NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
384349 | 1kio | 5273 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 348 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1kio # This FRED archive file contains, for PDB entry <1kio>: # # - 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_1kio _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1kio _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3695.15 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 $SERINE_PROTEASE_INHIBITOR_I A . 1 1 stop_ save_ save_SERINE_PROTEASE_INHIBITOR_I _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "SERINE PROTEASE INHIBITOR I" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code EVTCEPGTTFKDKCNTCRCGSDGKSAACTRMACPQ _Entity.Number_of_monomers 35 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLU . 1 1 2 VAL . 1 1 3 THR . 1 1 4 CYS . 1 1 5 GLU . 1 1 6 PRO . 1 1 7 GLY . 1 1 8 THR . 1 1 9 THR . 1 1 10 PHE . 1 1 11 LYS . 1 1 12 ASP . 1 1 13 LYS . 1 1 14 CYS . 1 1 15 ASN . 1 1 16 THR . 1 1 17 CYS . 1 1 18 ARG . 1 1 19 CYS . 1 1 20 GLY . 1 1 21 SER . 1 1 22 ASP . 1 1 23 GLY . 1 1 24 LYS . 1 1 25 SER . 1 1 26 ALA . 1 1 27 ALA . 1 1 28 CYS . 1 1 29 THR . 1 1 30 ARG . 1 1 31 MET . 1 1 32 ALA . 1 1 33 CYS . 1 1 34 PRO . 1 1 35 GLN . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLU 1 1 1 1 VAL 2 2 1 1 THR 3 3 1 1 CYS 4 4 1 1 GLU 5 5 1 1 PRO 6 6 1 1 GLY 7 7 1 1 THR 8 8 1 1 THR 9 9 1 1 PHE 10 10 1 1 LYS 11 11 1 1 ASP 12 12 1 1 LYS 13 13 1 1 CYS 14 14 1 1 ASN 15 15 1 1 THR 16 16 1 1 CYS 17 17 1 1 ARG 18 18 1 1 CYS 19 19 1 1 GLY 20 20 1 1 SER 21 21 1 1 ASP 22 22 1 1 GLY 23 23 1 1 LYS 24 24 1 1 SER 25 25 1 1 ALA 26 26 1 1 ALA 27 27 1 1 CYS 28 28 1 1 THR 29 29 1 1 ARG 30 30 1 1 MET 31 31 1 1 ALA 32 32 1 1 CYS 33 33 1 1 PRO 34 34 1 1 GLN 35 35 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 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 GLU HA . 1 . HA 1 1 1 1 2 1 1 2 VAL H . 2 . HN 1 1 2 1 1 1 1 2 VAL H . 2 . HN 1 1 2 1 2 1 1 2 VAL MG1 . 2 . HG1# 1 1 3 1 1 1 1 2 VAL H . 2 . HN 1 1 3 1 2 1 1 2 VAL MG2 . 2 . HG2# 1 1 4 1 1 1 1 2 VAL H . 2 . HN 1 1 4 1 2 1 1 24 LYS HA . 24 . HA 1 1 5 1 1 1 1 2 VAL HA . 2 . HA 1 1 5 1 2 1 1 2 VAL MG1 . 2 . HG1# 1 1 6 1 1 1 1 2 VAL HA . 2 . HA 1 1 6 1 2 1 1 2 VAL MG2 . 2 . HG2# 1 1 7 1 1 1 1 2 VAL HA . 2 . HA 1 1 7 1 2 1 1 3 THR H . 3 . HN 1 1 8 1 1 1 1 2 VAL HB . 2 . HB 1 1 8 1 2 1 1 3 THR H . 3 . HN 1 1 9 1 1 1 1 2 VAL HB . 2 . HB 1 1 9 1 2 1 1 25 SER HA . 25 . HA 1 1 10 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 10 1 2 1 1 3 THR H . 3 . HN 1 1 11 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 11 1 2 1 1 4 CYS H . 4 . HN 1 1 12 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 12 1 2 1 1 10 PHE QE . 10 . HE# 1 1 13 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 13 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 14 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 14 1 2 1 1 24 LYS HA . 24 . HA 1 1 15 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 15 1 2 1 1 25 SER H . 25 . HN 1 1 16 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 16 1 2 1 1 25 SER HA . 25 . HA 1 1 17 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 17 1 2 1 1 26 ALA H . 26 . HN 1 1 18 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 18 1 2 1 1 26 ALA MB . 26 . HB# 1 1 19 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 19 1 2 1 1 3 THR H . 3 . HN 1 1 20 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 20 1 2 1 1 4 CYS H . 4 . HN 1 1 21 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 21 1 2 1 1 10 PHE QE . 10 . HE# 1 1 22 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 22 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 23 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 23 1 2 1 1 24 LYS HA . 24 . HA 1 1 24 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 24 1 2 1 1 25 SER H . 25 . HN 1 1 25 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 25 1 2 1 1 25 SER HA . 25 . HA 1 1 26 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 26 1 2 1 1 26 ALA H . 26 . HN 1 1 27 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 27 1 2 1 1 26 ALA MB . 26 . HB# 1 1 28 1 1 1 1 3 THR H . 3 . HN 1 1 28 1 2 1 1 3 THR MG . 3 . HG2# 1 1 29 1 1 1 1 3 THR H . 3 . HN 1 1 29 1 2 1 1 4 CYS H . 4 . HN 1 1 30 1 1 1 1 3 THR H . 3 . HN 1 1 30 1 2 1 1 4 CYS HA . 4 . HA 1 1 31 1 1 1 1 3 THR H . 3 . HN 1 1 31 1 2 1 1 4 CYS HB3 . 4 . HB1 1 1 32 1 1 1 1 3 THR HA . 3 . HA 1 1 32 1 2 1 1 3 THR MG . 3 . HG2# 1 1 33 1 1 1 1 3 THR HA . 3 . HA 1 1 33 1 2 1 1 4 CYS H . 4 . HN 1 1 34 1 1 1 1 3 THR HB . 3 . HB 1 1 34 1 2 1 1 4 CYS H . 4 . HN 1 1 35 1 1 1 1 3 THR MG . 3 . HG2# 1 1 35 1 2 1 1 4 CYS H . 4 . HN 1 1 36 1 1 1 1 4 CYS H . 4 . HN 1 1 36 1 2 1 1 24 LYS HA . 24 . HA 1 1 37 1 1 1 1 4 CYS HA . 4 . HA 1 1 37 1 2 1 1 5 GLU H . 5 . HN 1 1 38 1 1 1 1 4 CYS HA . 4 . HA 1 1 38 1 2 1 1 5 GLU HB2 . 5 . HB2 1 1 39 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 39 1 2 1 1 5 GLU H . 5 . HN 1 1 40 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 40 1 2 1 1 10 PHE QD . 10 . HD# 1 1 41 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 41 1 2 1 1 10 PHE QE . 10 . HE# 1 1 42 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 42 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 43 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 43 1 2 1 1 5 GLU H . 5 . HN 1 1 44 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 44 1 2 1 1 10 PHE QD . 10 . HD# 1 1 45 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 45 1 2 1 1 10 PHE QE . 10 . HE# 1 1 46 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 46 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 47 1 1 1 1 5 GLU H . 5 . HN 1 1 47 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 48 1 1 1 1 5 GLU H . 5 . HN 1 1 48 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 49 1 1 1 1 5 GLU HA . 5 . HA 1 1 49 1 2 1 1 6 PRO HB3 . 6 . HB1 1 1 50 1 1 1 1 5 GLU HA . 5 . HA 1 1 50 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 51 1 1 1 1 5 GLU HA . 5 . HA 1 1 51 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 52 1 1 1 1 5 GLU HA . 5 . HA 1 1 52 1 2 1 1 6 PRO HG2 . 6 . HG2 1 1 53 1 1 1 1 5 GLU HA . 5 . HA 1 1 53 1 2 1 1 6 PRO HG3 . 6 . HG1 1 1 54 1 1 1 1 6 PRO HA . 6 . HA 1 1 54 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 55 1 1 1 1 6 PRO HA . 6 . HA 1 1 55 1 2 1 1 7 GLY H . 7 . HN 1 1 56 1 1 1 1 6 PRO HA . 6 . HA 1 1 56 1 2 1 1 8 THR H . 8 . HN 1 1 57 1 1 1 1 6 PRO HA . 6 . HA 1 1 57 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 58 1 1 1 1 6 PRO HA . 6 . HA 1 1 58 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 59 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 59 1 2 1 1 7 GLY H . 7 . HN 1 1 60 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 60 1 2 1 1 21 SER HA . 21 . HA 1 1 61 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 61 1 2 1 1 23 GLY H . 23 . HN 1 1 62 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 62 1 2 1 1 7 GLY H . 7 . HN 1 1 63 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 63 1 2 1 1 21 SER HA . 21 . HA 1 1 64 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 64 1 2 1 1 23 GLY H . 23 . HN 1 1 65 1 1 1 1 6 PRO QG . 6 . HG2 1 1 65 1 2 1 1 23 GLY QA . 23 . HA2 1 1 66 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 66 1 2 1 1 21 SER HA . 21 . HA 1 1 67 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 67 1 2 1 1 23 GLY H . 23 . HN 1 1 68 1 1 1 1 6 PRO HG3 . 6 . HG1 1 1 68 1 2 1 1 21 SER HA . 21 . HA 1 1 69 1 1 1 1 6 PRO HG3 . 6 . HG1 1 1 69 1 2 1 1 23 GLY H . 23 . HN 1 1 70 1 1 1 1 7 GLY H . 7 . HN 1 1 70 1 2 1 1 8 THR H . 8 . HN 1 1 71 1 1 1 1 7 GLY H . 7 . HN 1 1 71 1 2 1 1 19 CYS H . 19 . HN 1 1 72 1 1 1 1 7 GLY H . 7 . HN 1 1 72 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 73 1 1 1 1 7 GLY H . 7 . HN 1 1 73 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 74 1 1 1 1 7 GLY H . 7 . HN 1 1 74 1 2 1 1 21 SER HA . 21 . HA 1 1 75 1 1 1 1 7 GLY HA2 . 7 . HA2 1 1 75 1 2 1 1 8 THR H . 8 . HN 1 1 76 1 1 1 1 7 GLY HA3 . 7 . HA1 1 1 76 1 2 1 1 8 THR H . 8 . HN 1 1 77 1 1 1 1 8 THR H . 8 . HN 1 1 77 1 2 1 1 8 THR MG . 8 . HG2# 1 1 78 1 1 1 1 8 THR H . 8 . HN 1 1 78 1 2 1 1 9 THR H . 9 . HN 1 1 79 1 1 1 1 8 THR H . 8 . HN 1 1 79 1 2 1 1 18 ARG HA . 18 . HA 1 1 80 1 1 1 1 8 THR H . 8 . HN 1 1 80 1 2 1 1 19 CYS H . 19 . HN 1 1 81 1 1 1 1 8 THR H . 8 . HN 1 1 81 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 82 1 1 1 1 8 THR H . 8 . HN 1 1 82 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 83 1 1 1 1 8 THR HA . 8 . HA 1 1 83 1 2 1 1 8 THR MG . 8 . HG2# 1 1 84 1 1 1 1 8 THR HA . 8 . HA 1 1 84 1 2 1 1 9 THR HB . 9 . HB 1 1 85 1 1 1 1 8 THR HA . 8 . HA 1 1 85 1 2 1 1 9 THR MG . 9 . HG2# 1 1 86 1 1 1 1 8 THR HB . 8 . HB 1 1 86 1 2 1 1 9 THR H . 9 . HN 1 1 87 1 1 1 1 8 THR HB . 8 . HB 1 1 87 1 2 1 1 10 PHE QD . 10 . HD# 1 1 88 1 1 1 1 8 THR MG . 8 . HG2# 1 1 88 1 2 1 1 9 THR H . 9 . HN 1 1 89 1 1 1 1 8 THR MG . 8 . HG2# 1 1 89 1 2 1 1 10 PHE QD . 10 . HD# 1 1 90 1 1 1 1 9 THR H . 9 . HN 1 1 90 1 2 1 1 9 THR HB . 9 . HB 1 1 91 1 1 1 1 9 THR H . 9 . HN 1 1 91 1 2 1 1 9 THR MG . 9 . HG2# 1 1 92 1 1 1 1 9 THR H . 9 . HN 1 1 92 1 2 1 1 18 ARG HA . 18 . HA 1 1 93 1 1 1 1 9 THR H . 9 . HN 1 1 93 1 2 1 1 19 CYS H . 19 . HN 1 1 94 1 1 1 1 9 THR HA . 9 . HA 1 1 94 1 2 1 1 9 THR MG . 9 . HG2# 1 1 95 1 1 1 1 9 THR HA . 9 . HA 1 1 95 1 2 1 1 10 PHE H . 10 . HN 1 1 96 1 1 1 1 9 THR HA . 9 . HA 1 1 96 1 2 1 1 10 PHE QB . 10 . HB# 1 1 97 1 1 1 1 9 THR HA . 9 . HA 1 1 97 1 2 1 1 10 PHE QD . 10 . HD# 1 1 98 1 1 1 1 9 THR HA . 9 . HA 1 1 98 1 2 1 1 10 PHE QE . 10 . HE# 1 1 99 1 1 1 1 9 THR HA . 9 . HA 1 1 99 1 2 1 1 17 CYS H . 17 . HN 1 1 100 1 1 1 1 9 THR HA . 9 . HA 1 1 100 1 2 1 1 18 ARG HA . 18 . HA 1 1 101 1 1 1 1 9 THR HA . 9 . HA 1 1 101 1 2 1 1 18 ARG HB2 . 18 . HB2 1 1 102 1 1 1 1 9 THR HA . 9 . HA 1 1 102 1 2 1 1 18 ARG HB3 . 18 . HB1 1 1 103 1 1 1 1 9 THR HA . 9 . HA 1 1 103 1 2 1 1 19 CYS H . 19 . HN 1 1 104 1 1 1 1 9 THR HB . 9 . HB 1 1 104 1 2 1 1 10 PHE H . 10 . HN 1 1 105 1 1 1 1 9 THR MG . 9 . HG2# 1 1 105 1 2 1 1 10 PHE H . 10 . HN 1 1 106 1 1 1 1 9 THR MG . 9 . HG2# 1 1 106 1 2 1 1 10 PHE HA . 10 . HA 1 1 107 1 1 1 1 9 THR MG . 9 . HG2# 1 1 107 1 2 1 1 18 ARG HA . 18 . HA 1 1 108 1 1 1 1 9 THR MG . 9 . HG2# 1 1 108 1 2 1 1 18 ARG QD . 18 . HD# 1 1 109 1 1 1 1 10 PHE H . 10 . HN 1 1 109 1 2 1 1 10 PHE QD . 10 . HD# 1 1 110 1 1 1 1 10 PHE H . 10 . HN 1 1 110 1 2 1 1 10 PHE QE . 10 . HE# 1 1 111 1 1 1 1 10 PHE H . 10 . HN 1 1 111 1 2 1 1 11 LYS H . 11 . HN 1 1 112 1 1 1 1 10 PHE H . 10 . HN 1 1 112 1 2 1 1 11 LYS HA . 11 . HA 1 1 113 1 1 1 1 10 PHE H . 10 . HN 1 1 113 1 2 1 1 16 THR HA . 16 . HA 1 1 114 1 1 1 1 10 PHE H . 10 . HN 1 1 114 1 2 1 1 16 THR HB . 16 . HB 1 1 115 1 1 1 1 10 PHE H . 10 . HN 1 1 115 1 2 1 1 17 CYS H . 17 . HN 1 1 116 1 1 1 1 10 PHE H . 10 . HN 1 1 116 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 117 1 1 1 1 10 PHE H . 10 . HN 1 1 117 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 118 1 1 1 1 10 PHE H . 10 . HN 1 1 118 1 2 1 1 18 ARG HA . 18 . HA 1 1 119 1 1 1 1 10 PHE H . 10 . HN 1 1 119 1 2 1 1 19 CYS H . 19 . HN 1 1 120 1 1 1 1 10 PHE HA . 10 . HA 1 1 120 1 2 1 1 10 PHE QD . 10 . HD# 1 1 121 1 1 1 1 10 PHE HA . 10 . HA 1 1 121 1 2 1 1 11 LYS H . 11 . HN 1 1 122 1 1 1 1 10 PHE HA . 10 . HA 1 1 122 1 2 1 1 11 LYS HB2 . 11 . HB2 1 1 123 1 1 1 1 10 PHE HA . 10 . HA 1 1 123 1 2 1 1 11 LYS HB3 . 11 . HB1 1 1 124 1 1 1 1 10 PHE QB . 10 . HB# 1 1 124 1 2 1 1 11 LYS H . 11 . HN 1 1 125 1 1 1 1 10 PHE QD . 10 . HD# 1 1 125 1 2 1 1 11 LYS H . 11 . HN 1 1 126 1 1 1 1 10 PHE QD . 10 . HD# 1 1 126 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 127 1 1 1 1 10 PHE QD . 10 . HD# 1 1 127 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 128 1 1 1 1 10 PHE QD . 10 . HD# 1 1 128 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 129 1 1 1 1 10 PHE QD . 10 . HD# 1 1 129 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 130 1 1 1 1 10 PHE QD . 10 . HD# 1 1 130 1 2 1 1 18 ARG HA . 18 . HA 1 1 131 1 1 1 1 10 PHE QD . 10 . HD# 1 1 131 1 2 1 1 19 CYS H . 19 . HN 1 1 132 1 1 1 1 10 PHE QD . 10 . HD# 1 1 132 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 133 1 1 1 1 10 PHE QD . 10 . HD# 1 1 133 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 134 1 1 1 1 10 PHE QD . 10 . HD# 1 1 134 1 2 1 1 26 ALA MB . 26 . HB# 1 1 135 1 1 1 1 10 PHE QE . 10 . HE# 1 1 135 1 2 1 1 11 LYS H . 11 . HN 1 1 136 1 1 1 1 10 PHE QE . 10 . HE# 1 1 136 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 137 1 1 1 1 10 PHE QE . 10 . HE# 1 1 137 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 138 1 1 1 1 10 PHE QE . 10 . HE# 1 1 138 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 139 1 1 1 1 10 PHE QE . 10 . HE# 1 1 139 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 140 1 1 1 1 10 PHE QE . 10 . HE# 1 1 140 1 2 1 1 18 ARG HA . 18 . HA 1 1 141 1 1 1 1 10 PHE QE . 10 . HE# 1 1 141 1 2 1 1 19 CYS H . 19 . HN 1 1 142 1 1 1 1 10 PHE QE . 10 . HE# 1 1 142 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 143 1 1 1 1 10 PHE QE . 10 . HE# 1 1 143 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 144 1 1 1 1 10 PHE QE . 10 . HE# 1 1 144 1 2 1 1 20 GLY H . 20 . HN 1 1 145 1 1 1 1 10 PHE QE . 10 . HE# 1 1 145 1 2 1 1 26 ALA MB . 26 . HB# 1 1 146 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 146 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 147 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 147 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 148 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 148 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 149 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 149 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 150 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 150 1 2 1 1 19 CYS H . 19 . HN 1 1 151 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 151 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 152 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 152 1 2 1 1 26 ALA MB . 26 . HB# 1 1 153 1 1 1 1 11 LYS H . 11 . HN 1 1 153 1 2 1 1 11 LYS HG2 . 11 . HG2 1 1 154 1 1 1 1 11 LYS H . 11 . HN 1 1 154 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 155 1 1 1 1 11 LYS H . 11 . HN 1 1 155 1 2 1 1 12 ASP H . 12 . HN 1 1 156 1 1 1 1 11 LYS H . 11 . HN 1 1 156 1 2 1 1 16 THR MG . 16 . HG2# 1 1 157 1 1 1 1 11 LYS HA . 11 . HA 1 1 157 1 2 1 1 11 LYS QD . 11 . HD# 1 1 158 1 1 1 1 11 LYS HA . 11 . HA 1 1 158 1 2 1 1 16 THR MG . 16 . HG2# 1 1 159 1 1 1 1 11 LYS HA . 11 . HA 1 1 159 1 2 1 1 17 CYS H . 17 . HN 1 1 160 1 1 1 1 11 LYS HB2 . 11 . HB2 1 1 160 1 2 1 1 12 ASP H . 12 . HN 1 1 161 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 161 1 2 1 1 12 ASP H . 12 . HN 1 1 162 1 1 1 1 12 ASP H . 12 . HN 1 1 162 1 2 1 1 13 LYS H . 13 . HN 1 1 163 1 1 1 1 12 ASP H . 12 . HN 1 1 163 1 2 1 1 13 LYS HB2 . 13 . HB2 1 1 164 1 1 1 1 12 ASP H . 12 . HN 1 1 164 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 165 1 1 1 1 12 ASP H . 12 . HN 1 1 165 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 166 1 1 1 1 12 ASP HA . 12 . HA 1 1 166 1 2 1 1 13 LYS H . 13 . HN 1 1 167 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 167 1 2 1 1 13 LYS H . 13 . HN 1 1 168 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 168 1 2 1 1 13 LYS H . 13 . HN 1 1 169 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 169 1 2 1 1 15 ASN H . 15 . HN 1 1 170 1 1 1 1 13 LYS H . 13 . HN 1 1 170 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 171 1 1 1 1 13 LYS H . 13 . HN 1 1 171 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 172 1 1 1 1 13 LYS H . 13 . HN 1 1 172 1 2 1 1 14 CYS H . 14 . HN 1 1 173 1 1 1 1 13 LYS HA . 13 . HA 1 1 173 1 2 1 1 14 CYS H . 14 . HN 1 1 174 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 174 1 2 1 1 14 CYS H . 14 . HN 1 1 175 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 175 1 2 1 1 14 CYS QB . 14 . HB2 1 1 176 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 176 1 2 1 1 15 ASN H . 15 . HN 1 1 177 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 177 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 178 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 178 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 179 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 179 1 2 1 1 14 CYS H . 14 . HN 1 1 180 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 180 1 2 1 1 14 CYS QB . 14 . HB2 1 1 181 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 181 1 2 1 1 15 ASN H . 