2.723 -6.935 1.679 1.00 . A A . 22 ARG HA 1 1 15 5469 1 1 22 ARG HB2 H 4.392 -8.678 1.901 1.00 . A A . 22 ARG HB2 1 1 15 5470 1 1 22 ARG HB3 H 4.639 -7.888 0.368 1.00 . A A . 22 ARG HB3 1 1 15 5471 1 1 22 ARG HD2 H 6.338 -5.350 1.623 1.00 . A A . 22 ARG HD2 1 1 15 5472 1 1 22 ARG HD3 H 7.866 -6.182 1.421 1.00 . A A . 22 ARG HD3 1 1 15 5473 1 1 22 ARG HE H 6.497 -7.139 -0.716 1.00 . A A . 22 ARG HE 1 1 15 5474 1 1 22 ARG HG2 H 6.311 -7.467 2.889 1.00 . A A . 22 ARG HG2 1 1 15 5475 1 1 22 ARG HG3 H 6.797 -8.359 1.469 1.00 . A A . 22 ARG HG3 1 1 15 5476 1 1 22 ARG HH11 H 6.943 -3.935 0.537 1.00 . A A . 22 ARG HH11 1 1 15 5477 1 1 22 ARG HH12 H 6.815 -3.190 -1.020 1.00 . A A . 22 ARG HH12 1 1 15 5478 1 1 22 ARG HH21 H 6.336 -6.212 -2.694 1.00 . A A . 22 ARG HH21 1 1 15 5479 1 1 22 ARG HH22 H 6.469 -4.495 -2.875 1.00 . A A . 22 ARG HH22 1 1 15 5480 1 1 22 ARG N N 4.021 -5.380 1.077 1.00 . A A . 22 ARG N 1 1 15 5481 1 1 22 ARG NE N 6.628 -6.273 -0.277 1.00 . A A . 22 ARG NE 1 1 15 5482 1 1 22 ARG NH1 N 6.812 -4.012 -0.452 1.00 . A A . 22 ARG NH1 1 1 15 5483 1 1 22 ARG NH2 N 6.468 -5.306 -2.292 1.00 . A A . 22 ARG NH2 1 1 15 5484 1 1 22 ARG O O 3.418 -7.125 4.187 1.00 . A A . 22 ARG O 1 1 15 5485 1 1 23 ARG C C 3.532 -4.217 5.642 1.00 . A A . 23 ARG C 1 1 15 5486 1 1 23 ARG CA C 4.802 -4.884 5.084 1.00 . A A . 23 ARG CA 1 1 15 5487 1 1 23 ARG CB C 6.001 -3.909 5.116 1.00 . A A . 23 ARG CB 1 1 15 5488 1 1 23 ARG CD C 6.915 -1.705 4.276 1.00 . A A . 23 ARG CD 1 1 15 5489 1 1 23 ARG CG C 5.712 -2.661 4.236 1.00 . A A . 23 ARG CG 1 1 15 5490 1 1 23 ARG CZ C 9.311 -1.918 3.800 1.00 . A A . 23 ARG CZ 1 1 15 5491 1 1 23 ARG H H 4.916 -4.721 2.944 1.00 . A A . 23 ARG H 1 1 15 5492 1 1 23 ARG HA H 5.026 -5.764 5.669 1.00 . A A . 23 ARG HA 1 1 15 5493 1 1 23 ARG HB2 H 6.187 -3.601 6.136 1.00 . A A . 23 ARG HB2 1 1 15 5494 1 1 23 ARG HB3 H 6.878 -4.422 4.750 1.00 . A A . 23 ARG HB3 1 1 15 5495 1 1 23 ARG HD2 H 6.723 -0.836 3.664 1.00 . A A . 23 ARG HD2 1 1 15 5496 1 1 23 ARG HD3 H 7.116 -1.391 5.291 1.00 . A A . 23 ARG HD3 1 1 15 5497 1 1 23 ARG HE H 7.984 -3.305 3.315 1.00 . A A . 23 ARG HE 1 1 15 5498 1 1 23 ARG HG2 H 5.532 -2.955 3.213 1.00 . A A . 23 ARG HG2 1 1 15 5499 1 1 23 ARG HG3 H 4.836 -2.150 4.603 1.00 . A A . 23 ARG HG3 1 1 15 5500 1 1 23 ARG HH11 H 8.744 -0.230 4.724 1.00 . A A . 23 ARG HH11 1 1 15 5501 1 1 23 ARG HH12 H 10.438 -0.373 4.394 1.00 . A A . 23 ARG HH12 1 1 15 5502 1 1 23 ARG HH21 H 10.118 -3.505 2.889 1.00 . A A . 23 ARG HH21 1 1 15 5503 1 1 23 ARG HH22 H 11.230 -2.255 3.339 1.00 . A A . 23 ARG HH22 1 1 15 5504 1 1 23 ARG N N 4.564 -5.281 3.666 1.00 . A A . 23 ARG N 1 1 15 5505 1 1 23 ARG NE N 8.107 -2.427 3.732 1.00 . A A . 23 ARG NE 1 1 15 5506 1 1 23 ARG NH1 N 9.512 -0.749 4.350 1.00 . A A . 23 ARG NH1 1 1 15 5507 1 1 23 ARG NH2 N 10.296 -2.613 3.304 1.00 . A A . 23 ARG NH2 1 1 15 5508 1 1 23 ARG O O 3.502 -3.788 6.780 1.00 . A A . 23 ARG O 1 1 15 5509 1 1 24 GLY C C 1.319 -2.021 5.213 1.00 . A A . 24 GLY C 1 1 15 5510 1 1 24 GLY CA C 1.224 -3.545 5.203 1.00 . A A . 24 GLY CA 1 1 15 5511 1 1 24 GLY H H 2.613 -4.520 3.900 1.00 . A A . 24 GLY H 1 1 15 5512 1 1 24 GLY HA2 H 0.466 -3.842 4.493 1.00 . A A . 24 GLY HA2 1 1 15 5513 1 1 24 GLY HA3 H 0.946 -3.894 6.187 1.00 . A A . 24 GLY HA3 1 1 15 5514 1 1 24 GLY N N 2.521 -4.158 4.807 1.00 . A A . 24 GLY N 1 1 15 5515 1 1 24 GLY O O 0.514 -1.377 5.853 1.00 . A A . 24 GLY O 1 1 15 5516 1 1 25 LYS C C 2.362 0.426 3.003 1.00 . A A . 25 LYS C 1 1 15 5517 1 1 25 LYS CA C 2.466 -0.002 4.456 1.00 . A A . 25 LYS CA 1 1 15 5518 1 1 25 LYS CB C 3.847 0.419 4.992 1.00 . A A . 25 LYS CB 1 1 15 5519 1 1 25 LYS CD C 3.045 0.511 7.409 1.00 . A A . 25 LYS CD 1 1 15 5520 1 1 25 LYS CE C 3.236 -0.098 8.805 1.00 . A A . 25 LYS CE 1 1 15 5521 1 1 25 LYS CG C 4.071 -0.109 6.429 1.00 . A A . 25 LYS CG 1 1 15 5522 1 1 25 LYS H H 2.909 -2.080 4.005 1.00 . A A . 25 LYS H 1 1 15 5523 1 1 25 LYS HA H 1.677 0.485 5.009 1.00 . A A . 25 LYS HA 1 1 15 5524 1 1 25 LYS HB2 H 4.617 0.089 4.317 1.00 . A A . 25 LYS HB2 1 1 15 5525 1 1 25 LYS HB3 H 3.886 1.498 5.021 1.00 . A A . 25 LYS HB3 1 1 15 5526 1 1 25 LYS HD2 H 3.203 1.577 7.468 1.00 . A A . 25 LYS HD2 1 1 15 5527 1 1 25 LYS HD3 H 2.034 0.335 7.076 1.00 . A A . 25 LYS HD3 1 1 15 5528 1 1 25 LYS HE2 H 4.238 0.086 9.163 1.00 . A A . 25 LYS HE2 1 1 15 5529 1 1 25 LYS HE3 H 2.530 0.335 9.499 1.00 . A A . 25 LYS HE3 1 1 15 5530 1 1 25 LYS HG2 H 3.986 -1.185 6.437 1.00 . A A . 25 LYS HG2 1 1 15 5531 1 1 25 LYS HG3 H 5.071 0.154 6.744 1.00 . A A . 25 LYS HG3 1 1 15 5532 1 1 25 LYS HZ1 H 2.312 -1.787 8.010 1.00 . A A . 25 LYS HZ1 1 1 15 5533 1 1 25 LYS HZ2 H 3.905 -2.052 8.532 1.00 . A A . 25 LYS HZ2 1 1 15 5534 1 1 25 LYS HZ3 H 2.653 -1.902 9.670 1.00 . A A . 25 LYS HZ3 1 1 15 5535 1 1 25 LYS N N 2.293 -1.494 4.508 1.00 . A A . 25 LYS N 1 1 15 5536 1 1 25 LYS NZ N 3.010 -1.571 8.751 1.00 . A A . 25 LYS NZ 1 1 15 5537 1 1 25 LYS O O 2.558 -0.369 2.108 1.00 . A A . 25 LYS O 1 1 15 5538 1 1 26 CYS C C 3.252 2.629 0.790 1.00 . A A . 26 CYS C 1 1 15 5539 1 1 26 CYS CA C 1.921 2.230 1.438 1.00 . A A . 26 CYS CA 1 1 15 5540 1 1 26 CYS CB C 0.983 3.425 1.519 1.00 . A A . 26 CYS CB 1 1 15 5541 1 1 26 CYS H H 1.926 2.253 3.600 1.00 . A A . 26 CYS H 1 1 15 5542 1 1 26 CYS HA H 1.453 1.487 0.815 1.00 . A A . 26 CYS HA 1 1 15 5543 1 1 26 CYS HB2 H 1.389 4.120 2.228 1.00 . A A . 26 CYS HB2 1 1 15 5544 1 1 26 CYS HB3 H 0.929 3.901 0.555 1.00 . A A . 26 CYS HB3 1 1 15 5545 1 1 26 CYS N N 2.058 1.680 2.818 1.00 . A A . 26 CYS N 1 1 15 5546 1 1 26 CYS O O 4.313 2.498 1.368 1.00 . A A . 26 CYS O 1 1 15 5547 1 1 26 CYS SG S -0.714 3.098 2.030 1.00 . A A . 26 CYS SG 1 1 15 5548 1 1 27 NH2 HN1 H 2.372 3.227 -0.883 1.00 . A A . 27 NH2 HN1 1 1 15 5549 1 1 27 NH2 HN2 H 4.058 3.384 -0.867 1.00 . A A . 27 NH2 HN2 1 1 15 5550 1 1 27 NH2 N N 3.228 3.121 -0.419 1.00 . A A . 27 NH2 N 1 1 16 5551 1 1 1 CYS C C -5.858 6.594 1.899 1.00 . A A . 1 CYS C 1 1 16 5552 1 1 1 CYS CA C -6.992 6.257 0.923 1.00 . A A . 1 CYS CA 1 1 16 5553 1 1 1 CYS CB C -6.519 6.584 -0.492 1.00 . A A . 1 CYS CB 1 1 16 5554 1 1 1 CYS H1 H -7.966 8.061 1.270 1.00 . A A . 1 CYS H1 1 1 16 5555 1 1 1 CYS H2 H -8.944 6.871 0.553 1.00 . A A . 1 CYS H2 1 1 16 5556 1 1 1 CYS H3 H -8.551 6.768 2.204 1.00 . A A . 1 CYS H3 1 1 16 5557 1 1 1 CYS HA H -7.228 5.204 1.007 1.00 . A A . 1 CYS HA 1 1 16 5558 1 1 1 CYS HB2 H -5.658 5.969 -0.708 1.00 . A A . 1 CYS HB2 1 1 16 5559 1 1 1 CYS HB3 H -7.294 6.309 -1.191 1.00 . A A . 1 CYS HB3 1 1 16 5560 1 1 1 CYS N N -8.206 7.049 1.264 1.00 . A A . 1 CYS N 1 1 16 5561 1 1 1 CYS O O -5.732 7.714 2.356 1.00 . A A . 1 CYS O 1 1 16 5562 1 1 1 CYS SG S -6.068 8.309 -0.797 1.00 . A A . 1 CYS SG 1 1 16 5563 1 1 2 LYS C C -2.699 6.300 2.383 1.00 . A A . 2 LYS C 1 1 16 5564 1 1 2 LYS CA C -3.906 5.718 3.111 1.00 . A A . 2 LYS CA 1 1 16 5565 1 1 2 LYS CB C -3.583 4.322 3.669 1.00 . A A . 2 LYS CB 1 1 16 5566 1 1 2 LYS CD C -6.058 3.943 4.544 1.00 . A A . 2 LYS CD 1 1 16 5567 1 1 2 LYS CE C -6.622 5.358 4.820 1.00 . A A . 2 LYS CE 1 1 16 5568 1 1 2 LYS CG C -4.532 3.824 4.801 1.00 . A A . 2 LYS CG 1 1 16 5569 1 1 2 LYS H H -5.246 4.726 1.761 1.00 . A A . 2 LYS H 1 1 16 5570 1 1 2 LYS HA H -4.165 6.378 3.924 1.00 . A A . 2 LYS HA 1 1 16 5571 1 1 2 LYS HB2 H -3.615 3.608 2.862 1.00 . A A . 