15 . HN 1 1 182 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 182 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 183 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 183 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 184 1 1 1 1 13 LYS HG2 . 13 . HG2 1 1 184 1 2 1 1 14 CYS H . 14 . HN 1 1 185 1 1 1 1 13 LYS HG3 . 13 . HG1 1 1 185 1 2 1 1 14 CYS H . 14 . HN 1 1 186 1 1 1 1 14 CYS H . 14 . HN 1 1 186 1 2 1 1 15 ASN H . 15 . HN 1 1 187 1 1 1 1 14 CYS H . 14 . HN 1 1 187 1 2 1 1 15 ASN QB . 15 . HB2 1 1 188 1 1 1 1 14 CYS H . 14 . HN 1 1 188 1 2 1 1 32 ALA H . 32 . HN 1 1 189 1 1 1 1 14 CYS H . 14 . HN 1 1 189 1 2 1 1 33 CYS HA . 33 . HA 1 1 190 1 1 1 1 14 CYS H . 14 . HN 1 1 190 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 191 1 1 1 1 14 CYS H . 14 . HN 1 1 191 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 192 1 1 1 1 14 CYS HA . 14 . HA 1 1 192 1 2 1 1 15 ASN H . 15 . HN 1 1 193 1 1 1 1 14 CYS QB . 14 . HB2 1 1 193 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 194 1 1 1 1 14 CYS QB . 14 . HB2 1 1 194 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 195 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 195 1 2 1 1 15 ASN H . 15 . HN 1 1 196 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 196 1 2 1 1 33 CYS HA . 33 . HA 1 1 197 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 197 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 198 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 198 1 2 1 1 15 ASN H . 15 . HN 1 1 199 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 199 1 2 1 1 33 CYS HA . 33 . HA 1 1 200 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 200 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 201 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 201 1 2 1 1 28 CYS HA . 28 . HA 1 1 202 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 202 1 2 1 1 29 THR H . 29 . HN 1 1 203 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 203 1 2 1 1 30 ARG H . 30 . HN 1 1 204 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 204 1 2 1 1 30 ARG HA . 30 . HA 1 1 205 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 205 1 2 1 1 31 MET H . 31 . HN 1 1 206 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 206 1 2 1 1 32 ALA H . 32 . HN 1 1 207 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 207 1 2 1 1 29 THR H . 29 . HN 1 1 208 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 208 1 2 1 1 30 ARG H . 30 . HN 1 1 209 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 209 1 2 1 1 30 ARG HA . 30 . HA 1 1 210 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 210 1 2 1 1 31 MET H . 31 . HN 1 1 211 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 211 1 2 1 1 32 ALA H . 32 . HN 1 1 212 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 212 1 2 1 1 30 ARG H . 30 . HN 1 1 213 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 213 1 2 1 1 31 MET H . 31 . HN 1 1 214 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 214 1 2 1 1 31 MET HB2 . 31 . HB2 1 1 215 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 215 1 2 1 1 31 MET HB3 . 31 . HB1 1 1 216 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 216 1 2 1 1 32 ALA H . 32 . HN 1 1 217 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 217 1 2 1 1 30 ARG H . 30 . HN 1 1 218 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 218 1 2 1 1 31 MET H . 31 . HN 1 1 219 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 219 1 2 1 1 31 MET HB2 . 31 . HB2 1 1 220 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 220 1 2 1 1 31 MET HB3 . 31 . HB1 1 1 221 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 221 1 2 1 1 32 ALA H . 32 . HN 1 1 222 1 1 1 1 16 THR H . 16 . HN 1 1 222 1 2 1 1 16 THR MG . 16 . HG2# 1 1 223 1 1 1 1 16 THR H . 16 . HN 1 1 223 1 2 1 1 17 CYS H . 17 . HN 1 1 224 1 1 1 1 16 THR H . 16 . HN 1 1 224 1 2 1 1 28 CYS HA . 28 . HA 1 1 225 1 1 1 1 16 THR H . 16 . HN 1 1 225 1 2 1 1 29 THR H . 29 . HN 1 1 226 1 1 1 1 16 THR H . 16 . HN 1 1 226 1 2 1 1 29 THR MG . 29 . HG2# 1 1 227 1 1 1 1 16 THR HA . 16 . HA 1 1 227 1 2 1 1 16 THR MG . 16 . HG2# 1 1 228 1 1 1 1 16 THR HA . 16 . HA 1 1 228 1 2 1 1 17 CYS H . 17 . HN 1 1 229 1 1 1 1 16 THR HA . 16 . HA 1 1 229 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 230 1 1 1 1 16 THR HB . 16 . HB 1 1 230 1 2 1 1 17 CYS H . 17 . HN 1 1 231 1 1 1 1 16 THR HB . 16 . HB 1 1 231 1 2 1 1 29 THR H . 29 . HN 1 1 232 1 1 1 1 16 THR HB . 16 . HB 1 1 232 1 2 1 1 29 THR MG . 29 . HG2# 1 1 233 1 1 1 1 16 THR MG . 16 . HG2# 1 1 233 1 2 1 1 17 CYS H . 17 . HN 1 1 234 1 1 1 1 16 THR MG . 16 . HG2# 1 1 234 1 2 1 1 29 THR H . 29 . HN 1 1 235 1 1 1 1 17 CYS H . 17 . HN 1 1 235 1 2 1 1 18 ARG H . 18 . HN 1 1 236 1 1 1 1 17 CYS H . 17 . HN 1 1 236 1 2 1 1 28 CYS HA . 28 . HA 1 1 237 1 1 1 1 17 CYS HA . 17 . HA 1 1 237 1 2 1 1 18 ARG H . 18 . HN 1 1 238 1 1 1 1 17 CYS HA . 17 . HA 1 1 238 1 2 1 1 18 ARG HB2 . 18 . HB2 1 1 239 1 1 1 1 17 CYS HA . 17 . HA 1 1 239 1 2 1 1 18 ARG HB3 . 18 . HB1 1 1 240 1 1 1 1 17 CYS HA . 17 . HA 1 1 240 1 2 1 1 26 ALA MB . 26 . HB# 1 1 241 1 1 1 1 17 CYS HA . 17 . HA 1 1 241 1 2 1 1 27 ALA H . 27 . HN 1 1 242 1 1 1 1 17 CYS HA . 17 . HA 1 1 242 1 2 1 1 28 CYS H . 28 . HN 1 1 243 1 1 1 1 17 CYS HA . 17 . HA 1 1 243 1 2 1 1 28 CYS HA . 28 . HA 1 1 244 1 1 1 1 17 CYS HA . 17 . HA 1 1 244 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 245 1 1 1 1 17 CYS HA . 17 . HA 1 1 245 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 246 1 1 1 1 17 CYS HA . 17 . HA 1 1 246 1 2 1 1 29 THR H . 29 . HN 1 1 247 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 247 1 2 1 1 18 ARG H . 18 . HN 1 1 248 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 248 1 2 1 1 28 CYS HA . 28 . HA 1 1 249 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 249 1 2 1 1 18 ARG H . 18 . HN 1 1 250 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 250 1 2 1 1 26 ALA MB . 26 . HB# 1 1 251 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 251 1 2 1 1 27 ALA H . 27 . HN 1 1 252 1 1 1 1 18 ARG H . 18 . HN 1 1 252 1 2 1 1 19 CYS H . 19 . HN 1 1 253 1 1 1 1 18 ARG H . 18 . HN 1 1 253 1 2 1 1 26 ALA MB . 26 . HB# 1 1 254 1 1 1 1 18 ARG H . 18 . HN 1 1 254 1 2 1 1 27 ALA H . 27 . HN 1 1 255 1 1 1 1 18 ARG H . 18 . HN 1 1 255 1 2 1 1 28 CYS HA . 28 . HA 1 1 256 1 1 1 1 18 ARG HA . 18 . HA 1 1 256 1 2 1 1 19 CYS H . 19 . HN 1 1 257 1 1 1 1 18 ARG HA . 18 . HA 1 1 257 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 258 1 1 1 1 18 ARG HA . 18 . HA 1 1 258 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 259 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 259 1 2 1 1 18 ARG QD . 18 . HD# 1 1 260 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 260 1 2 1 1 19 CYS H . 19 . HN 1 1 261 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 261 1 2 1 1 27 ALA H . 27 . HN 1 1 262 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 262 1 2 1 1 18 ARG QD . 18 . HD# 1 1 263 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 263 1 2 1 1 19 CYS H . 19 . HN 1 1 264 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 264 1 2 1 1 27 ALA H . 27 . HN 1 1 265 1 1 1 1 18 ARG QD . 18 . HD# 1 1 265 1 2 1 1 19 CYS H . 19 . HN 1 1 266 1 1 1 1 18 ARG HG2 . 18 . HG2 1 1 266 1 2 1 1 19 CYS H . 19 . HN 1 1 267 1 1 1 1 18 ARG HG3 . 18 . HG1 1 1 267 1 2 1 1 19 CYS H . 19 . HN 1 1 268 1 1 1 1 19 CYS H . 19 . HN 1 1 268 1 2 1 1 20 GLY H . 20 . HN 1 1 269 1 1 1 1 19 CYS H . 19 . HN 1 1 269 1 2 1 1 26 ALA MB . 26 . HB# 1 1 270 1 1 1 1 19 CYS HA . 19 . HA 1 1 270 1 2 1 1 20 GLY H . 20 . HN 1 1 271 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 271 1 2 1 1 20 GLY H . 20 . HN 1 1 272 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 272 1 2 1 1 20 GLY H . 20 . HN 1 1 273 1 1 1 1 20 GLY H . 20 . HN 1 1 273 1 2 1 1 21 SER H . 21 . HN 1 1 274 1 1 1 1 20 GLY H . 20 . HN 1 1 274 1 2 1 1 22 ASP H . 22 . HN 1 1 275 1 1 1 1 20 GLY H . 20 . HN 1 1 275 1 2 1 1 23 GLY H . 23 . HN 1 1 276 1 1 1 1 20 GLY H . 20 . HN 1 1 276 1 2 1 1 25 SER H . 25 . HN 1 1 277 1 1 1 1 20 GLY H . 20 . HN 1 1 277 1 2 1 1 25 SER HA . 25 . HA 1 1 278 1 1 1 1 20 GLY H . 20 . HN 1 1 278 1 2 1 1 26 ALA HA . 26 . HA 1 1 279 1 1 1 1 20 GLY H . 20 . HN 1 1 279 1 2 1 1 26 ALA MB . 26 . HB# 1 1 280 1 1 1 1 20 GLY H . 20 . HN 1 1 280 1 2 1 1 27 ALA H . 27 . HN 1 1 281 1 1 1 1 20 GLY HA2 . 20 . HA2 1 1 281 1 2 1 1 21 SER H . 21 . HN 1 1 282 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 282 1 2 1 1 21 SER H . 21 . HN 1 1 283 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 283 1 2 1 1 23 GLY H . 23 . HN 1 1 284 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 284 1 2 1 1 25 SER H . 25 . HN 1 1 285 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 285 1 2 1 1 26 ALA HA . 26 . HA 1 1 286 1 1 1 1 21 SER H . 21 . HN 1 1 286 1 2 1 1 22 ASP H . 22 . HN 1 1 287 1 1 1 1 21 SER H . 21 . HN 1 1 287 1 2 1 1 23 GLY H . 23 . HN 1 1 288 1 1 1 1 21 SER HA . 21 . HA 1 1 288 1 2 1 1 23 GLY H . 23 . HN 1 1 289 1 1 1 1 21 SER QB . 21 . HB# 1 1 289 1 2 1 1 22 ASP H . 22 . HN 1 1 290 1 1 1 1 22 ASP HA . 22 . HA 1 1 290 1 2 1 1 23 GLY H . 23 . HN 1 1 291 1 1 1 1 22 ASP HB2 . 22 . HB2 1 1 291 1 2 1 1 23 GLY H . 23 . HN 1 1 292 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 292 1 2 1 1 23 GLY H . 23 . HN 1 1 293 1 1 1 1 24 LYS H . 24 . HN 1 1 293 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 294 1 1 1 1 24 LYS H . 24 . HN 1 1 294 1 2 1 1 24 LYS HG3 . 24 . HG1 1 1 295 1 1 1 1 24 LYS H . 24 . HN 1 1 295 1 2 1 1 25 SER H . 25 . HN 1 1 296 1 1 1 1 24 LYS HA . 24 . HA 1 1 296 1 2 1 1 24 LYS HD2 . 24 . HD2 1 1 297 1 1 1 1 24 LYS HA . 24 . HA 1 1 297 1 2 1 1 24 LYS HD3 . 24 . HD1 1 1 298 1 1 1 1 24 LYS HA . 24 . HA 1 1 298 1 2 1 1 24 LYS QE . 24 . HE# 1 1 299 1 1 1 1 24 LYS HA . 24 . HA 1 1 299 1 2 1 1 24 LYS QG . 24 . HG# 1 1 300 1 1 1 1 24 LYS HA . 24 . HA 1 1 300 1 2 1 1 25 SER H . 25 . HN 1 1 301 1 1 1 1 24 LYS HB2 . 24 . HB2 1 1 301 1 2 1 1 25 SER H . 25 . HN 1 1 302 1 1 1 1 24 LYS HB3 . 24 . HB1 1 1 302 1 2 1 1 25 SER H . 25 . HN 1 1 303 1 1 1 1 25 SER H . 25 . HN 1 1 303 1 2 1 1 26 ALA H . 26 . HN 1 1 304 1 1 1 1 25 SER H . 25 . HN 1 1 304 1 2 1 1 26 ALA MB . 26 . HB# 1 1 305 1 1 1 1 25 SER HA . 25 . HA 1 1 305 1 2 1 1 26 ALA H . 26 . HN 1 1 306 1 1 1 1 25 SER HB2 . 25 . HB2 1 1 306 1 2 1 1 26 ALA H . 26 . HN 1 1 307 1 1 1 1 25 SER HB2 . 25 . HB2 1 1 307 1 2 1 1 26 ALA HA . 26 . HA 1 1 308 1 1 1 1 25 SER HB3 . 25 . HB1 1 1 308 1 2 1 1 26 ALA H . 26 . HN 1 1 309 1 1 1 1 25 SER HB3 . 25 . HB1 1 1 309 1 2 1 1 26 ALA HA . 26 . HA 1 1 310 1 1 1 1 26 ALA H . 26 . HN 1 1 310 1 2 1 1 26 ALA MB . 26 . HB# 1 1 311 1 1 1 1 26 ALA H . 26 . HN 1 1 311 1 2 1 1 27 ALA H . 27 . HN 1 1 312 1 1 1 1 26 ALA H . 26 . HN 1 1 312 1 2 1 1 27 ALA HA . 27 . HA 1 1 313 1 1 1 1 26 ALA HA . 26 . HA 1 1 313 1 2 1 1 27 ALA H . 27 . HN 1 1 314 1 1 1 1 27 ALA H . 27 . HN 1 1 314 1 2 1 1 27 ALA MB . 27 . HB# 1 1 315 1 1 1 1 27 ALA H . 27 . HN 1 1 315 1 2 1 1 28 CYS H . 28 . HN 1 1 316 1 1 1 1 27 ALA H . 27 . HN 1 1 316 1 2 1 1 28 CYS HA . 28 . HA 1 1 317 1 1 1 1 27 ALA HA . 27 . HA 1 1 317 1 2 1 1 28 CYS H . 28 . HN 1 1 318 1 1 1 1 27 ALA MB . 27 . HB# 1 1 318 1 2 1 1 28 CYS H . 28 . HN 1 1 319 1 1 1 1 27 ALA MB . 27 . HB# 1 1 319 1 2 1 1 28 CYS HA . 28 . HA 1 1 320 1 1 1 1 28 CYS HA . 28 . HA 1 1 320 1 2 1 1 29 THR H . 29 . HN 1 1 321 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 321 1 2 1 1 29 THR H . 29 . HN 1 1 322 1 1 1 1 29 THR H . 29 . HN 1 1 322 1 2 1 1 29 THR MG . 29 . HG2# 1 1 323 1 1 1 1 29 THR HA . 29 . HA 1 1 323 1 2 1 1 29 THR MG . 29 . HG2# 1 1 324 1 1 1 1 29 THR HA . 29 . HA 1 1 324 1 2 1 1 30 ARG H . 30 . HN 1 1 325 1 1 1 1 29 THR HB . 29 . HB 1 1 325 1 2 1 1 30 ARG H . 30 . HN 1 1 326 1 1 1 1 30 ARG H . 30 . HN 1 1 326 1 2 1 1 31 MET H . 31 . HN 1 1 327 1 1 1 1 30 ARG HA . 30 . HA 1 1 327 1 2 1 1 30 ARG QD . 30 . HD# 1 1 328 1 1 1 1 30 ARG HA . 30 . HA 1 1 328 1 2 1 1 31 MET H . 31 . HN 1 1 329 1 1 1 1 31 MET HA . 31 . HA 1 1 329 1 2 1 1 31 MET QG . 31 . HG# 1 1 330 1 1 1 1 31 MET HB2 . 31 . HB2 1 1 330 1 2 1 1 32 ALA H . 32 . HN 1 1 331 1 1 1 1 31 MET HB3 . 31 . HB1 1 1 331 1 2 1 1 32 ALA H . 32 . HN 1 1 332 1 1 1 1 32 ALA H . 32 . HN 1 1 332 1 2 1 1 32 ALA MB . 32 . HB# 1 1 333 1 1 1 1 32 ALA MB . 32 . HB# 1 1 333 1 2 1 1 33 CYS HA . 33 . HA 1 1 334 1 1 1 1 33 CYS H . 33 . HN 1 1 334 1 2 1 1 34 PRO QD . 34 . HD2 1 1 335 1 1 1 1 33 CYS HA . 33 . HA 1 1 335 1 2 1 1 34 PRO HB3 . 34 . HB1 1 1 336 1 1 1 1 33 CYS HA . 33 . HA 1 1 336 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 337 1 1 1 1 33 CYS HA . 33 . HA 1 1 337 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 338 1 1 1 1 33 CYS HB2 . 33 . HB2 1 1 338 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 339 1 1 1 1 33 CYS HB2 . 33 . HB2 1 1 339 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 340 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 340 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 341 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 341 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 342 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 342 1 2 1 1 35 GLN H . 35 . HN 1 1 343 1 1 1 1 34 PRO HA . 34 . HA 1 1 343 1 2 1 1 35 GLN H . 35 . HN 1 1 344 1 1 1 1 34 PRO HB2 . 34 . HB2 1 1 344 1 2 1 1 35 GLN H . 35 . HN 1 1 345 1 1 1 1 34 PRO HB3 . 34 . HB1 1 1 345 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 346 1 1 1 1 34 PRO HB3 . 34 . HB1 1 1 346 1 2 1 1 35 GLN H . 35 . HN 1 1 347 1 1 1 1 34 PRO QG . 34 . HG# 1 1 347 1 2 1 1 35 GLN H . 35 . HN 1 1 348 1 1 1 1 35 GLN HA . 35 . HA 1 1 348 1 2 1 1 35 GLN QG . 35 . HG# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.8 3.5 1 1 2 1 . . . . . 1.8 1.8 5.0 1 1 3 1 . . . . . 1.8 1.8 5.0 1 1 4 1 . . . . . 1.8 1.8 5.0 1 1 5 1 . . . . . 1.8 1.8 5.0 1 1 6 1 . . . . . 1.8 1.8 5.0 1 1 7 1 . . . . . 1.8 1.8 3.5 1 1 8 1 . . . . . 1.8 1.8 5.0 1 1 9 1 . . . . . 1.8 1.8 5.0 1 1 10 1 . . . . . 1.8 1.8 5.0 1 1 11 1 . . . . . 1.8 1.8 5.0 1 1 12 1 . . . . . 1.8 1.8 7.15 1 1 13 1 . . . . . 1.8 1.8 5.0 1 1 14 1 . . . . . 1.8 1.8 5.0 1 1 15 1 . . . . . 1.8 1.8 5.0 1 1 16 1 . . . . . 1.8 1.8 5.0 1 1 17 1 . . . . . 1.8 1.8 5.0 1 1 18 1 . . . . . 1.8 1.8 5.0 1 1 19 1 . . . . . 1.8 1.8 5.0 1 1 20 1 . . . . . 1.8 1.8 5.0 1 1 21 1 . . . . . 1.8 1.8 7.15 1 1 22 1 . . . . . 1.8 1.8 5.0 1 1 23 1 . . . . . 1.8 1.8 5.0 1 1 24 1 . . . . . 1.8 1.8 5.0 1 1 25 1 . . . . . 1.8 1.8 5.0 1 1 26 1 . . . . . 1.8 1.8 5.0 1 1 27 1 . . . . . 1.8 1.8 5.0 1 1 28 1 . . . . . 1.8 1.8 5.0 1 1 29 1 . . . . . 1.8 1.8 5.0 1 1 30 1 . . . . . 1.8 1.8 5.0 1 1 31 1 . . . . . 1.8 1.8 5.0 1 1 32 1 . . . . . 1.8 1.8 5.0 1 1 33 1 . . . . . 1.8 1.8 5.0 1 1 34 1 . . . . . 1.8 1.8 5.0 1 1 35 1 . . . . . 1.8 1.8 5.0 1 1 36 1 . . . . . 1.8 1.8 5.0 1 1 37 1 . . . . . 1.8 1.8 3.5 1 1 38 1 . . . . . 1.8 1.8 5.0 1 1 39 1 . . . . . 1.8 1.8 3.5 1 1 40 1 . . . . . 1.8 1.8 7.15 1 1 41 1 . . . . . 1.8 1.8 7.15 1 1 42 1 . . . . . 1.8 1.8 5.0 1 1 43 1 . . . . . 1.8 1.8 5.0 1 1 44 1 . . . . . 1.8 1.8 7.15 1 1 45 1 . . . . . 1.8 1.8 7.15 1 1 46 1 . . . . . 1.8 1.8 5.0 1 1 47 1 . . . . . 1.8 1.8 5.0 1 1 48 1 . . . . . 1.8 1.8 5.0 1 1 49 1 . . . . . 1.8 1.8 5.0 1 1 50 1 . . . . . 1.8 1.8 3.5 1 1 51 1 . . . . . 1.8 1.8 3.5 1 1 52 1 . . . . . 1.8 1.8 5.0 1 1 53 1 . . . . . 1.8 1.8 5.0 1 1 54 1 . . . . . 1.8 1.8 5.0 1 1 55 1 . . . . . 1.8 1.8 3.5 1 1 56 1 . . . . . 1.8 1.8 5.0 1 1 57 1 . . . . . 1.8 1.8 5.0 1 1 58 1 . . . . . 1.8 1.8 5.0 1 1 59 1 . . . . . 1.8 1.8 5.0 1 1 60 1 . . . . . 1.8 1.8 5.0 1 1 61 1 . . . . . 1.8 1.8 5.0 1 1 62 1 . . . . . 1.8 1.8 5.0 1 1 63 1 . . . . . 1.8 1.8 5.0 1 1 64 1 . . . . . 1.8 1.8 5.0 1 1 65 1 . . . . . 1.8 1.8 5.0 1 1 66 1 . . . . . 1.8 1.8 5.0 1 1 67 1 . . . . . 1.8 1.8 5.0 1 1 68 1 . . . . . 1.8 1.8 5.0 1 1 69 1 . . . . . 1.8 1.8 5.0 1 1 70 1 . . . . . 1.8 1.8 5.0 1 1 71 1 . . . . . 1.8 1.8 5.0 1 1 72 1 . . . . . 1.8 1.8 5.0 1 1 73 1 . . . . . 1.8 1.8 5.0 1 1 74 1 . . . . . 1.8 1.8 5.0 1 1 75 1 . . . . . 1.8 1.8 5.0 1 1 76 1 . . . . . 1.8 1.8 5.0 1 1 77 1 . . . . . 1.8 1.8 5.0 1 1 78 1 . . . . . 1.8 1.8 5.0 1 1 79 1 . . . . . 1.8 1.8 5.0 1 1 80 1 . . . . . 1.8 1.8 5.0 1 1 81 1 . . . . . 1.8 1.8 5.0 1 1 82 1 . . . . . 1.8 1.8 5.0 1 1 83 1 . . . . . 1.8 1.8 5.0 1 1 84 1 . . . . . 1.8 1.8 5.0 1 1 85 1 . . . . . 1.8 1.8 5.0 1 1 86 1 . . . . . 1.8 1.8 3.5 1 1 87 1 . . . . . 1.8 1.8 7.15 1 1 88 1 . . . . . 1.8 1.8 5.0 1 1 89 1 . . . . . 1.8 1.8 7.15 1 1 90 1 . . . . . 1.8 1.8 3.5 1 1 91 1 . . . . . 1.8 1.8 5.0 1 1 92 1 . . . . . 1.8 1.8 5.0 1 1 93 1 . . . . . 1.8 1.8 5.0 1 1 94 1 . . . . . 1.8 1.8 5.0 1 1 95 1 . . . . . 1.8 1.8 3.5 1 1 96 1 . . . . . 1.8 1.8 5.0 1 1 97 1 . . . . . 1.8 1.8 7.15 1 1 98 1 . . . . . 1.8 1.8 7.15 1 1 99 1 . . . . . 1.8 1.8 5.0 1 1 100 1 . . . . . 1.8 1.8 5.0 1 1 101 1 . . . . . 