2 LYS HB2 1 1 16 5572 1 1 2 LYS HB3 H -2.580 4.305 4.057 1.00 . A A . 2 LYS HB3 1 1 16 5573 1 1 2 LYS HD2 H -6.284 3.664 3.527 1.00 . A A . 2 LYS HD2 1 1 16 5574 1 1 2 LYS HD3 H -6.553 3.257 5.206 1.00 . A A . 2 LYS HD3 1 1 16 5575 1 1 2 LYS HE2 H -6.153 6.125 4.238 1.00 . A A . 2 LYS HE2 1 1 16 5576 1 1 2 LYS HE3 H -7.681 5.372 4.609 1.00 . A A . 2 LYS HE3 1 1 16 5577 1 1 2 LYS HG2 H -4.310 2.781 4.965 1.00 . A A . 2 LYS HG2 1 1 16 5578 1 1 2 LYS HG3 H -4.284 4.352 5.709 1.00 . A A . 2 LYS HG3 1 1 16 5579 1 1 2 LYS HZ1 H -6.633 4.877 6.845 1.00 . A A . 2 LYS HZ1 1 1 16 5580 1 1 2 LYS HZ2 H -5.442 6.007 6.406 1.00 . A A . 2 LYS HZ2 1 1 16 5581 1 1 2 LYS HZ3 H -7.069 6.484 6.511 1.00 . A A . 2 LYS HZ3 1 1 16 5582 1 1 2 LYS N N -5.070 5.590 2.181 1.00 . A A . 2 LYS N 1 1 16 5583 1 1 2 LYS NZ N -6.427 5.708 6.254 1.00 . A A . 2 LYS NZ 1 1 16 5584 1 1 2 LYS O O -2.307 5.831 1.333 1.00 . A A . 2 LYS O 1 1 16 5585 1 1 3 GLY C C 0.234 7.058 2.259 1.00 . A A . 3 GLY C 1 1 16 5586 1 1 3 GLY CA C -0.955 8.017 2.415 1.00 . A A . 3 GLY CA 1 1 16 5587 1 1 3 GLY H H -2.547 7.612 3.839 1.00 . A A . 3 GLY H 1 1 16 5588 1 1 3 GLY HA2 H -1.215 8.415 1.446 1.00 . A A . 3 GLY HA2 1 1 16 5589 1 1 3 GLY HA3 H -0.676 8.829 3.068 1.00 . A A . 3 GLY HA3 1 1 16 5590 1 1 3 GLY N N -2.151 7.318 2.990 1.00 . A A . 3 GLY N 1 1 16 5591 1 1 3 GLY O O 0.181 5.934 2.714 1.00 . A A . 3 GLY O 1 1 16 5592 1 1 4 LYS C C 3.098 6.339 2.784 1.00 . A A . 4 LYS C 1 1 16 5593 1 1 4 LYS CA C 2.489 6.672 1.410 1.00 . A A . 4 LYS CA 1 1 16 5594 1 1 4 LYS CB C 3.462 7.475 0.507 1.00 . A A . 4 LYS CB 1 1 16 5595 1 1 4 LYS CD C 5.703 6.255 1.171 1.00 . A A . 4 LYS CD 1 1 16 5596 1 1 4 LYS CE C 6.252 7.489 1.917 1.00 . A A . 4 LYS CE 1 1 16 5597 1 1 4 LYS CG C 4.716 6.668 0.044 1.00 . A A . 4 LYS CG 1 1 16 5598 1 1 4 LYS H H 1.263 8.443 1.277 1.00 . A A . 4 LYS H 1 1 16 5599 1 1 4 LYS HA H 2.196 5.759 0.912 1.00 . A A . 4 LYS HA 1 1 16 5600 1 1 4 LYS HB2 H 2.918 7.782 -0.374 1.00 . A A . 4 LYS HB2 1 1 16 5601 1 1 4 LYS HB3 H 3.774 8.370 1.024 1.00 . A A . 4 LYS HB3 1 1 16 5602 1 1 4 LYS HD2 H 5.253 5.560 1.859 1.00 . A A . 4 LYS HD2 1 1 16 5603 1 1 4 LYS HD3 H 6.537 5.749 0.708 1.00 . A A . 4 LYS HD3 1 1 16 5604 1 1 4 LYS HE2 H 5.457 8.053 2.378 1.00 . A A . 4 LYS HE2 1 1 16 5605 1 1 4 LYS HE3 H 6.941 7.172 2.687 1.00 . A A . 4 LYS HE3 1 1 16 5606 1 1 4 LYS HG2 H 4.370 5.767 -0.442 1.00 . A A . 4 LYS HG2 1 1 16 5607 1 1 4 LYS HG3 H 5.247 7.253 -0.691 1.00 . A A . 4 LYS HG3 1 1 16 5608 1 1 4 LYS HZ1 H 7.684 7.822 0.443 1.00 . A A . 4 LYS HZ1 1 1 16 5609 1 1 4 LYS HZ2 H 6.309 8.808 0.307 1.00 . A A . 4 LYS HZ2 1 1 16 5610 1 1 4 LYS HZ3 H 7.469 9.129 1.506 1.00 . A A . 4 LYS HZ3 1 1 16 5611 1 1 4 LYS N N 1.276 7.525 1.621 1.00 . A A . 4 LYS N 1 1 16 5612 1 1 4 LYS NZ N 6.984 8.380 0.972 1.00 . A A . 4 LYS NZ 1 1 16 5613 1 1 4 LYS O O 3.377 7.223 3.573 1.00 . A A . 4 LYS O 1 1 16 5614 1 1 5 GLY C C 2.778 4.330 5.368 1.00 . A A . 5 GLY C 1 1 16 5615 1 1 5 GLY CA C 3.857 4.572 4.303 1.00 . A A . 5 GLY CA 1 1 16 5616 1 1 5 GLY H H 3.027 4.413 2.329 1.00 . A A . 5 GLY H 1 1 16 5617 1 1 5 GLY HA2 H 4.374 3.645 4.111 1.00 . A A . 5 GLY HA2 1 1 16 5618 1 1 5 GLY HA3 H 4.566 5.294 4.681 1.00 . A A . 5 GLY HA3 1 1 16 5619 1 1 5 GLY N N 3.277 5.063 3.016 1.00 . A A . 5 GLY N 1 1 16 5620 1 1 5 GLY O O 3.099 3.984 6.488 1.00 . A A . 5 GLY O 1 1 16 5621 1 1 6 ALA C C -0.206 2.895 5.790 1.00 . A A . 6 ALA C 1 1 16 5622 1 1 6 ALA CA C 0.392 4.317 5.938 1.00 . A A . 6 ALA CA 1 1 16 5623 1 1 6 ALA CB C -0.653 5.402 5.631 1.00 . A A . 6 ALA CB 1 1 16 5624 1 1 6 ALA H H 1.361 4.801 4.068 1.00 . A A . 6 ALA H 1 1 16 5625 1 1 6 ALA HA H 0.745 4.450 6.949 1.00 . A A . 6 ALA HA 1 1 16 5626 1 1 6 ALA HB1 H -0.980 5.319 4.610 1.00 . A A . 6 ALA HB1 1 1 16 5627 1 1 6 ALA HB2 H -1.513 5.315 6.276 1.00 . A A . 6 ALA HB2 1 1 16 5628 1 1 6 ALA HB3 H -0.215 6.379 5.773 1.00 . A A . 6 ALA HB3 1 1 16 5629 1 1 6 ALA N N 1.538 4.520 4.990 1.00 . A A . 6 ALA N 1 1 16 5630 1 1 6 ALA O O -0.091 2.304 4.733 1.00 . A A . 6 ALA O 1 1 16 5631 1 1 7 PRO C C -2.327 0.545 5.879 1.00 . A A . 7 PRO C 1 1 16 5632 1 1 7 PRO CA C -1.262 0.953 6.922 1.00 . A A . 7 PRO CA 1 1 16 5633 1 1 7 PRO CB C -1.764 0.762 8.361 1.00 . A A . 7 PRO CB 1 1 16 5634 1 1 7 PRO CD C -1.169 3.149 8.080 1.00 . A A . 7 PRO CD 1 1 16 5635 1 1 7 PRO CG C -1.946 2.161 8.961 1.00 . A A . 7 PRO CG 1 1 16 5636 1 1 7 PRO HA H -0.392 0.335 6.787 1.00 . A A . 7 PRO HA 1 1 16 5637 1 1 7 PRO HB2 H -2.699 0.221 8.388 1.00 . A A . 7 PRO HB2 1 1 16 5638 1 1 7 PRO HB3 H -1.033 0.212 8.935 1.00 . A A . 7 PRO HB3 1 1 16 5639 1 1 7 PRO HD2 H -1.780 4.001 7.829 1.00 . A A . 7 PRO HD2 1 1 16 5640 1 1 7 PRO HD3 H -0.264 3.469 8.573 1.00 . A A . 7 PRO HD3 1 1 16 5641 1 1 7 PRO HG2 H -2.994 2.423 8.975 1.00 . A A . 7 PRO HG2 1 1 16 5642 1 1 7 PRO HG3 H -1.565 2.184 9.973 1.00 . A A . 7 PRO HG3 1 1 16 5643 1 1 7 PRO N N -0.825 2.383 6.840 1.00 . A A . 7 PRO N 1 1 16 5644 1 1 7 PRO O O -3.509 0.757 6.070 1.00 . A A . 7 PRO O 1 1 16 5645 1 1 8 CYS C C -3.043 -2.000 3.644 1.00 . A A . 8 CYS C 1 1 16 5646 1 1 8 CYS CA C -2.732 -0.498 3.682 1.00 . A A . 8 CYS CA 1 1 16 5647 1 1 8 CYS CB C -2.063 -0.096 2.402 1.00 . A A . 8 CYS CB 1 1 16 5648 1 1 8 CYS H H -0.881 -0.157 4.720 1.00 . A A . 8 CYS H 1 1 16 5649 1 1 8 CYS HA H -3.671 0.026 3.737 1.00 . A A . 8 CYS HA 1 1 16 5650 1 1 8 CYS HB2 H -2.582 -0.535 1.563 1.00 . A A . 8 CYS HB2 1 1 16 5651 1 1 8 CYS HB3 H -2.160 0.962 2.282 1.00 . A A . 8 CYS HB3 1 1 16 5652 1 1 8 CYS N N -1.851 -0.031 4.804 1.00 . A A . 8 CYS N 1 1 16 5653 1 1 8 CYS O O -2.665 -2.757 4.517 1.00 . A A . 8 CYS O 1 1 16 5654 1 1 8 CYS SG S -0.330 -0.589 2.267 1.00 . A A . 8 CYS SG 1 1 16 5655 1 1 9 ARG C C -4.016 -3.968 0.800 1.00 . A A . 9 ARG C 1 1 16 5656 1 1 9 ARG CA C -4.176 -3.741 2.311 1.00 . A A . 9 ARG CA 1 1 16 5657 1 1 9 ARG CB C -5.656 -3.927 2.693 1.00 . A A . 9 ARG CB 1 1 16 5658 1 1 9 ARG CD C -7.379 -3.804 4.524 1.00 . A A . 9 ARG CD 1 1 16 5659 1 1 9 ARG CG C -5.889 -3.594 4.177 1.00 . A A . 9 ARG CG 1 1 16 5660 1 1 9 ARG CZ C -8.336 -1.622 3.917 1.00 . A A . 9 ARG CZ 1 1 16 5661 1 1 9 ARG H H -3.994 -1.651 1.946 1.00 . A A . 9 ARG H 1 1 16 5662 1 1 9 ARG HA H -3.543 -4.436 2.847 1.00 . A A . 9 ARG HA 1 1 16 5663 1 1 9 ARG HB2 H -6.268 -3.283 2.078 1.00 . A A . 9 ARG HB2 1 1 16 5664 1 1 9 ARG HB3 H -5.944 -4.952 2.506 1.00 . A A . 9 ARG HB3 1 1 16 5665 1 1 9 ARG HD2 H -7.668 -4.827 4.332 1.00 . A A . 9 ARG HD2 1 1 16 5666 1 1 9 ARG HD3 H -7.562 -3.581 5.564 1.00 . A A . 9 ARG HD3 1 1 16 5667 1 1 9 ARG HE H -8.693 -3.283 2.900 1.00 . A A . 9 ARG HE 1 1 16 5668 1 1 9 ARG HG2 H -5.278 -4.234 4.796 1.00 . A A . 9 ARG HG2 1 1 16 5669 1 1 9 ARG HG3 H -5.620 -2.565 4.366 1.00 . A A . 9 ARG HG3 1 1 16 5670 1 1 9 ARG HH11 H -7.148 -1.641 5.532 1.00 . A A . 9 ARG HH11 1 1 16 5671 1 1 9 ARG HH12 H -7.816 -0.101 5.108 1.00 . A A . 9 ARG HH12 1 1 16 5672 1 1 9 ARG HH21 H -9.552 -1.343 2.352 1.00 . A A . 9 ARG HH21 1 1 16 5673 1 1 9 ARG HH22 H -9.196 0.070 3.287 1.00 . A A . 9 ARG HH22 1 1 16 5674 1 1 9 ARG N N -3.742 -2.345 2.588 1.00 . A A . 9 ARG N 1 1 16 5675 1 1 9 ARG NE N -8.218 -2.903 3.668 1.00 . A A . 9 ARG NE 1 1 16 5676 1 1 9 ARG NH1 N -7.719 -1.080 4.932 1.00 . A A . 9 ARG NH1 1 1 16 5677 1 1 9 ARG NH2 N -9.087 -0.910 3.123 1.00 . A A . 9 ARG NH2 1 1 16 5678 1 1 9 ARG O O -4.696 -3.330 0.013 1.00 . A A . 9 ARG O 1 1 16 5679 1 1 10 LYS C C -4.214 -5.640 -1.611 1.00 . A A . 10 LYS C 1 1 16 5680 1 1 10 LYS CA C -2.880 -5.179 -1.007 1.00 . A A . 10 LYS CA 1 1 16 5681 1 1 10 LYS CB C -1.876 -6.343 -1.204 1.00 . A A . 10 LYS CB 1 1 16 5682 1 1 10 LYS CD C -0.411 -5.935 0.868 1.00 . A A . 10 LYS CD 1 1 16 5683 1 1 10 LYS CE C 1.051 -5.860 1.300 1.00 . A A . 10 LYS CE 1 1 16 5684 1 1 10 LYS CG C -0.449 -6.096 -0.664 1.00 . A A . 10 LYS CG 1 1 16 5685 1 1 10 LYS H H -2.621 -5.324 1.146 1.00 . A A . 10 LYS H 1 1 16 5686 1 1 10 LYS HA H -2.545 -4.286 -1.517 1.00 . A A . 10 LYS HA 1 1 16 5687 1 1 10 LYS HB2 H -2.271 -7.228 -0.726 1.00 . A A . 10 LYS HB2 1 1 16 5688 1 1 10 LYS HB3 H -1.798 -6.551 -2.262 1.00 . A A . 10 LYS HB3 1 1 16 5689 1 1 10 LYS HD2 H -0.882 -5.011 1.163 1.00 . A A . 10 LYS HD2 1 1 16 5690 1 1 10 LYS HD3 H -0.907 -6.763 1.355 1.00 . A A . 10 LYS HD3 1 1 16 5691 1 1 10 LYS HE2 H 1.565 -6.771 1.034 1.00 . A A . 10 LYS HE2 1 1 16 5692 1 1 10 LYS HE3 H 1.531 -5.028 0.810 1.00 . A A . 10 LYS HE3 1 1 16 5693 1 1 10 LYS HG2 H 0.177 -6.928 -0.952 1.00 . A A . 10 LYS HG2 1 1 16 5694 1 1 10 LYS HG3 H -0.053 -5.203 -1.126 1.00 . A A . 10 LYS HG3 1 1 16 5695 1 1 10 LYS HZ1 H 0.654 -6.466 3.252 1.00 . A A . 10 LYS HZ1 1 1 16 5696 1 1 10 LYS HZ2 H 2.141 -5.664 3.065 1.00 . A A . 10 LYS HZ2 1 1 16 5697 1 1 10 LYS HZ3 H 0.690 -4.781 3.041 1.00 . A A . 10 LYS HZ3 1 1 16 5698 1 1 10 LYS N N -3.125 -4.863 0.445 1.00 . A A . 10 LYS N 1 1 16 5699 1 1 10 LYS NZ N 1.141 -5.680 2.776 1.00 . A A . 10 LYS NZ 1 1 16 5700 1 1 10 LYS O O -4.498 -5.413 -2.771 1.00 . A A . 10 LYS O 1 1 16 5701 1 1 11 THR C C -7.118 -5.996 -2.007 1.00 . A A . 11 THR C 1 1 16 5702 1 1 11 THR CA C -6.313 -6.851 -1.026 1.00 . A A . 11 THR CA 1 1 16 5703 1 1 11 THR CB C -7.065 -6.955 0.314 1.00 . A A . 11 THR CB 1 1 16 5704 1 1 11 THR CG2 C -8.407 -7.704 0.173 1.00 . A A . 11 THR CG2 1 1 16 5705 1 1 11 THR H H -4.603 -6.399 0.162 1.00 . A A . 11 THR H 1 1 16 5706 1 1 11 THR HA H -6.183 -7.835 -1.454 1.00 . A A . 11 THR HA 1 1 16 5707 1 1 11 THR HB H -7.163 -5.988 0.797 1.00 . A A . 11 THR HB 1 1 16 5708 1 1 11 THR HG1 H -6.097 -8.619 0.616 1.00 . A A . 11 THR HG1 1 1 16 5709 1 1 11 THR HG21 H -8.241 -8.709 -0.189 1.00 . A A . 11 THR HG21 1 1 16 5710 1 1 11 THR HG22 H -8.902 -7.757 1.131 1.00 . A A . 11 THR HG22 1 1 16 5711 1 1 11 THR HG23 H -9.054 -7.187 -0.521 1.00 . A A . 11 THR HG23 1 1 16 5712 1 1 11 THR N N -4.960 -6.282 -0.743 1.00 . A A . 11 THR N 1 1 16 5713 1 1 11 THR O O -7.797 -6.505 -2.877 1.00 . A A . 11 THR O 1 1 16 5714 1 1 11 THR OG1 O -6.265 -7.815 1.114 1.00 . A A . 11 THR OG1 1 1 16 5715 1 1 12 MET C C -6.871 -2.462 -2.861 1.00 . A A . 12 MET C 1 1 16 5716 1 1 12 MET CA C -7.710 -3.723 -2.667 1.00 . A A . 12 MET CA 1 1 16 5717 1 1 12 MET CB C -9.050 -3.392 -1.978 1.00 . A A . 12 MET CB 1 1 16 5718 1 1 12 MET CE C -10.610 -4.029 1.133 1.00 . A A . 12 MET CE 1 1 16 5719 1 1 12 MET CG C -8.812 -2.842 -0.546 1.00 . A A . 12 MET CG 1 1 16 5720 1 1 12 MET H H -6.421 -4.389 -1.083 1.00 . A A . 12 MET H 1 1 16 5721 1 1 12 MET HA H -7.894 -4.159 -3.638 1.00 . A A . 12 MET HA 1 1 16 5722 1 1 12 MET HB2 H -9.603 -2.671 -2.561 1.00 . A A . 12 MET HB2 1 1 16 5723 1 1 12 MET HB3 H -9.637 -4.294 -1.904 1.00 . A A . 12 MET HB3 1 1 16 5724 1 1 12 MET HE1 H -9.744 -4.374 1.680 1.00 . A A . 12 MET HE1 1 1 16 5725 1 1 12 MET HE2 H -11.435 -3.939 1.824 1.00 . A A . 12 MET HE2 1 1 16 5726 1 1 12 MET HE3 H -10.880 -4.731 0.358 1.00 . A A . 12 MET HE3 1 1 16 5727 1 1 12 MET HG2 H -8.271 -3.586 0.020 1.00 . A A . 12 MET HG2 1 1 16 5728 1 1 12 MET HG3 H -8.184 -1.964 -0.590 1.00 . A A . 12 MET HG3 1 1 16 5729 1 1 12 MET N N -6.995 -4.711 -1.809 1.00 . A A . 12 MET N 1 1 16 5730 1 1 12 MET O O -7.370 -1.479 -3.371 1.00 . A A . 12 MET O 1 1 16 5731 1 1 12 MET SD S -10.285 -2.401 0.411 1.00 . A A . 12 MET SD 1 1 16 5732 1 1 13 TYR C C -5.387 -0.184 -1.920 1.00 . A A . 13 TYR C 1 1 16 5733 1 1 13 TYR CA C -4.685 -1.378 -2.568 1.00 . A A . 13 TYR CA 1 1 16 5734 1 1 13 TYR CB C -4.373 -1.136 -4.064 1.00 . A A . 13 TYR CB 1 1 16 5735 1 1 13 TYR CD1 C -2.317 -2.589 -4.312 1.00 . A A . 13 TYR CD1 1 1 16 5736 1 1 13 TYR CD2 C -4.343 -3.351 -5.305 1.00 . A A . 13 TYR CD2 1 1 16 5737 1 1 13 TYR CE1 C -1.669 -3.718 -4.763 1.00 . A A . 13 TYR CE1 1 1 16 5738 1 1 13 TYR CE2 C -3.694 -4.482 -5.754 1.00 . A A . 13 TYR CE2 1 1 16 5739 1 1 13 TYR CG C -3.660 -2.395 -4.578 1.00 . A A . 13 TYR CG 1 1 16 5740 1 1 13 TYR CZ C -2.354 -4.673 -5.486 1.00 . A A . 13 TYR CZ 1 1 16 5741 1 1 13 TYR H H -5.298 -3.374 -2.063 1.00 . A A . 13 TYR H 1 1 16 5742 1 1 13 TYR HA H -3.782 -1.601 -2.017 1.00 . A A . 13 TYR HA 1 1 16 5743 1 1 13 TYR HB2 H -5.277 -0.978 -4.633 1.00 . A A . 13 TYR HB2 1 1 16 5744 1 1 13 TYR HB3 H -3.722 -0.283 -4.184 1.00 . A A . 13 TYR HB3 1 1 16 5745 1 1 13 TYR HD1 H -1.768 -1.849 -3.746 1.00 . A A . 13 TYR HD1 1 1 16 5746 1 1 13 TYR HD2 H -5.393 -3.216 -5.521 1.00 . A A . 13 TYR HD2 1 1 16 5747 1 1 13 TYR HE1 H -0.620 -3.857 -4.546 1.00 . A A . 13 TYR HE1 1 1 16 5748 1 1 13 TYR HE2 H -4.239 -5.222 -6.320 1.00 . A A . 13 TYR HE2 1 1 16 5749 1 1 13 TYR HH H -1.702 -5.777 -6.896 1.00 . A A . 13 TYR HH 1 1 16 5750 1 1 13 TYR N N -5.624 -2.537 -2.453 1.00 . A A . 13 TYR N 1 1 16 5751 1 1 13 TYR O O -5.919 0.707 -2.555 1.00 . A A . 13 TYR O 1 1 16 5752 1 1 13 TYR OH O -1.706 -5.804 -5.937 1.00 . A A . 13 TYR OH 1 1 16 5753 1 1 14 ASP C C -5.066 2.025 0.378 1.00 . A A . 14 ASP C 1 1 16 5754 1 1 14 ASP CA C -5.945 0.770 0.279 1.00 . A A . 14 ASP CA 1 1 16 5755 1 1 14 ASP CB C -6.141 0.052 1.639 1.00 . A A . 14 ASP CB 1 1 16 5756 1 1 14 ASP CG C -6.696 0.975 2.738 1.00 . A A . 14 ASP CG 1 1 16 5757 1 1 14 ASP H H -4.870 -1.015 -0.219 1.00 . A A . 14 ASP H 1 1 16 5758 1 1 14 ASP HA H -6.906 1.054 -0.123 1.00 . A A . 14 ASP HA 1 1 16 5759 1 1 14 ASP HB2 H -6.832 -0.764 1.505 1.00 . A A . 14 ASP HB2 1 1 16 5760 1 1 14 ASP HB3 H -5.207 -0.376 1.961 1.00 . A A . 14 ASP HB3 1 1 16 5761 1 1 14 ASP N N -5.335 -0.254 -0.618 1.00 . A A . 14 ASP N 1 1 16 5762 1 1 14 ASP O O -5.213 2.821 1.283 1.00 . A A . 14 ASP O 1 1 16 5763 1 1 14 ASP OD1 O -7.710 1.606 2.485 1.00 . A A . 14 ASP OD1 1 1 16 5764 1 1 14 ASP OD2 O -6.064 0.991 3.781 1.00 . A A . 14 ASP OD2 1 1 16 5765 1 1 15 CYS C C -3.596 4.345 -1.711 1.00 . A A . 15 CYS C 1 1 16 5766 1 1 15 CYS CA C -3.240 3.320 -0.632 1.00 . A A . 15 CYS CA 1 1 16 5767 1 1 15 CYS CB C -1.844 2.834 -0.925 1.00 . A A . 15 CYS CB 1 1 16 5768 1 1 15 CYS H H -4.131 1.456 -1.261 1.00 . A A . 15 CYS H 1 1 16 5769 1 1 15 CYS HA H -3.232 3.819 0.326 1.00 . A A . 15 CYS HA 1 1 16 5770 1 1 15 CYS HB2 H -1.845 2.397 -1.911 1.00 . A A . 15 CYS HB2 1 1 16 5771 1 1 15 CYS HB3 H -1.179 3.685 -0.940 1.00 . A A . 15 CYS HB3 1 1 16 5772 1 1 15 CYS N N -4.178 2.154 -0.574 1.00 . A A . 15 CYS N 1 1 16 5773 1 1 15 CYS O O -4.146 4.006 -2.741 1.00 . A A . 15 CYS O 1 1 16 5774 1 1 15 CYS SG S -1.145 1.629 0.219 1.00 . A A . 15 CYS SG 1 1 16 5775 1 1 16 CYS C C -2.557 6.489 -3.543 1.00 . A A . 16 CYS C 1 1 16 5776 1 1 16 CYS CA C -3.510 6.703 -2.358 1.00 . A A . 16 CYS CA 1 1 16 5777 1 1 16 CYS CB C -3.200 8.012 -1.638 1.00 . A A . 