1.8 1.8 5.0 1 1 102 1 . . . . . 1.8 1.8 5.0 1 1 103 1 . . . . . 1.8 1.8 5.0 1 1 104 1 . . . . . 1.8 1.8 5.0 1 1 105 1 . . . . . 1.8 1.8 5.0 1 1 106 1 . . . . . 1.8 1.8 5.0 1 1 107 1 . . . . . 1.8 1.8 5.0 1 1 108 1 . . . . . 1.8 1.8 5.0 1 1 109 1 . . . . . 1.8 1.8 7.15 1 1 110 1 . . . . . 1.8 1.8 7.15 1 1 111 1 . . . . . 1.8 1.8 5.0 1 1 112 1 . . . . . 1.8 1.8 5.0 1 1 113 1 . . . . . 1.8 1.8 5.0 1 1 114 1 . . . . . 1.8 1.8 5.0 1 1 115 1 . . . . . 1.8 1.8 3.5 1 1 116 1 . . . . . 1.8 1.8 5.0 1 1 117 1 . . . . . 1.8 1.8 5.0 1 1 118 1 . . . . . 1.8 1.8 5.0 1 1 119 1 . . . . . 1.8 1.8 5.0 1 1 120 1 . . . . . 1.8 1.8 7.15 1 1 121 1 . . . . . 1.8 1.8 3.5 1 1 122 1 . . . . . 1.8 1.8 5.0 1 1 123 1 . . . . . 1.8 1.8 5.0 1 1 124 1 . . . . . 1.8 1.8 3.5 1 1 125 1 . . . . . 1.8 1.8 7.15 1 1 126 1 . . . . . 1.8 1.8 7.15 1 1 127 1 . . . . . 1.8 1.8 7.15 1 1 128 1 . . . . . 1.8 1.8 7.15 1 1 129 1 . . . . . 1.8 1.8 7.15 1 1 130 1 . . . . . 1.8 1.8 7.15 1 1 131 1 . . . . . 1.8 1.8 7.15 1 1 132 1 . . . . . 1.8 1.8 7.15 1 1 133 1 . . . . . 1.8 1.8 7.15 1 1 134 1 . . . . . 1.8 1.8 7.15 1 1 135 1 . . . . . 1.8 1.8 7.15 1 1 136 1 . . . . . 1.8 1.8 7.15 1 1 137 1 . . . . . 1.8 1.8 7.15 1 1 138 1 . . . . . 1.8 1.8 7.15 1 1 139 1 . . . . . 1.8 1.8 7.15 1 1 140 1 . . . . . 1.8 1.8 7.15 1 1 141 1 . . . . . 1.8 1.8 7.15 1 1 142 1 . . . . . 1.8 1.8 7.15 1 1 143 1 . . . . . 1.8 1.8 7.15 1 1 144 1 . . . . . 1.8 1.8 7.15 1 1 145 1 . . . . . 1.8 1.8 7.15 1 1 146 1 . . . . . 1.8 1.8 5.0 1 1 147 1 . . . . . 1.8 1.8 5.0 1 1 148 1 . . . . . 1.8 1.8 5.0 1 1 149 1 . . . . . 1.8 1.8 5.0 1 1 150 1 . . . . . 1.8 1.8 5.0 1 1 151 1 . . . . . 1.8 1.8 5.0 1 1 152 1 . . . . . 1.8 1.8 5.0 1 1 153 1 . . . . . 1.8 1.8 5.0 1 1 154 1 . . . . . 1.8 1.8 5.0 1 1 155 1 . . . . . 1.8 1.8 5.0 1 1 156 1 . . . . . 1.8 1.8 5.0 1 1 157 1 . . . . . 1.8 1.8 5.0 1 1 158 1 . . . . . 1.8 1.8 5.0 1 1 159 1 . . . . . 1.8 1.8 5.0 1 1 160 1 . . . . . 1.8 1.8 5.0 1 1 161 1 . . . . . 1.8 1.8 5.0 1 1 162 1 . . . . . 1.8 1.8 5.0 1 1 163 1 . . . . . 1.8 1.8 5.0 1 1 164 1 . . . . . 1.8 1.8 5.0 1 1 165 1 . . . . . 1.8 1.8 5.0 1 1 166 1 . . . . . 1.8 1.8 3.5 1 1 167 1 . . . . . 1.8 1.8 5.0 1 1 168 1 . . . . . 1.8 1.8 5.0 1 1 169 1 . . . . . 1.8 1.8 5.0 1 1 170 1 . . . . . 1.8 1.8 3.5 1 1 171 1 . . . . . 1.8 1.8 5.0 1 1 172 1 . . . . . 1.8 1.8 5.0 1 1 173 1 . . . . . 1.8 1.8 5.0 1 1 174 1 . . . . . 1.8 1.8 3.5 1 1 175 1 . . . . . 1.8 1.8 5.0 1 1 176 1 . . . . . 1.8 1.8 5.0 1 1 177 1 . . . . . 1.8 1.8 5.0 1 1 178 1 . . . . . 1.8 1.8 5.0 1 1 179 1 . . . . . 1.8 1.8 3.5 1 1 180 1 . . . . . 1.8 1.8 5.0 1 1 181 1 . . . . . 1.8 1.8 5.0 1 1 182 1 . . . . . 1.8 1.8 5.0 1 1 183 1 . . . . . 1.8 1.8 5.0 1 1 184 1 . . . . . 1.8 1.8 5.0 1 1 185 1 . . . . . 1.8 1.8 5.0 1 1 186 1 . . . . . 1.8 1.8 5.0 1 1 187 1 . . . . . 1.8 1.8 5.0 1 1 188 1 . . . . . 1.8 1.8 5.0 1 1 189 1 . . . . . 1.8 1.8 5.0 1 1 190 1 . . . . . 1.8 1.8 5.0 1 1 191 1 . . . . . 1.8 1.8 5.0 1 1 192 1 . . . . . 1.8 1.8 5.0 1 1 193 1 . . . . . 1.8 1.8 5.0 1 1 194 1 . . . . . 1.8 1.8 5.0 1 1 195 1 . . . . . 1.8 1.8 5.0 1 1 196 1 . . . . . 1.8 1.8 5.0 1 1 197 1 . . . . . 1.8 1.8 5.0 1 1 198 1 . . . . . 1.8 1.8 5.0 1 1 199 1 . . . . . 1.8 1.8 5.0 1 1 200 1 . . . . . 1.8 1.8 5.0 1 1 201 1 . . . . . 1.8 1.8 5.0 1 1 202 1 . . . . . 1.8 1.8 5.0 1 1 203 1 . . . . . 1.8 1.8 5.0 1 1 204 1 . . . . . 1.8 1.8 5.0 1 1 205 1 . . . . . 1.8 1.8 5.0 1 1 206 1 . . . . . 1.8 1.8 5.0 1 1 207 1 . . . . . 1.8 1.8 5.0 1 1 208 1 . . . . . 1.8 1.8 5.0 1 1 209 1 . . . . . 1.8 1.8 5.0 1 1 210 1 . . . . . 1.8 1.8 5.0 1 1 211 1 . . . . . 1.8 1.8 5.0 1 1 212 1 . . . . . 1.8 1.8 5.0 1 1 213 1 . . . . . 1.8 1.8 5.0 1 1 214 1 . . . . . 1.8 1.8 5.0 1 1 215 1 . . . . . 1.8 1.8 5.0 1 1 216 1 . . . . . 1.8 1.8 5.0 1 1 217 1 . . . . . 1.8 1.8 5.0 1 1 218 1 . . . . . 1.8 1.8 5.0 1 1 219 1 . . . . . 1.8 1.8 5.0 1 1 220 1 . . . . . 1.8 1.8 5.0 1 1 221 1 . . . . . 1.8 1.8 5.0 1 1 222 1 . . . . . 1.8 1.8 5.0 1 1 223 1 . . . . . 1.8 1.8 5.0 1 1 224 1 . . . . . 1.8 1.8 5.0 1 1 225 1 . . . . . 1.8 1.8 5.0 1 1 226 1 . . . . . 1.8 1.8 5.0 1 1 227 1 . . . . . 1.8 1.8 5.0 1 1 228 1 . . . . . 1.8 1.8 3.5 1 1 229 1 . . . . . 1.8 1.8 5.0 1 1 230 1 . . . . . 1.8 1.8 5.0 1 1 231 1 . . . . . 1.8 1.8 5.0 1 1 232 1 . . . . . 1.8 1.8 5.0 1 1 233 1 . . . . . 1.8 1.8 3.5 1 1 234 1 . . . . . 1.8 1.8 5.0 1 1 235 1 . . . . . 1.8 1.8 5.0 1 1 236 1 . . . . . 1.8 1.8 5.0 1 1 237 1 . . . . . 1.8 1.8 3.5 1 1 238 1 . . . . . 1.8 1.8 5.0 1 1 239 1 . . . . . 1.8 1.8 5.0 1 1 240 1 . . . . . 1.8 1.8 5.0 1 1 241 1 . . . . . 1.8 1.8 5.0 1 1 242 1 . . . . . 1.8 1.8 5.0 1 1 243 1 . . . . . 1.8 1.8 3.5 1 1 244 1 . . . . . 1.8 1.8 5.0 1 1 245 1 . . . . . 1.8 1.8 5.0 1 1 246 1 . . . . . 1.8 1.8 5.0 1 1 247 1 . . . . . 1.8 1.8 5.0 1 1 248 1 . . . . . 1.8 1.8 5.0 1 1 249 1 . . . . . 1.8 1.8 5.0 1 1 250 1 . . . . . 1.8 1.8 3.5 1 1 251 1 . . . . . 1.8 1.8 5.0 1 1 252 1 . . . . . 1.8 1.8 5.0 1 1 253 1 . . . . . 1.8 1.8 5.0 1 1 254 1 . . . . . 1.8 1.8 5.0 1 1 255 1 . . . . . 1.8 1.8 5.0 1 1 256 1 . . . . . 1.8 1.8 3.5 1 1 257 1 . . . . . 1.8 1.8 5.0 1 1 258 1 . . . . . 1.8 1.8 5.0 1 1 259 1 . . . . . 1.8 1.8 5.0 1 1 260 1 . . . . . 1.8 1.8 5.0 1 1 261 1 . . . . . 1.8 1.8 5.0 1 1 262 1 . . . . . 1.8 1.8 5.0 1 1 263 1 . . . . . 1.8 1.8 5.0 1 1 264 1 . . . . . 1.8 1.8 5.0 1 1 265 1 . . . . . 1.8 1.8 5.0 1 1 266 1 . . . . . 1.8 1.8 5.0 1 1 267 1 . . . . . 1.8 1.8 5.0 1 1 268 1 . . . . . 1.8 1.8 5.0 1 1 269 1 . . . . . 1.8 1.8 5.0 1 1 270 1 . . . . . 1.8 1.8 3.5 1 1 271 1 . . . . . 1.8 1.8 5.0 1 1 272 1 . . . . . 1.8 1.8 5.0 1 1 273 1 . . . . . 1.8 1.8 5.0 1 1 274 1 . . . . . 1.8 1.8 5.0 1 1 275 1 . . . . . 1.8 1.8 5.0 1 1 276 1 . . . . . 1.8 1.8 5.0 1 1 277 1 . . . . . 1.8 1.8 5.0 1 1 278 1 . . . . . 1.8 1.8 5.0 1 1 279 1 . . . . . 1.8 1.8 5.0 1 1 280 1 . . . . . 1.8 1.8 5.0 1 1 281 1 . . . . . 1.8 1.8 3.5 1 1 282 1 . . . . . 1.8 1.8 3.5 1 1 283 1 . . . . . 1.8 1.8 5.0 1 1 284 1 . . . . . 1.8 1.8 5.0 1 1 285 1 . . . . . 1.8 1.8 5.0 1 1 286 1 . . . . . 1.8 1.8 5.0 1 1 287 1 . . . . . 1.8 1.8 5.0 1 1 288 1 . . . . . 1.8 1.8 5.0 1 1 289 1 . . . . . 1.8 1.8 5.0 1 1 290 1 . . . . . 1.8 1.8 5.0 1 1 291 1 . . . . . 1.8 1.8 5.0 1 1 292 1 . . . . . 1.8 1.8 5.0 1 1 293 1 . . . . . 1.8 1.8 5.0 1 1 294 1 . . . . . 1.8 1.8 5.0 1 1 295 1 . . . . . 1.8 1.8 3.5 1 1 296 1 . . . . . 1.8 1.8 5.0 1 1 297 1 . . . . . 1.8 1.8 5.0 1 1 298 1 . . . . . 1.8 1.8 5.0 1 1 299 1 . . . . . 1.8 1.8 5.0 1 1 300 1 . . . . . 1.8 1.8 5.0 1 1 301 1 . . . . . 1.8 1.8 5.0 1 1 302 1 . . . . . 1.8 1.8 5.0 1 1 303 1 . . . . . 1.8 1.8 5.0 1 1 304 1 . . . . . 1.8 1.8 5.0 1 1 305 1 . . . . . 1.8 1.8 3.5 1 1 306 1 . . . . . 1.8 1.8 5.0 1 1 307 1 . . . . . 1.8 1.8 5.0 1 1 308 1 . . . . . 1.8 1.8 5.0 1 1 309 1 . . . . . 1.8 1.8 5.0 1 1 310 1 . . . . . 1.8 1.8 5.0 1 1 311 1 . . . . . 1.8 1.8 5.0 1 1 312 1 . . . . . 1.8 1.8 5.0 1 1 313 1 . . . . . 1.8 1.8 3.5 1 1 314 1 . . . . . 1.8 1.8 3.5 1 1 315 1 . . . . . 1.8 1.8 5.0 1 1 316 1 . . . . . 1.8 1.8 5.0 1 1 317 1 . . . . . 1.8 1.8 3.5 1 1 318 1 . . . . . 1.8 1.8 5.0 1 1 319 1 . . . . . 1.8 1.8 5.0 1 1 320 1 . . . . . 1.8 1.8 3.5 1 1 321 1 . . . . . 1.8 1.8 5.0 1 1 322 1 . . . . . 1.8 1.8 5.0 1 1 323 1 . . . . . 1.8 1.8 3.5 1 1 324 1 . . . . . 1.8 1.8 3.5 1 1 325 1 . . . . . 1.8 1.8 3.5 1 1 326 1 . . . . . 1.8 1.8 5.0 1 1 327 1 . . . . . 1.8 1.8 5.0 1 1 328 1 . . . . . 1.8 1.8 3.5 1 1 329 1 . . . . . 1.8 1.8 5.0 1 1 330 1 . . . . . 1.8 1.8 5.0 1 1 331 1 . . . . . 1.8 1.8 5.0 1 1 332 1 . . . . . 1.8 1.8 3.5 1 1 333 1 . . . . . 1.8 1.8 5.0 1 1 334 1 . . . . . 1.8 1.8 5.0 1 1 335 1 . . . . . 1.8 1.8 5.0 1 1 336 1 . . . . . 1.8 1.8 5.0 1 1 337 1 . . . . . 1.8 1.8 5.0 1 1 338 1 . . . . . 1.8 1.8 5.0 1 1 339 1 . . . . . 1.8 1.8 5.0 1 1 340 1 . . . . . 1.8 1.8 5.0 1 1 341 1 . . . . . 1.8 1.8 5.0 1 1 342 1 . . . . . 1.8 1.8 5.0 1 1 343 1 . . . . . 1.8 1.8 3.5 1 1 344 1 . . . . . 1.8 1.8 5.0 1 1 345 1 . . . . . 1.8 1.8 3.5 1 1 346 1 . . . . . 1.8 1.8 5.0 1 1 347 1 . . . . . 1.8 1.8 5.0 1 1 348 1 . . . . . 1.8 1.8 5.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLU C C 4.728 3.140 6.593 1.00 . A A . 1 GLU C 1 1 1 2 1 1 1 GLU CA C 6.026 3.857 6.971 1.00 . A A . 1 GLU CA 1 1 1 3 1 1 1 GLU CB C 5.756 4.939 8.020 1.00 . A A . 1 GLU CB 1 1 1 4 1 1 1 GLU CD C 5.755 5.122 10.512 1.00 . A A . 1 GLU CD 1 1 1 5 1 1 1 GLU CG C 6.539 4.625 9.296 1.00 . A A . 1 GLU CG 1 1 1 6 1 1 1 GLU H1 H 6.957 3.911 5.107 1.00 . A A . 1 GLU H1 1 1 1 7 1 1 1 GLU H2 H 7.330 5.234 6.105 1.00 . A A . 1 GLU H2 1 1 1 8 1 1 1 GLU H3 H 5.813 5.141 5.344 1.00 . A A . 1 GLU H3 1 1 1 9 1 1 1 GLU HA H 6.752 3.154 7.347 1.00 . A A . 1 GLU HA 1 1 1 10 1 1 1 GLU HB2 H 6.066 5.899 7.632 1.00 . A A . 1 GLU HB2 1 1 1 11 1 1 1 GLU HB3 H 4.701 4.965 8.244 1.00 . A A . 1 GLU HB3 1 1 1 12 1 1 1 GLU HG2 H 6.688 3.558 9.374 1.00 . A A . 1 GLU HG2 1 1 1 13 1 1 1 GLU HG3 H 7.497 5.121 9.261 1.00 . A A . 1 GLU HG3 1 1 1 14 1 1 1 GLU N N 6.573 4.592 5.792 1.00 . A A . 1 GLU N 1 1 1 15 1 1 1 GLU O O 3.646 3.668 6.758 1.00 . A A . 1 GLU O 1 1 1 16 1 1 1 GLU OE1 O 4.557 4.895 10.554 1.00 . A A . 1 GLU OE1 1 1 1 17 1 1 1 GLU OE2 O 6.366 5.721 11.382 1.00 . A A . 1 GLU OE2 1 1 1 18 1 1 2 VAL C C 3.116 0.325 6.868 1.00 . A A . 2 VAL C 1 1 1 19 1 1 2 VAL CA C 3.593 1.193 5.700 1.00 . A A . 2 VAL CA 1 1 1 20 1 1 2 VAL CB C 4.014 0.325 4.508 1.00 . A A . 2 VAL CB 1 1 1 21 1 1 2 VAL CG1 C 3.076 -0.879 4.378 1.00 . A A . 2 VAL CG1 1 1 1 22 1 1 2 VAL CG2 C 3.940 1.155 3.226 1.00 . A A . 2 VAL CG2 1 1 1 23 1 1 2 VAL H H 5.707 1.531 5.961 1.00 . A A . 2 VAL H 1 1 1 24 1 1 2 VAL HA H 2.817 1.879 5.399 1.00 . A A . 2 VAL HA 1 1 1 25 1 1 2 VAL HB H 5.026 -0.022 4.656 1.00 . A A . 2 VAL HB 1 1 1 26 1 1 2 VAL HG11 H 3.086 -1.443 5.299 1.00 . A A . 2 VAL HG11 1 1 1 27 1 1 2 VAL HG12 H 3.408 -1.508 3.566 1.00 . A A . 2 VAL HG12 1 1 1 28 1 1 2 VAL HG13 H 2.072 -0.533 4.179 1.00 . A A . 2 VAL HG13 1 1 1 29 1 1 2 VAL HG21 H 4.888 1.643 3.057 1.00 . A A . 2 VAL HG21 1 1 1 30 1 1 2 VAL HG22 H 3.163 1.899 3.323 1.00 . A A . 2 VAL HG22 1 1 1 31 1 1 2 VAL HG23 H 3.715 0.507 2.391 1.00 . A A . 2 VAL HG23 1 1 1 32 1 1 2 VAL N N 4.825 1.941 6.086 1.00 . A A . 2 VAL N 1 1 1 33 1 1 2 VAL O O 3.759 -0.633 7.247 1.00 . A A . 2 VAL O 1 1 1 34 1 1 3 THR C C 0.362 -1.102 8.064 1.00 . A A . 3 THR C 1 1 1 35 1 1 3 THR CA C 1.460 -0.161 8.567 1.00 . A A . 3 THR CA 1 1 1 36 1 1 3 THR CB C 0.884 0.859 9.552 1.00 . A A . 3 THR CB 1 1 1 37 1 1 3 THR CG2 C -0.210 1.675 8.862 1.00 . A A . 3 THR CG2 1 1 1 38 1 1 3 THR H H 1.479 1.421 7.107 1.00 . A A . 3 THR H 1 1 1 39 1 1 3 THR HA H 2.254 -0.720 9.035 1.00 . A A . 3 THR HA 1 1 1 40 1 1 3 THR HB H 1.669 1.522 9.882 1.00 . A A . 3 THR HB 1 1 1 41 1 1 3 THR HG1 H 0.972 -0.485 10.955 1.00 . A A . 3 THR HG1 1 1 1 42 1 1 3 THR HG21 H -0.796 1.029 8.225 1.00 . A A . 3 THR HG21 1 1 1 43 1 1 3 THR HG22 H 0.244 2.452 8.264 1.00 . A A . 3 THR HG22 1 1 1 44 1 1 3 THR HG23 H -0.849 2.123 9.608 1.00 . A A . 3 THR HG23 1 1 1 45 1 1 3 THR N N 1.986 0.648 7.433 1.00 . A A . 3 THR N 1 1 1 46 1 1 3 THR O O -0.515 -1.503 8.801 1.00 . A A . 3 THR O 1 1 1 47 1 1 3 THR OG1 O 0.337 0.176 10.671 1.00 . A A . 3 THR OG1 1 1 1 48 1 1 4 CYS C C -0.261 -3.818 6.512 1.00 . A A . 4 CYS C 1 1 1 49 1 1 4 CYS CA C -0.631 -2.357 6.242 1.00 . A A . 4 CYS CA 1 1 1 50 1 1 4 CYS CB C -0.638 -2.043 4.737 1.00 . A A . 4 CYS CB 1 1 1 51 1 1 4 CYS H H 1.124 -1.108 6.231 1.00 . A A . 4 CYS H 1 1 1 52 1 1 4 CYS HA H -1.597 -2.131 6.667 1.00 . A A . 4 CYS HA 1 1 1 53 1 1 4 CYS HB2 H -1.297 -1.210 4.558 1.00 . A A . 4 CYS HB2 1 1 1 54 1 1 4 CYS HB3 H 0.364 -1.783 4.422 1.00 . A A . 4 CYS HB3 1 1 1 55 1 1 4 CYS N N 0.407 -1.449 6.807 1.00 . A A . 4 CYS N 1 1 1 56 1 1 4 CYS O O 0.846 -4.132 6.902 1.00 . A A . 4 CYS O 1 1 1 57 1 1 4 CYS SG S -1.222 -3.467 3.773 1.00 . A A . 4 CYS SG 1 1 1 58 1 1 5 GLU C C -0.454 -6.810 5.222 1.00 . A A . 5 GLU C 1 1 1 59 1 1 5 GLU CA C -0.906 -6.153 6.530 1.00 . A A . 5 GLU CA 1 1 1 60 1 1 5 GLU CB C -2.236 -6.745 6.999 1.00 . A A . 5 GLU CB 1 1 1 61 1 1 5 GLU CD C -1.288 -7.517 9.178 1.00 . A A . 5 GLU CD 1 1 1 62 1 1 5 GLU CG C -1.972 -7.964 7.884 1.00 . A A . 5 GLU CG 1 1 1 63 1 1 5 GLU H H -2.068 -4.423 5.977 1.00 . A A . 5 GLU H 1 1 1 64 1 1 5 GLU HA H -0.156 -6.275 7.295 1.00 . A A . 5 GLU HA 1 1 1 65 1 1 5 GLU HB2 H -2.781 -6.000 7.564 1.00 . A A . 5 GLU HB2 1 1 1 66 1 1 5 GLU HB3 H -2.820 -7.044 6.142 1.00 . A A . 5 GLU HB3 1 1 1 67 1 1 5 GLU HG2 H -2.908 -8.448 8.118 1.00 . A A . 5 GLU HG2 1 1 1 68 1 1 5 GLU HG3 H -1.329 -8.656 7.360 1.00 . A A . 5 GLU HG3 1 1 1 69 1 1 5 GLU N N -1.187 -4.707 6.299 1.00 . A A . 5 GLU N 1 1 1 70 1 1 5 GLU O O -1.054 -6.603 4.186 1.00 . A A . 5 GLU O 1 1 1 71 1 1 5 GLU OE1 O -1.980 -7.005 10.043 1.00 . A A . 5 GLU OE1 1 1 1 72 1 1 5 GLU OE2 O -0.086 -7.694 9.281 1.00 . A A . 5 GLU OE2 1 1 1 73 1 1 6 PRO C C 0.210 -9.387 3.666 1.00 . A A . 6 PRO C 1 1 1 74 1 1 6 PRO CA C 1.146 -8.263 4.120 1.00 . A A . 6 PRO CA 1 1 1 75 1 1 6 PRO CB C 2.479 -8.823 4.610 1.00 . A A . 6 PRO CB 1 1 1 76 1 1 6 PRO CD C 1.367 -7.875 6.527 1.00 . A A . 6 PRO CD 1 1 1 77 1 1 6 PRO CG C 2.321 -8.957 6.090 1.00 . A A . 6 PRO CG 1 1 1 78 1 1 6 PRO HA H 1.313 -7.561 3.321 1.00 . A A . 6 PRO HA 1 1 1 79 1 1 6 PRO HB2 H 2.667 -9.788 4.161 1.00 . A A . 6 PRO HB2 1 1 1 80 1 1 6 PRO HB3 H 3.281 -8.138 4.384 1.00 . A A . 6 PRO HB3 1 1 1 81 1 1 6 PRO HD2 H 0.718 -8.239 7.313 1.00 . A A . 6 PRO HD2 1 1 1 82 1 1 6 PRO HD3 H 1.907 -6.999 6.852 1.00 . A A . 6 PRO HD3 1 1 1 83 1 1 6 PRO HG2 H 1.915 -9.930 6.331 1.00 . A A . 6 PRO HG2 1 1 1 84 1 1 6 PRO HG3 H 3.274 -8.819 6.578 1.00 . A A . 6 PRO HG3 1 1 1 85 1 1 6 PRO N N 0.598 -7.575 5.315 1.00 . A A . 6 PRO N 1 1 1 86 1 1 6 PRO O O -0.061 -10.320 4.398 1.00 . A A . 6 PRO O 1 1 1 87 1 1 7 GLY C C -2.431 -9.707 1.318 1.00 . A A . 7 GLY C 1 1 1 88 1 1 7 GLY CA C -1.203 -10.359 1.955 1.00 . A A . 7 GLY CA 1 1 1 89 1 1 7 GLY H H -0.053 -8.541 1.890 1.00 . A A . 7 GLY H 1 1 1 90 1 1 7 GLY HA2 H -0.687 -10.958 1.216 1.00 . A A . 7 GLY HA2 1 1 1 91 1 1 7 GLY HA3 H -1.518 -10.988 2.775 1.00 . A A . 7 GLY HA3 1 1 1 92 1 1 7 GLY N N -0.285 -9.302 2.463 1.00 . A A . 7 GLY N 1 1 1 93 1 1 7 GLY O O -3.538 -10.190 1.449 1.00 . A A . 7 GLY O 1 1 1 94 1 1 8 THR C C -2.961 -6.738 -0.841 1.00 . A A . 8 THR C 1 1 1 95 1 1 8 THR CA C -3.414 -7.941 -0.016 1.00 . A A . 8 THR CA 1 1 1 96 1 1 8 THR CB C -4.299 -7.470 1.141 1.00 . A A . 8 THR CB 1 1 1 97 1 1 8 THR CG2 C -3.429 -6.874 2.250 1.00 . A A . 8 THR CG2 1 1 1 98 1 1 8 THR H H -1.349 -8.238 0.531 1.00 . A A . 8 THR H 1 1 1 99 1 1 8 THR HA H -3.959 -8.638 -0.632 1.00 . A A . 8 THR HA 1 1 1 100 1 1 8 THR HB H -4.855 -8.301 1.532 1.00 . A A . 8 THR HB 1 1 1 101 1 1 8 THR HG1 H -5.873 -6.921 0.137 1.00 . A A . 8 THR HG1 1 1 1 102 1 1 8 THR HG21 H -3.357 -7.577 3.067 1.00 . A A . 8 THR HG21 1 1 1 103 1 1 8 THR HG22 H -3.875 -5.956 2.604 1.00 . A A . 8 THR HG22 1 1 1 104 1 1 8 THR HG23 H -2.442 -6.668 1.863 1.00 . A A . 8 THR HG23 1 1 1 105 1 1 8 THR N N -2.249 -8.615 0.626 1.00 . A A . 8 THR N 1 1 1 106 1 1 8 THR O O -1.798 -6.387 -0.874 1.00 . A A . 8 THR O 1 1 1 107 1 1 8 THR OG1 O -5.203 -6.482 0.666 1.00 . A A . 8 THR OG1 1 1 1 108 1 1 9 THR C C -4.614 -3.826 -2.079 1.00 . A A . 9 THR C 1 1 1 109 1 1 9 THR CA C -3.549 -4.898 -2.311 1.00 . A A . 9 THR CA 1 1 1 110 1 1 9 THR CB C -3.565 -5.380 -3.763 1.00 . A A . 9 THR CB 1 1 1 111 1 1 9 THR CG2 C -4.954 -5.919 -4.109 1.00 . A A . 9 THR CG2 1 1 1 112 1 1 9 THR H H -4.818 -6.396 -1.435 1.00 . A A . 9 THR H 1 1 1 113 1 1 9 THR HA H -2.571 -4.524 -2.052 1.00 . A A . 9 THR HA 1 1 1 114 1 1 9 THR HB H -2.837 -6.167 -3.888 1.00 . A A . 9 THR HB 1 1 1 115 1 1 9 THR HG1 H -4.067 -3.876 -4.888 1.00 . A A . 9 THR HG1 1 1 1 116 1 1 9 THR HG21 H -4.889 -6.978 -4.315 1.00 . A A . 9 THR HG21 1 1 1 117 1 1 9 THR HG22 H -5.331 -5.406 -4.982 1.00 . A A . 9 THR HG22 1 1 1 118 1 1 9 THR HG23 H -5.622 -5.753 -3.277 1.00 . A A . 9 THR HG23 1 1 1 119 1 1 9 THR N N -3.887 -6.096 -1.494 1.00 . A A . 9 THR N 1 1 1 120 1 1 9 THR O O -5.770 -4.132 -1.866 1.00 . A A . 9 THR O 1 1 1 121 1 1 9 THR OG1 O -3.246 -4.296 -4.624 1.00 . A A . 9 THR OG1 1 1 1 122 1 1 10 PHE C C -4.840 -0.199 -2.517 1.00 . A A . 10 PHE C 1 1 1 123 1 1 10 PHE CA C -5.264 -1.515 -1.862 1.00 . A A . 10 PHE CA 1 1 1 124 1 1 10 PHE CB C -5.330 -1.370 -0.340 1.00 . A A . 10 PHE CB 1 1 1 125 1 1 10 PHE CD1 C -3.124 -2.417 0.314 1.00 . A A . 10 PHE CD1 1 1 1 126 1 1 10 PHE CD2 C -3.444 -0.040 0.672 1.00 . A A . 10 PHE CD2 1 1 1 127 1 1 10 PHE CE1 C -1.829 -2.321 0.842 1.00 . A A . 10 PHE CE1 1 1 1 128 1 1 10 PHE CE2 C -2.151 0.056 1.200 1.00 . A A . 10 PHE CE2 1 1 1 129 1 1 10 PHE CG C -3.931 -1.275 0.229 1.00 . A A . 10 PHE CG 1 1 1 130 1 1 10 PHE CZ C -1.343 -1.085 1.284 1.00 . A A . 10 PHE CZ 1 1 1 131 1 1 10 PHE H H -3.309 -2.338 -2.267 1.00 . A A . 