16 CYS CB 1 1 16 5778 1 1 16 CYS H H -2.823 5.777 -0.568 1.00 . A A . 16 CYS H 1 1 16 5779 1 1 16 CYS HA H -4.534 6.670 -2.703 1.00 . A A . 16 CYS HA 1 1 16 5780 1 1 16 CYS HB2 H -2.160 8.003 -1.350 1.00 . A A . 16 CYS HB2 1 1 16 5781 1 1 16 CYS HB3 H -3.335 8.824 -2.327 1.00 . A A . 16 CYS HB3 1 1 16 5782 1 1 16 CYS N N -3.255 5.576 -1.420 1.00 . A A . 16 CYS N 1 1 16 5783 1 1 16 CYS O O -2.872 6.790 -4.678 1.00 . A A . 16 CYS O 1 1 16 5784 1 1 16 CYS SG S -4.156 8.390 -0.150 1.00 . A A . 16 CYS SG 1 1 16 5785 1 1 17 SER C C -0.744 4.413 -4.992 1.00 . A A . 17 SER C 1 1 16 5786 1 1 17 SER CA C -0.333 5.664 -4.195 1.00 . A A . 17 SER CA 1 1 16 5787 1 1 17 SER CB C 0.973 5.417 -3.428 1.00 . A A . 17 SER CB 1 1 16 5788 1 1 17 SER H H -1.240 5.757 -2.257 1.00 . A A . 17 SER H 1 1 16 5789 1 1 17 SER HA H -0.230 6.501 -4.870 1.00 . A A . 17 SER HA 1 1 16 5790 1 1 17 SER HB2 H 1.255 6.281 -2.844 1.00 . A A . 17 SER HB2 1 1 16 5791 1 1 17 SER HB3 H 0.898 4.549 -2.788 1.00 . A A . 17 SER HB3 1 1 16 5792 1 1 17 SER HG H 1.835 4.270 -4.740 1.00 . A A . 17 SER HG 1 1 16 5793 1 1 17 SER N N -1.405 5.964 -3.201 1.00 . A A . 17 SER N 1 1 16 5794 1 1 17 SER O O -0.262 4.185 -6.084 1.00 . A A . 17 SER O 1 1 16 5795 1 1 17 SER OG O 1.947 5.174 -4.433 1.00 . A A . 17 SER OG 1 1 16 5796 1 1 18 GLY C C -1.119 1.243 -4.991 1.00 . A A . 18 GLY C 1 1 16 5797 1 1 18 GLY CA C -2.130 2.393 -5.045 1.00 . A A . 18 GLY CA 1 1 16 5798 1 1 18 GLY H H -1.971 3.893 -3.518 1.00 . A A . 18 GLY H 1 1 16 5799 1 1 18 GLY HA2 H -3.023 2.084 -4.522 1.00 . A A . 18 GLY HA2 1 1 16 5800 1 1 18 GLY HA3 H -2.369 2.600 -6.077 1.00 . A A . 18 GLY HA3 1 1 16 5801 1 1 18 GLY N N -1.628 3.644 -4.402 1.00 . A A . 18 GLY N 1 1 16 5802 1 1 18 GLY O O -1.387 0.169 -5.492 1.00 . A A . 18 GLY O 1 1 16 5803 1 1 19 SER C C 1.319 0.212 -2.760 1.00 . A A . 19 SER C 1 1 16 5804 1 1 19 SER CA C 1.091 0.490 -4.252 1.00 . A A . 19 SER CA 1 1 16 5805 1 1 19 SER CB C 2.362 1.054 -4.935 1.00 . A A . 19 SER CB 1 1 16 5806 1 1 19 SER H H 0.152 2.402 -4.004 1.00 . A A . 19 SER H 1 1 16 5807 1 1 19 SER HA H 0.795 -0.428 -4.739 1.00 . A A . 19 SER HA 1 1 16 5808 1 1 19 SER HB2 H 3.203 0.387 -4.818 1.00 . A A . 19 SER HB2 1 1 16 5809 1 1 19 SER HB3 H 2.187 1.246 -5.984 1.00 . A A . 19 SER HB3 1 1 16 5810 1 1 19 SER HG H 1.836 2.807 -4.266 1.00 . A A . 19 SER HG 1 1 16 5811 1 1 19 SER N N 0.010 1.510 -4.383 1.00 . A A . 19 SER N 1 1 16 5812 1 1 19 SER O O 1.963 0.979 -2.071 1.00 . A A . 19 SER O 1 1 16 5813 1 1 19 SER OG O 2.641 2.283 -4.275 1.00 . A A . 19 SER OG 1 1 16 5814 1 1 20 CYS C C 2.060 -2.272 -0.649 1.00 . A A . 20 CYS C 1 1 16 5815 1 1 20 CYS CA C 0.924 -1.263 -0.867 1.00 . A A . 20 CYS CA 1 1 16 5816 1 1 20 CYS CB C -0.408 -1.841 -0.371 1.00 . A A . 20 CYS CB 1 1 16 5817 1 1 20 CYS H H 0.261 -1.469 -2.907 1.00 . A A . 20 CYS H 1 1 16 5818 1 1 20 CYS HA H 1.134 -0.374 -0.291 1.00 . A A . 20 CYS HA 1 1 16 5819 1 1 20 CYS HB2 H -1.161 -1.074 -0.477 1.00 . A A . 20 CYS HB2 1 1 16 5820 1 1 20 CYS HB3 H -0.718 -2.665 -0.981 1.00 . A A . 20 CYS HB3 1 1 16 5821 1 1 20 CYS N N 0.771 -0.889 -2.303 1.00 . A A . 20 CYS N 1 1 16 5822 1 1 20 CYS O O 2.032 -3.387 -1.135 1.00 . A A . 20 CYS O 1 1 16 5823 1 1 20 CYS SG S -0.437 -2.381 1.351 1.00 . A A . 20 CYS SG 1 1 16 5824 1 1 21 GLY C C 3.919 -3.790 1.348 1.00 . A A . 21 GLY C 1 1 16 5825 1 1 21 GLY CA C 4.243 -2.594 0.449 1.00 . A A . 21 GLY CA 1 1 16 5826 1 1 21 GLY H H 2.953 -0.893 0.436 1.00 . A A . 21 GLY H 1 1 16 5827 1 1 21 GLY HA2 H 4.714 -2.943 -0.461 1.00 . A A . 21 GLY HA2 1 1 16 5828 1 1 21 GLY HA3 H 4.923 -1.944 0.972 1.00 . A A . 21 GLY HA3 1 1 16 5829 1 1 21 GLY N N 3.030 -1.805 0.095 1.00 . A A . 21 GLY N 1 1 16 5830 1 1 21 GLY O O 2.981 -3.761 2.118 1.00 . A A . 21 GLY O 1 1 16 5831 1 1 22 ARG C C 4.693 -5.895 3.477 1.00 . A A . 22 ARG C 1 1 16 5832 1 1 22 ARG CA C 4.640 -6.078 1.963 1.00 . A A . 22 ARG CA 1 1 16 5833 1 1 22 ARG CB C 5.784 -7.013 1.531 1.00 . A A . 22 ARG CB 1 1 16 5834 1 1 22 ARG CD C 6.811 -8.289 -0.369 1.00 . A A . 22 ARG CD 1 1 16 5835 1 1 22 ARG CG C 5.658 -7.349 0.031 1.00 . A A . 22 ARG CG 1 1 16 5836 1 1 22 ARG CZ C 5.824 -9.543 -2.235 1.00 . A A . 22 ARG CZ 1 1 16 5837 1 1 22 ARG H H 5.476 -4.672 0.566 1.00 . A A . 22 ARG H 1 1 16 5838 1 1 22 ARG HA H 3.696 -6.540 1.713 1.00 . A A . 22 ARG HA 1 1 16 5839 1 1 22 ARG HB2 H 6.733 -6.530 1.718 1.00 . A A . 22 ARG HB2 1 1 16 5840 1 1 22 ARG HB3 H 5.745 -7.925 2.110 1.00 . A A . 22 ARG HB3 1 1 16 5841 1 1 22 ARG HD2 H 7.761 -7.793 -0.227 1.00 . A A . 22 ARG HD2 1 1 16 5842 1 1 22 ARG HD3 H 6.798 -9.196 0.219 1.00 . A A . 22 ARG HD3 1 1 16 5843 1 1 22 ARG HE H 7.227 -8.164 -2.477 1.00 . A A . 22 ARG HE 1 1 16 5844 1 1 22 ARG HG2 H 4.710 -7.831 -0.156 1.00 . A A . 22 ARG HG2 1 1 16 5845 1 1 22 ARG HG3 H 5.710 -6.445 -0.558 1.00 . A A . 22 ARG HG3 1 1 16 5846 1 1 22 ARG HH11 H 5.122 -9.989 -0.410 1.00 . A A . 22 ARG HH11 1 1 16 5847 1 1 22 ARG HH12 H 4.426 -10.880 -1.720 1.00 . A A . 22 ARG HH12 1 1 16 5848 1 1 22 ARG HH21 H 6.355 -9.282 -4.147 1.00 . A A . 22 ARG HH21 1 1 16 5849 1 1 22 ARG HH22 H 5.130 -10.474 -3.864 1.00 . A A . 22 ARG HH22 1 1 16 5850 1 1 22 ARG N N 4.748 -4.790 1.202 1.00 . A A . 22 ARG N 1 1 16 5851 1 1 22 ARG NE N 6.671 -8.632 -1.819 1.00 . A A . 22 ARG NE 1 1 16 5852 1 1 22 ARG NH1 N 5.065 -10.188 -1.387 1.00 . A A . 22 ARG NH1 1 1 16 5853 1 1 22 ARG NH2 N 5.765 -9.785 -3.515 1.00 . A A . 22 ARG NH2 1 1 16 5854 1 1 22 ARG O O 4.193 -6.722 4.215 1.00 . A A . 22 ARG O 1 1 16 5855 1 1 23 ARG C C 4.081 -3.956 5.879 1.00 . A A . 23 ARG C 1 1 16 5856 1 1 23 ARG CA C 5.411 -4.523 5.351 1.00 . A A . 23 ARG CA 1 1 16 5857 1 1 23 ARG CB C 6.574 -3.509 5.582 1.00 . A A . 23 ARG CB 1 1 16 5858 1 1 23 ARG CD C 6.133 -2.061 3.461 1.00 . A A . 23 ARG CD 1 1 16 5859 1 1 23 ARG CG C 6.368 -2.082 4.981 1.00 . A A . 23 ARG CG 1 1 16 5860 1 1 23 ARG CZ C 7.737 -2.472 1.626 1.00 . A A . 23 ARG CZ 1 1 16 5861 1 1 23 ARG H H 5.674 -4.200 3.227 1.00 . A A . 23 ARG H 1 1 16 5862 1 1 23 ARG HA H 5.628 -5.442 5.876 1.00 . A A . 23 ARG HA 1 1 16 5863 1 1 23 ARG HB2 H 6.723 -3.402 6.647 1.00 . A A . 23 ARG HB2 1 1 16 5864 1 1 23 ARG HB3 H 7.481 -3.929 5.174 1.00 . A A . 23 ARG HB3 1 1 16 5865 1 1 23 ARG HD2 H 5.180 -2.496 3.208 1.00 . A A . 23 ARG HD2 1 1 16 5866 1 1 23 ARG HD3 H 6.143 -1.034 3.127 1.00 . A A . 23 ARG HD3 1 1 16 5867 1 1 23 ARG HE H 7.617 -3.601 3.241 1.00 . A A . 23 ARG HE 1 1 16 5868 1 1 23 ARG HG2 H 5.520 -1.625 5.462 1.00 . A A . 23 ARG HG2 1 1 16 5869 1 1 23 ARG HG3 H 7.238 -1.481 5.205 1.00 . A A . 23 ARG HG3 1 1 16 5870 1 1 23 ARG HH11 H 6.546 -0.879 1.354 1.00 . A A . 23 ARG HH11 1 1 16 5871 1 1 23 ARG HH12 H 7.680 -1.196 0.087 1.00 . A A . 23 ARG HH12 1 1 16 5872 1 1 23 ARG HH21 H 9.031 -3.997 1.655 1.00 . A A . 23 ARG HH21 1 1 16 5873 1 1 23 ARG HH22 H 9.103 -2.980 0.255 1.00 . A A . 23 ARG HH22 1 1 16 5874 1 1 23 ARG N N 5.297 -4.812 3.889 1.00 . A A . 23 ARG N 1 1 16 5875 1 1 23 ARG NE N 7.243 -2.814 2.791 1.00 . A A . 23 ARG NE 1 1 16 5876 1 1 23 ARG NH1 N 7.284 -1.434 0.974 1.00 . A A . 23 ARG NH1 1 1 16 5877 1 1 23 ARG NH2 N 8.699 -3.207 1.140 1.00 . A A . 23 ARG NH2 1 1 16 5878 1 1 23 ARG O O 3.992 -3.520 7.011 1.00 . A A . 23 ARG O 1 1 16 5879 1 1 24 GLY C C 1.655 -1.960 5.318 1.00 . A A . 24 GLY C 1 1 16 5880 1 1 24 GLY CA C 1.732 -3.477 5.388 1.00 . A A . 24 GLY CA 1 1 16 5881 1 1 24 GLY H H 3.221 -4.335 4.121 1.00 . A A . 24 GLY H 1 1 16 5882 1 1 24 GLY HA2 H 1.008 -3.892 4.704 1.00 . A A . 24 GLY HA2 1 1 16 5883 1 1 24 GLY HA3 H 1.489 -3.798 6.391 1.00 . A A . 24 GLY HA3 1 1 16 5884 1 1 24 GLY N N 3.084 -3.983 5.024 1.00 . A A . 24 GLY N 1 1 16 5885 1 1 24 GLY O O 0.718 -1.390 5.841 1.00 . A A . 24 GLY O 1 1 16 5886 1 1 25 LYS C C 2.569 0.495 3.096 1.00 . A A . 25 LYS C 1 1 16 5887 1 1 25 LYS CA C 2.618 0.147 4.572 1.00 . A A . 25 LYS CA 1 1 16 5888 1 1 25 LYS CB C 3.892 0.730 5.198 1.00 . A A . 25 LYS CB 1 1 16 5889 1 1 25 LYS CD C 2.865 0.786 7.545 1.00 . A A . 25 LYS CD 1 1 16 5890 1 1 25 LYS CE C 3.011 0.232 8.970 1.00 . A A . 25 LYS CE 1 1 16 5891 1 1 25 LYS CG C 4.036 0.268 6.672 1.00 . A A . 25 LYS CG 1 1 16 5892 1 1 25 LYS H H 3.351 -1.873 4.266 1.00 . A A . 25 LYS H 1 1 16 5893 1 1 25 LYS HA H 1.738 0.556 5.042 1.00 . A A . 25 LYS HA 1 1 16 5894 1 1 25 LYS HB2 H 4.742 0.444 4.603 1.00 . A A . 25 LYS HB2 1 1 16 5895 1 1 25 LYS HB3 H 3.825 1.806 5.180 1.00 . A A . 25 LYS HB3 1 1 16 5896 1 1 25 LYS HD2 H 2.891 1.863 7.590 1.00 . A A . 25 LYS HD2 1 1 16 5897 1 1 25 LYS HD3 H 1.913 0.485 7.139 1.00 . A A . 25 LYS HD3 1 1 16 5898 1 1 25 LYS HE2 H 3.951 0.543 9.404 1.00 . A A . 25 LYS HE2 1 1 16 5899 1 1 25 LYS HE3 H 2.204 0.589 9.592 1.00 . A A . 25 LYS HE3 1 1 16 5900 1 1 25 LYS HG2 H 4.059 -0.810 6.714 1.00 . A A . 25 LYS HG2 1 1 16 5901 1 1 25 LYS HG3 H 4.969 0.642 7.069 1.00 . A A . 25 LYS HG3 1 1 16 5902 1 1 25 LYS HZ1 H 2.304 -1.574 8.206 1.00 . A A . 25 LYS HZ1 1 1 16 5903 1 1 25 LYS HZ2 H 3.915 -1.631 8.736 1.00 . A A . 25 LYS HZ2 1 1 16 5904 1 1 25 LYS HZ3 H 2.649 -1.614 9.870 1.00 . A A . 25 LYS HZ3 1 1 16 5905 1 1 25 LYS N N 2.625 -1.350 4.680 1.00 . A A . 25 LYS N 1 1 16 5906 1 1 25 LYS NZ N 2.965 -1.260 8.944 1.00 . A A . 25 LYS NZ 1 1 16 5907 1 1 25 LYS O O 2.913 -0.316 2.262 1.00 . A A . 25 LYS O 1 1 16 5908 1 1 26 CYS C C 3.324 2.694 0.762 1.00 . A A . 26 CYS C 1 1 16 5909 1 1 26 CYS CA C 2.040 2.175 1.412 1.00 . A A . 26 CYS CA 1 1 16 5910 1 1 26 CYS CB C 0.984 3.259 1.380 1.00 . A A . 26 CYS CB 1 1 16 5911 1 1 26 CYS H H 1.905 2.285 3.571 1.00 . A A . 26 CYS H 1 1 16 5912 1 1 26 CYS HA H 1.680 1.354 0.810 1.00 . A A . 26 CYS HA 1 1 16 5913 1 1 26 CYS HB2 H 1.278 4.039 2.057 1.00 . A A . 26 CYS HB2 1 1 16 5914 1 1 26 CYS HB3 H 0.927 3.671 0.388 1.00 . A A . 26 CYS HB3 1 1 16 5915 1 1 26 CYS N N 2.148 1.698 2.825 1.00 . A A . 26 CYS N 1 1 16 5916 1 1 26 CYS O O 4.349 2.865 1.390 1.00 . A A . 26 CYS O 1 1 16 5917 1 1 26 CYS SG S -0.689 2.761 1.825 1.00 . A A . 26 CYS SG 1 1 16 5918 1 1 27 NH2 HN1 H 2.431 2.806 -0.999 1.00 . A A . 27 NH2 HN1 1 1 16 5919 1 1 27 NH2 HN2 H 4.051 3.290 -1.004 1.00 . A A . 27 NH2 HN2 1 1 16 5920 1 1 27 NH2 N N 3.272 2.953 -0.519 1.00 . A A . 27 NH2 N 1 1 17 5921 1 1 1 CYS C C -6.233 5.987 1.951 1.00 . A A . 1 CYS C 1 1 17 5922 1 1 1 CYS CA C -7.225 5.855 0.789 1.00 . A A . 1 CYS CA 1 1 17 5923 1 1 1 CYS CB C -6.611 6.418 -0.503 1.00 . A A . 1 CYS CB 1 1 17 5924 1 1 1 CYS H1 H -8.914 6.196 1.951 1.00 . A A . 1 CYS H1 1 1 17 5925 1 1 1 CYS H2 H -8.283 7.594 1.222 1.00 . A A . 1 CYS H2 1 1 17 5926 1 1 1 CYS H3 H -9.150 6.467 0.290 1.00 . A A . 1 CYS H3 1 1 17 5927 1 1 1 CYS HA H -7.453 4.808 0.665 1.00 . A A . 1 CYS HA 1 1 17 5928 1 1 1 CYS HB2 H -5.702 5.870 -0.699 1.00 . A A . 1 CYS HB2 1 1 17 5929 1 1 1 CYS HB3 H -7.285 6.210 -1.320 1.00 . A A . 1 CYS HB3 1 1 17 5930 1 1 1 CYS N N -8.489 6.584 1.085 1.00 . A A . 1 CYS N 1 1 17 5931 1 1 1 CYS O O -6.487 6.677 2.920 1.00 . A A . 1 CYS O 1 1 17 5932 1 1 1 CYS SG S -6.209 8.182 -0.557 1.00 . A A . 1 CYS SG 1 1 17 5933 1 1 2 LYS C C -2.794 5.991 2.249 1.00 . A A . 2 LYS C 1 1 17 5934 1 1 2 LYS CA C -4.048 5.305 2.822 1.00 . A A . 2 LYS CA 1 1 17 5935 1 1 2 LYS CB C -3.803 3.826 3.179 1.00 . A A . 2 LYS CB 1 1 17 5936 1 1 2 LYS CD C -3.402 3.902 5.767 1.00 . A A . 2 LYS CD 1 1 17 5937 1 1 2 LYS CE C -4.076 5.255 6.079 1.00 . A A . 2 LYS CE 1 1 17 5938 1 1 2 LYS CG C -2.822 3.653 4.338 1.00 . A A . 2 LYS CG 1 1 17 5939 1 1 2 LYS H H -4.986 4.777 0.991 1.00 . A A . 2 LYS H 1 1 17 5940 1 1 2 LYS HA H -4.359 5.872 3.675 1.00 . A A . 2 LYS HA 1 1 17 5941 1 1 2 LYS HB2 H -4.744 3.363 3.442 1.00 . A A . 2 LYS HB2 1 1 17 5942 1 1 2 LYS HB3 H -3.417 3.312 2.312 1.00 . A A . 2 LYS HB3 1 1 17 5943 1 1 2 LYS HD2 H -4.150 3.143 5.930 1.00 . A A . 2 LYS HD2 1 1 17 5944 1 1 2 LYS HD3 H -2.606 3.744 6.469 1.00 . A A . 2 LYS HD3 1 1 17 5945 1 1 2 LYS HE2 H -4.181 5.372 7.148 1.00 . A A . 2 LYS HE2 1 1 17 5946 1 1 2 LYS HE3 H -3.472 6.067 5.702 1.00 . A A . 2 LYS HE3 1 1 17 5947 1 1 2 LYS HG2 H -2.446 2.644 4.310 1.00 . A A . 2 LYS HG2 1 1 17 5948 1 1 2 LYS HG3 H -1.984 4.308 4.174 1.00 . A A . 2 LYS HG3 1 1 17 5949 1 1 2 LYS HZ1 H -5.520 4.634 4.705 1.00 . A A . 2 LYS HZ1 1 1 17 5950 1 1 2 LYS HZ2 H -6.152 5.153 6.191 1.00 . A A . 2 LYS HZ2 1 1 17 5951 1 1 2 LYS HZ3 H -5.578 6.292 5.072 1.00 . A A . 2 LYS HZ3 1 1 17 5952 1 1 2 LYS N N -5.125 5.308 1.799 1.00 . A A . 2 LYS N 1 1 17 5953 1 1 2 LYS NZ N -5.433 5.340 5.463 1.00 . A A . 2 LYS NZ 1 1 17 5954 1 1 2 LYS O O -2.234 5.551 1.264 1.00 . A A . 2 LYS O 1 1 17 5955 1 1 3 GLY C C 0.087 6.974 2.381 1.00 . A A . 3 GLY C 1 1 17 5956 1 1 3 GLY CA C -1.185 7.837 2.458 1.00 . A A . 3 GLY CA 1 1 17 5957 1 1 3 GLY H H -2.898 7.351 3.680 1.00 . A A . 3 GLY H 1 1 17 5958 1 1 3 GLY HA2 H -1.381 8.264 1.485 1.00 . A A . 3 GLY HA2 1 1 17 5959 1 1 3 GLY HA3 H -1.019 8.638 3.164 1.00 . A A . 3 GLY HA3 1 1 17 5960 1 1 3 GLY N N -2.391 7.058 2.895 1.00 . A A . 3 GLY N 1 1 17 5961 1 1 3 GLY O O 0.109 5.865 2.875 1.00 . A A . 3 GLY O 1 1 17 5962 1 1 4 LYS C C 3.035 6.347 2.946 1.00 . A A . 4 LYS C 1 1 17 5963 1 1 4 LYS CA C 2.411 6.790 1.609 1.00 . A A . 4 LYS CA 1 1 17 5964 1 1 4 LYS CB C 3.376 7.717 0.854 1.00 . A A . 4 LYS CB 1 1 17 5965 1 1 4 LYS CD C 3.814 8.925 -1.319 1.00 . A A . 4 LYS CD 1 1 17 5966 1 1 4 LYS CE C 3.305 9.202 -2.749 1.00 . A A . 4 LYS CE 1 1 17 5967 1 1 4 LYS CG C 2.835 7.992 -0.568 1.00 . A A . 4 LYS CG 1 1 17 5968 1 1 4 LYS H H 1.038 8.414 1.386 1.00 . A A . 4 LYS H 1 1 17 5969 1 1 4 LYS HA H 2.235 5.914 1.004 1.00 . A A . 4 LYS HA 1 1 17 5970 1 1 4 LYS HB2 H 3.483 8.649 1.394 1.00 . A A . 4 LYS HB2 1 1 17 5971 1 1 4 LYS HB3 H 4.340 7.244 0.790 1.00 . A A . 4 LYS HB3 1 1 17 5972 1 1 4 LYS HD2 H 3.904 9.862 -0.787 1.00 . A A . 4 LYS HD2 1 1 17 5973 1 1 4 LYS HD3 H 4.790 8.466 -1.368 1.00 . A A . 4 LYS HD3 1 1 17 5974 1 1 4 LYS HE2 H 2.323 9.650 -2.720 1.00 . A A . 4 LYS HE2 1 1 17 5975 1 1 4 LYS HE3 H 3.981 9.876 -3.253 1.00 . A A . 4 LYS HE3 1 1 17 5976 1 1 4 LYS HG2 H 2.736 7.053 -1.094 1.00 . A A . 4 LYS HG2 1 1 17 5977 1 1 4 LYS HG3 H 1.862 8.460 -0.510 1.00 . A A . 4 LYS HG3 1 1 17 5978 1 1 4 LYS HZ1 H 2.885 7.166 -2.934 1.00 . A A . 4 LYS HZ1 1 1 17 5979 1 1 4 LYS HZ2 H 2.580 8.066 -4.338 1.00 . A A . 4 LYS HZ2 1 1 17 5980 1 1 4 LYS HZ3 H 4.176 7.698 -3.895 1.00 . A A . 4 LYS HZ3 1 1 17 5981 1 1 4 LYS N N 1.110 7.513 1.764 1.00 . A A . 4 LYS N 1 1 17 5982 1 1 4 LYS NZ N 3.230 7.938 -3.538 1.00 . A A . 4 LYS NZ 1 1 17 5983 1 1 4 LYS O O 3.097 7.105 3.894 1.00 . A A . 4 LYS O 1 1 17 5984 1 1 5 GLY C C 3.143 4.299 5.327 1.00 . A A . 