10 PHE H 1 1 1 132 1 1 10 PHE HA H -6.224 -1.827 -2.240 1.00 . A A . 10 PHE HA 1 1 1 133 1 1 10 PHE HB2 H -5.881 -0.476 -0.088 1.00 . A A . 10 PHE HB2 1 1 1 134 1 1 10 PHE HB3 H -5.829 -2.231 0.081 1.00 . A A . 10 PHE HB3 1 1 1 135 1 1 10 PHE HD1 H -3.499 -3.372 -0.026 1.00 . A A . 10 PHE HD1 1 1 1 136 1 1 10 PHE HD2 H -4.066 0.838 0.608 1.00 . A A . 10 PHE HD2 1 1 1 137 1 1 10 PHE HE1 H -1.207 -3.201 0.908 1.00 . A A . 10 PHE HE1 1 1 1 138 1 1 10 PHE HE2 H -1.776 1.009 1.542 1.00 . A A . 10 PHE HE2 1 1 1 139 1 1 10 PHE HZ H -0.343 -1.009 1.692 1.00 . A A . 10 PHE HZ 1 1 1 140 1 1 10 PHE N N -4.247 -2.577 -2.102 1.00 . A A . 10 PHE N 1 1 1 141 1 1 10 PHE O O -3.668 0.093 -2.651 1.00 . A A . 10 PHE O 1 1 1 142 1 1 11 LYS C C -5.128 2.950 -2.522 1.00 . A A . 11 LYS C 1 1 1 143 1 1 11 LYS CA C -5.457 1.892 -3.579 1.00 . A A . 11 LYS CA 1 1 1 144 1 1 11 LYS CB C -6.721 2.280 -4.347 1.00 . A A . 11 LYS CB 1 1 1 145 1 1 11 LYS CD C -7.212 3.309 -6.570 1.00 . A A . 11 LYS CD 1 1 1 146 1 1 11 LYS CE C -6.810 4.416 -7.547 1.00 . A A . 11 LYS CE 1 1 1 147 1 1 11 LYS CG C -6.418 3.461 -5.271 1.00 . A A . 11 LYS CG 1 1 1 148 1 1 11 LYS H H -6.729 0.333 -2.810 1.00 . A A . 11 LYS H 1 1 1 149 1 1 11 LYS HA H -4.633 1.771 -4.263 1.00 . A A . 11 LYS HA 1 1 1 150 1 1 11 LYS HB2 H -7.056 1.438 -4.936 1.00 . A A . 11 LYS HB2 1 1 1 151 1 1 11 LYS HB3 H -7.494 2.562 -3.650 1.00 . A A . 11 LYS HB3 1 1 1 152 1 1 11 LYS HD2 H -7.002 2.346 -7.010 1.00 . A A . 11 LYS HD2 1 1 1 153 1 1 11 LYS HD3 H -8.267 3.386 -6.357 1.00 . A A . 11 LYS HD3 1 1 1 154 1 1 11 LYS HE2 H -5.779 4.294 -7.848 1.00 . A A . 11 LYS HE2 1 1 1 155 1 1 11 LYS HE3 H -7.459 4.412 -8.409 1.00 . A A . 11 LYS HE3 1 1 1 156 1 1 11 LYS HG2 H -6.698 4.382 -4.781 1.00 . A A . 11 LYS HG2 1 1 1 157 1 1 11 LYS HG3 H -5.362 3.480 -5.497 1.00 . A A . 11 LYS HG3 1 1 1 158 1 1 11 LYS HZ1 H -7.941 5.718 -6.380 1.00 . A A . 11 LYS HZ1 1 1 1 159 1 1 11 LYS HZ2 H -6.847 6.493 -7.423 1.00 . A A . 11 LYS HZ2 1 1 1 160 1 1 11 LYS HZ3 H -6.284 5.725 -6.016 1.00 . A A . 11 LYS HZ3 1 1 1 161 1 1 11 LYS N N -5.791 0.594 -2.927 1.00 . A A . 11 LYS N 1 1 1 162 1 1 11 LYS NZ N -6.984 5.684 -6.784 1.00 . A A . 11 LYS NZ 1 1 1 163 1 1 11 LYS O O -5.976 3.720 -2.116 1.00 . A A . 11 LYS O 1 1 1 164 1 1 12 ASP C C -2.720 5.134 -1.715 1.00 . A A . 12 ASP C 1 1 1 165 1 1 12 ASP CA C -3.518 4.009 -1.056 1.00 . A A . 12 ASP CA 1 1 1 166 1 1 12 ASP CB C -2.646 3.251 -0.056 1.00 . A A . 12 ASP CB 1 1 1 167 1 1 12 ASP CG C -2.794 3.882 1.330 1.00 . A A . 12 ASP CG 1 1 1 168 1 1 12 ASP H H -3.231 2.372 -2.423 1.00 . A A . 12 ASP H 1 1 1 169 1 1 12 ASP HA H -4.393 4.402 -0.563 1.00 . A A . 12 ASP HA 1 1 1 170 1 1 12 ASP HB2 H -2.960 2.216 -0.017 1.00 . A A . 12 ASP HB2 1 1 1 171 1 1 12 ASP HB3 H -1.612 3.306 -0.366 1.00 . A A . 12 ASP HB3 1 1 1 172 1 1 12 ASP N N -3.901 2.997 -2.080 1.00 . A A . 12 ASP N 1 1 1 173 1 1 12 ASP O O -2.391 5.070 -2.883 1.00 . A A . 12 ASP O 1 1 1 174 1 1 12 ASP OD1 O -2.227 4.942 1.540 1.00 . A A . 12 ASP OD1 1 1 1 175 1 1 12 ASP OD2 O -3.473 3.296 2.156 1.00 . A A . 12 ASP OD2 1 1 1 176 1 1 13 LYS C C -2.226 7.643 -2.943 1.00 . A A . 13 LYS C 1 1 1 177 1 1 13 LYS CA C -1.625 7.280 -1.581 1.00 . A A . 13 LYS CA 1 1 1 178 1 1 13 LYS CB C -0.202 6.735 -1.748 1.00 . A A . 13 LYS CB 1 1 1 179 1 1 13 LYS CD C 1.340 6.687 0.223 1.00 . A A . 13 LYS CD 1 1 1 180 1 1 13 LYS CE C 2.091 5.715 1.136 1.00 . A A . 13 LYS CE 1 1 1 181 1 1 13 LYS CG C 0.215 5.944 -0.501 1.00 . A A . 13 LYS CG 1 1 1 182 1 1 13 LYS H H -2.674 6.200 -0.040 1.00 . A A . 13 LYS H 1 1 1 183 1 1 13 LYS HA H -1.622 8.136 -0.925 1.00 . A A . 13 LYS HA 1 1 1 184 1 1 13 LYS HB2 H -0.168 6.084 -2.611 1.00 . A A . 13 LYS HB2 1 1 1 185 1 1 13 LYS HB3 H 0.482 7.559 -1.893 1.00 . A A . 13 LYS HB3 1 1 1 186 1 1 13 LYS HD2 H 2.024 7.100 -0.504 1.00 . A A . 13 LYS HD2 1 1 1 187 1 1 13 LYS HD3 H 0.920 7.485 0.818 1.00 . A A . 13 LYS HD3 1 1 1 188 1 1 13 LYS HE2 H 1.427 4.929 1.473 1.00 . A A . 13 LYS HE2 1 1 1 189 1 1 13 LYS HE3 H 2.942 5.297 0.622 1.00 . A A . 13 LYS HE3 1 1 1 190 1 1 13 LYS HG2 H -0.629 5.834 0.162 1.00 . A A . 13 LYS HG2 1 1 1 191 1 1 13 LYS HG3 H 0.567 4.968 -0.797 1.00 . A A . 13 LYS HG3 1 1 1 192 1 1 13 LYS HZ1 H 2.831 7.482 1.949 1.00 . A A . 13 LYS HZ1 1 1 1 193 1 1 13 LYS HZ2 H 3.357 6.078 2.749 1.00 . A A . 13 LYS HZ2 1 1 1 194 1 1 13 LYS HZ3 H 1.770 6.642 2.972 1.00 . A A . 13 LYS HZ3 1 1 1 195 1 1 13 LYS N N -2.404 6.162 -0.981 1.00 . A A . 13 LYS N 1 1 1 196 1 1 13 LYS NZ N 2.547 6.542 2.288 1.00 . A A . 13 LYS NZ 1 1 1 197 1 1 13 LYS O O -3.429 7.732 -3.095 1.00 . A A . 13 LYS O 1 1 1 198 1 1 14 CYS C C -1.688 7.027 -6.255 1.00 . A A . 14 CYS C 1 1 1 199 1 1 14 CYS CA C -1.943 8.186 -5.287 1.00 . A A . 14 CYS CA 1 1 1 200 1 1 14 CYS CB C -1.179 9.441 -5.709 1.00 . A A . 14 CYS CB 1 1 1 201 1 1 14 CYS H H -0.440 7.761 -3.805 1.00 . A A . 14 CYS H 1 1 1 202 1 1 14 CYS HA H -2.998 8.400 -5.227 1.00 . A A . 14 CYS HA 1 1 1 203 1 1 14 CYS HB2 H -0.136 9.336 -5.446 1.00 . A A . 14 CYS HB2 1 1 1 204 1 1 14 CYS HB3 H -1.270 9.583 -6.774 1.00 . A A . 14 CYS HB3 1 1 1 205 1 1 14 CYS N N -1.406 7.843 -3.940 1.00 . A A . 14 CYS N 1 1 1 206 1 1 14 CYS O O -1.629 7.205 -7.457 1.00 . A A . 14 CYS O 1 1 1 207 1 1 14 CYS SG S -1.876 10.872 -4.849 1.00 . A A . 14 CYS SG 1 1 1 208 1 1 15 ASN C C -1.549 3.368 -5.804 1.00 . A A . 15 ASN C 1 1 1 209 1 1 15 ASN CA C -1.300 4.650 -6.602 1.00 . A A . 15 ASN CA 1 1 1 210 1 1 15 ASN CB C 0.171 4.744 -7.011 1.00 . A A . 15 ASN CB 1 1 1 211 1 1 15 ASN CG C 1.040 4.845 -5.758 1.00 . A A . 15 ASN CG 1 1 1 212 1 1 15 ASN H H -1.600 5.725 -4.760 1.00 . A A . 15 ASN H 1 1 1 213 1 1 15 ASN HA H -1.932 4.684 -7.476 1.00 . A A . 15 ASN HA 1 1 1 214 1 1 15 ASN HB2 H 0.445 3.858 -7.571 1.00 . A A . 15 ASN HB2 1 1 1 215 1 1 15 ASN HB3 H 0.323 5.620 -7.626 1.00 . A A . 15 ASN HB3 1 1 1 216 1 1 15 ASN HD21 H 1.339 6.800 -5.952 1.00 . A A . 15 ASN HD21 1 1 1 217 1 1 15 ASN HD22 H 2.094 6.075 -4.606 1.00 . A A . 15 ASN HD22 1 1 1 218 1 1 15 ASN N N -1.544 5.839 -5.733 1.00 . A A . 15 ASN N 1 1 1 219 1 1 15 ASN ND2 N 1.530 6.003 -5.409 1.00 . A A . 15 ASN ND2 1 1 1 220 1 1 15 ASN O O -1.424 3.346 -4.595 1.00 . A A . 15 ASN O 1 1 1 221 1 1 15 ASN OD1 O 1.276 3.859 -5.088 1.00 . A A . 15 ASN OD1 1 1 1 222 1 1 16 THR C C -0.967 0.699 -4.818 1.00 . A A . 16 THR C 1 1 1 223 1 1 16 THR CA C -2.151 1.022 -5.733 1.00 . A A . 16 THR CA 1 1 1 224 1 1 16 THR CB C -2.286 -0.050 -6.817 1.00 . A A . 16 THR CB 1 1 1 225 1 1 16 THR CG2 C -3.636 -0.749 -6.680 1.00 . A A . 16 THR CG2 1 1 1 226 1 1 16 THR H H -1.993 2.333 -7.439 1.00 . A A . 16 THR H 1 1 1 227 1 1 16 THR HA H -3.063 1.087 -5.162 1.00 . A A . 16 THR HA 1 1 1 228 1 1 16 THR HB H -1.498 -0.779 -6.699 1.00 . A A . 16 THR HB 1 1 1 229 1 1 16 THR HG1 H -1.698 -0.045 -8.671 1.00 . A A . 16 THR HG1 1 1 1 230 1 1 16 THR HG21 H -4.002 -1.021 -7.659 1.00 . A A . 16 THR HG21 1 1 1 231 1 1 16 THR HG22 H -4.340 -0.081 -6.205 1.00 . A A . 16 THR HG22 1 1 1 232 1 1 16 THR HG23 H -3.521 -1.638 -6.078 1.00 . A A . 16 THR HG23 1 1 1 233 1 1 16 THR N N -1.898 2.298 -6.465 1.00 . A A . 16 THR N 1 1 1 234 1 1 16 THR O O 0.008 1.420 -4.779 1.00 . A A . 16 THR O 1 1 1 235 1 1 16 THR OG1 O -2.188 0.551 -8.101 1.00 . A A . 16 THR OG1 1 1 1 236 1 1 17 CYS C C -0.129 -2.195 -2.668 1.00 . A A . 17 CYS C 1 1 1 237 1 1 17 CYS CA C 0.077 -0.769 -3.186 1.00 . A A . 17 CYS CA 1 1 1 238 1 1 17 CYS CB C 0.030 0.232 -2.026 1.00 . A A . 17 CYS CB 1 1 1 239 1 1 17 CYS H H -1.843 -0.954 -4.148 1.00 . A A . 17 CYS H 1 1 1 240 1 1 17 CYS HA H 1.016 -0.694 -3.703 1.00 . A A . 17 CYS HA 1 1 1 241 1 1 17 CYS HB2 H -0.974 0.620 -1.931 1.00 . A A . 17 CYS HB2 1 1 1 242 1 1 17 CYS HB3 H 0.309 -0.271 -1.109 1.00 . A A . 17 CYS HB3 1 1 1 243 1 1 17 CYS N N -1.045 -0.385 -4.092 1.00 . A A . 17 CYS N 1 1 1 244 1 1 17 CYS O O -0.714 -2.408 -1.625 1.00 . A A . 17 CYS O 1 1 1 245 1 1 17 CYS SG S 1.176 1.607 -2.330 1.00 . A A . 17 CYS SG 1 1 1 246 1 1 18 ARG C C 1.014 -4.835 -1.677 1.00 . A A . 18 ARG C 1 1 1 247 1 1 18 ARG CA C 0.182 -4.586 -2.936 1.00 . A A . 18 ARG CA 1 1 1 248 1 1 18 ARG CB C 0.697 -5.437 -4.099 1.00 . A A . 18 ARG CB 1 1 1 249 1 1 18 ARG CD C -0.334 -7.707 -4.297 1.00 . A A . 18 ARG CD 1 1 1 250 1 1 18 ARG CG C 0.801 -6.901 -3.660 1.00 . A A . 18 ARG CG 1 1 1 251 1 1 18 ARG CZ C -0.480 -7.358 -6.689 1.00 . A A . 18 ARG CZ 1 1 1 252 1 1 18 ARG H H 0.819 -2.980 -4.226 1.00 . A A . 18 ARG H 1 1 1 253 1 1 18 ARG HA H -0.856 -4.804 -2.749 1.00 . A A . 18 ARG HA 1 1 1 254 1 1 18 ARG HB2 H 0.015 -5.358 -4.931 1.00 . A A . 18 ARG HB2 1 1 1 255 1 1 18 ARG HB3 H 1.673 -5.085 -4.398 1.00 . A A . 18 ARG HB3 1 1 1 256 1 1 18 ARG HD2 H -0.472 -8.640 -3.769 1.00 . A A . 18 ARG HD2 1 1 1 257 1 1 18 ARG HD3 H -1.247 -7.134 -4.299 1.00 . A A . 18 ARG HD3 1 1 1 258 1 1 18 ARG HE H 0.851 -8.581 -5.869 1.00 . A A . 18 ARG HE 1 1 1 259 1 1 18 ARG HG2 H 1.752 -7.304 -3.977 1.00 . A A . 18 ARG HG2 1 1 1 260 1 1 18 ARG HG3 H 0.723 -6.964 -2.586 1.00 . A A . 18 ARG HG3 1 1 1 261 1 1 18 ARG HH11 H -2.024 -8.631 -6.741 1.00 . A A . 18 ARG HH11 1 1 1 262 1 1 18 ARG HH12 H -2.067 -7.355 -7.912 1.00 . A A . 18 ARG HH12 1 1 1 263 1 1 18 ARG HH21 H 0.924 -5.942 -6.870 1.00 . A A . 18 ARG HH21 1 1 1 264 1 1 18 ARG HH22 H -0.396 -5.834 -7.986 1.00 . A A . 18 ARG HH22 1 1 1 265 1 1 18 ARG N N 0.349 -3.173 -3.388 1.00 . A A . 18 ARG N 1 1 1 266 1 1 18 ARG NE N 0.112 -7.960 -5.695 1.00 . A A . 18 ARG NE 1 1 1 267 1 1 18 ARG NH1 N -1.612 -7.817 -7.150 1.00 . A A . 18 ARG NH1 1 1 1 268 1 1 18 ARG NH2 N 0.057 -6.295 -7.223 1.00 . A A . 18 ARG NH2 1 1 1 269 1 1 18 ARG O O 2.203 -5.077 -1.744 1.00 . A A . 18 ARG O 1 1 1 270 1 1 19 CYS C C 2.119 -6.182 0.569 1.00 . A A . 19 CYS C 1 1 1 271 1 1 19 CYS CA C 1.149 -5.008 0.736 1.00 . A A . 19 CYS CA 1 1 1 272 1 1 19 CYS CB C 0.076 -5.337 1.774 1.00 . A A . 19 CYS CB 1 1 1 273 1 1 19 CYS H H -0.562 -4.579 -0.500 1.00 . A A . 19 CYS H 1 1 1 274 1 1 19 CYS HA H 1.682 -4.117 1.027 1.00 . A A . 19 CYS HA 1 1 1 275 1 1 19 CYS HB2 H -0.887 -5.005 1.414 1.00 . A A . 19 CYS HB2 1 1 1 276 1 1 19 CYS HB3 H 0.053 -6.404 1.940 1.00 . A A . 19 CYS HB3 1 1 1 277 1 1 19 CYS N N 0.397 -4.776 -0.530 1.00 . A A . 19 CYS N 1 1 1 278 1 1 19 CYS O O 1.717 -7.302 0.321 1.00 . A A . 19 CYS O 1 1 1 279 1 1 19 CYS SG S 0.463 -4.490 3.329 1.00 . A A . 19 CYS SG 1 1 1 280 1 1 20 GLY C C 4.020 -8.196 1.457 1.00 . A A . 20 GLY C 1 1 1 281 1 1 20 GLY CA C 4.391 -7.027 0.542 1.00 . A A . 20 GLY CA 1 1 1 282 1 1 20 GLY H H 3.695 -5.020 0.895 1.00 . A A . 20 GLY H 1 1 1 283 1 1 20 GLY HA2 H 4.399 -7.362 -0.486 1.00 . A A . 20 GLY HA2 1 1 1 284 1 1 20 GLY HA3 H 5.372 -6.661 0.812 1.00 . A A . 20 GLY HA3 1 1 1 285 1 1 20 GLY N N 3.393 -5.931 0.698 1.00 . A A . 20 GLY N 1 1 1 286 1 1 20 GLY O O 2.983 -8.197 2.091 1.00 . A A . 20 GLY O 1 1 1 287 1 1 21 SER C C 5.354 -10.282 3.702 1.00 . A A . 21 SER C 1 1 1 288 1 1 21 SER CA C 4.551 -10.365 2.402 1.00 . A A . 21 SER CA 1 1 1 289 1 1 21 SER CB C 4.973 -11.587 1.588 1.00 . A A . 21 SER CB 1 1 1 290 1 1 21 SER H H 5.689 -9.176 1.008 1.00 . A A . 21 SER H 1 1 1 291 1 1 21 SER HA H 3.494 -10.409 2.611 1.00 . A A . 21 SER HA 1 1 1 292 1 1 21 SER HB2 H 5.171 -12.412 2.251 1.00 . A A . 21 SER HB2 1 1 1 293 1 1 21 SER HB3 H 4.176 -11.858 0.907 1.00 . A A . 21 SER HB3 1 1 1 294 1 1 21 SER HG H 6.524 -12.104 0.534 1.00 . A A . 21 SER HG 1 1 1 295 1 1 21 SER N N 4.858 -9.195 1.528 1.00 . A A . 21 SER N 1 1 1 296 1 1 21 SER O O 5.290 -11.161 4.538 1.00 . A A . 21 SER O 1 1 1 297 1 1 21 SER OG O 6.153 -11.280 0.858 1.00 . A A . 21 SER OG 1 1 1 298 1 1 22 ASP C C 6.371 -7.959 5.989 1.00 . A A . 22 ASP C 1 1 1 299 1 1 22 ASP CA C 6.916 -9.101 5.128 1.00 . A A . 22 ASP CA 1 1 1 300 1 1 22 ASP CB C 8.335 -8.783 4.651 1.00 . A A . 22 ASP CB 1 1 1 301 1 1 22 ASP CG C 8.709 -9.722 3.503 1.00 . A A . 22 ASP CG 1 1 1 302 1 1 22 ASP H H 6.151 -8.536 3.193 1.00 . A A . 22 ASP H 1 1 1 303 1 1 22 ASP HA H 6.912 -10.026 5.680 1.00 . A A . 22 ASP HA 1 1 1 304 1 1 22 ASP HB2 H 8.378 -7.758 4.309 1.00 . A A . 22 ASP HB2 1 1 1 305 1 1 22 ASP HB3 H 9.029 -8.923 5.469 1.00 . A A . 22 ASP HB3 1 1 1 306 1 1 22 ASP N N 6.111 -9.235 3.879 1.00 . A A . 22 ASP N 1 1 1 307 1 1 22 ASP O O 6.589 -7.912 7.183 1.00 . A A . 22 ASP O 1 1 1 308 1 1 22 ASP OD1 O 8.850 -10.907 3.753 1.00 . A A . 22 ASP OD1 1 1 1 309 1 1 22 ASP OD2 O 8.849 -9.238 2.391 1.00 . A A . 22 ASP OD2 1 1 1 310 1 1 23 GLY C C 5.998 -4.675 6.009 1.00 . A A . 23 GLY C 1 1 1 311 1 1 23 GLY CA C 5.103 -5.904 6.179 1.00 . A A . 23 GLY CA 1 1 1 312 1 1 23 GLY H H 5.497 -7.097 4.429 1.00 . A A . 23 GLY H 1 1 1 313 1 1 23 GLY HA2 H 4.106 -5.678 5.825 1.00 . A A . 23 GLY HA2 1 1 1 314 1 1 23 GLY HA3 H 5.065 -6.173 7.225 1.00 . A A . 23 GLY HA3 1 1 1 315 1 1 23 GLY N N 5.662 -7.040 5.394 1.00 . A A . 23 GLY N 1 1 1 316 1 1 23 GLY O O 7.163 -4.784 5.683 1.00 . A A . 23 GLY O 1 1 1 317 1 1 24 LYS C C 6.942 -2.233 4.694 1.00 . A A . 24 LYS C 1 1 1 318 1 1 24 LYS CA C 6.280 -2.268 6.074 1.00 . A A . 24 LYS CA 1 1 1 319 1 1 24 LYS CB C 7.340 -2.357 7.174 1.00 . A A . 24 LYS CB 1 1 1 320 1 1 24 LYS CD C 7.539 -1.231 9.400 1.00 . A A . 24 LYS CD 1 1 1 321 1 1 24 LYS CE C 9.007 -1.376 9.807 1.00 . A A . 24 LYS CE 1 1 1 322 1 1 24 LYS CG C 7.448 -1.007 7.888 1.00 . A A . 24 LYS CG 1 1 1 323 1 1 24 LYS H H 4.518 -3.440 6.486 1.00 . A A . 24 LYS H 1 1 1 324 1 1 24 LYS HA H 5.669 -1.392 6.222 1.00 . A A . 24 LYS HA 1 1 1 325 1 1 24 LYS HB2 H 7.059 -3.121 7.885 1.00 . A A . 24 LYS HB2 1 1 1 326 1 1 24 LYS HB3 H 8.294 -2.607 6.735 1.00 . A A . 24 LYS HB3 1 1 1 327 1 1 24 LYS HD2 H 7.104 -0.386 9.915 1.00 . A A . 24 LYS HD2 1 1 1 328 1 1 24 LYS HD3 H 7.004 -2.130 9.665 1.00 . A A . 24 LYS HD3 1 1 1 329 1 1 24 LYS HE2 H 9.334 -2.398 9.667 1.00 . A A . 24 LYS HE2 1 1 1 330 1 1 24 LYS HE3 H 9.625 -0.700 9.237 1.00 . A A . 24 LYS HE3 1 1 1 331 1 1 24 LYS HG2 H 8.333 -0.489 7.546 1.00 . A A . 24 LYS HG2 1 1 1 332 1 1 24 LYS HG3 H 6.575 -0.412 7.667 1.00 . A A . 24 LYS HG3 1 1 1 333 1 1 24 LYS HZ1 H 8.633 -0.063 11.379 1.00 . A A . 24 LYS HZ1 1 1 1 334 1 1 24 LYS HZ2 H 10.032 -1.007 11.582 1.00 . A A . 24 LYS HZ2 1 1 1 335 1 1 24 LYS HZ3 H 8.496 -1.701 11.800 1.00 . A A . 24 LYS HZ3 1 1 1 336 1 1 24 LYS N N 5.461 -3.505 6.225 1.00 . A A . 24 LYS N 1 1 1 337 1 1 24 LYS NZ N 9.045 -1.009 11.250 1.00 . A A . 24 LYS NZ 1 1 1 338 1 1 24 LYS O O 8.047 -1.754 4.540 1.00 . A A . 24 LYS O 1 1 1 339 1 1 25 SER C C 5.820 -3.134 1.285 1.00 . A A . 25 SER C 1 1 1 340 1 1 25 SER CA C 6.870 -2.725 2.320 1.00 . A A . 25 SER CA 1 1 1 341 1 1 25 SER CB C 7.997 -3.754 2.369 1.00 . A A . 25 SER CB 1 1 1 342 1 1 25 SER H H 5.382 -3.113 3.832 1.00 . A A . 25 SER H 1 1 1 343 1 1 25 SER HA H 7.270 -1.750 2.089 1.00 . A A . 25 SER HA 1 1 1 344 1 1 25 SER HB2 H 7.659 -4.638 2.887 1.00 . A A . 25 SER HB2 1 1 1 345 1 1 25 SER HB3 H 8.286 -4.018 1.359 1.00 . A A . 25 SER HB3 1 1 1 346 1 1 25 SER HG H 9.345 -2.376 2.637 1.00 . A A . 25 SER HG 1 1 1 347 1 1 25 SER N N 6.275 -2.733 3.688 1.00 . A A . 25 SER N 1 1 1 348 1 1 25 SER O O 5.324 -4.243 1.295 1.00 . A A . 25 SER O 1 1 1 349 1 1 25 SER OG O 9.109 -3.203 3.064 1.00 . A A . 25 SER OG 1 1 1 350 1 1 26 ALA C C 5.016 -2.286 -2.044 1.00 . A A . 26 ALA C 1 1 1 351 1 1 26 ALA CA C 4.463 -2.587 -0.647 1.00 . A A . 26 ALA CA 1 1 1 352 1 1 26 ALA CB C 3.265 -1.689 -0.332 1.00 . A A . 26 ALA CB 1 1 1 353 1 1 26 ALA H H 5.893 -1.360 0.398 1.00 . A A . 26 ALA H 1 1 1 354 1 1 26 ALA HA H 4.178 -3.623 -0.569 1.00 . A A . 26 ALA HA 1 1 1 355 1 1 26 ALA HB1 H 3.274 -0.833 -0.991 1.00 . A A . 26 ALA HB1 1 1 1 356 1 1 26 ALA HB2 H 3.325 -1.355 0.693 1.00 . A A . 26 ALA HB2 1 1 1 357 1 1 26 ALA HB3 H 2.351 -2.245 -0.476 1.00 . A A . 26 ALA HB3 1 1 1 358 1 1 26 ALA N N 5.480 -2.248 0.390 1.00 . A A . 26 ALA N 1 1 1 359 1 1 26 ALA O O 5.974 -1.555 -2.199 1.00 . A A . 26 ALA O 1 1 1 360 1 1 27 ALA C C 4.314 -1.311 -5.012 1.00 . A A . 27 ALA C 1 1 1 361 1 1 27 ALA CA C 4.920 -2.597 -4.450 1.00 . A A . 27 ALA CA 1 1 1 362 1 1 27 ALA CB C 4.451 -3.802 -5.262 1.00 . A A . 27 ALA CB 1 1 1 363 1 1 27 ALA H H 3.653 -3.438 -2.919 1.00 . A A . 27 ALA H 1 1 1 364 1 1 27 ALA HA H 5.994 -2.542 -4.460 1.00 . A A . 27 ALA HA 1 1 1 365 1 1 27 ALA HB1 H 3.673 -4.320 -4.720 1.00 . A A . 27 ALA HB1 1 1 1 366 1 1 27 ALA HB2 H 5.283 -4.471 -5.428 1.00 . A A . 27 ALA HB2 1 1 1 367 1 1 27 ALA HB3 H 4.064 -3.466 -6.212 1.00 . A A . 27 ALA HB3 1 1 1 368 1 1 27 ALA N N 4.423 -2.848 -3.064 1.00 . A A . 27 ALA N 1 1 1 369 1 1 27 ALA O O 5.014 -0.408 -5.423 1.00 . A A . 27 ALA O 1 1 1 370 1 1 28 CYS C C 2.659 0.155 -7.063 1.00 . A A . 28 CYS C 1 1 1 371 1 1 28 CYS CA C 2.344 -0.014 -5.573 1.00 . A A . 28 CYS CA 1 1 1 372 1 1 28 CYS CB C 2.914 1.153 -4.763 1.00 . A A . 