5 GLY C 1 1 17 5985 1 1 5 GLY CA C 4.112 4.486 4.156 1.00 . A A . 5 GLY CA 1 1 17 5986 1 1 5 GLY H H 3.375 4.576 2.141 1.00 . A A . 5 GLY H 1 1 17 5987 1 1 5 GLY HA2 H 4.494 3.517 3.874 1.00 . A A . 5 GLY HA2 1 1 17 5988 1 1 5 GLY HA3 H 4.939 5.096 4.484 1.00 . A A . 5 GLY HA3 1 1 17 5989 1 1 5 GLY N N 3.472 5.110 2.955 1.00 . A A . 5 GLY N 1 1 17 5990 1 1 5 GLY O O 3.564 3.928 6.405 1.00 . A A . 5 GLY O 1 1 17 5991 1 1 6 ALA C C 0.184 3.016 6.052 1.00 . A A . 6 ALA C 1 1 17 5992 1 1 6 ALA CA C 0.849 4.411 6.161 1.00 . A A . 6 ALA CA 1 1 17 5993 1 1 6 ALA CB C -0.176 5.547 5.981 1.00 . A A . 6 ALA CB 1 1 17 5994 1 1 6 ALA H H 1.614 4.857 4.193 1.00 . A A . 6 ALA H 1 1 17 5995 1 1 6 ALA HA H 1.325 4.509 7.125 1.00 . A A . 6 ALA HA 1 1 17 5996 1 1 6 ALA HB1 H 0.322 6.501 6.064 1.00 . A A . 6 ALA HB1 1 1 17 5997 1 1 6 ALA HB2 H -0.640 5.491 5.013 1.00 . A A . 6 ALA HB2 1 1 17 5998 1 1 6 ALA HB3 H -0.948 5.495 6.731 1.00 . A A . 6 ALA HB3 1 1 17 5999 1 1 6 ALA N N 1.883 4.561 5.088 1.00 . A A . 6 ALA N 1 1 17 6000 1 1 6 ALA O O 0.172 2.443 4.977 1.00 . A A . 6 ALA O 1 1 17 6001 1 1 7 PRO C C -2.002 0.728 6.305 1.00 . A A . 7 PRO C 1 1 17 6002 1 1 7 PRO CA C -0.844 1.101 7.257 1.00 . A A . 7 PRO CA 1 1 17 6003 1 1 7 PRO CB C -1.235 0.918 8.735 1.00 . A A . 7 PRO CB 1 1 17 6004 1 1 7 PRO CD C -0.510 3.265 8.434 1.00 . A A . 7 PRO CD 1 1 17 6005 1 1 7 PRO CG C -1.226 2.303 9.386 1.00 . A A . 7 PRO CG 1 1 17 6006 1 1 7 PRO HA H -0.022 0.439 7.054 1.00 . A A . 7 PRO HA 1 1 17 6007 1 1 7 PRO HB2 H -2.211 0.468 8.836 1.00 . A A . 7 PRO HB2 1 1 17 6008 1 1 7 PRO HB3 H -0.513 0.281 9.226 1.00 . A A . 7 PRO HB3 1 1 17 6009 1 1 7 PRO HD2 H -1.105 4.149 8.268 1.00 . A A . 7 PRO HD2 1 1 17 6010 1 1 7 PRO HD3 H 0.460 3.537 8.824 1.00 . A A . 7 PRO HD3 1 1 17 6011 1 1 7 PRO HG2 H -2.238 2.639 9.553 1.00 . A A . 7 PRO HG2 1 1 17 6012 1 1 7 PRO HG3 H -0.707 2.267 10.332 1.00 . A A . 7 PRO HG3 1 1 17 6013 1 1 7 PRO N N -0.345 2.510 7.151 1.00 . A A . 7 PRO N 1 1 17 6014 1 1 7 PRO O O -3.163 0.848 6.644 1.00 . A A . 7 PRO O 1 1 17 6015 1 1 8 CYS C C -2.845 -1.643 4.003 1.00 . A A . 8 CYS C 1 1 17 6016 1 1 8 CYS CA C -2.612 -0.134 4.083 1.00 . A A . 8 CYS CA 1 1 17 6017 1 1 8 CYS CB C -2.128 0.318 2.718 1.00 . A A . 8 CYS CB 1 1 17 6018 1 1 8 CYS H H -0.670 0.228 4.922 1.00 . A A . 8 CYS H 1 1 17 6019 1 1 8 CYS HA H -3.556 0.345 4.290 1.00 . A A . 8 CYS HA 1 1 17 6020 1 1 8 CYS HB2 H -2.713 -0.181 1.962 1.00 . A A . 8 CYS HB2 1 1 17 6021 1 1 8 CYS HB3 H -2.302 1.361 2.554 1.00 . A A . 8 CYS HB3 1 1 17 6022 1 1 8 CYS N N -1.626 0.284 5.131 1.00 . A A . 8 CYS N 1 1 17 6023 1 1 8 CYS O O -2.214 -2.450 4.657 1.00 . A A . 8 CYS O 1 1 17 6024 1 1 8 CYS SG S -0.411 -0.140 2.385 1.00 . A A . 8 CYS SG 1 1 17 6025 1 1 9 ARG C C -4.066 -3.410 1.296 1.00 . A A . 9 ARG C 1 1 17 6026 1 1 9 ARG CA C -4.271 -3.276 2.820 1.00 . A A . 9 ARG CA 1 1 17 6027 1 1 9 ARG CB C -5.763 -3.382 3.208 1.00 . A A . 9 ARG CB 1 1 17 6028 1 1 9 ARG CD C -7.411 -3.207 5.126 1.00 . A A . 9 ARG CD 1 1 17 6029 1 1 9 ARG CG C -5.928 -3.129 4.708 1.00 . A A . 9 ARG CG 1 1 17 6030 1 1 9 ARG CZ C -8.075 -0.863 4.850 1.00 . A A . 9 ARG CZ 1 1 17 6031 1 1 9 ARG H H -4.217 -1.154 2.706 1.00 . A A . 9 ARG H 1 1 17 6032 1 1 9 ARG HA H -3.676 -4.017 3.333 1.00 . A A . 9 ARG HA 1 1 17 6033 1 1 9 ARG HB2 H -6.351 -2.669 2.649 1.00 . A A . 9 ARG HB2 1 1 17 6034 1 1 9 ARG HB3 H -6.106 -4.382 2.990 1.00 . A A . 9 ARG HB3 1 1 17 6035 1 1 9 ARG HD2 H -7.838 -4.154 4.828 1.00 . A A . 9 ARG HD2 1 1 17 6036 1 1 9 ARG HD3 H -7.509 -3.105 6.198 1.00 . A A . 9 ARG HD3 1 1 17 6037 1 1 9 ARG HE H -8.774 -2.325 3.710 1.00 . A A . 9 ARG HE 1 1 17 6038 1 1 9 ARG HG2 H -5.363 -3.866 5.254 1.00 . A A . 9 ARG HG2 1 1 17 6039 1 1 9 ARG HG3 H -5.550 -2.146 4.937 1.00 . A A . 9 ARG HG3 1 1 17 6040 1 1 9 ARG HH11 H -6.755 -1.234 6.315 1.00 . A A . 9 ARG HH11 1 1 17 6041 1 1 9 ARG HH12 H -7.218 0.422 6.128 1.00 . A A . 9 ARG HH12 1 1 17 6042 1 1 9 ARG HH21 H -9.381 -0.230 3.472 1.00 . A A . 9 ARG HH21 1 1 17 6043 1 1 9 ARG HH22 H -8.721 0.995 4.504 1.00 . A A . 9 ARG HH22 1 1 17 6044 1 1 9 ARG N N -3.795 -1.912 3.150 1.00 . A A . 9 ARG N 1 1 17 6045 1 1 9 ARG NE N -8.178 -2.109 4.456 1.00 . A A . 9 ARG NE 1 1 17 6046 1 1 9 ARG NH1 N -7.288 -0.534 5.842 1.00 . A A . 9 ARG NH1 1 1 17 6047 1 1 9 ARG NH2 N -8.781 0.036 4.227 1.00 . A A . 9 ARG NH2 1 1 17 6048 1 1 9 ARG O O -4.923 -3.059 0.507 1.00 . A A . 9 ARG O 1 1 17 6049 1 1 10 LYS C C -3.554 -5.047 -1.193 1.00 . A A . 10 LYS C 1 1 17 6050 1 1 10 LYS CA C -2.545 -4.115 -0.507 1.00 . A A . 10 LYS CA 1 1 17 6051 1 1 10 LYS CB C -1.120 -4.733 -0.609 1.00 . A A . 10 LYS CB 1 1 17 6052 1 1 10 LYS CD C -1.333 -6.274 1.475 1.00 . A A . 10 LYS CD 1 1 17 6053 1 1 10 LYS CE C -1.127 -7.717 1.963 1.00 . A A . 10 LYS CE 1 1 17 6054 1 1 10 LYS CG C -0.998 -6.182 -0.034 1.00 . A A . 10 LYS CG 1 1 17 6055 1 1 10 LYS H H -2.264 -4.160 1.633 1.00 . A A . 10 LYS H 1 1 17 6056 1 1 10 LYS HA H -2.581 -3.160 -1.006 1.00 . A A . 10 LYS HA 1 1 17 6057 1 1 10 LYS HB2 H -0.820 -4.747 -1.647 1.00 . A A . 10 LYS HB2 1 1 17 6058 1 1 10 LYS HB3 H -0.428 -4.103 -0.074 1.00 . A A . 10 LYS HB3 1 1 17 6059 1 1 10 LYS HD2 H -0.711 -5.598 2.043 1.00 . A A . 10 LYS HD2 1 1 17 6060 1 1 10 LYS HD3 H -2.369 -6.031 1.651 1.00 . A A . 10 LYS HD3 1 1 17 6061 1 1 10 LYS HE2 H -0.104 -8.027 1.801 1.00 . A A . 10 LYS HE2 1 1 17 6062 1 1 10 LYS HE3 H -1.349 -7.786 3.018 1.00 . A A . 10 LYS HE3 1 1 17 6063 1 1 10 LYS HG2 H -1.649 -6.839 -0.594 1.00 . A A . 10 LYS HG2 1 1 17 6064 1 1 10 LYS HG3 H 0.018 -6.520 -0.184 1.00 . A A . 10 LYS HG3 1 1 17 6065 1 1 10 LYS HZ1 H -2.663 -8.101 0.608 1.00 . A A . 10 LYS HZ1 1 1 17 6066 1 1 10 LYS HZ2 H -1.462 -9.302 0.654 1.00 . A A . 10 LYS HZ2 1 1 17 6067 1 1 10 LYS HZ3 H -2.601 -9.187 1.910 1.00 . A A . 10 LYS HZ3 1 1 17 6068 1 1 10 LYS N N -2.908 -3.913 0.938 1.00 . A A . 10 LYS N 1 1 17 6069 1 1 10 LYS NZ N -2.031 -8.648 1.227 1.00 . A A . 10 LYS NZ 1 1 17 6070 1 1 10 LYS O O -3.704 -5.050 -2.399 1.00 . A A . 10 LYS O 1 1 17 6071 1 1 11 THR C C -6.298 -6.197 -1.684 1.00 . A A . 11 THR C 1 1 17 6072 1 1 11 THR CA C -5.242 -6.802 -0.739 1.00 . A A . 11 THR CA 1 1 17 6073 1 1 11 THR CB C -5.870 -7.285 0.571 1.00 . A A . 11 THR CB 1 1 17 6074 1 1 11 THR CG2 C -6.881 -8.428 0.360 1.00 . A A . 11 THR CG2 1 1 17 6075 1 1 11 THR H H -3.993 -5.716 0.601 1.00 . A A . 11 THR H 1 1 17 6076 1 1 11 THR HA H -4.753 -7.624 -1.245 1.00 . A A . 11 THR HA 1 1 17 6077 1 1 11 THR HB H -6.251 -6.446 1.144 1.00 . A A . 11 THR HB 1 1 17 6078 1 1 11 THR HG1 H -4.051 -7.281 1.277 1.00 . A A . 11 THR HG1 1 1 17 6079 1 1 11 THR HG21 H -6.396 -9.278 -0.099 1.00 . A A . 11 THR HG21 1 1 17 6080 1 1 11 THR HG22 H -7.294 -8.732 1.310 1.00 . A A . 11 THR HG22 1 1 17 6081 1 1 11 THR HG23 H -7.689 -8.103 -0.279 1.00 . A A . 11 THR HG23 1 1 17 6082 1 1 11 THR N N -4.202 -5.806 -0.351 1.00 . A A . 11 THR N 1 1 17 6083 1 1 11 THR O O -6.872 -6.886 -2.506 1.00 . A A . 11 THR O 1 1 17 6084 1 1 11 THR OG1 O -4.797 -7.886 1.283 1.00 . A A . 11 THR OG1 1 1 17 6085 1 1 12 MET C C -6.920 -2.782 -2.753 1.00 . A A . 12 MET C 1 1 17 6086 1 1 12 MET CA C -7.491 -4.144 -2.333 1.00 . A A . 12 MET CA 1 1 17 6087 1 1 12 MET CB C -8.790 -3.957 -1.489 1.00 . A A . 