28 CYS CB 1 1 1 373 1 1 28 CYS H H 2.479 -1.978 -4.700 1.00 . A A . 28 CYS H 1 1 1 374 1 1 28 CYS HA H 1.282 -0.082 -5.425 1.00 . A A . 28 CYS HA 1 1 1 375 1 1 28 CYS HB2 H 3.933 1.342 -5.069 1.00 . A A . 28 CYS HB2 1 1 1 376 1 1 28 CYS HB3 H 2.315 2.037 -4.940 1.00 . A A . 28 CYS HB3 1 1 1 377 1 1 28 CYS N N 3.016 -1.232 -5.035 1.00 . A A . 28 CYS N 1 1 1 378 1 1 28 CYS O O 3.781 -0.019 -7.494 1.00 . A A . 28 CYS O 1 1 1 379 1 1 28 CYS SG S 2.878 0.745 -2.999 1.00 . A A . 28 CYS SG 1 1 1 380 1 1 29 THR C C 2.902 1.802 -9.563 1.00 . A A . 29 THR C 1 1 1 381 1 1 29 THR CA C 1.910 0.665 -9.314 1.00 . A A . 29 THR CA 1 1 1 382 1 1 29 THR CB C 0.542 1.010 -9.901 1.00 . A A . 29 THR CB 1 1 1 383 1 1 29 THR CG2 C -0.140 -0.264 -10.403 1.00 . A A . 29 THR CG2 1 1 1 384 1 1 29 THR H H 0.772 0.622 -7.482 1.00 . A A . 29 THR H 1 1 1 385 1 1 29 THR HA H 2.274 -0.250 -9.746 1.00 . A A . 29 THR HA 1 1 1 386 1 1 29 THR HB H 0.667 1.695 -10.726 1.00 . A A . 29 THR HB 1 1 1 387 1 1 29 THR HG1 H -0.512 2.491 -9.209 1.00 . A A . 29 THR HG1 1 1 1 388 1 1 29 THR HG21 H -0.092 -1.024 -9.637 1.00 . A A . 29 THR HG21 1 1 1 389 1 1 29 THR HG22 H 0.364 -0.616 -11.292 1.00 . A A . 29 THR HG22 1 1 1 390 1 1 29 THR HG23 H -1.173 -0.053 -10.636 1.00 . A A . 29 THR HG23 1 1 1 391 1 1 29 THR N N 1.672 0.489 -7.851 1.00 . A A . 29 THR N 1 1 1 392 1 1 29 THR O O 3.815 1.679 -10.355 1.00 . A A . 29 THR O 1 1 1 393 1 1 29 THR OG1 O -0.262 1.618 -8.899 1.00 . A A . 29 THR OG1 1 1 1 394 1 1 30 ARG C C 3.688 4.960 -7.872 1.00 . A A . 30 ARG C 1 1 1 395 1 1 30 ARG CA C 3.665 4.052 -9.104 1.00 . A A . 30 ARG CA 1 1 1 396 1 1 30 ARG CB C 3.110 4.805 -10.314 1.00 . A A . 30 ARG CB 1 1 1 397 1 1 30 ARG CD C 1.462 6.600 -10.861 1.00 . A A . 30 ARG CD 1 1 1 398 1 1 30 ARG CG C 1.738 5.386 -9.971 1.00 . A A . 30 ARG CG 1 1 1 399 1 1 30 ARG CZ C -0.630 7.360 -11.813 1.00 . A A . 30 ARG CZ 1 1 1 400 1 1 30 ARG H H 1.986 2.987 -8.266 1.00 . A A . 30 ARG H 1 1 1 401 1 1 30 ARG HA H 4.656 3.691 -9.321 1.00 . A A . 30 ARG HA 1 1 1 402 1 1 30 ARG HB2 H 3.786 5.606 -10.580 1.00 . A A . 30 ARG HB2 1 1 1 403 1 1 30 ARG HB3 H 3.012 4.123 -11.148 1.00 . A A . 30 ARG HB3 1 1 1 404 1 1 30 ARG HD2 H 1.464 7.505 -10.271 1.00 . A A . 30 ARG HD2 1 1 1 405 1 1 30 ARG HD3 H 2.194 6.662 -11.650 1.00 . A A . 30 ARG HD3 1 1 1 406 1 1 30 ARG HE H -0.222 5.439 -11.534 1.00 . A A . 30 ARG HE 1 1 1 407 1 1 30 ARG HG2 H 0.978 4.636 -10.135 1.00 . A A . 30 ARG HG2 1 1 1 408 1 1 30 ARG HG3 H 1.724 5.692 -8.935 1.00 . A A . 30 ARG HG3 1 1 1 409 1 1 30 ARG HH11 H -0.488 8.320 -10.062 1.00 . A A . 30 ARG HH11 1 1 1 410 1 1 30 ARG HH12 H -1.439 9.110 -11.274 1.00 . A A . 30 ARG HH12 1 1 1 411 1 1 30 ARG HH21 H -0.944 6.636 -13.653 1.00 . A A . 30 ARG HH21 1 1 1 412 1 1 30 ARG HH22 H -1.697 8.158 -13.308 1.00 . A A . 30 ARG HH22 1 1 1 413 1 1 30 ARG N N 2.730 2.908 -8.897 1.00 . A A . 30 ARG N 1 1 1 414 1 1 30 ARG NE N 0.111 6.354 -11.437 1.00 . A A . 30 ARG NE 1 1 1 415 1 1 30 ARG NH1 N -0.871 8.340 -10.985 1.00 . A A . 30 ARG NH1 1 1 1 416 1 1 30 ARG NH2 N -1.130 7.387 -13.019 1.00 . A A . 30 ARG NH2 1 1 1 417 1 1 30 ARG O O 3.373 4.544 -6.775 1.00 . A A . 30 ARG O 1 1 1 418 1 1 31 MET C C 3.753 8.554 -7.344 1.00 . A A . 31 MET C 1 1 1 419 1 1 31 MET CA C 4.111 7.137 -6.888 1.00 . A A . 31 MET CA 1 1 1 420 1 1 31 MET CB C 5.557 7.080 -6.395 1.00 . A A . 31 MET CB 1 1 1 421 1 1 31 MET CE C 7.841 7.546 -4.437 1.00 . A A . 31 MET CE 1 1 1 422 1 1 31 MET CG C 5.657 6.128 -5.204 1.00 . A A . 31 MET CG 1 1 1 423 1 1 31 MET H H 4.316 6.511 -8.940 1.00 . A A . 31 MET H 1 1 1 424 1 1 31 MET HA H 3.444 6.809 -6.109 1.00 . A A . 31 MET HA 1 1 1 425 1 1 31 MET HB2 H 6.195 6.729 -7.193 1.00 . A A . 31 MET HB2 1 1 1 426 1 1 31 MET HB3 H 5.872 8.067 -6.092 1.00 . A A . 31 MET HB3 1 1 1 427 1 1 31 MET HE1 H 7.703 8.421 -5.057 1.00 . A A . 31 MET HE1 1 1 1 428 1 1 31 MET HE2 H 8.250 6.747 -5.033 1.00 . A A . 31 MET HE2 1 1 1 429 1 1 31 MET HE3 H 8.521 7.776 -3.628 1.00 . A A . 31 MET HE3 1 1 1 430 1 1 31 MET HG2 H 4.684 5.706 -4.995 1.00 . A A . 31 MET HG2 1 1 1 431 1 1 31 MET HG3 H 6.350 5.332 -5.435 1.00 . A A . 31 MET HG3 1 1 1 432 1 1 31 MET N N 4.064 6.198 -8.047 1.00 . A A . 31 MET N 1 1 1 433 1 1 31 MET O O 4.611 9.336 -7.702 1.00 . A A . 31 MET O 1 1 1 434 1 1 31 MET SD S 6.244 7.036 -3.753 1.00 . A A . 31 MET SD 1 1 1 435 1 1 32 ALA C C 1.508 11.045 -6.593 1.00 . A A . 32 ALA C 1 1 1 436 1 1 32 ALA CA C 2.081 10.255 -7.772 1.00 . A A . 32 ALA CA 1 1 1 437 1 1 32 ALA CB C 1.000 10.023 -8.828 1.00 . A A . 32 ALA CB 1 1 1 438 1 1 32 ALA H H 1.815 8.243 -7.045 1.00 . A A . 32 ALA H 1 1 1 439 1 1 32 ALA HA H 2.915 10.779 -8.208 1.00 . A A . 32 ALA HA 1 1 1 440 1 1 32 ALA HB1 H 1.117 10.743 -9.625 1.00 . A A . 32 ALA HB1 1 1 1 441 1 1 32 ALA HB2 H 0.025 10.140 -8.377 1.00 . A A . 32 ALA HB2 1 1 1 442 1 1 32 ALA HB3 H 1.095 9.025 -9.227 1.00 . A A . 32 ALA HB3 1 1 1 443 1 1 32 ALA N N 2.491 8.889 -7.335 1.00 . A A . 32 ALA N 1 1 1 444 1 1 32 ALA O O 0.800 12.016 -6.772 1.00 . A A . 32 ALA O 1 1 1 445 1 1 33 CYS C C 2.387 12.118 -3.482 1.00 . A A . 33 CYS C 1 1 1 446 1 1 33 CYS CA C 1.265 11.382 -4.210 1.00 . A A . 33 CYS CA 1 1 1 447 1 1 33 CYS CB C 0.643 10.316 -3.309 1.00 . A A . 33 CYS CB 1 1 1 448 1 1 33 CYS H H 2.375 9.855 -5.257 1.00 . A A . 33 CYS H 1 1 1 449 1 1 33 CYS HA H 0.510 12.081 -4.528 1.00 . A A . 33 CYS HA 1 1 1 450 1 1 33 CYS HB2 H 0.698 9.353 -3.796 1.00 . A A . 33 CYS HB2 1 1 1 451 1 1 33 CYS HB3 H 1.178 10.278 -2.375 1.00 . A A . 33 CYS HB3 1 1 1 452 1 1 33 CYS N N 1.804 10.641 -5.387 1.00 . A A . 33 CYS N 1 1 1 453 1 1 33 CYS O O 3.019 11.581 -2.594 1.00 . A A . 33 CYS O 1 1 1 454 1 1 33 CYS SG S -1.087 10.740 -2.998 1.00 . A A . 33 CYS SG 1 1 1 455 1 1 34 PRO C C 3.191 14.686 -1.903 1.00 . A A . 34 PRO C 1 1 1 456 1 1 34 PRO CA C 3.636 14.188 -3.281 1.00 . A A . 34 PRO CA 1 1 1 457 1 1 34 PRO CB C 3.758 15.349 -4.262 1.00 . A A . 34 PRO CB 1 1 1 458 1 1 34 PRO CD C 1.857 14.029 -4.958 1.00 . A A . 34 PRO CD 1 1 1 459 1 1 34 PRO CG C 2.433 15.420 -4.954 1.00 . A A . 34 PRO CG 1 1 1 460 1 1 34 PRO HA H 4.571 13.657 -3.216 1.00 . A A . 34 PRO HA 1 1 1 461 1 1 34 PRO HB2 H 3.961 16.270 -3.732 1.00 . A A . 34 PRO HB2 1 1 1 462 1 1 34 PRO HB3 H 4.534 15.147 -4.981 1.00 . A A . 34 PRO HB3 1 1 1 463 1 1 34 PRO HD2 H 0.797 14.056 -4.741 1.00 . A A . 34 PRO HD2 1 1 1 464 1 1 34 PRO HD3 H 2.042 13.545 -5.906 1.00 . A A . 34 PRO HD3 1 1 1 465 1 1 34 PRO HG2 H 1.776 16.092 -4.420 1.00 . A A . 34 PRO HG2 1 1 1 466 1 1 34 PRO HG3 H 2.565 15.761 -5.969 1.00 . A A . 34 PRO HG3 1 1 1 467 1 1 34 PRO N N 2.587 13.338 -3.891 1.00 . A A . 34 PRO N 1 1 1 468 1 1 34 PRO O O 3.226 15.867 -1.619 1.00 . A A . 34 PRO O 1 1 1 469 1 1 35 GLN C C 3.409 13.899 1.354 1.00 . A A . 35 GLN C 1 1 1 470 1 1 35 GLN CA C 2.331 14.226 0.317 1.00 . A A . 35 GLN CA 1 1 1 471 1 1 35 GLN CB C 1.060 13.420 0.593 1.00 . A A . 35 GLN CB 1 1 1 472 1 1 35 GLN CD C -0.855 14.275 -0.766 1.00 . A A . 35 GLN CD 1 1 1 473 1 1 35 GLN CG C -0.150 14.356 0.590 1.00 . A A . 35 GLN CG 1 1 1 474 1 1 35 GLN H H 2.754 12.849 -1.288 1.00 . A A . 35 GLN H 1 1 1 475 1 1 35 GLN HA H 2.107 15.280 0.325 1.00 . A A . 35 GLN HA 1 1 1 476 1 1 35 GLN HB2 H 0.938 12.668 -0.173 1.00 . A A . 35 GLN HB2 1 1 1 477 1 1 35 GLN HB3 H 1.140 12.941 1.557 1.00 . A A . 35 GLN HB3 1 1 1 478 1 1 35 GLN HE21 H -0.984 12.294 -0.739 1.00 . A A . 35 GLN HE21 1 1 1 479 1 1 35 GLN HE22 H -1.637 13.045 -2.115 1.00 . A A . 35 GLN HE22 1 1 1 480 1 1 35 GLN HG2 H -0.837 14.059 1.371 1.00 . A A . 35 GLN HG2 1 1 1 481 1 1 35 GLN HG3 H 0.176 15.370 0.764 1.00 . A A . 35 GLN HG3 1 1 1 482 1 1 35 GLN N N 2.775 13.798 -1.042 1.00 . A A . 35 GLN N 1 1 1 483 1 1 35 GLN NE2 N -1.186 13.107 -1.247 1.00 . A A . 35 GLN NE2 1 1 1 484 1 1 35 GLN O O 4.306 14.709 1.522 1.00 . A A . 35 GLN O 1 1 1 485 1 1 35 GLN OXT O 3.319 12.846 1.962 1.00 . A A . 35 GLN OXT 1 1 1 486 1 1 35 GLN OE1 O -1.106 15.284 -1.394 1.00 . A A . 35 GLN OE1 1 1 2 487 1 1 1 GLU C C 6.167 2.382 4.770 1.00 . A A . 1 GLU C 1 1 2 488 1 1 1 GLU CA C 7.560 2.936 5.081 1.00 . A A . 1 GLU CA 1 1 2 489 1 1 1 GLU CB C 7.548 4.465 5.052 1.00 . A A . 1 GLU CB 1 1 2 490 1 1 1 GLU CD C 6.366 6.511 5.862 1.00 . A A . 1 GLU CD 1 1 2 491 1 1 1 GLU CG C 6.418 4.984 5.944 1.00 . A A . 1 GLU CG 1 1 2 492 1 1 1 GLU H1 H 9.380 3.120 4.085 1.00 . A A . 1 GLU H1 1 1 2 493 1 1 1 GLU H2 H 8.083 2.673 3.082 1.00 . A A . 1 GLU H2 1 1 2 494 1 1 1 GLU H3 H 8.777 1.535 4.135 1.00 . A A . 1 GLU H3 1 1 2 495 1 1 1 GLU HA H 7.898 2.589 6.044 1.00 . A A . 1 GLU HA 1 1 2 496 1 1 1 GLU HB2 H 8.495 4.838 5.414 1.00 . A A . 1 GLU HB2 1 1 2 497 1 1 1 GLU HB3 H 7.389 4.804 4.040 1.00 . A A . 1 GLU HB3 1 1 2 498 1 1 1 GLU HG2 H 5.477 4.572 5.610 1.00 . A A . 1 GLU HG2 1 1 2 499 1 1 1 GLU HG3 H 6.599 4.687 6.966 1.00 . A A . 1 GLU HG3 1 1 2 500 1 1 1 GLU N N 8.523 2.536 4.016 1.00 . A A . 1 GLU N 1 1 2 501 1 1 1 GLU O O 5.365 3.021 4.120 1.00 . A A . 1 GLU O 1 1 2 502 1 1 1 GLU OE1 O 5.683 7.015 4.985 1.00 . A A . 1 GLU OE1 1 1 2 503 1 1 1 GLU OE2 O 7.011 7.150 6.675 1.00 . A A . 1 GLU OE2 1 1 2 504 1 1 2 VAL C C 3.897 0.144 6.284 1.00 . A A . 2 VAL C 1 1 2 505 1 1 2 VAL CA C 4.533 0.603 4.967 1.00 . A A . 2 VAL CA 1 1 2 506 1 1 2 VAL CB C 4.807 -0.586 4.035 1.00 . A A . 2 VAL CB 1 1 2 507 1 1 2 VAL CG1 C 3.717 -1.649 4.201 1.00 . A A . 2 VAL CG1 1 1 2 508 1 1 2 VAL CG2 C 4.813 -0.098 2.584 1.00 . A A . 2 VAL CG2 1 1 2 509 1 1 2 VAL H H 6.536 0.699 5.756 1.00 . A A . 2 VAL H 1 1 2 510 1 1 2 VAL HA H 3.898 1.320 4.472 1.00 . A A . 2 VAL HA 1 1 2 511 1 1 2 VAL HB H 5.768 -1.018 4.274 1.00 . A A . 2 VAL HB 1 1 2 512 1 1 2 VAL HG11 H 3.911 -2.229 5.091 1.00 . A A . 2 VAL HG11 1 1 2 513 1 1 2 VAL HG12 H 3.715 -2.301 3.339 1.00 . A A . 2 VAL HG12 1 1 2 514 1 1 2 VAL HG13 H 2.755 -1.166 4.288 1.00 . A A . 2 VAL HG13 1 1 2 515 1 1 2 VAL HG21 H 4.198 -0.750 1.982 1.00 . A A . 2 VAL HG21 1 1 2 516 1 1 2 VAL HG22 H 5.825 -0.106 2.205 1.00 . A A . 2 VAL HG22 1 1 2 517 1 1 2 VAL HG23 H 4.421 0.908 2.541 1.00 . A A . 2 VAL HG23 1 1 2 518 1 1 2 VAL N N 5.874 1.197 5.232 1.00 . A A . 2 VAL N 1 1 2 519 1 1 2 VAL O O 4.574 -0.276 7.200 1.00 . A A . 2 VAL O 1 1 2 520 1 1 3 THR C C 0.728 -1.115 7.304 1.00 . A A . 3 THR C 1 1 2 521 1 1 3 THR CA C 1.915 -0.207 7.635 1.00 . A A . 3 THR CA 1 1 2 522 1 1 3 THR CB C 1.434 1.090 8.288 1.00 . A A . 3 THR CB 1 1 2 523 1 1 3 THR CG2 C 0.773 1.981 7.234 1.00 . A A . 3 THR CG2 1 1 2 524 1 1 3 THR H H 2.071 0.566 5.631 1.00 . A A . 3 THR H 1 1 2 525 1 1 3 THR HA H 2.609 -0.714 8.288 1.00 . A A . 3 THR HA 1 1 2 526 1 1 3 THR HB H 2.276 1.612 8.716 1.00 . A A . 3 THR HB 1 1 2 527 1 1 3 THR HG1 H -0.166 1.478 9.323 1.00 . A A . 3 THR HG1 1 1 2 528 1 1 3 THR HG21 H 0.257 2.794 7.723 1.00 . A A . 3 THR HG21 1 1 2 529 1 1 3 THR HG22 H 0.066 1.398 6.661 1.00 . A A . 3 THR HG22 1 1 2 530 1 1 3 THR HG23 H 1.528 2.379 6.573 1.00 . A A . 3 THR HG23 1 1 2 531 1 1 3 THR N N 2.598 0.224 6.381 1.00 . A A . 3 THR N 1 1 2 532 1 1 3 THR O O 0.018 -1.570 8.179 1.00 . A A . 3 THR O 1 1 2 533 1 1 3 THR OG1 O 0.496 0.784 9.310 1.00 . A A . 3 THR OG1 1 1 2 534 1 1 4 CYS C C -0.339 -3.714 6.016 1.00 . A A . 4 CYS C 1 1 2 535 1 1 4 CYS CA C -0.637 -2.256 5.657 1.00 . A A . 4 CYS CA 1 1 2 536 1 1 4 CYS CB C -0.764 -2.097 4.141 1.00 . A A . 4 CYS CB 1 1 2 537 1 1 4 CYS H H 1.090 -1.002 5.357 1.00 . A A . 4 CYS H 1 1 2 538 1 1 4 CYS HA H -1.543 -1.927 6.139 1.00 . A A . 4 CYS HA 1 1 2 539 1 1 4 CYS HB2 H -1.514 -2.781 3.770 1.00 . A A . 4 CYS HB2 1 1 2 540 1 1 4 CYS HB3 H -1.057 -1.081 3.910 1.00 . A A . 4 CYS HB3 1 1 2 541 1 1 4 CYS N N 0.507 -1.380 6.046 1.00 . A A . 4 CYS N 1 1 2 542 1 1 4 CYS O O 0.754 -4.055 6.421 1.00 . A A . 4 CYS O 1 1 2 543 1 1 4 CYS SG S 0.825 -2.459 3.349 1.00 . A A . 4 CYS SG 1 1 2 544 1 1 5 GLU C C -0.511 -6.740 4.959 1.00 . A A . 5 GLU C 1 1 2 545 1 1 5 GLU CA C -1.076 -6.015 6.183 1.00 . A A . 5 GLU CA 1 1 2 546 1 1 5 GLU CB C -2.455 -6.566 6.552 1.00 . A A . 5 GLU CB 1 1 2 547 1 1 5 GLU CD C -4.157 -6.350 8.374 1.00 . A A . 5 GLU CD 1 1 2 548 1 1 5 GLU CG C -2.661 -6.450 8.064 1.00 . A A . 5 GLU CG 1 1 2 549 1 1 5 GLU H H -2.177 -4.284 5.526 1.00 . A A . 5 GLU H 1 1 2 550 1 1 5 GLU HA H -0.404 -6.110 7.021 1.00 . A A . 5 GLU HA 1 1 2 551 1 1 5 GLU HB2 H -3.218 -6.000 6.037 1.00 . A A . 5 GLU HB2 1 1 2 552 1 1 5 GLU HB3 H -2.517 -7.603 6.260 1.00 . A A . 5 GLU HB3 1 1 2 553 1 1 5 GLU HG2 H -2.251 -7.323 8.550 1.00 . A A . 5 GLU HG2 1 1 2 554 1 1 5 GLU HG3 H -2.160 -5.566 8.429 1.00 . A A . 5 GLU HG3 1 1 2 555 1 1 5 GLU N N -1.304 -4.578 5.860 1.00 . A A . 5 GLU N 1 1 2 556 1 1 5 GLU O O -0.867 -6.436 3.837 1.00 . A A . 5 GLU O 1 1 2 557 1 1 5 GLU OE1 O -4.779 -5.417 7.895 1.00 . A A . 5 GLU OE1 1 1 2 558 1 1 5 GLU OE2 O -4.652 -7.208 9.086 1.00 . A A . 5 GLU OE2 1 1 2 559 1 1 6 PRO C C 0.007 -9.427 3.495 1.00 . A A . 6 PRO C 1 1 2 560 1 1 6 PRO CA C 1.002 -8.450 4.129 1.00 . A A . 6 PRO CA 1 1 2 561 1 1 6 PRO CB C 2.125 -9.201 4.839 1.00 . A A . 6 PRO CB 1 1 2 562 1 1 6 PRO CD C 0.834 -8.086 6.546 1.00 . A A . 6 PRO CD 1 1 2 563 1 1 6 PRO CG C 1.689 -9.294 6.267 1.00 . A A . 6 PRO CG 1 1 2 564 1 1 6 PRO HA H 1.417 -7.791 3.383 1.00 . A A . 6 PRO HA 1 1 2 565 1 1 6 PRO HB2 H 2.242 -10.190 4.414 1.00 . A A . 6 PRO HB2 1 1 2 566 1 1 6 PRO HB3 H 3.050 -8.650 4.772 1.00 . A A . 6 PRO HB3 1 1 2 567 1 1 6 PRO HD2 H 0.000 -8.352 7.182 1.00 . A A . 6 PRO HD2 1 1 2 568 1 1 6 PRO HD3 H 1.421 -7.299 6.994 1.00 . A A . 6 PRO HD3 1 1 2 569 1 1 6 PRO HG2 H 1.113 -10.199 6.418 1.00 . A A . 6 PRO HG2 1 1 2 570 1 1 6 PRO HG3 H 2.549 -9.289 6.918 1.00 . A A . 6 PRO HG3 1 1 2 571 1 1 6 PRO N N 0.364 -7.671 5.220 1.00 . A A . 6 PRO N 1 1 2 572 1 1 6 PRO O O -0.364 -10.421 4.085 1.00 . A A . 6 PRO O 1 1 2 573 1 1 7 GLY C C -2.758 -9.404 1.517 1.00 . A A . 7 GLY C 1 1 2 574 1 1 7 GLY CA C -1.382 -10.069 1.612 1.00 . A A . 7 GLY CA 1 1 2 575 1 1 7 GLY H H -0.102 -8.349 1.829 1.00 . A A . 7 GLY H 1 1 2 576 1 1 7 GLY HA2 H -1.020 -10.293 0.616 1.00 . A A . 7 GLY HA2 1 1 2 577 1 1 7 GLY HA3 H -1.467 -10.985 2.180 1.00 . A A . 7 GLY HA3 1 1 2 578 1 1 7 GLY N N -0.420 -9.153 2.290 1.00 . A A . 7 GLY N 1 1 2 579 1 1 7 GLY O O -3.731 -9.900 2.050 1.00 . A A . 7 GLY O 1 1 2 580 1 1 8 THR C C -4.137 -6.545 -0.394 1.00 . A A . 8 THR C 1 1 2 581 1 1 8 THR CA C -4.171 -7.606 0.714 1.00 . A A . 8 THR CA 1 1 2 582 1 1 8 THR CB C -4.408 -6.939 2.071 1.00 . A A . 8 THR CB 1 1 2 583 1 1 8 THR CG2 C -5.797 -6.300 2.088 1.00 . A A . 8 THR CG2 1 1 2 584 1 1 8 THR H H -2.055 -7.908 0.413 1.00 . A A . 8 THR H 1 1 2 585 1 1 8 THR HA H -4.949 -8.325 0.519 1.00 . A A . 8 THR HA 1 1 2 586 1 1 8 THR HB H -3.663 -6.176 2.233 1.00 . A A . 8 THR HB 1 1 2 587 1 1 8 THR HG1 H -4.656 -7.521 3.910 1.00 . A A . 8 THR HG1 1 1 2 588 1 1 8 THR HG21 H -5.700 -5.227 2.033 1.00 . A A . 8 THR HG21 1 1 2 589 1 1 8 THR HG22 H -6.306 -6.570 3.001 1.00 . A A . 8 THR HG22 1 1 2 590 1 1 8 THR HG23 H -6.366 -6.655 1.240 1.00 . A A . 8 THR HG23 1 1 2 591 1 1 8 THR N N -2.850 -8.291 0.840 1.00 . A A . 8 THR N 1 1 2 592 1 1 8 THR O O -5.124 -6.310 -1.057 1.00 . A A . 8 THR O 1 1 2 593 1 1 8 THR OG1 O -4.321 -7.913 3.101 1.00 . A A . 8 THR OG1 1 1 2 594 1 1 9 THR C C -4.041 -3.817 -1.482 1.00 . A A . 9 THR C 1 1 2 595 1 1 9 THR CA C -2.904 -4.836 -1.636 1.00 . A A . 9 THR CA 1 1 2 596 1 1 9 THR CB C -2.963 -5.577 -2.988 1.00 . A A . 9 THR CB 1 1 2 597 1 1 9 THR CG2 C -4.409 -5.809 -3.446 1.00 . A A . 9 THR CG2 1 1 2 598 1 1 9 THR H H -2.235 -6.105 -0.024 1.00 . A A . 9 THR H 1 1 2 599 1 1 9 THR HA H -1.954 -4.334 -1.545 1.00 . A A . 9 THR HA 1 1 2 600 1 1 9 THR HB H -2.471 -6.531 -2.888 1.00 . A A . 9 THR HB 1 1 2 601 1 1 9 THR HG1 H -2.071 -5.384 -4.705 1.00 . A A . 9 THR HG1 1 1 2 602 1 1 9 THR HG21 H -4.763 -6.748 -3.049 1.00 . A A . 9 THR HG21 1 1 2 603 1 1 9 THR HG22 H -4.437 -5.846 -4.524 1.00 . A A . 9 THR HG22 1 1 2 604 1 1 9 THR HG23 H -5.041 -5.009 -3.101 1.00 . A A . 9 THR HG23 1 1 2 605 1 1 9 THR N N -3.013 -5.899 -0.584 1.00 . A A . 9 THR N 1 1 2 606 1 1 9 THR O O -4.999 -4.049 -0.774 1.00 . A A . 9 THR O 1 1 2 607 1 1 9 THR OG1 O -2.284 -4.806 -3.969 1.00 . A A . 9 THR OG1 1 1 2 608 1 1 10 PHE C C -4.668 -0.375 -2.738 1.00 . A A . 10 PHE C 1 1 2 609 1 1 10 PHE CA C -5.021 -1.659 -1.982 1.00 . A A . 10 PHE CA 1 1 2 610 1 1 10 PHE CB C -5.090 -1.367 -0.482 1.00 . A A . 10 PHE CB 1 1 2 611 1 1 10 PHE CD1 C -3.036 0.077 -0.276 1.00 . A A . 10 PHE CD1 1 1 2 612 1 1 10 PHE CD2 C -3.056 -2.081 0.829 1.00 . A A . 10 PHE CD2 1 1 2 613 1 1 10 PHE CE1 C -1.740 0.310 0.201 1.00 . A A . 10 PHE CE1 1 1 2 614 1 1 10 PHE CE2 C -1.759 -1.849 1.305 1.00 . A A . 10 PHE CE2 1 1 2 615 1 1 10 PHE CG C -3.694 -1.117 0.038 1.00 . A A . 10 PHE CG 1 1 2 616 1 1 10 PHE CZ C -1.101 -0.653 0.991 1.00 . A A . 10 PHE CZ 1 1 2 617 1 1 10 PHE H H -3.157 -2.498 -2.684 1.00 . A A . 10 PHE H 1 1 2 618 1 1 10 PHE HA H -5.964 -2.053 -2.324 1.00 . A A . 10 PHE HA 1 1 2 619 1 1 10 PHE HB2 H -5.700 -0.492 -0.313 1.00 . A A . 10 PHE HB2 1 1 2 620 1 1 10 PHE HB3 H -5.521 -2.211 0.034 1.00 . A A . 10 PHE HB3 1 1 2 621 1 1 10 PHE HD1 H -3.527 0.820 -0.887 1.00 . A A . 10 PHE HD1 1 1 2 622 1 1 10 PHE HD2 H -3.564 -3.003 1.073 1.00 . A A . 10 PHE HD2 1 1 2 623 1 1 10 PHE HE1 H -1.232 1.232 -0.041 1.00 . A A . 10 PHE HE1 1 1 2 624 1 1 10 PHE HE2 H -1.268 -2.591 1.916 1.00 . A A . 10 PHE HE2 1 1 2 625 1 1 10 PHE HZ H -0.100 -0.474 1.359 1.00 . A A . 10 PHE HZ 1 1 2 626 1 1 10 PHE N N -3.940 -2.680 -2.122 1.00 . A A . 10 PHE N 1 1 2 627 1 1 10 PHE O O -3.549 -0.179 -3.171 1.00 . A A . 10 PHE O 1 1 2 628 1 1 11 LYS C C -5.224 2.924 -2.558 1.00 . A A . 11 LYS C 1 1 2 629 1 1 11 LYS CA C -5.360 1.798 -3.585 1.00 . A A . 11 LYS CA 1 1 2 630 1 1 11 LYS CB C -6.587 2.025 -4.471 1.00 . A A . 11 LYS CB 1 1 2 631 1 1 11 LYS CD C -7.739 3.799 -5.803 1.00 . A A . 11 LYS CD 1 1 2 632 1 1 11 LYS CE C -7.846 5.300 -5.519 1.00 . A A . 11 LYS CE 1 1 2 633 1 1 11 LYS CG C -6.382 3.282 -5.318 1.00 . A A . 11 LYS CG 1 1 2 634 1 1 11 LYS H H -6.507 0.327 -2.510 1.00 . A A . 11 LYS H 1 1 2 635 1 1 11 LYS HA H -4.474 1.729 -4.190 1.00 . A A . 11 LYS HA 1 1 2 636 1 1 11 LYS HB2 H -6.725 1.171 -5.118 1.00 . A A . 11 LYS HB2 1 1 2 637 1 1 11 LYS HB3 H -7.462 2.151 -3.850 1.00 . A A . 11 LYS HB3 1 1 2 638 1 1 11 LYS HD2 H -7.831 3.625 -6.866 1.00 . A A . 11 LYS HD2 1 1 2 639 1 1 11 LYS HD3 H -8.528 3.279 -5.283 1.00 . A A . 11 LYS HD3 1 1 2 640 1 1 11 LYS HE2 H -8.502 5.475 -4.677 1.00 . A A . 11 LYS HE2 1 1 2 641 1 1 11 LYS HE3 H -6.869 5.718 -5.331 1.00 . A A . 11 LYS HE3 1 1 2 642 1 1 11 LYS HG2 H -5.899 4.043 -4.721 1.00 . A A . 11 LYS HG2 1 1 2 643 1 1 11 LYS HG3 H -5.763 3.046 -6.170 1.00 . A A . 11 LYS HG3 1 1 2 644 1 1 11 LYS HZ1 H -9.460 5.859 -6.709 1.00 . A A . 11 LYS HZ1 1 1 2 645 1 1 11 LYS HZ2 H -8.100 5.340 -7.585 1.00 . A A . 11 LYS HZ2 1 1 2 646 1 1 11 LYS HZ3 H -8.109 6.874 -6.856 1.00 . A A . 11 LYS HZ3 1 1 2 647 1 1 11 LYS N N -5.620 0.508 -2.880 1.00 . A A . 11 LYS N 1 1 2 648 1 1 11 LYS NZ N -8.423 5.887 -6.762 1.00 . A A . 11 LYS NZ 1 1 2 649 1 1 11 LYS O O -6.188 3.569 -2.199 1.00 . A A . 11 LYS O 1 1 2 650 1 1 12 ASP C C -3.004 5.369 -1.642 1.00 . A A . 12 ASP C 1 1 2 651 1 1 12 ASP CA C -3.844 4.234 -1.061 1.00 . A A . 12 ASP CA 1 1 2 652 1 1 12 ASP CB C -3.095 3.558 0.085 1.00 . A A . 12 ASP CB 1 1 2 653 1 1 12 ASP CG C -3.807 3.851 1.406 1.00 . A A . 12 ASP CG 1 1 2 654 1 1 12 ASP H H -3.267 2.625 -2.367 1.00 . A A . 12 ASP H 1 1 2 655 1 1 12 ASP HA H -4.796 4.603 -0.714 1.00 . A A . 12 ASP HA 1 1 2 656 1 1 12 ASP HB2 H -3.067 2.489 -0.083 1.00 . A A . 12 ASP HB2 1 1 2 657 1 1 12 ASP HB3 H -2.086 3.945 0.126 1.00 . A A . 12 ASP HB3 1 1 2 658 1 1 12 ASP N N -4.035 3.159 -2.072 1.00 . A A . 12 ASP N 1 1 2 659 1 1 12 ASP O O -2.577 5.323 -2.778 1.00 . A A . 12 ASP O 1 1 2 660 1 1 12 ASP OD1 O -4.930 3.399 1.563 1.00 . A A . 12 ASP OD1 1 1 2 661 1 1 12 ASP OD2 O -3.217 4.518 2.239 1.00 . A A . 12 ASP OD2 1 1 2 662 1 1 13 LYS C C -2.443 7.967 -2.745 1.00 . A A . 13 LYS C 1 1 2 663 1 1 13 LYS CA C -1.936 7.519 -1.366 1.00 . A A . 13 LYS CA 1 1 2 664 1 1 13 LYS CB C -0.515 6.954 -1.444 1.00 . A A . 13 LYS CB 1 1 2 665 1 1 13 LYS CD C 0.751 7.293 0.685 1.00 . A A . 13 LYS CD 1 1 2 666 1 1 13 LYS CE C 1.471 6.534 1.803 1.00 . A A . 13 LYS CE 1 1 2 667 1 1 13 LYS CG C -0.143 6.329 -0.098 1.00 . A A . 13 LYS CG 1 1 2 668 1 1 13 LYS H H -3.106 6.398 0.050 1.00 . A A . 13 LYS H 1 1 2 669 1 1 13 LYS HA H -1.967 8.341 -0.669 1.00 . A A . 13 LYS HA 1 1 2 670 1 1 13 LYS HB2 H -0.470 6.195 -2.213 1.00 . A A . 13 LYS HB2 1 1 2 671 1 1 13 LYS HB3 H 0.179 7.750 -1.675 1.00 . A A . 13 LYS HB3 1 1 2 672 1 1 13 LYS HD2 H 1.481 7.728 0.018 1.00 . A A . 13 LYS HD2 1 1 2 673 1 1 13 LYS HD3 H 0.147 8.075 1.116 1.00 . A A . 13 LYS HD3 1 1 2 674 1 1 13 LYS HE2 H 0.970 6.695 2.747 1.00 . A A . 13 LYS HE2 1 1 2 675 1 1 13 LYS HE3 H 1.517 5.481 1.574 1.00 . A A . 13 LYS HE3 1 1 2 676 1 1 13 LYS HG2 H -1.043 6.131 0.467 1.00 . A A . 13 LYS HG2 1 1 2 677 1 1 13 LYS HG3 H 0.385 5.403 -0.267 1.00 . A A . 13 LYS HG3 1 1 2 678 1 1 13 LYS HZ1 H 3.446 6.536 2.457 1.00 . A A . 13 LYS HZ1 1 1 2 679 1 1 13 LYS HZ2 H 2.800 8.087 2.195 1.00 . A A . 13 LYS HZ2 1 1 2 680 1 1 13 LYS HZ3 H 3.242 7.113 0.875 1.00 . A A . 13 LYS HZ3 1 1 2 681 1 1 13 LYS N N -2.757 6.385 -0.865 1.00 . A A . 13 LYS N 1 1 2 682 1 1 13 LYS NZ N 2.843 7.110 1.835 1.00 . A A . 13 LYS NZ 1 1 2 683 1 1 13 LYS O O -3.448 8.642 -2.851 1.00 . A A . 13 LYS O 1 1 2 684 1 1 14 CYS C C -2.086 6.859 -6.144 1.00 . A A . 14 CYS C 1 1 2 685 1 1 14 CYS CA C -2.224 8.021 -5.155 1.00 . A A . 14 CYS CA 1 1 2 686 1 1 14 CYS CB C -1.299 9.175 -5.539 1.00 . A A . 14 CYS CB 1 1 2 687 1 1 14 CYS H H -0.956 7.065 -3.712 1.00 . A A . 14 CYS H 1 1 2 688 1 1 14 CYS HA H -3.246 8.365 -5.118 1.00 . A A . 14 CYS HA 1 1 2 689 1 1 14 CYS HB2 H -0.277 8.821 -5.573 1.00 . A A . 14 CYS HB2 1 1 2 690 1 1 14 CYS HB3 H -1.581 9.561 -6.506 1.00 . A A . 14 CYS HB3 1 1 2 691 1 1 14 CYS N N -1.764 7.605 -3.803 1.00 . A A . 14 CYS N 1 1 2 692 1 1 14 CYS O O -2.072 7.051 -7.343 1.00 . A A . 14 CYS O 1 1 2 693 1 1 14 CYS SG S -1.442 10.486 -4.300 1.00 . A A . 14 CYS SG 1 1 2 694 1 1 15 ASN C C -1.927 3.177 -5.766 1.00 . A A . 15 ASN C 1 1 2 695 1 1 15 ASN CA C -1.855 4.481 -6.562 1.00 . A A . 15 ASN CA 1 1 2 696 1 1 15 ASN CB C -0.477 4.632 -7.209 1.00 . A A . 15 ASN CB 1 1 2 697 1 1 15 ASN CG C 0.556 4.978 -6.135 1.00 . A A . 15 ASN CG 1 1 2 698 1 1 15 ASN H H -2.004 5.518 -4.675 1.00 . A A . 15 ASN H 1 1 2 699 1 1 15 ASN HA H -2.622 4.504 -7.319 1.00 . A A . 15 ASN HA 1 1 2 700 1 1 15 ASN HB2 H -0.201 3.701 -7.687 1.00 . A A . 15 ASN HB2 1 1 2 701 1 1 15 ASN HB3 H -0.508 5.421 -7.945 1.00 . A A . 15 ASN HB3 1 1 2 702 1 1 15 ASN HD21 H 1.599 6.174 -7.331 1.00 . A A . 15 ASN HD21 1 1 2 703 1 1 15 ASN HD22 H 2.203 6.020 -5.744 1.00 . A A . 15 ASN HD22 1 1 2 704 1 1 15 ASN N N -1.988 5.654 -5.648 1.00 . A A . 15 ASN N 1 1 2 705 1 1 15 ASN ND2 N 1.533 5.792 -6.427 1.00 . A A . 15 ASN ND2 1 1 2 706 1 1 15 ASN O O -1.680 3.149 -4.577 1.00 . A A . 15 ASN O 1 1 2 707 1 1 15 ASN OD1 O 0.472 4.505 -5.020 1.00 . A A . 15 ASN OD1 1 1 2 708 1 1 16 THR C C -1.042 0.534 -4.936 1.00 . A A . 16 THR C 1 1 2 709 1 1 16 THR CA C -2.341 0.793 -5.696 1.00 . A A . 16 THR CA 1 1 2 710 1 1 16 THR CB C -2.538 -0.253 -6.793 1.00 . A A . 16 THR CB 1 1 2 711 1 1 16 THR CG2 C -3.424 -1.381 -6.269 1.00 . A A . 16 THR CG2 1 1 2 712 1 1 16 THR H H -2.451 2.139 -7.375 1.00 . A A . 16 THR H 1 1 2 713 1 1 16 THR HA H -3.181 0.781 -5.024 1.00 . A A . 16 THR HA 1 1 2 714 1 1 16 THR HB H -1.580 -0.659 -7.080 1.00 . A A . 16 THR HB 1 1 2 715 1 1 16 THR HG1 H -2.707 0.040 -8.708 1.00 . A A . 16 THR HG1 1 1 2 716 1 1 16 THR HG21 H -4.005 -1.023 -5.432 1.00 . A A . 16 THR HG21 1 1 2 717 1 1 16 THR HG22 H -2.805 -2.206 -5.950 1.00 . A A . 16 THR HG22 1 1 2 718 1 1 16 THR HG23 H -4.088 -1.711 -7.053 1.00 . A A . 16 THR HG23 1 1 2 719 1 1 16 THR N N -2.259 2.096 -6.414 1.00 . A A . 16 THR N 1 1 2 720 1 1 16 THR O O -0.164 1.370 -4.892 1.00 . A A . 16 THR O 1 1 2 721 1 1 16 THR OG1 O -3.155 0.354 -7.920 1.00 . A A . 16 THR OG1 1 1 2 722 1 1 17 CYS C C 0.188 -2.286 -2.883 1.00 . A A . 17 CYS C 1 1 2 723 1 1 17 CYS CA C 0.334 -0.940 -3.588 1.00 . A A . 17 CYS CA 1 1 2 724 1 1 17 CYS CB C 0.505 0.187 -2.568 1.00 . A A . 17 CYS CB 1 1 2 725 1 1 17 CYS H H -1.635 -1.279 -4.393 1.00 . A A . 17 CYS H 1 1 2 726 1 1 17 CYS HA H 1.176 -0.964 -4.255 1.00 . A A . 17 CYS HA 1 1 2 727 1 1 17 CYS HB2 H -0.167 0.999 -2.810 1.00 . A A . 17 CYS HB2 1 1 2 728 1 1 17 CYS HB3 H 0.283 -0.188 -1.578 1.00 . A A . 17 CYS HB3 1 1 2 729 1 1 17 CYS N N -0.913 -0.620 -4.341 1.00 . A A . 17 CYS N 1 1 2 730 1 1 17 CYS O O -0.344 -2.377 -1.794 1.00 . A A . 17 CYS O 1 1 2 731 1 1 17 CYS SG S 2.216 0.782 -2.611 1.00 . A A . 17 CYS SG 1 1 2 732 1 1 18 ARG C C 1.382 -4.726 -1.590 1.00 . A A . 18 ARG C 1 1 2 733 1 1 18 ARG CA C 0.555 -4.676 -2.876 1.00 . A A . 18 ARG CA 1 1 2 734 1 1 18 ARG CB C 1.124 -5.631 -3.922 1.00 . A A . 18 ARG CB 1 1 2 735 1 1 18 ARG CD C 0.075 -7.448 -2.562 1.00 . A A . 18 ARG CD 1 1 2 736 1 1 18 ARG CG C 0.269 -6.897 -3.976 1.00 . A A . 18 ARG CG 1 1 2 737 1 1 18 ARG CZ C -0.382 -9.787 -2.147 1.00 . A A . 18 ARG CZ 1 1 2 738 1 1 18 ARG H H 1.084 -3.231 -4.377 1.00 . A A . 18 ARG H 1 1 2 739 1 1 18 ARG HA H -0.476 -4.921 -2.674 1.00 . A A . 18 ARG HA 1 1 2 740 1 1 18 ARG HB2 H 1.117 -5.148 -4.888 1.00 . A A . 18 ARG HB2 1 1 2 741 1 1 18 ARG HB3 H 2.136 -5.890 -3.656 1.00 . A A . 18 ARG HB3 1 1 2 742 1 1 18 ARG HD2 H 0.741 -6.951 -1.871 1.00 . A A . 18 ARG HD2 1 1 2 743 1 1 18 ARG HD3 H -0.950 -7.330 -2.248 1.00 . A A . 18 ARG HD3 1 1 2 744 1 1 18 ARG HE H 1.233 -9.172 -3.124 1.00 . A A . 18 ARG HE 1 1 2 745 1 1 18 ARG HG2 H -0.693 -6.663 -4.408 1.00 . A A . 18 ARG HG2 1 1 2 746 1 1 18 ARG HG3 H 0.764 -7.638 -4.582 1.00 . A A . 18 ARG HG3 1 1 2 747 1 1 18 ARG HH11 H -2.023 -9.064 -3.037 1.00 . A A . 18 ARG HH11 1 1 2 748 1 1 18 ARG HH12 H -2.268 -10.450 -2.029 1.00 . A A . 18 ARG HH12 1 1 2 749 1 1 18 ARG HH21 H 1.073 -10.720 -1.139 1.00 . A A . 18 ARG HH21 1 1 2 750 1 1 18 ARG HH22 H -0.513 -11.389 -0.952 1.00 . A A . 18 ARG HH22 1 1 2 751 1 1 18 ARG N N 0.658 -3.331 -3.500 1.00 . A A . 18 ARG N 1 1 2 752 1 1 18 ARG NE N 0.413 -8.893 -2.665 1.00 . A A . 18 ARG NE 1 1 2 753 1 1 18 ARG NH1 N -1.657 -9.765 -2.426 1.00 . A A . 18 ARG NH1 1 1 2 754 1 1 18 ARG NH2 N 0.096 -10.704 -1.351 1.00 . A A . 18 ARG NH2 1 1 2 755 1 1 18 ARG O O 2.594 -4.653 -1.615 1.00 . A A . 18 ARG O 1 1 2 756 1 1 19 CYS C C 2.429 -6.108 0.833 1.00 . A A . 19 CYS C 1 1 2 757 1 1 19 CYS CA C 1.476 -4.909 0.824 1.00 . A A . 19 CYS CA 1 1 2 758 1 1 19 CYS CB C 0.394 -5.074 1.891 1.00 . A A . 19 CYS CB 1 1 2 759 1 1 19 CYS H H -0.245 -4.910 -0.473 1.00 . A A . 19 CYS H 1 1 2 760 1 1 19 CYS HA H 2.019 -3.992 0.989 1.00 . A A . 19 CYS HA 1 1 2 761 1 1 19 CYS HB2 H -0.483 -4.507 1.606 1.00 . A A . 19 CYS HB2 1 1 2 762 1 1 19 CYS HB3 H 0.133 -6.120 1.982 1.00 . A A . 19 CYS HB3 1 1 2 763 1 1 19 CYS N N 0.733 -4.852 -0.467 1.00 . A A . 19 CYS N 1 1 2 764 1 1 19 CYS O O 2.008 -7.246 0.877 1.00 . A A . 19 CYS O 1 1 2 765 1 1 19 CYS SG S 1.012 -4.466 3.480 1.00 . A A . 19 CYS SG 1 1 2 766 1 1 20 GLY C C 4.266 -8.030 1.830 1.00 . A A . 20 GLY C 1 1 2 767 1 1 20 GLY CA C 4.685 -6.989 0.791 1.00 . A A . 20 GLY CA 1 1 2 768 1 1 20 GLY H H 4.029 -4.936 0.750 1.00 . A A . 20 GLY H 1 1 2 769 1 1 20 GLY HA2 H 4.708 -7.447 -0.189 1.00 . A A . 20 GLY HA2 1 1 2 770 1 1 20 GLY HA3 H 5.668 -6.615 1.039 1.00 . A A . 20 GLY HA3 1 1 2 771 1 1 20 GLY N N 3.709 -5.862 0.788 1.00 . A A . 20 GLY N 1 1 2 772 1 1 20 GLY O O 3.439 -7.774 2.683 1.00 . A A . 20 GLY O 1 1 2 773 1 1 21 SER C C 5.272 -10.086 4.040 1.00 . A A . 21 SER C 1 1 2 774 1 1 21 SER CA C 4.468 -10.265 2.749 1.00 . A A . 21 SER CA 1 1 2 775 1 1 21 SER CB C 4.836 -11.581 2.066 1.00 . A A . 21 SER CB 1 1 2 776 1 1 21 SER H H 5.497 -9.390 1.070 1.00 . A A . 21 SER H 1 1 2 777 1 1 21 SER HA H 3.411 -10.240 2.957 1.00 . A A . 21 SER HA 1 1 2 778 1 1 21 SER HB2 H 4.935 -11.423 1.005 1.00 . A A . 21 SER HB2 1 1 2 779 1 1 21 SER HB3 H 5.775 -11.942 2.463 1.00 . A A . 21 SER HB3 1 1 2 780 1 1 21 SER HG H 2.992 -12.057 2.471 1.00 . A A . 21 SER HG 1 1 2 781 1 1 21 SER N N 4.832 -9.205 1.765 1.00 . A A . 21 SER N 1 1 2 782 1 1 21 SER O O 5.200 -10.895 4.945 1.00 . A A . 21 SER O 1 1 2 783 1 1 21 SER OG O 3.808 -12.535 2.301 1.00 . A A . 21 SER OG 1 1 2 784 1 1 22 ASP C C 6.116 -7.838 6.302 1.00 . A A . 22 ASP C 1 1 2 785 1 1 22 ASP CA C 6.844 -8.805 5.365 1.00 . A A . 22 ASP CA 1 1 2 786 1 1 22 ASP CB C 8.157 -8.194 4.872 1.00 . A A . 22 ASP CB 1 1 2 787 1 1 22 ASP CG C 9.317 -8.739 5.707 1.00 . A A . 22 ASP CG 1 1 2 788 1 1 22 ASP H H 6.083 -8.394 3.391 1.00 . A A . 22 ASP H 1 1 2 789 1 1 22 ASP HA H 7.040 -9.740 5.866 1.00 . A A . 22 ASP HA 1 1 2 790 1 1 22 ASP HB2 H 8.308 -8.454 3.833 1.00 . A A . 22 ASP HB2 1 1 2 791 1 1 22 ASP HB3 H 8.116 -7.118 4.975 1.00 . A A . 22 ASP HB3 1 1 2 792 1 1 22 ASP N N 6.038 -9.034 4.132 1.00 . A A . 22 ASP N 1 1 2 793 1 1 22 ASP O O 6.469 -7.691 7.456 1.00 . A A . 22 ASP O 1 1 2 794 1 1 22 ASP OD1 O 9.049 -9.395 6.700 1.00 . A A . 22 ASP OD1 1 1 2 795 1 1 22 ASP OD2 O 10.454 -8.491 5.341 1.00 . A A . 22 ASP OD2 1 1 2 796 1 1 23 GLY C C 5.107 -4.897 6.758 1.00 . A A . 23 GLY C 1 1 2 797 1 1 23 GLY CA C 4.348 -6.222 6.680 1.00 . A A . 23 GLY CA 1 1 2 798 1 1 23 GLY H H 4.828 -7.312 4.883 1.00 . A A . 23 GLY H 1 1 2 799 1 1 23 GLY HA2 H 3.366 -6.051 6.257 1.00 . A A . 23 GLY HA2 1 1 2 800 1 1 23 GLY HA3 H 4.248 -6.635 7.674 1.00 . A A . 23 GLY HA3 1 1 2 801 1 1 23 GLY N N 5.098 -7.178 5.816 1.00 . A A . 23 GLY N 1 1 2 802 1 1 23 GLY O O 5.171 -4.268 7.795 1.00 . A A . 23 GLY O 1 1 2 803 1 1 24 LYS C C 7.219 -3.013 4.373 1.00 . A A . 24 LYS C 1 1 2 804 1 1 24 LYS CA C 6.444 -3.183 5.683 1.00 . A A . 24 LYS CA 1 1 2 805 1 1 24 LYS CB C 7.409 -3.304 6.864 1.00 . A A . 24 LYS CB 1 1 2 806 1 1 24 LYS CD C 7.771 -1.024 7.822 1.00 . A A . 24 LYS CD 1 1 2 807 1 1 24 LYS CE C 9.009 -1.064 8.720 1.00 . A A . 24 LYS CE 1 1 2 808 1 1 24 LYS CG C 6.991 -2.332 7.968 1.00 . A A . 24 LYS CG 1 1 2 809 1 1 24 LYS H H 5.625 -4.992 4.842 1.00 . A A . 24 LYS H 1 1 2 810 1 1 24 LYS HA H 5.775 -2.351 5.837 1.00 . A A . 24 LYS HA 1 1 2 811 1 1 24 LYS HB2 H 7.386 -4.315 7.243 1.00 . A A . 24 LYS HB2 1 1 2 812 1 1 24 LYS HB3 H 8.410 -3.065 6.537 1.00 . A A . 24 LYS HB3 1 1 2 813 1 1 24 LYS HD2 H 8.074 -0.901 6.792 1.00 . A A . 24 LYS HD2 1 1 2 814 1 1 24 LYS HD3 H 7.143 -0.196 8.115 1.00 . A A . 24 LYS HD3 1 1 2 815 1 1 24 LYS HE2 H 9.341 -2.084 8.856 1.00 . A A . 24 LYS HE2 1 1 2 816 1 1 24 LYS HE3 H 9.800 -0.462 8.299 1.00 . A A . 24 LYS HE3 1 1 2 817 1 1 24 LYS HG2 H 5.932 -2.132 7.889 1.00 . A A . 24 LYS HG2 1 1 2 818 1 1 24 LYS HG3 H 7.203 -2.770 8.932 1.00 . A A . 24 LYS HG3 1 1 2 819 1 1 24 LYS HZ1 H 9.381 -0.085 10.519 1.00 . A A . 24 LYS HZ1 1 1 2 820 1 1 24 LYS HZ2 H 8.128 -1.229 10.598 1.00 . A A . 24 LYS HZ2 1 1 2 821 1 1 24 LYS HZ3 H 7.868 0.269 9.840 1.00 . A A . 24 LYS HZ3 1 1 2 822 1 1 24 LYS N N 5.687 -4.468 5.669 1.00 . A A . 24 LYS N 1 1 2 823 1 1 24 LYS NZ N 8.563 -0.484 10.017 1.00 . A A . 24 LYS NZ 1 1 2 824 1 1 24 LYS O O 8.353 -2.579 4.365 1.00 . A A . 24 LYS O 1 1 2 825 1 1 25 SER C C 6.338 -3.497 0.812 1.00 . A A . 25 SER C 1 1 2 826 1 1 25 SER CA C 7.313 -3.213 1.954 1.00 . A A . 25 SER CA 1 1 2 827 1 1 25 SER CB C 8.416 -4.270 1.975 1.00 . A A . 25 SER CB 1 1 2 828 1 1 25 SER H H 5.697 -3.697 3.294 1.00 . A A . 25 SER H 1 1 2 829 1 1 25 SER HA H 7.742 -2.229 1.853 1.00 . A A . 25 SER HA 1 1 2 830 1 1 25 SER HB2 H 8.028 -5.186 2.392 1.00 . A A . 25 SER HB2 1 1 2 831 1 1 25 SER HB3 H 8.755 -4.453 0.963 1.00 . A A . 25 SER HB3 1 1 2 832 1 1 25 SER HG H 10.195 -4.473 2.735 1.00 . A A . 25 SER HG 1 1 2 833 1 1 25 SER N N 6.614 -3.351 3.265 1.00 . A A . 25 SER N 1 1 2 834 1 1 25 SER O O 6.053 -4.635 0.500 1.00 . A A . 25 SER O 1 1 2 835 1 1 25 SER OG O 9.499 -3.813 2.774 1.00 . A A . 25 SER OG 1 1 2 836 1 1 26 ALA C C 5.542 -2.464 -2.283 1.00 . A A . 26 ALA C 1 1 2 837 1 1 26 ALA CA C 4.862 -2.720 -0.933 1.00 . A A . 26 ALA CA 1 1 2 838 1 1 26 ALA CB C 3.717 -1.733 -0.702 1.00 . A A . 26 ALA CB 1 1 2 839 1 1 26 ALA H H 6.054 -1.565 0.445 1.00 . A A . 26 ALA H 1 1 2 840 1 1 26 ALA HA H 4.490 -3.731 -0.890 1.00 . A A . 26 ALA HA 1 1 2 841 1 1 26 ALA HB1 H 2.922 -1.933 -1.405 1.00 . A A . 26 ALA HB1 1 1 2 842 1 1 26 ALA HB2 H 4.075 -0.724 -0.839 1.00 . A A . 26 ALA HB2 1 1 2 843 1 1 26 ALA HB3 H 3.341 -1.848 0.305 1.00 . A A . 26 ALA HB3 1 1 2 844 1 1 26 ALA N N 5.818 -2.480 0.184 1.00 . A A . 26 ALA N 1 1 2 845 1 1 26 ALA O O 6.734 -2.646 -2.432 1.00 . A A . 26 ALA O 1 1 2 846 1 1 27 ALA C C 4.660 -0.654 -5.307 1.00 . A A . 27 ALA C 1 1 2 847 1 1 27 ALA CA C 5.390 -1.796 -4.611 1.00 . A A . 27 ALA CA 1 1 2 848 1 1 27 ALA CB C 5.163 -3.087 -5.389 1.00 . A A . 27 ALA CB 1 1 2 849 1 1 27 ALA H H 3.830 -1.920 -3.126 1.00 . A A . 27 ALA H 1 1 2 850 1 1 27 ALA HA H 6.443 -1.589 -4.530 1.00 . A A . 27 ALA HA 1 1 2 851 1 1 27 ALA HB1 H 4.272 -2.986 -5.993 1.00 . A A . 27 ALA HB1 1 1 2 852 1 1 27 ALA HB2 H 5.037 -3.906 -4.698 1.00 . A A . 27 ALA HB2 1 1 2 853 1 1 27 ALA HB3 H 6.011 -3.275 -6.026 1.00 . A A . 27 ALA HB3 1 1 2 854 1 1 27 ALA N N 4.791 -2.053 -3.266 1.00 . A A . 27 ALA N 1 1 2 855 1 1 27 ALA O O 5.253 0.166 -5.981 1.00 . A A . 27 ALA O 1 1 2 856 1 1 28 CYS C C 2.659 0.327 -7.338 1.00 . A A . 28 CYS C 1 1 2 857 1 1 28 CYS CA C 2.558 0.442 -5.815 1.00 . A A . 28 CYS CA 1 1 2 858 1 1 28 CYS CB C 3.136 1.771 -5.319 1.00 . A A . 