12 MET CB 1 1 17 6088 1 1 12 MET CE C -8.827 -5.252 1.782 1.00 . A A . 12 MET CE 1 1 17 6089 1 1 12 MET CG C -8.467 -3.318 -0.114 1.00 . A A . 12 MET CG 1 1 17 6090 1 1 12 MET H H -5.991 -4.444 -0.831 1.00 . A A . 12 MET H 1 1 17 6091 1 1 12 MET HA H -7.725 -4.700 -3.230 1.00 . A A . 12 MET HA 1 1 17 6092 1 1 12 MET HB2 H -9.494 -3.335 -2.021 1.00 . A A . 12 MET HB2 1 1 17 6093 1 1 12 MET HB3 H -9.244 -4.925 -1.330 1.00 . A A . 12 MET HB3 1 1 17 6094 1 1 12 MET HE1 H -9.518 -4.571 2.256 1.00 . A A . 12 MET HE1 1 1 17 6095 1 1 12 MET HE2 H -9.329 -5.858 1.041 1.00 . A A . 12 MET HE2 1 1 17 6096 1 1 12 MET HE3 H -8.413 -5.904 2.539 1.00 . A A . 12 MET HE3 1 1 17 6097 1 1 12 MET HG2 H -7.922 -2.401 -0.284 1.00 . A A . 12 MET HG2 1 1 17 6098 1 1 12 MET HG3 H -9.364 -3.055 0.424 1.00 . A A . 12 MET HG3 1 1 17 6099 1 1 12 MET N N -6.505 -4.917 -1.518 1.00 . A A . 12 MET N 1 1 17 6100 1 1 12 MET O O -7.674 -1.887 -3.088 1.00 . A A . 12 MET O 1 1 17 6101 1 1 12 MET SD S -7.477 -4.324 1.014 1.00 . A A . 12 MET SD 1 1 17 6102 1 1 13 TYR C C -5.589 -0.242 -2.335 1.00 . A A . 13 TYR C 1 1 17 6103 1 1 13 TYR CA C -4.923 -1.385 -3.112 1.00 . A A . 13 TYR CA 1 1 17 6104 1 1 13 TYR CB C -5.060 -1.184 -4.640 1.00 . A A . 13 TYR CB 1 1 17 6105 1 1 13 TYR CD1 C -3.002 -2.321 -5.574 1.00 . A A . 13 TYR CD1 1 1 17 6106 1 1 13 TYR CD2 C -5.088 -3.451 -5.785 1.00 . A A . 13 TYR CD2 1 1 17 6107 1 1 13 TYR CE1 C -2.372 -3.369 -6.211 1.00 . A A . 13 TYR CE1 1 1 17 6108 1 1 13 TYR CE2 C -4.456 -4.498 -6.422 1.00 . A A . 13 TYR CE2 1 1 17 6109 1 1 13 TYR CG C -4.366 -2.353 -5.355 1.00 . A A . 13 TYR CG 1 1 17 6110 1 1 13 TYR CZ C -3.093 -4.464 -6.639 1.00 . A A . 13 TYR CZ 1 1 17 6111 1 1 13 TYR H H -5.068 -3.433 -2.454 1.00 . A A . 13 TYR H 1 1 17 6112 1 1 13 TYR HA H -3.883 -1.448 -2.827 1.00 . A A . 13 TYR HA 1 1 17 6113 1 1 13 TYR HB2 H -6.101 -1.161 -4.929 1.00 . A A . 13 TYR HB2 1 1 17 6114 1 1 13 TYR HB3 H -4.591 -0.259 -4.940 1.00 . A A . 13 TYR HB3 1 1 17 6115 1 1 13 TYR HD1 H -2.423 -1.471 -5.244 1.00 . A A . 13 TYR HD1 1 1 17 6116 1 1 13 TYR HD2 H -6.156 -3.491 -5.621 1.00 . A A . 13 TYR HD2 1 1 17 6117 1 1 13 TYR HE1 H -1.304 -3.331 -6.376 1.00 . A A . 13 TYR HE1 1 1 17 6118 1 1 13 TYR HE2 H -5.032 -5.350 -6.754 1.00 . A A . 13 TYR HE2 1 1 17 6119 1 1 13 TYR HH H -2.486 -5.344 -8.221 1.00 . A A . 13 TYR HH 1 1 17 6120 1 1 13 TYR N N -5.610 -2.666 -2.728 1.00 . A A . 13 TYR N 1 1 17 6121 1 1 13 TYR O O -6.223 0.642 -2.880 1.00 . A A . 13 TYR O 1 1 17 6122 1 1 13 TYR OH O -2.458 -5.512 -7.276 1.00 . A A . 13 TYR OH 1 1 17 6123 1 1 14 ASP C C -5.158 1.977 -0.013 1.00 . A A . 14 ASP C 1 1 17 6124 1 1 14 ASP CA C -5.951 0.661 -0.090 1.00 . A A . 14 ASP CA 1 1 17 6125 1 1 14 ASP CB C -6.000 -0.069 1.265 1.00 . A A . 14 ASP CB 1 1 17 6126 1 1 14 ASP CG C -6.484 0.824 2.422 1.00 . A A . 14 ASP CG 1 1 17 6127 1 1 14 ASP H H -4.860 -1.080 -0.700 1.00 . A A . 14 ASP H 1 1 17 6128 1 1 14 ASP HA H -6.962 0.895 -0.394 1.00 . A A . 14 ASP HA 1 1 17 6129 1 1 14 ASP HB2 H -6.668 -0.903 1.195 1.00 . A A . 14 ASP HB2 1 1 17 6130 1 1 14 ASP HB3 H -5.030 -0.484 1.469 1.00 . A A . 14 ASP HB3 1 1 17 6131 1 1 14 ASP N N -5.392 -0.333 -1.049 1.00 . A A . 14 ASP N 1 1 17 6132 1 1 14 ASP O O -5.538 2.863 0.724 1.00 . A A . 14 ASP O 1 1 17 6133 1 1 14 ASP OD1 O -7.487 1.494 2.227 1.00 . A A . 14 ASP OD1 1 1 17 6134 1 1 14 ASP OD2 O -5.819 0.786 3.443 1.00 . A A . 14 ASP OD2 1 1 17 6135 1 1 15 CYS C C -3.642 4.351 -1.817 1.00 . A A . 15 CYS C 1 1 17 6136 1 1 15 CYS CA C -3.272 3.335 -0.744 1.00 . A A . 15 CYS CA 1 1 17 6137 1 1 15 CYS CB C -1.811 2.975 -0.915 1.00 . A A . 15 CYS CB 1 1 17 6138 1 1 15 CYS H H -3.834 1.338 -1.352 1.00 . A A . 15 CYS H 1 1 17 6139 1 1 15 CYS HA H -3.381 3.806 0.217 1.00 . A A . 15 CYS HA 1 1 17 6140 1 1 15 CYS HB2 H -1.687 2.508 -1.881 1.00 . A A . 15 CYS HB2 1 1 17 6141 1 1 15 CYS HB3 H -1.222 3.881 -0.910 1.00 . A A . 15 CYS HB3 1 1 17 6142 1 1 15 CYS N N -4.094 2.082 -0.769 1.00 . A A . 15 CYS N 1 1 17 6143 1 1 15 CYS O O -4.125 4.007 -2.878 1.00 . A A . 15 CYS O 1 1 17 6144 1 1 15 CYS SG S -1.127 1.870 0.337 1.00 . A A . 15 CYS SG 1 1 17 6145 1 1 16 CYS C C -2.707 6.587 -3.574 1.00 . A A . 16 CYS C 1 1 17 6146 1 1 16 CYS CA C -3.663 6.736 -2.380 1.00 . A A . 16 CYS CA 1 1 17 6147 1 1 16 CYS CB C -3.389 8.021 -1.603 1.00 . A A . 16 CYS CB 1 1 17 6148 1 1 16 CYS H H -2.996 5.780 -0.597 1.00 . A A . 16 CYS H 1 1 17 6149 1 1 16 CYS HA H -4.687 6.690 -2.723 1.00 . A A . 16 CYS HA 1 1 17 6150 1 1 16 CYS HB2 H -2.329 8.085 -1.396 1.00 . A A . 16 CYS HB2 1 1 17 6151 1 1 16 CYS HB3 H -3.650 8.855 -2.231 1.00 . A A . 16 CYS HB3 1 1 17 6152 1 1 16 CYS N N -3.384 5.588 -1.474 1.00 . A A . 16 CYS N 1 1 17 6153 1 1 16 CYS O O -3.011 6.956 -4.691 1.00 . A A . 16 CYS O 1 1 17 6154 1 1 16 CYS SG S -4.260 8.226 -0.030 1.00 . A A . 16 CYS SG 1 1 17 6155 1 1 17 SER C C -0.788 4.472 -4.991 1.00 . A A . 17 SER C 1 1 17 6156 1 1 17 SER CA C -0.479 5.777 -4.234 1.00 . A A . 17 SER CA 1 1 17 6157 1 1 17 SER CB C 0.832 5.660 -3.454 1.00 . A A . 17 SER CB 1 1 17 6158 1 1 17 SER H H -1.420 5.770 -2.316 1.00 . A A . 17 SER H 1 1 17 6159 1 1 17 SER HA H -0.432 6.597 -4.937 1.00 . A A . 17 SER HA 1 1 17 6160 1 1 17 SER HB2 H 1.016 6.549 -2.870 1.00 . A A . 17 SER HB2 1 1 17 6161 1 1 17 SER HB3 H 0.823 4.794 -2.807 1.00 . A A . 17 SER HB3 1 1 17 6162 1 1 17 SER HG H 1.692 4.652 -4.876 1.00 . A A . 17 SER HG 1 1 17 6163 1 1 17 SER N N -1.566 6.031 -3.248 1.00 . A A . 17 SER N 1 1 17 6164 1 1 17 SER O O -0.329 4.276 -6.100 1.00 . A A . 17 SER O 1 1 17 6165 1 1 17 SER OG O 1.837 5.497 -4.444 1.00 . A A . 17 SER OG 1 1 17 6166 1 1 18 GLY C C -0.728 1.379 -5.083 1.00 . A A . 18 GLY C 1 1 17 6167 1 1 18 GLY CA C -1.943 2.311 -4.966 1.00 . A A . 18 GLY CA 1 1 17 6168 1 1 18 GLY H H -1.893 3.850 -3.462 1.00 . A A . 18 GLY H 1 1 17 6169 1 1 18 GLY HA2 H -2.684 1.840 -4.338 1.00 . A A . 18 GLY HA2 1 1 17 6170 1 1 18 GLY HA3 H -2.358 2.482 -5.947 1.00 . A A . 18 GLY HA3 1 1 17 6171 1 1 18 GLY N N -1.559 3.622 -4.355 1.00 . A A . 18 GLY N 1 1 17 6172 1 1 18 GLY O O -0.715 0.480 -5.899 1.00 . A A . 18 GLY O 1 1 17 6173 1 1 19 SER C C 1.763 0.340 -2.791 1.00 . A A . 19 SER C 1 1 17 6174 1 1 19 SER CA C 1.508 0.829 -4.226 1.00 . A A . 19 SER CA 1 1 17 6175 1 1 19 SER CB C 2.658 1.734 -4.737 1.00 . A A . 19 SER CB 1 1 17 6176 1 1 19 SER H H 0.156 2.382 -3.622 1.00 . A A . 19 SER H 1 1 17 6177 1 1 19 SER HA H 1.408 -0.032 -4.871 1.00 . A A . 19 SER HA 1 1 17 6178 1 1 19 SER HB2 H 3.611 1.227 -4.700 1.00 . A A . 19 SER HB2 1 1 17 6179 1 1 19 SER HB3 H 2.464 2.084 -5.740 1.00 . A A . 19 SER HB3 1 1 17 6180 1 1 19 SER HG H 3.125 2.577 -3.045 1.00 . A A . 19 SER HG 1 1 17 6181 1 1 19 SER N N 0.250 1.637 -4.250 1.00 . A A . 19 SER N 1 1 17 6182 1 1 19 SER O O 2.798 0.596 -2.204 1.00 . A A . 19 SER O 1 1 17 6183 1 1 19 SER OG O 2.676 2.844 -3.850 1.00 . A A . 19 SER OG 1 1 17 6184 1 1 20 CYS C C 1.823 -2.125 -0.796 1.00 . A A . 20 CYS C 1 1 17 6185 1 1 20 CYS CA C 0.912 -0.893 -0.881 1.00 . A A . 20 CYS CA 1 1 17 6186 1 1 20 CYS CB C -0.482 -1.250 -0.356 1.00 . A A . 20 CYS CB 1 1 17 6187 1 1 20 CYS H H -0.020 -0.540 -2.792 1.00 . A A . 20 CYS H 1 1 17 6188 1 1 20 CYS HA H 1.323 -0.122 -0.253 1.00 . A A . 20 CYS HA 1 1 17 6189 1 1 20 CYS HB2 H -1.117 -0.383 -0.418 1.00 . A A . 