28 CYS CB 1 1 2 859 1 1 28 CYS H H 2.928 -1.307 -4.626 1.00 . A A . 28 CYS H 1 1 2 860 1 1 28 CYS HA H 1.537 0.349 -5.508 1.00 . A A . 28 CYS HA 1 1 2 861 1 1 28 CYS HB2 H 4.167 1.633 -5.026 1.00 . A A . 28 CYS HB2 1 1 2 862 1 1 28 CYS HB3 H 3.079 2.507 -6.109 1.00 . A A . 28 CYS HB3 1 1 2 863 1 1 28 CYS N N 3.371 -0.619 -5.162 1.00 . A A . 28 CYS N 1 1 2 864 1 1 28 CYS O O 3.727 0.147 -7.888 1.00 . A A . 28 CYS O 1 1 2 865 1 1 28 CYS SG S 2.180 2.344 -3.892 1.00 . A A . 28 CYS SG 1 1 2 866 1 1 29 THR C C 1.907 1.633 -10.166 1.00 . A A . 29 THR C 1 1 2 867 1 1 29 THR CA C 1.573 0.292 -9.508 1.00 . A A . 29 THR CA 1 1 2 868 1 1 29 THR CB C 0.158 -0.147 -9.887 1.00 . A A . 29 THR CB 1 1 2 869 1 1 29 THR CG2 C -0.124 -1.532 -9.304 1.00 . A A . 29 THR CG2 1 1 2 870 1 1 29 THR H H 0.694 0.548 -7.554 1.00 . A A . 29 THR H 1 1 2 871 1 1 29 THR HA H 2.280 -0.459 -9.810 1.00 . A A . 29 THR HA 1 1 2 872 1 1 29 THR HB H 0.068 -0.188 -10.961 1.00 . A A . 29 THR HB 1 1 2 873 1 1 29 THR HG1 H -0.926 1.462 -10.034 1.00 . A A . 29 THR HG1 1 1 2 874 1 1 29 THR HG21 H 0.231 -1.573 -8.284 1.00 . A A . 29 THR HG21 1 1 2 875 1 1 29 THR HG22 H 0.385 -2.282 -9.892 1.00 . A A . 29 THR HG22 1 1 2 876 1 1 29 THR HG23 H -1.188 -1.721 -9.322 1.00 . A A . 29 THR HG23 1 1 2 877 1 1 29 THR N N 1.548 0.415 -8.021 1.00 . A A . 29 THR N 1 1 2 878 1 1 29 THR O O 2.723 1.707 -11.063 1.00 . A A . 29 THR O 1 1 2 879 1 1 29 THR OG1 O -0.779 0.787 -9.367 1.00 . A A . 29 THR OG1 1 1 2 880 1 1 30 ARG C C 2.326 4.917 -9.395 1.00 . A A . 30 ARG C 1 1 2 881 1 1 30 ARG CA C 1.544 4.018 -10.356 1.00 . A A . 30 ARG CA 1 1 2 882 1 1 30 ARG CB C 0.162 4.610 -10.629 1.00 . A A . 30 ARG CB 1 1 2 883 1 1 30 ARG CD C 0.049 5.727 -12.860 1.00 . A A . 30 ARG CD 1 1 2 884 1 1 30 ARG CG C -0.195 4.419 -12.104 1.00 . A A . 30 ARG CG 1 1 2 885 1 1 30 ARG CZ C -1.551 4.973 -14.515 1.00 . A A . 30 ARG CZ 1 1 2 886 1 1 30 ARG H H 0.612 2.600 -9.024 1.00 . A A . 30 ARG H 1 1 2 887 1 1 30 ARG HA H 2.081 3.901 -11.283 1.00 . A A . 30 ARG HA 1 1 2 888 1 1 30 ARG HB2 H -0.572 4.107 -10.013 1.00 . A A . 30 ARG HB2 1 1 2 889 1 1 30 ARG HB3 H 0.169 5.665 -10.396 1.00 . A A . 30 ARG HB3 1 1 2 890 1 1 30 ARG HD2 H -0.559 6.518 -12.443 1.00 . A A . 30 ARG HD2 1 1 2 891 1 1 30 ARG HD3 H 1.093 5.993 -12.825 1.00 . A A . 30 ARG HD3 1 1 2 892 1 1 30 ARG HE H 0.269 5.602 -14.999 1.00 . A A . 30 ARG HE 1 1 2 893 1 1 30 ARG HG2 H 0.422 3.638 -12.526 1.00 . A A . 30 ARG HG2 1 1 2 894 1 1 30 ARG HG3 H -1.235 4.144 -12.191 1.00 . A A . 30 ARG HG3 1 1 2 895 1 1 30 ARG HH11 H -2.493 6.652 -13.964 1.00 . A A . 30 ARG HH11 1 1 2 896 1 1 30 ARG HH12 H -3.515 5.362 -14.506 1.00 . A A . 30 ARG HH12 1 1 2 897 1 1 30 ARG HH21 H -0.887 3.185 -15.123 1.00 . A A . 30 ARG HH21 1 1 2 898 1 1 30 ARG HH22 H -2.606 3.397 -15.159 1.00 . A A . 30 ARG HH22 1 1 2 899 1 1 30 ARG N N 1.273 2.686 -9.740 1.00 . A A . 30 ARG N 1 1 2 900 1 1 30 ARG NE N -0.358 5.440 -14.264 1.00 . A A . 30 ARG NE 1 1 2 901 1 1 30 ARG NH1 N -2.602 5.720 -14.312 1.00 . A A . 30 ARG NH1 1 1 2 902 1 1 30 ARG NH2 N -1.692 3.757 -14.968 1.00 . A A . 30 ARG NH2 1 1 2 903 1 1 30 ARG O O 2.639 4.536 -8.284 1.00 . A A . 30 ARG O 1 1 2 904 1 1 31 MET C C 2.935 8.489 -9.198 1.00 . A A . 31 MET C 1 1 2 905 1 1 31 MET CA C 3.395 7.050 -8.943 1.00 . A A . 31 MET CA 1 1 2 906 1 1 31 MET CB C 4.859 6.875 -9.345 1.00 . A A . 31 MET CB 1 1 2 907 1 1 31 MET CE C 6.280 8.437 -12.742 1.00 . A A . 31 MET CE 1 1 2 908 1 1 31 MET CG C 4.985 6.964 -10.866 1.00 . A A . 31 MET CG 1 1 2 909 1 1 31 MET H H 2.370 6.393 -10.720 1.00 . A A . 31 MET H 1 1 2 910 1 1 31 MET HA H 3.263 6.788 -7.905 1.00 . A A . 31 MET HA 1 1 2 911 1 1 31 MET HB2 H 5.452 7.654 -8.888 1.00 . A A . 31 MET HB2 1 1 2 912 1 1 31 MET HB3 H 5.212 5.911 -9.012 1.00 . A A . 31 MET HB3 1 1 2 913 1 1 31 MET HE1 H 6.621 7.941 -13.640 1.00 . A A . 31 MET HE1 1 1 2 914 1 1 31 MET HE2 H 6.770 9.393 -12.655 1.00 . A A . 31 MET HE2 1 1 2 915 1 1 31 MET HE3 H 5.210 8.586 -12.790 1.00 . A A . 31 MET HE3 1 1 2 916 1 1 31 MET HG2 H 4.744 6.006 -11.304 1.00 . A A . 31 MET HG2 1 1 2 917 1 1 31 MET HG3 H 4.304 7.713 -11.241 1.00 . A A . 31 MET HG3 1 1 2 918 1 1 31 MET N N 2.637 6.111 -9.820 1.00 . A A . 31 MET N 1 1 2 919 1 1 31 MET O O 3.542 9.218 -9.957 1.00 . A A . 31 MET O 1 1 2 920 1 1 31 MET SD S 6.682 7.418 -11.303 1.00 . A A . 31 MET SD 1 1 2 921 1 1 32 ALA C C 1.271 11.026 -7.446 1.00 . A A . 32 ALA C 1 1 2 922 1 1 32 ALA CA C 1.366 10.290 -8.784 1.00 . A A . 32 ALA CA 1 1 2 923 1 1 32 ALA CB C -0.022 10.120 -9.401 1.00 . A A . 32 ALA CB 1 1 2 924 1 1 32 ALA H H 1.388 8.295 -7.967 1.00 . A A . 32 ALA H 1 1 2 925 1 1 32 ALA HA H 2.009 10.824 -9.465 1.00 . A A . 32 ALA HA 1 1 2 926 1 1 32 ALA HB1 H 0.022 10.344 -10.456 1.00 . A A . 32 ALA HB1 1 1 2 927 1 1 32 ALA HB2 H -0.716 10.793 -8.918 1.00 . A A . 32 ALA HB2 1 1 2 928 1 1 32 ALA HB3 H -0.354 9.102 -9.263 1.00 . A A . 32 ALA HB3 1 1 2 929 1 1 32 ALA N N 1.866 8.900 -8.573 1.00 . A A . 32 ALA N 1 1 2 930 1 1 32 ALA O O 0.865 12.170 -7.385 1.00 . A A . 32 ALA O 1 1 2 931 1 1 33 CYS C C 2.808 11.909 -4.814 1.00 . A A . 33 CYS C 1 1 2 932 1 1 33 CYS CA C 1.565 11.045 -5.044 1.00 . A A . 33 CYS CA 1 1 2 933 1 1 33 CYS CB C 1.510 9.898 -4.034 1.00 . A A . 33 CYS CB 1 1 2 934 1 1 33 CYS H H 1.961 9.457 -6.445 1.00 . A A . 33 CYS H 1 1 2 935 1 1 33 CYS HA H 0.671 11.640 -4.972 1.00 . A A . 33 CYS HA 1 1 2 936 1 1 33 CYS HB2 H 1.460 8.956 -4.561 1.00 . A A . 33 CYS HB2 1 1 2 937 1 1 33 CYS HB3 H 2.395 9.921 -3.417 1.00 . A A . 33 CYS HB3 1 1 2 938 1 1 33 CYS N N 1.638 10.380 -6.375 1.00 . A A . 33 CYS N 1 1 2 939 1 1 33 CYS O O 3.921 11.444 -4.952 1.00 . A A . 33 CYS O 1 1 2 940 1 1 33 CYS SG S 0.043 10.086 -2.990 1.00 . A A . 33 CYS SG 1 1 2 941 1 1 34 PRO C C 4.372 13.773 -2.889 1.00 . A A . 34 PRO C 1 1 2 942 1 1 34 PRO CA C 3.687 14.093 -4.221 1.00 . A A . 34 PRO CA 1 1 2 943 1 1 34 PRO CB C 2.997 15.454 -4.166 1.00 . A A . 34 PRO CB 1 1 2 944 1 1 34 PRO CD C 1.260 13.778 -4.288 1.00 . A A . 34 PRO CD 1 1 2 945 1 1 34 PRO CG C 1.583 15.157 -3.774 1.00 . A A . 34 PRO CG 1 1 2 946 1 1 34 PRO HA H 4.396 14.072 -5.032 1.00 . A A . 34 PRO HA 1 1 2 947 1 1 34 PRO HB2 H 3.470 16.084 -3.425 1.00 . A A . 34 PRO HB2 1 1 2 948 1 1 34 PRO HB3 H 3.019 15.928 -5.134 1.00 . A A . 34 PRO HB3 1 1 2 949 1 1 34 PRO HD2 H 0.672 13.232 -3.561 1.00 . A A . 34 PRO HD2 1 1 2 950 1 1 34 PRO HD3 H 0.740 13.836 -5.233 1.00 . A A . 34 PRO HD3 1 1 2 951 1 1 34 PRO HG2 H 1.486 15.185 -2.698 1.00 . A A . 34 PRO HG2 1 1 2 952 1 1 34 PRO HG3 H 0.917 15.877 -4.225 1.00 . A A . 34 PRO HG3 1 1 2 953 1 1 34 PRO N N 2.572 13.148 -4.473 1.00 . A A . 34 PRO N 1 1 2 954 1 1 34 PRO O O 5.452 14.252 -2.605 1.00 . A A . 34 PRO O 1 1 2 955 1 1 35 GLN C C 4.887 13.875 -0.063 1.00 . A A . 35 GLN C 1 1 2 956 1 1 35 GLN CA C 4.366 12.615 -0.760 1.00 . A A . 35 GLN CA 1 1 2 957 1 1 35 GLN CB C 5.521 11.674 -1.102 1.00 . A A . 35 GLN CB 1 1 2 958 1 1 35 GLN CD C 6.519 9.426 -0.660 1.00 . A A . 35 GLN CD 1 1 2 959 1 1 35 GLN CG C 5.368 10.372 -0.314 1.00 . A A . 35 GLN CG 1 1 2 960 1 1 35 GLN H H 2.882 12.591 -2.321 1.00 . A A . 35 GLN H 1 1 2 961 1 1 35 GLN HA H 3.650 12.106 -0.133 1.00 . A A . 35 GLN HA 1 1 2 962 1 1 35 GLN HB2 H 5.509 11.460 -2.162 1.00 . A A . 35 GLN HB2 1 1 2 963 1 1 35 GLN HB3 H 6.458 12.143 -0.840 1.00 . A A . 35 GLN HB3 1 1 2 964 1 1 35 GLN HE21 H 7.516 9.799 1.016 1.00 . A A . 35 GLN HE21 1 1 2 965 1 1 35 GLN HE22 H 8.256 8.691 -0.036 1.00 . A A . 35 GLN HE22 1 1 2 966 1 1 35 GLN HG2 H 5.385 10.589 0.745 1.00 . A A . 35 GLN HG2 1 1 2 967 1 1 35 GLN HG3 H 4.430 9.904 -0.571 1.00 . A A . 35 GLN HG3 1 1 2 968 1 1 35 GLN N N 3.752 12.967 -2.072 1.00 . A A . 35 GLN N 1 1 2 969 1 1 35 GLN NE2 N 7.513 9.294 0.176 1.00 . A A . 35 GLN NE2 1 1 2 970 1 1 35 GLN O O 4.087 14.563 0.549 1.00 . A A . 35 GLN O 1 1 2 971 1 1 35 GLN OXT O 6.077 14.127 -0.152 1.00 . A A . 35 GLN OXT 1 1 2 972 1 1 35 GLN OE1 O 6.515 8.800 -1.702 1.00 . A A . 35 GLN OE1 1 1 3 973 1 1 1 GLU C C 3.373 0.007 8.074 1.00 . A A . 1 GLU C 1 1 3 974 1 1 1 GLU CA C 3.440 -1.103 9.124 1.00 . A A . 1 GLU CA 1 1 3 975 1 1 1 GLU CB C 4.890 -1.512 9.389 1.00 . A A . 1 GLU CB 1 1 3 976 1 1 1 GLU CD C 5.427 -1.988 11.782 1.00 . A A . 1 GLU CD 1 1 3 977 1 1 1 GLU CG C 5.356 -0.899 10.711 1.00 . A A . 1 GLU CG 1 1 3 978 1 1 1 GLU H1 H 2.975 -2.436 7.592 1.00 . A A . 1 GLU H1 1 1 3 979 1 1 1 GLU H2 H 1.751 -2.265 8.757 1.00 . A A . 1 GLU H2 1 1 3 980 1 1 1 GLU H3 H 3.146 -3.166 9.113 1.00 . A A . 1 GLU H3 1 1 3 981 1 1 1 GLU HA H 2.976 -0.782 10.039 1.00 . A A . 1 GLU HA 1 1 3 982 1 1 1 GLU HB2 H 4.953 -2.589 9.449 1.00 . A A . 1 GLU HB2 1 1 3 983 1 1 1 GLU HB3 H 5.519 -1.157 8.588 1.00 . A A . 1 GLU HB3 1 1 3 984 1 1 1 GLU HG2 H 6.333 -0.458 10.578 1.00 . A A . 1 GLU HG2 1 1 3 985 1 1 1 GLU HG3 H 4.656 -0.138 11.021 1.00 . A A . 1 GLU HG3 1 1 3 986 1 1 1 GLU N N 2.779 -2.335 8.608 1.00 . A A . 1 GLU N 1 1 3 987 1 1 1 GLU O O 2.751 1.029 8.279 1.00 . A A . 1 GLU O 1 1 3 988 1 1 1 GLU OE1 O 4.382 -2.371 12.281 1.00 . A A . 1 GLU OE1 1 1 3 989 1 1 1 GLU OE2 O 6.528 -2.421 12.087 1.00 . A A . 1 GLU OE2 1 1 3 990 1 1 2 VAL C C 2.594 1.472 5.781 1.00 . A A . 2 VAL C 1 1 3 991 1 1 2 VAL CA C 3.987 0.843 5.876 1.00 . A A . 2 VAL CA 1 1 3 992 1 1 2 VAL CB C 4.341 0.105 4.572 1.00 . A A . 2 VAL CB 1 1 3 993 1 1 2 VAL CG1 C 3.607 -1.239 4.479 1.00 . A A . 2 VAL CG1 1 1 3 994 1 1 2 VAL CG2 C 3.927 0.965 3.379 1.00 . A A . 2 VAL CG2 1 1 3 995 1 1 2 VAL H H 4.505 -1.025 6.823 1.00 . A A . 2 VAL H 1 1 3 996 1 1 2 VAL HA H 4.722 1.603 6.077 1.00 . A A . 2 VAL HA 1 1 3 997 1 1 2 VAL HB H 5.407 -0.067 4.536 1.00 . A A . 2 VAL HB 1 1 3 998 1 1 2 VAL HG11 H 4.176 -1.915 3.857 1.00 . A A . 2 VAL HG11 1 1 3 999 1 1 2 VAL HG12 H 2.632 -1.085 4.038 1.00 . A A . 2 VAL HG12 1 1 3 1000 1 1 2 VAL HG13 H 3.491 -1.667 5.460 1.00 . A A . 2 VAL HG13 1 1 3 1001 1 1 2 VAL HG21 H 4.727 0.987 2.656 1.00 . A A . 2 VAL HG21 1 1 3 1002 1 1 2 VAL HG22 H 3.715 1.969 3.718 1.00 . A A . 2 VAL HG22 1 1 3 1003 1 1 2 VAL HG23 H 3.041 0.543 2.926 1.00 . A A . 2 VAL HG23 1 1 3 1004 1 1 2 VAL N N 4.011 -0.193 6.954 1.00 . A A . 2 VAL N 1 1 3 1005 1 1 2 VAL O O 2.429 2.671 5.894 1.00 . A A . 2 VAL O 1 1 3 1006 1 1 3 THR C C -0.771 0.061 5.146 1.00 . A A . 3 THR C 1 1 3 1007 1 1 3 THR CA C 0.207 1.194 5.473 1.00 . A A . 3 THR CA 1 1 3 1008 1 1 3 THR CB C 0.251 2.207 4.328 1.00 . A A . 3 THR CB 1 1 3 1009 1 1 3 THR CG2 C 0.963 1.590 3.125 1.00 . A A . 3 THR CG2 1 1 3 1010 1 1 3 THR H H 1.766 -0.289 5.490 1.00 . A A . 3 THR H 1 1 3 1011 1 1 3 THR HA H -0.078 1.686 6.388 1.00 . A A . 3 THR HA 1 1 3 1012 1 1 3 THR HB H 0.786 3.087 4.647 1.00 . A A . 3 THR HB 1 1 3 1013 1 1 3 THR HG1 H -1.325 3.335 4.479 1.00 . A A . 3 THR HG1 1 1 3 1014 1 1 3 THR HG21 H 1.177 0.550 3.325 1.00 . A A . 3 THR HG21 1 1 3 1015 1 1 3 THR HG22 H 1.888 2.118 2.945 1.00 . A A . 3 THR HG22 1 1 3 1016 1 1 3 THR HG23 H 0.331 1.666 2.253 1.00 . A A . 3 THR HG23 1 1 3 1017 1 1 3 THR N N 1.598 0.666 5.575 1.00 . A A . 3 THR N 1 1 3 1018 1 1 3 THR O O -1.822 0.283 4.578 1.00 . A A . 3 THR O 1 1 3 1019 1 1 3 THR OG1 O -1.075 2.564 3.966 1.00 . A A . 3 THR OG1 1 1 3 1020 1 1 4 CYS C C -0.798 -3.592 5.769 1.00 . A A . 4 CYS C 1 1 3 1021 1 1 4 CYS CA C -1.356 -2.288 5.195 1.00 . A A . 4 CYS CA 1 1 3 1022 1 1 4 CYS CB C -1.396 -2.360 3.671 1.00 . A A . 4 CYS CB 1 1 3 1023 1 1 4 CYS H H 0.415 -1.320 5.950 1.00 . A A . 4 CYS H 1 1 3 1024 1 1 4 CYS HA H -2.343 -2.093 5.583 1.00 . A A . 4 CYS HA 1 1 3 1025 1 1 4 CYS HB2 H -1.956 -3.233 3.365 1.00 . A A . 4 CYS HB2 1 1 3 1026 1 1 4 CYS HB3 H -1.868 -1.470 3.279 1.00 . A A . 4 CYS HB3 1 1 3 1027 1 1 4 CYS N N -0.437 -1.154 5.496 1.00 . A A . 4 CYS N 1 1 3 1028 1 1 4 CYS O O 0.273 -3.624 6.342 1.00 . A A . 4 CYS O 1 1 3 1029 1 1 4 CYS SG S 0.297 -2.474 3.039 1.00 . A A . 4 CYS SG 1 1 3 1030 1 1 5 GLU C C -0.442 -6.794 4.956 1.00 . A A . 5 GLU C 1 1 3 1031 1 1 5 GLU CA C -1.021 -5.980 6.115 1.00 . A A . 5 GLU CA 1 1 3 1032 1 1 5 GLU CB C -2.256 -6.667 6.699 1.00 . A A . 5 GLU CB 1 1 3 1033 1 1 5 GLU CD C -3.940 -6.105 8.462 1.00 . A A . 5 GLU CD 1 1 3 1034 1 1 5 GLU CG C -2.447 -6.222 8.152 1.00 . A A . 5 GLU CG 1 1 3 1035 1 1 5 GLU H H -2.366 -4.622 5.123 1.00 . A A . 5 GLU H 1 1 3 1036 1 1 5 GLU HA H -0.279 -5.831 6.883 1.00 . A A . 5 GLU HA 1 1 3 1037 1 1 5 GLU HB2 H -3.127 -6.396 6.120 1.00 . A A . 5 GLU HB2 1 1 3 1038 1 1 5 GLU HB3 H -2.121 -7.737 6.667 1.00 . A A . 5 GLU HB3 1 1 3 1039 1 1 5 GLU HG2 H -1.997 -6.949 8.812 1.00 . A A . 5 GLU HG2 1 1 3 1040 1 1 5 GLU HG3 H -1.975 -5.263 8.298 1.00 . A A . 5 GLU HG3 1 1 3 1041 1 1 5 GLU N N -1.511 -4.671 5.601 1.00 . A A . 5 GLU N 1 1 3 1042 1 1 5 GLU O O -0.854 -6.636 3.824 1.00 . A A . 5 GLU O 1 1 3 1043 1 1 5 GLU OE1 O -4.662 -7.043 8.168 1.00 . A A . 5 GLU OE1 1 1 3 1044 1 1 5 GLU OE2 O -4.336 -5.078 8.989 1.00 . A A . 5 GLU OE2 1 1 3 1045 1 1 6 PRO C C 0.193 -9.545 3.718 1.00 . A A . 6 PRO C 1 1 3 1046 1 1 6 PRO CA C 1.154 -8.469 4.232 1.00 . A A . 6 PRO CA 1 1 3 1047 1 1 6 PRO CB C 2.339 -9.095 4.963 1.00 . A A . 6 PRO CB 1 1 3 1048 1 1 6 PRO CD C 1.053 -7.889 6.609 1.00 . A A . 6 PRO CD 1 1 3 1049 1 1 6 PRO CG C 1.950 -9.084 6.406 1.00 . A A . 6 PRO CG 1 1 3 1050 1 1 6 PRO HA H 1.506 -7.856 3.419 1.00 . A A . 6 PRO HA 1 1 3 1051 1 1 6 PRO HB2 H 2.498 -10.109 4.620 1.00 . A A . 6 PRO HB2 1 1 3 1052 1 1 6 PRO HB3 H 3.228 -8.503 4.815 1.00 . A A . 6 PRO HB3 1 1 3 1053 1 1 6 PRO HD2 H 0.263 -8.124 7.309 1.00 . A A . 6 PRO HD2 1 1 3 1054 1 1 6 PRO HD3 H 1.624 -7.036 6.946 1.00 . A A . 6 PRO HD3 1 1 3 1055 1 1 6 PRO HG2 H 1.418 -9.994 6.651 1.00 . A A . 6 PRO HG2 1 1 3 1056 1 1 6 PRO HG3 H 2.830 -8.987 7.026 1.00 . A A . 6 PRO HG3 1 1 3 1057 1 1 6 PRO N N 0.505 -7.634 5.272 1.00 . A A . 6 PRO N 1 1 3 1058 1 1 6 PRO O O -0.374 -10.302 4.481 1.00 . A A . 6 PRO O 1 1 3 1059 1 1 7 GLY C C -2.170 -9.974 1.317 1.00 . A A . 7 GLY C 1 1 3 1060 1 1 7 GLY CA C -0.909 -10.647 1.863 1.00 . A A . 7 GLY CA 1 1 3 1061 1 1 7 GLY H H 0.480 -9.001 1.830 1.00 . A A . 7 GLY H 1 1 3 1062 1 1 7 GLY HA2 H -0.407 -11.174 1.062 1.00 . A A . 7 GLY HA2 1 1 3 1063 1 1 7 GLY HA3 H -1.185 -11.346 2.638 1.00 . A A . 7 GLY HA3 1 1 3 1064 1 1 7 GLY N N 0.010 -9.619 2.427 1.00 . A A . 7 GLY N 1 1 3 1065 1 1 7 GLY O O -3.238 -10.552 1.317 1.00 . A A . 7 GLY O 1 1 3 1066 1 1 8 THR C C -2.840 -6.831 -0.511 1.00 . A A . 8 THR C 1 1 3 1067 1 1 8 THR CA C -3.259 -8.058 0.304 1.00 . A A . 8 THR CA 1 1 3 1068 1 1 8 THR CB C -4.063 -7.632 1.534 1.00 . A A . 8 THR CB 1 1 3 1069 1 1 8 THR CG2 C -5.422 -7.088 1.095 1.00 . A A . 8 THR CG2 1 1 3 1070 1 1 8 THR H H -1.187 -8.308 0.855 1.00 . A A . 8 THR H 1 1 3 1071 1 1 8 THR HA H -3.844 -8.731 -0.303 1.00 . A A . 8 THR HA 1 1 3 1072 1 1 8 THR HB H -3.526 -6.861 2.065 1.00 . A A . 8 THR HB 1 1 3 1073 1 1 8 THR HG1 H -3.518 -8.782 3.004 1.00 . A A . 8 THR HG1 1 1 3 1074 1 1 8 THR HG21 H -6.082 -7.035 1.948 1.00 . A A . 8 THR HG21 1 1 3 1075 1 1 8 THR HG22 H -5.849 -7.743 0.350 1.00 . A A . 8 THR HG22 1 1 3 1076 1 1 8 THR HG23 H -5.296 -6.100 0.675 1.00 . A A . 8 THR HG23 1 1 3 1077 1 1 8 THR N N -2.058 -8.759 0.850 1.00 . A A . 8 THR N 1 1 3 1078 1 1 8 THR O O -1.695 -6.424 -0.496 1.00 . A A . 8 THR O 1 1 3 1079 1 1 8 THR OG1 O -4.252 -8.752 2.387 1.00 . A A . 8 THR OG1 1 1 3 1080 1 1 9 THR C C -4.341 -3.865 -1.647 1.00 . A A . 9 THR C 1 1 3 1081 1 1 9 THR CA C -3.425 -5.031 -2.033 1.00 . A A . 9 THR CA 1 1 3 1082 1 1 9 THR CB C -3.674 -5.449 -3.483 1.00 . A A . 9 THR CB 1 1 3 1083 1 1 9 THR CG2 C -5.090 -6.007 -3.618 1.00 . A A . 9 THR CG2 1 1 3 1084 1 1 9 THR H H -4.680 -6.580 -1.214 1.00 . A A . 9 THR H 1 1 3 1085 1 1 9 THR HA H -2.390 -4.760 -1.898 1.00 . A A . 9 THR HA 1 1 3 1086 1 1 9 THR HB H -2.963 -6.210 -3.766 1.00 . A A . 9 THR HB 1 1 3 1087 1 1 9 THR HG1 H -3.163 -4.624 -5.169 1.00 . A A . 9 THR HG1 1 1 3 1088 1 1 9 THR HG21 H -5.476 -5.779 -4.601 1.00 . A A . 9 THR HG21 1 1 3 1089 1 1 9 THR HG22 H -5.726 -5.559 -2.869 1.00 . A A . 9 THR HG22 1 1 3 1090 1 1 9 THR HG23 H -5.070 -7.077 -3.479 1.00 . A A . 9 THR HG23 1 1 3 1091 1 1 9 THR N N -3.762 -6.236 -1.220 1.00 . A A . 9 THR N 1 1 3 1092 1 1 9 THR O O -5.372 -4.055 -1.033 1.00 . A A . 9 THR O 1 1 3 1093 1 1 9 THR OG1 O -3.522 -4.319 -4.332 1.00 . A A . 9 THR OG1 1 1 3 1094 1 1 10 PHE C C -4.219 -0.199 -2.199 1.00 . A A . 10 PHE C 1 1 3 1095 1 1 10 PHE CA C -4.827 -1.491 -1.643 1.00 . A A . 10 PHE CA 1 1 3 1096 1 1 10 PHE CB C -4.824 -1.456 -0.116 1.00 . A A . 10 PHE CB 1 1 3 1097 1 1 10 PHE CD1 C -2.361 -1.920 0.136 1.00 . A A . 10 PHE CD1 1 1 3 1098 1 1 10 PHE CD2 C -3.255 0.147 1.035 1.00 . A A . 10 PHE CD2 1 1 3 1099 1 1 10 PHE CE1 C -1.084 -1.559 0.576 1.00 . A A . 10 PHE CE1 1 1 3 1100 1 1 10 PHE CE2 C -1.977 0.509 1.474 1.00 . A A . 