20 CYS HB2 1 1 17 6190 1 1 20 CYS HB3 H -0.921 -1.994 -0.990 1.00 . A A . 20 CYS HB3 1 1 17 6191 1 1 20 CYS N N 0.789 -0.363 -2.269 1.00 . A A . 20 CYS N 1 1 17 6192 1 1 20 CYS O O 1.523 -3.174 -1.331 1.00 . A A . 20 CYS O 1 1 17 6193 1 1 20 CYS SG S -0.534 -1.863 1.343 1.00 . A A . 20 CYS SG 1 1 17 6194 1 1 21 GLY C C 3.414 -4.165 0.956 1.00 . A A . 21 GLY C 1 1 17 6195 1 1 21 GLY CA C 3.936 -3.012 0.083 1.00 . A A . 21 GLY CA 1 1 17 6196 1 1 21 GLY H H 3.091 -1.049 0.274 1.00 . A A . 21 GLY H 1 1 17 6197 1 1 21 GLY HA2 H 4.222 -3.404 -0.882 1.00 . A A . 21 GLY HA2 1 1 17 6198 1 1 21 GLY HA3 H 4.806 -2.583 0.557 1.00 . A A . 21 GLY HA3 1 1 17 6199 1 1 21 GLY N N 2.923 -1.931 -0.114 1.00 . A A . 21 GLY N 1 1 17 6200 1 1 21 GLY O O 2.368 -4.084 1.572 1.00 . A A . 21 GLY O 1 1 17 6201 1 1 22 ARG C C 4.027 -6.255 3.257 1.00 . A A . 22 ARG C 1 1 17 6202 1 1 22 ARG CA C 3.893 -6.447 1.742 1.00 . A A . 22 ARG CA 1 1 17 6203 1 1 22 ARG CB C 4.832 -7.616 1.289 1.00 . A A . 22 ARG CB 1 1 17 6204 1 1 22 ARG CD C 6.965 -6.255 0.672 1.00 . A A . 22 ARG CD 1 1 17 6205 1 1 22 ARG CG C 6.363 -7.404 1.515 1.00 . A A . 22 ARG CG 1 1 17 6206 1 1 22 ARG CZ C 7.334 -7.359 -1.493 1.00 . A A . 22 ARG CZ 1 1 17 6207 1 1 22 ARG H H 5.016 -5.145 0.437 1.00 . A A . 22 ARG H 1 1 17 6208 1 1 22 ARG HA H 2.872 -6.730 1.530 1.00 . A A . 22 ARG HA 1 1 17 6209 1 1 22 ARG HB2 H 4.538 -8.512 1.817 1.00 . A A . 22 ARG HB2 1 1 17 6210 1 1 22 ARG HB3 H 4.662 -7.795 0.237 1.00 . A A . 22 ARG HB3 1 1 17 6211 1 1 22 ARG HD2 H 6.592 -5.288 0.965 1.00 . A A . 22 ARG HD2 1 1 17 6212 1 1 22 ARG HD3 H 8.037 -6.244 0.801 1.00 . A A . 22 ARG HD3 1 1 17 6213 1 1 22 ARG HE H 5.936 -5.989 -1.197 1.00 . A A . 22 ARG HE 1 1 17 6214 1 1 22 ARG HG2 H 6.533 -7.194 2.561 1.00 . A A . 22 ARG HG2 1 1 17 6215 1 1 22 ARG HG3 H 6.877 -8.324 1.277 1.00 . A A . 22 ARG HG3 1 1 17 6216 1 1 22 ARG HH11 H 8.551 -7.933 -0.004 1.00 . A A . 22 ARG HH11 1 1 17 6217 1 1 22 ARG HH12 H 8.812 -8.708 -1.529 1.00 . A A . 22 ARG HH12 1 1 17 6218 1 1 22 ARG HH21 H 6.253 -6.962 -3.128 1.00 . A A . 22 ARG HH21 1 1 17 6219 1 1 22 ARG HH22 H 7.494 -8.154 -3.322 1.00 . A A . 22 ARG HH22 1 1 17 6220 1 1 22 ARG N N 4.204 -5.207 0.964 1.00 . A A . 22 ARG N 1 1 17 6221 1 1 22 ARG NE N 6.661 -6.494 -0.775 1.00 . A A . 22 ARG NE 1 1 17 6222 1 1 22 ARG NH1 N 8.308 -8.053 -0.966 1.00 . A A . 22 ARG NH1 1 1 17 6223 1 1 22 ARG NH2 N 7.000 -7.503 -2.745 1.00 . A A . 22 ARG NH2 1 1 17 6224 1 1 22 ARG O O 3.521 -7.062 4.014 1.00 . A A . 22 ARG O 1 1 17 6225 1 1 23 ARG C C 3.546 -4.328 5.656 1.00 . A A . 23 ARG C 1 1 17 6226 1 1 23 ARG CA C 4.858 -4.945 5.132 1.00 . A A . 23 ARG CA 1 1 17 6227 1 1 23 ARG CB C 6.015 -3.924 5.460 1.00 . A A . 23 ARG CB 1 1 17 6228 1 1 23 ARG CD C 6.225 -2.426 3.287 1.00 . A A . 23 ARG CD 1 1 17 6229 1 1 23 ARG CG C 5.849 -2.516 4.792 1.00 . A A . 23 ARG CG 1 1 17 6230 1 1 23 ARG CZ C 8.311 -3.746 3.032 1.00 . A A . 23 ARG CZ 1 1 17 6231 1 1 23 ARG H H 5.080 -4.599 3.002 1.00 . A A . 23 ARG H 1 1 17 6232 1 1 23 ARG HA H 5.037 -5.880 5.644 1.00 . A A . 23 ARG HA 1 1 17 6233 1 1 23 ARG HB2 H 6.021 -3.770 6.530 1.00 . A A . 23 ARG HB2 1 1 17 6234 1 1 23 ARG HB3 H 6.968 -4.356 5.207 1.00 . A A . 23 ARG HB3 1 1 17 6235 1 1 23 ARG HD2 H 5.720 -3.144 2.667 1.00 . A A . 23 ARG HD2 1 1 17 6236 1 1 23 ARG HD3 H 5.963 -1.443 2.927 1.00 . A A . 23 ARG HD3 1 1 17 6237 1 1 23 ARG HE H 8.263 -1.777 3.116 1.00 . A A . 23 ARG HE 1 1 17 6238 1 1 23 ARG HG2 H 4.823 -2.205 4.894 1.00 . A A . 23 ARG HG2 1 1 17 6239 1 1 23 ARG HG3 H 6.458 -1.808 5.336 1.00 . A A . 23 ARG HG3 1 1 17 6240 1 1 23 ARG HH11 H 6.642 -4.838 3.151 1.00 . A A . 23 ARG HH11 1 1 17 6241 1 1 23 ARG HH12 H 8.110 -5.734 2.975 1.00 . A A . 23 ARG HH12 1 1 17 6242 1 1 23 ARG HH21 H 10.111 -2.884 2.889 1.00 . A A . 23 ARG HH21 1 1 17 6243 1 1 23 ARG HH22 H 10.100 -4.614 2.822 1.00 . A A . 23 ARG HH22 1 1 17 6244 1 1 23 ARG N N 4.694 -5.202 3.664 1.00 . A A . 23 ARG N 1 1 17 6245 1 1 23 ARG NE N 7.710 -2.587 3.137 1.00 . A A . 23 ARG NE 1 1 17 6246 1 1 23 ARG NH1 N 7.634 -4.859 3.054 1.00 . A A . 23 ARG NH1 1 1 17 6247 1 1 23 ARG NH2 N 9.608 -3.749 2.905 1.00 . A A . 23 ARG NH2 1 1 17 6248 1 1 23 ARG O O 3.420 -4.041 6.831 1.00 . A A . 23 ARG O 1 1 17 6249 1 1 24 GLY C C 1.365 -2.035 5.114 1.00 . A A . 24 GLY C 1 1 17 6250 1 1 24 GLY CA C 1.291 -3.561 5.109 1.00 . A A . 24 GLY CA 1 1 17 6251 1 1 24 GLY H H 2.777 -4.400 3.821 1.00 . A A . 24 GLY H 1 1 17 6252 1 1 24 GLY HA2 H 0.562 -3.874 4.377 1.00 . A A . 24 GLY HA2 1 1 17 6253 1 1 24 GLY HA3 H 0.988 -3.910 6.085 1.00 . A A . 24 GLY HA3 1 1 17 6254 1 1 24 GLY N N 2.612 -4.147 4.753 1.00 . A A . 24 GLY N 1 1 17 6255 1 1 24 GLY O O 0.523 -1.401 5.717 1.00 . A A . 24 GLY O 1 1 17 6256 1 1 25 LYS C C 2.449 0.446 2.947 1.00 . A A . 25 LYS C 1 1 17 6257 1 1 25 LYS CA C 2.509 0.004 4.397 1.00 . A A . 25 LYS CA 1 1 17 6258 1 1 25 LYS CB C 3.863 0.458 4.983 1.00 . A A . 25 LYS CB 1 1 17 6259 1 1 25 LYS CD C 2.957 0.711 7.332 1.00 . A A . 25 LYS CD 1 1 17 6260 1 1 25 LYS CE C 3.079 0.255 8.789 1.00 . A A . 25 LYS CE 1 1 17 6261 1 1 25 LYS CG C 4.023 0.018 6.460 1.00 . A A . 25 LYS CG 1 1 17 6262 1 1 25 LYS H H 3.007 -2.067 3.975 1.00 . A A . 25 LYS H 1 1 17 6263 1 1 25 LYS HA H 1.690 0.474 4.919 1.00 . A A . 25 LYS HA 1 1 17 6264 1 1 25 LYS HB2 H 4.665 0.088 4.368 1.00 . A A . 25 LYS HB2 1 1 17 6265 1 1 25 LYS HB3 H 3.904 1.536 4.947 1.00 . A A . 25 LYS HB3 1 1 17 6266 1 1 25 LYS HD2 H 3.091 1.780 7.291 1.00 . A A . 25 LYS HD2 1 1 17 6267 1 1 25 LYS HD3 H 1.973 0.478 6.966 1.00 . A A . 25 LYS HD3 1 1 17 6268 1 1 25 LYS HE2 H 2.948 -0.814 8.864 1.00 . A A . 25 LYS HE2 1 1 17 6269 1 1 25 LYS HE3 H 4.046 0.524 9.189 1.00 . A A . 25 LYS HE3 1 1 17 6270 1 1 25 LYS HG2 H 3.916 -1.054 6.542 1.00 . A A . 25 LYS HG2 1 1 17 6271 1 1 25 LYS HG3 H 5.010 0.291 6.807 1.00 . A A . 25 LYS HG3 1 1 17 6272 1 1 25 LYS HZ1 H 1.316 1.349 8.975 1.00 . A A . 25 LYS HZ1 1 1 17 6273 1 1 25 LYS HZ2 H 1.567 0.223 10.220 1.00 . A A . 25 LYS HZ2 1 1 17 6274 1 1 25 LYS HZ3 H 2.460 1.667 10.190 1.00 . A A . 25 LYS HZ3 1 1 17 6275 1 1 25 LYS N N 2.360 -1.492 4.448 1.00 . A A . 25 LYS N 1 1 17 6276 1 1 25 LYS NZ N 2.027 0.924 9.606 1.00 . A A . 25 LYS NZ 1 1 17 6277 1 1 25 LYS O O 2.661 -0.346 2.050 1.00 . A A . 25 LYS O 1 1 17 6278 1 1 26 CYS C C 3.399 2.691 0.760 1.00 . A A . 26 CYS C 1 1 17 6279 1 1 26 CYS CA C 2.068 2.265 1.382 1.00 . A A . 26 CYS CA 1 1 17 6280 1 1 26 CYS CB C 1.114 3.445 1.426 1.00 . A A . 26 CYS CB 1 1 17 6281 1 1 26 CYS H H 2.016 2.272 3.550 1.00 . A A . 26 CYS H 1 1 17 6282 1 1 26 CYS HA H 1.624 1.525 0.741 1.00 . A A . 26 CYS HA 1 1 17 6283 1 1 26 CYS HB2 H 1.485 4.153 2.144 1.00 . A A . 26 CYS HB2 1 1 17 6284 1 1 26 CYS HB3 H 1.087 3.919 0.460 1.00 . A A . 26 CYS HB3 1 1 17 6285 1 1 26 CYS N N 2.164 1.705 2.765 1.00 . A A . 26 CYS N 1 1 17 6286 1 1 26 CYS O O 4.413 2.809 1.418 1.00 . A A . 26 CYS O 1 1 17 6287 1 1 26 CYS SG S -0.592 3.065 1.874 1.00 . A A . 26 CYS SG 1 1 17 6288 1 1 27 NH2 HN1 H 2.599 2.831 -1.050 1.00 . A A . 27 NH2 HN1 1 1 17 6289 1 1 27 NH2 HN2 H 4.250 3.203 -0.966 1.00 . A A . 27 NH2 HN2 1 1 17 6290 1 1 27 NH2 N N 3.421 2.929 -0.524 1.00 . A A . 27 NH2 N 1 1 stop_ save_
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