10 PHE CE2 1 1 3 1101 1 1 10 PHE CG C -3.448 -1.068 0.365 1.00 . A A . 10 PHE CG 1 1 3 1102 1 1 10 PHE CZ C -0.891 -0.346 1.245 1.00 . A A . 10 PHE CZ 1 1 3 1103 1 1 10 PHE H H -3.138 -2.529 -2.492 1.00 . A A . 10 PHE H 1 1 3 1104 1 1 10 PHE HA H -5.832 -1.626 -2.008 1.00 . A A . 10 PHE HA 1 1 3 1105 1 1 10 PHE HB2 H -5.547 -0.733 0.231 1.00 . A A . 10 PHE HB2 1 1 3 1106 1 1 10 PHE HB3 H -5.076 -2.433 0.269 1.00 . A A . 10 PHE HB3 1 1 3 1107 1 1 10 PHE HD1 H -2.509 -2.857 -0.379 1.00 . A A . 10 PHE HD1 1 1 3 1108 1 1 10 PHE HD2 H -4.093 0.806 1.210 1.00 . A A . 10 PHE HD2 1 1 3 1109 1 1 10 PHE HE1 H -0.246 -2.217 0.400 1.00 . A A . 10 PHE HE1 1 1 3 1110 1 1 10 PHE HE2 H -1.828 1.446 1.991 1.00 . A A . 10 PHE HE2 1 1 3 1111 1 1 10 PHE HZ H 0.096 -0.069 1.584 1.00 . A A . 10 PHE HZ 1 1 3 1112 1 1 10 PHE N N -3.974 -2.663 -1.998 1.00 . A A . 10 PHE N 1 1 3 1113 1 1 10 PHE O O -3.075 -0.162 -2.606 1.00 . A A . 10 PHE O 1 1 3 1114 1 1 11 LYS C C -4.236 3.137 -1.569 1.00 . A A . 11 LYS C 1 1 3 1115 1 1 11 LYS CA C -4.449 2.157 -2.727 1.00 . A A . 11 LYS CA 1 1 3 1116 1 1 11 LYS CB C -5.533 2.677 -3.671 1.00 . A A . 11 LYS CB 1 1 3 1117 1 1 11 LYS CD C -6.416 4.709 -4.825 1.00 . A A . 11 LYS CD 1 1 3 1118 1 1 11 LYS CE C -6.593 3.919 -6.125 1.00 . A A . 11 LYS CE 1 1 3 1119 1 1 11 LYS CG C -5.240 4.135 -4.033 1.00 . A A . 11 LYS CG 1 1 3 1120 1 1 11 LYS H H -5.895 0.810 -1.871 1.00 . A A . 11 LYS H 1 1 3 1121 1 1 11 LYS HA H -3.529 2.002 -3.268 1.00 . A A . 11 LYS HA 1 1 3 1122 1 1 11 LYS HB2 H -5.545 2.078 -4.570 1.00 . A A . 11 LYS HB2 1 1 3 1123 1 1 11 LYS HB3 H -6.494 2.615 -3.184 1.00 . A A . 11 LYS HB3 1 1 3 1124 1 1 11 LYS HD2 H -7.318 4.637 -4.234 1.00 . A A . 11 LYS HD2 1 1 3 1125 1 1 11 LYS HD3 H -6.221 5.745 -5.060 1.00 . A A . 11 LYS HD3 1 1 3 1126 1 1 11 LYS HE2 H -6.879 4.583 -6.930 1.00 . A A . 11 LYS HE2 1 1 3 1127 1 1 11 LYS HE3 H -5.684 3.394 -6.372 1.00 . A A . 11 LYS HE3 1 1 3 1128 1 1 11 LYS HG2 H -5.101 4.709 -3.128 1.00 . A A . 11 LYS HG2 1 1 3 1129 1 1 11 LYS HG3 H -4.345 4.186 -4.633 1.00 . A A . 11 LYS HG3 1 1 3 1130 1 1 11 LYS HZ1 H -7.274 2.062 -5.478 1.00 . A A . 11 LYS HZ1 1 1 3 1131 1 1 11 LYS HZ2 H -8.210 2.749 -6.717 1.00 . A A . 11 LYS HZ2 1 1 3 1132 1 1 11 LYS HZ3 H -8.329 3.343 -5.131 1.00 . A A . 11 LYS HZ3 1 1 3 1133 1 1 11 LYS N N -4.978 0.862 -2.209 1.00 . A A . 11 LYS N 1 1 3 1134 1 1 11 LYS NZ N -7.683 2.945 -5.841 1.00 . A A . 11 LYS NZ 1 1 3 1135 1 1 11 LYS O O -5.158 3.475 -0.854 1.00 . A A . 11 LYS O 1 1 3 1136 1 1 12 ASP C C -2.731 5.983 -0.786 1.00 . A A . 12 ASP C 1 1 3 1137 1 1 12 ASP CA C -2.766 4.546 -0.260 1.00 . A A . 12 ASP CA 1 1 3 1138 1 1 12 ASP CB C -1.397 4.143 0.291 1.00 . A A . 12 ASP CB 1 1 3 1139 1 1 12 ASP CG C -0.902 5.216 1.260 1.00 . A A . 12 ASP CG 1 1 3 1140 1 1 12 ASP H H -2.296 3.309 -1.960 1.00 . A A . 12 ASP H 1 1 3 1141 1 1 12 ASP HA H -3.515 4.445 0.507 1.00 . A A . 12 ASP HA 1 1 3 1142 1 1 12 ASP HB2 H -1.483 3.198 0.810 1.00 . A A . 12 ASP HB2 1 1 3 1143 1 1 12 ASP HB3 H -0.695 4.045 -0.526 1.00 . A A . 12 ASP HB3 1 1 3 1144 1 1 12 ASP N N -3.030 3.593 -1.376 1.00 . A A . 12 ASP N 1 1 3 1145 1 1 12 ASP O O -3.705 6.705 -0.713 1.00 . A A . 12 ASP O 1 1 3 1146 1 1 12 ASP OD1 O -1.720 5.749 1.992 1.00 . A A . 12 ASP OD1 1 1 3 1147 1 1 12 ASP OD2 O 0.287 5.488 1.256 1.00 . A A . 12 ASP OD2 1 1 3 1148 1 1 13 LYS C C -2.397 7.943 -3.093 1.00 . A A . 13 LYS C 1 1 3 1149 1 1 13 LYS CA C -1.514 7.789 -1.842 1.00 . A A . 13 LYS CA 1 1 3 1150 1 1 13 LYS CB C -0.027 7.970 -2.162 1.00 . A A . 13 LYS CB 1 1 3 1151 1 1 13 LYS CD C 1.850 8.529 -0.609 1.00 . A A . 13 LYS CD 1 1 3 1152 1 1 13 LYS CE C 3.215 7.857 -0.438 1.00 . A A . 13 LYS CE 1 1 3 1153 1 1 13 LYS CG C 0.806 7.475 -0.979 1.00 . A A . 13 LYS CG 1 1 3 1154 1 1 13 LYS H H -0.843 5.800 -1.358 1.00 . A A . 13 LYS H 1 1 3 1155 1 1 13 LYS HA H -1.814 8.497 -1.086 1.00 . A A . 13 LYS HA 1 1 3 1156 1 1 13 LYS HB2 H 0.232 7.398 -3.039 1.00 . A A . 13 LYS HB2 1 1 3 1157 1 1 13 LYS HB3 H 0.181 9.016 -2.331 1.00 . A A . 13 LYS HB3 1 1 3 1158 1 1 13 LYS HD2 H 1.908 9.270 -1.393 1.00 . A A . 13 LYS HD2 1 1 3 1159 1 1 13 LYS HD3 H 1.568 9.005 0.319 1.00 . A A . 13 LYS HD3 1 1 3 1160 1 1 13 LYS HE2 H 3.454 7.754 0.612 1.00 . A A . 13 LYS HE2 1 1 3 1161 1 1 13 LYS HE3 H 3.224 6.895 -0.924 1.00 . A A . 13 LYS HE3 1 1 3 1162 1 1 13 LYS HG2 H 0.159 7.293 -0.135 1.00 . A A . 13 LYS HG2 1 1 3 1163 1 1 13 LYS HG3 H 1.306 6.558 -1.252 1.00 . A A . 13 LYS HG3 1 1 3 1164 1 1 13 LYS HZ1 H 5.046 8.251 -1.347 1.00 . A A . 13 LYS HZ1 1 1 3 1165 1 1 13 LYS HZ2 H 4.416 9.557 -0.462 1.00 . A A . 13 LYS HZ2 1 1 3 1166 1 1 13 LYS HZ3 H 3.756 9.154 -1.975 1.00 . A A . 13 LYS HZ3 1 1 3 1167 1 1 13 LYS N N -1.616 6.400 -1.313 1.00 . A A . 13 LYS N 1 1 3 1168 1 1 13 LYS NZ N 4.181 8.774 -1.106 1.00 . A A . 13 LYS NZ 1 1 3 1169 1 1 13 LYS O O -3.602 8.064 -2.991 1.00 . A A . 13 LYS O 1 1 3 1170 1 1 14 CYS C C -2.427 6.861 -6.411 1.00 . A A . 14 CYS C 1 1 3 1171 1 1 14 CYS CA C -2.655 8.070 -5.498 1.00 . A A . 14 CYS CA 1 1 3 1172 1 1 14 CYS CB C -2.177 9.362 -6.166 1.00 . A A . 14 CYS CB 1 1 3 1173 1 1 14 CYS H H -0.858 7.827 -4.350 1.00 . A A . 14 CYS H 1 1 3 1174 1 1 14 CYS HA H -3.699 8.152 -5.239 1.00 . A A . 14 CYS HA 1 1 3 1175 1 1 14 CYS HB2 H -2.661 9.468 -7.128 1.00 . A A . 14 CYS HB2 1 1 3 1176 1 1 14 CYS HB3 H -2.433 10.204 -5.539 1.00 . A A . 14 CYS HB3 1 1 3 1177 1 1 14 CYS N N -1.825 7.932 -4.270 1.00 . A A . 14 CYS N 1 1 3 1178 1 1 14 CYS O O -2.425 6.970 -7.620 1.00 . A A . 14 CYS O 1 1 3 1179 1 1 14 CYS SG S -0.383 9.306 -6.399 1.00 . A A . 14 CYS SG 1 1 3 1180 1 1 15 ASN C C -2.238 3.236 -5.774 1.00 . A A . 15 ASN C 1 1 3 1181 1 1 15 ASN CA C -2.008 4.479 -6.639 1.00 . A A . 15 ASN CA 1 1 3 1182 1 1 15 ASN CB C -0.546 4.561 -7.081 1.00 . A A . 15 ASN CB 1 1 3 1183 1 1 15 ASN CG C 0.360 4.584 -5.848 1.00 . A A . 15 ASN CG 1 1 3 1184 1 1 15 ASN H H -2.244 5.651 -4.849 1.00 . A A . 15 ASN H 1 1 3 1185 1 1 15 ASN HA H -2.655 4.467 -7.501 1.00 . A A . 15 ASN HA 1 1 3 1186 1 1 15 ASN HB2 H -0.304 3.701 -7.689 1.00 . A A . 15 ASN HB2 1 1 3 1187 1 1 15 ASN HB3 H -0.392 5.465 -7.654 1.00 . A A . 15 ASN HB3 1 1 3 1188 1 1 15 ASN HD21 H 2.028 4.813 -6.904 1.00 . A A . 15 ASN HD21 1 1 3 1189 1 1 15 ASN HD22 H 2.238 4.741 -5.212 1.00 . A A . 15 ASN HD22 1 1 3 1190 1 1 15 ASN N N -2.235 5.708 -5.827 1.00 . A A . 15 ASN N 1 1 3 1191 1 1 15 ASN ND2 N 1.648 4.725 -6.000 1.00 . A A . 15 ASN ND2 1 1 3 1192 1 1 15 ASN O O -2.411 3.330 -4.575 1.00 . A A . 15 ASN O 1 1 3 1193 1 1 15 ASN OD1 O -0.111 4.473 -4.733 1.00 . A A . 15 ASN OD1 1 1 3 1194 1 1 16 THR C C -1.191 0.476 -4.790 1.00 . A A . 16 THR C 1 1 3 1195 1 1 16 THR CA C -2.460 0.833 -5.567 1.00 . A A . 16 THR CA 1 1 3 1196 1 1 16 THR CB C -2.781 -0.250 -6.596 1.00 . A A . 16 THR CB 1 1 3 1197 1 1 16 THR CG2 C -3.619 -1.345 -5.937 1.00 . A A . 16 THR CG2 1 1 3 1198 1 1 16 THR H H -2.100 2.015 -7.335 1.00 . A A . 16 THR H 1 1 3 1199 1 1 16 THR HA H -3.293 0.960 -4.894 1.00 . A A . 16 THR HA 1 1 3 1200 1 1 16 THR HB H -1.862 -0.681 -6.966 1.00 . A A . 16 THR HB 1 1 3 1201 1 1 16 THR HG1 H -4.440 0.294 -7.453 1.00 . A A . 16 THR HG1 1 1 3 1202 1 1 16 THR HG21 H -3.093 -2.286 -5.993 1.00 . A A . 16 THR HG21 1 1 3 1203 1 1 16 THR HG22 H -4.567 -1.431 -6.448 1.00 . A A . 16 THR HG22 1 1 3 1204 1 1 16 THR HG23 H -3.793 -1.090 -4.901 1.00 . A A . 16 THR HG23 1 1 3 1205 1 1 16 THR N N -2.242 2.073 -6.367 1.00 . A A . 16 THR N 1 1 3 1206 1 1 16 THR O O -0.287 1.274 -4.672 1.00 . A A . 16 THR O 1 1 3 1207 1 1 16 THR OG1 O -3.506 0.322 -7.676 1.00 . A A . 16 THR OG1 1 1 3 1208 1 1 17 CYS C C -0.120 -2.508 -2.867 1.00 . A A . 17 CYS C 1 1 3 1209 1 1 17 CYS CA C 0.095 -1.131 -3.495 1.00 . A A . 17 CYS CA 1 1 3 1210 1 1 17 CYS CB C 0.276 -0.063 -2.413 1.00 . A A . 17 CYS CB 1 1 3 1211 1 1 17 CYS H H -1.863 -1.347 -4.373 1.00 . A A . 17 CYS H 1 1 3 1212 1 1 17 CYS HA H 0.958 -1.151 -4.138 1.00 . A A . 17 CYS HA 1 1 3 1213 1 1 17 CYS HB2 H -0.357 0.786 -2.631 1.00 . A A . 17 CYS HB2 1 1 3 1214 1 1 17 CYS HB3 H 0.006 -0.478 -1.451 1.00 . A A . 17 CYS HB3 1 1 3 1215 1 1 17 CYS N N -1.119 -0.718 -4.263 1.00 . A A . 17 CYS N 1 1 3 1216 1 1 17 CYS O O -0.864 -2.664 -1.919 1.00 . A A . 17 CYS O 1 1 3 1217 1 1 17 CYS SG S 2.008 0.465 -2.375 1.00 . A A . 17 CYS SG 1 1 3 1218 1 1 18 ARG C C 1.237 -5.042 -1.577 1.00 . A A . 18 ARG C 1 1 3 1219 1 1 18 ARG CA C 0.373 -4.883 -2.830 1.00 . A A . 18 ARG CA 1 1 3 1220 1 1 18 ARG CB C 0.856 -5.821 -3.935 1.00 . A A . 18 ARG CB 1 1 3 1221 1 1 18 ARG CD C -0.523 -7.896 -4.136 1.00 . A A . 18 ARG CD 1 1 3 1222 1 1 18 ARG CG C 0.709 -7.273 -3.477 1.00 . A A . 18 ARG CG 1 1 3 1223 1 1 18 ARG CZ C 0.572 -9.095 -5.930 1.00 . A A . 18 ARG CZ 1 1 3 1224 1 1 18 ARG H H 1.127 -3.362 -4.154 1.00 . A A . 18 ARG H 1 1 3 1225 1 1 18 ARG HA H -0.663 -5.082 -2.603 1.00 . A A . 18 ARG HA 1 1 3 1226 1 1 18 ARG HB2 H 0.265 -5.661 -4.825 1.00 . A A . 18 ARG HB2 1 1 3 1227 1 1 18 ARG HB3 H 1.894 -5.617 -4.151 1.00 . A A . 18 ARG HB3 1 1 3 1228 1 1 18 ARG HD2 H -0.745 -8.853 -3.684 1.00 . A A . 18 ARG HD2 1 1 3 1229 1 1 18 ARG HD3 H -1.371 -7.234 -4.054 1.00 . A A . 18 ARG HD3 1 1 3 1230 1 1 18 ARG HE H -0.438 -7.414 -6.233 1.00 . A A . 18 ARG HE 1 1 3 1231 1 1 18 ARG HG2 H 1.591 -7.829 -3.758 1.00 . A A . 18 ARG HG2 1 1 3 1232 1 1 18 ARG HG3 H 0.592 -7.301 -2.404 1.00 . A A . 18 ARG HG3 1 1 3 1233 1 1 18 ARG HH11 H -0.350 -10.373 -4.695 1.00 . A A . 18 ARG HH11 1 1 3 1234 1 1 18 ARG HH12 H 0.913 -11.052 -5.667 1.00 . A A . 18 ARG HH12 1 1 3 1235 1 1 18 ARG HH21 H 1.663 -8.057 -7.249 1.00 . A A . 18 ARG HH21 1 1 3 1236 1 1 18 ARG HH22 H 2.054 -9.739 -7.114 1.00 . A A . 18 ARG HH22 1 1 3 1237 1 1 18 ARG N N 0.531 -3.511 -3.390 1.00 . A A . 18 ARG N 1 1 3 1238 1 1 18 ARG NE N -0.146 -8.070 -5.566 1.00 . A A . 18 ARG NE 1 1 3 1239 1 1 18 ARG NH1 N 0.362 -10.264 -5.389 1.00 . A A . 18 ARG NH1 1 1 3 1240 1 1 18 ARG NH2 N 1.503 -8.953 -6.836 1.00 . A A . 18 ARG NH2 1 1 3 1241 1 1 18 ARG O O 2.421 -5.300 -1.657 1.00 . A A . 18 ARG O 1 1 3 1242 1 1 19 CYS C C 2.406 -6.206 0.743 1.00 . A A . 19 CYS C 1 1 3 1243 1 1 19 CYS CA C 1.435 -5.025 0.838 1.00 . A A . 19 CYS CA 1 1 3 1244 1 1 19 CYS CB C 0.390 -5.280 1.921 1.00 . A A . 19 CYS CB 1 1 3 1245 1 1 19 CYS H H -0.304 -4.674 -0.383 1.00 . A A . 19 CYS H 1 1 3 1246 1 1 19 CYS HA H 1.970 -4.113 1.052 1.00 . A A . 19 CYS HA 1 1 3 1247 1 1 19 CYS HB2 H -0.577 -4.938 1.576 1.00 . A A . 19 CYS HB2 1 1 3 1248 1 1 19 CYS HB3 H 0.345 -6.338 2.135 1.00 . A A . 19 CYS HB3 1 1 3 1249 1 1 19 CYS N N 0.652 -4.885 -0.422 1.00 . A A . 19 CYS N 1 1 3 1250 1 1 19 CYS O O 2.002 -7.345 0.602 1.00 . A A . 19 CYS O 1 1 3 1251 1 1 19 CYS SG S 0.847 -4.380 3.421 1.00 . A A . 19 CYS SG 1 1 3 1252 1 1 20 GLY C C 4.326 -8.139 1.746 1.00 . A A . 20 GLY C 1 1 3 1253 1 1 20 GLY CA C 4.681 -7.047 0.734 1.00 . A A . 20 GLY CA 1 1 3 1254 1 1 20 GLY H H 3.984 -5.018 0.934 1.00 . A A . 20 GLY H 1 1 3 1255 1 1 20 GLY HA2 H 4.674 -7.462 -0.264 1.00 . A A . 20 GLY HA2 1 1 3 1256 1 1 20 GLY HA3 H 5.664 -6.659 0.959 1.00 . A A . 20 GLY HA3 1 1 3 1257 1 1 20 GLY N N 3.682 -5.943 0.819 1.00 . A A . 20 GLY N 1 1 3 1258 1 1 20 GLY O O 3.394 -8.009 2.513 1.00 . A A . 20 GLY O 1 1 3 1259 1 1 21 SER C C 5.320 -9.964 4.104 1.00 . A A . 21 SER C 1 1 3 1260 1 1 21 SER CA C 4.771 -10.313 2.719 1.00 . A A . 21 SER CA 1 1 3 1261 1 1 21 SER CB C 5.489 -11.537 2.153 1.00 . A A . 21 SER CB 1 1 3 1262 1 1 21 SER H H 5.815 -9.299 1.129 1.00 . A A . 21 SER H 1 1 3 1263 1 1 21 SER HA H 3.709 -10.498 2.769 1.00 . A A . 21 SER HA 1 1 3 1264 1 1 21 SER HB2 H 4.891 -12.417 2.322 1.00 . A A . 21 SER HB2 1 1 3 1265 1 1 21 SER HB3 H 5.638 -11.406 1.089 1.00 . A A . 21 SER HB3 1 1 3 1266 1 1 21 SER HG H 7.434 -11.565 2.154 1.00 . A A . 21 SER HG 1 1 3 1267 1 1 21 SER N N 5.066 -9.214 1.756 1.00 . A A . 21 SER N 1 1 3 1268 1 1 21 SER O O 5.109 -10.676 5.065 1.00 . A A . 21 SER O 1 1 3 1269 1 1 21 SER OG O 6.741 -11.691 2.806 1.00 . A A . 21 SER OG 1 1 3 1270 1 1 22 ASP C C 5.627 -7.525 6.258 1.00 . A A . 22 ASP C 1 1 3 1271 1 1 22 ASP CA C 6.587 -8.476 5.536 1.00 . A A . 22 ASP CA 1 1 3 1272 1 1 22 ASP CB C 7.904 -7.770 5.213 1.00 . A A . 22 ASP CB 1 1 3 1273 1 1 22 ASP CG C 8.844 -7.875 6.413 1.00 . A A . 22 ASP CG 1 1 3 1274 1 1 22 ASP H H 6.184 -8.308 3.427 1.00 . A A . 22 ASP H 1 1 3 1275 1 1 22 ASP HA H 6.776 -9.349 6.141 1.00 . A A . 22 ASP HA 1 1 3 1276 1 1 22 ASP HB2 H 8.361 -8.240 4.352 1.00 . A A . 22 ASP HB2 1 1 3 1277 1 1 22 ASP HB3 H 7.711 -6.728 4.997 1.00 . A A . 22 ASP HB3 1 1 3 1278 1 1 22 ASP N N 6.024 -8.870 4.214 1.00 . A A . 22 ASP N 1 1 3 1279 1 1 22 ASP O O 5.724 -7.317 7.451 1.00 . A A . 22 ASP O 1 1 3 1280 1 1 22 ASP OD1 O 8.401 -7.591 7.514 1.00 . A A . 22 ASP OD1 1 1 3 1281 1 1 22 ASP OD2 O 9.991 -8.237 6.212 1.00 . A A . 22 ASP OD2 1 1 3 1282 1 1 23 GLY C C 4.345 -4.614 6.268 1.00 . A A . 23 GLY C 1 1 3 1283 1 1 23 GLY CA C 3.734 -6.014 6.192 1.00 . A A . 23 GLY CA 1 1 3 1284 1 1 23 GLY H H 4.634 -7.129 4.583 1.00 . A A . 23 GLY H 1 1 3 1285 1 1 23 GLY HA2 H 2.822 -5.979 5.609 1.00 . A A . 23 GLY HA2 1 1 3 1286 1 1 23 GLY HA3 H 3.511 -6.361 7.190 1.00 . A A . 23 GLY HA3 1 1 3 1287 1 1 23 GLY N N 4.698 -6.948 5.544 1.00 . A A . 23 GLY N 1 1 3 1288 1 1 23 GLY O O 3.802 -3.721 6.889 1.00 . A A . 23 GLY O 1 1 3 1289 1 1 24 LYS C C 6.911 -2.835 4.391 1.00 . A A . 24 LYS C 1 1 3 1290 1 1 24 LYS CA C 6.116 -3.069 5.678 1.00 . A A . 24 LYS CA 1 1 3 1291 1 1 24 LYS CB C 7.051 -3.108 6.889 1.00 . A A . 24 LYS CB 1 1 3 1292 1 1 24 LYS CD C 8.322 -1.647 8.468 1.00 . A A . 24 LYS CD 1 1 3 1293 1 1 24 LYS CE C 9.349 -2.765 8.662 1.00 . A A . 24 LYS CE 1 1 3 1294 1 1 24 LYS CG C 7.719 -1.743 7.065 1.00 . A A . 24 LYS CG 1 1 3 1295 1 1 24 LYS H H 5.893 -5.145 5.146 1.00 . A A . 24 LYS H 1 1 3 1296 1 1 24 LYS HA H 5.372 -2.299 5.809 1.00 . A A . 24 LYS HA 1 1 3 1297 1 1 24 LYS HB2 H 6.480 -3.348 7.774 1.00 . A A . 24 LYS HB2 1 1 3 1298 1 1 24 LYS HB3 H 7.809 -3.861 6.733 1.00 . A A . 24 LYS HB3 1 1 3 1299 1 1 24 LYS HD2 H 8.806 -0.688 8.586 1.00 . A A . 24 LYS HD2 1 1 3 1300 1 1 24 LYS HD3 H 7.540 -1.749 9.204 1.00 . A A . 24 LYS HD3 1 1 3 1301 1 1 24 LYS HE2 H 9.044 -3.653 8.127 1.00 . A A . 24 LYS HE2 1 1 3 1302 1 1 24 LYS HE3 H 10.325 -2.441 8.330 1.00 . A A . 24 LYS HE3 1 1 3 1303 1 1 24 LYS HG2 H 8.501 -1.627 6.328 1.00 . A A . 24 LYS HG2 1 1 3 1304 1 1 24 LYS HG3 H 6.985 -0.962 6.937 1.00 . A A . 24 LYS HG3 1 1 3 1305 1 1 24 LYS HZ1 H 8.393 -3.119 10.475 1.00 . A A . 24 LYS HZ1 1 1 3 1306 1 1 24 LYS HZ2 H 9.827 -2.219 10.613 1.00 . A A . 24 LYS HZ2 1 1 3 1307 1 1 24 LYS HZ3 H 9.895 -3.891 10.326 1.00 . A A . 24 LYS HZ3 1 1 3 1308 1 1 24 LYS N N 5.472 -4.413 5.642 1.00 . A A . 24 LYS N 1 1 3 1309 1 1 24 LYS NZ N 9.369 -3.018 10.129 1.00 . A A . 24 LYS NZ 1 1 3 1310 1 1 24 LYS O O 8.018 -2.337 4.413 1.00 . A A . 24 LYS O 1 1 3 1311 1 1 25 SER C C 6.086 -3.317 0.832 1.00 . A A . 25 SER C 1 1 3 1312 1 1 25 SER CA C 7.049 -2.999 1.974 1.00 . A A . 25 SER CA 1 1 3 1313 1 1 25 SER CB C 8.207 -3.995 1.991 1.00 . A A . 25 SER CB 1 1 3 1314 1 1 25 SER H H 5.450 -3.588 3.287 1.00 . A A . 25 SER H 1 1 3 1315 1 1 25 SER HA H 7.424 -1.991 1.889 1.00 . A A . 25 SER HA 1 1 3 1316 1 1 25 SER HB2 H 7.866 -4.939 2.387 1.00 . A A . 25 SER HB2 1 1 3 1317 1 1 25 SER HB3 H 8.571 -4.140 0.980 1.00 . A A . 25 SER HB3 1 1 3 1318 1 1 25 SER HG H 9.605 -4.224 3.326 1.00 . A A . 25 SER HG 1 1 3 1319 1 1 25 SER N N 6.346 -3.192 3.273 1.00 . A A . 25 SER N 1 1 3 1320 1 1 25 SER O O 5.715 -4.454 0.620 1.00 . A A . 25 SER O 1 1 3 1321 1 1 25 SER OG O 9.249 -3.492 2.816 1.00 . A A . 25 SER OG 1 1 3 1322 1 1 26 ALA C C 5.321 -2.155 -2.347 1.00 . A A . 26 ALA C 1 1 3 1323 1 1 26 ALA CA C 4.711 -2.580 -1.011 1.00 . A A . 26 ALA CA 1 1 3 1324 1 1 26 ALA CB C 3.485 -1.732 -0.674 1.00 . A A . 26 ALA CB 1 1 3 1325 1 1 26 ALA H H 5.964 -1.411 0.290 1.00 . A A . 26 ALA H 1 1 3 1326 1 1 26 ALA HA H 4.439 -3.623 -1.036 1.00 . A A . 26 ALA HA 1 1 3 1327 1 1 26 ALA HB1 H 2.792 -1.755 -1.501 1.00 . A A . 26 ALA HB1 1 1 3 1328 1 1 26 ALA HB2 H 3.791 -0.713 -0.489 1.00 . A A . 26 ALA HB2 1 1 3 1329 1 1 26 ALA HB3 H 3.004 -2.128 0.209 1.00 . A A . 26 ALA HB3 1 1 3 1330 1 1 26 ALA N N 5.663 -2.324 0.101 1.00 . A A . 26 ALA N 1 1 3 1331 1 1 26 ALA O O 6.365 -1.534 -2.397 1.00 . A A . 26 ALA O 1 1 3 1332 1 1 27 ALA C C 4.474 -0.903 -5.316 1.00 . A A . 27 ALA C 1 1 3 1333 1 1 27 ALA CA C 5.218 -2.115 -4.769 1.00 . A A . 27 ALA CA 1 1 3 1334 1 1 27 ALA CB C 4.937 -3.323 -5.653 1.00 . A A . 27 ALA CB 1 1 3 1335 1 1 27 ALA H H 3.841 -2.994 -3.366 1.00 . A A . 27 ALA H 1 1 3 1336 1 1 27 ALA HA H 6.276 -1.926 -4.715 1.00 . A A . 27 ALA HA 1 1 3 1337 1 1 27 ALA HB1 H 4.968 -4.220 -5.055 1.00 . A A . 27 ALA HB1 1 1 3 1338 1 1 27 ALA HB2 H 5.680 -3.377 -6.433 1.00 . A A . 27 ALA HB2 1 1 3 1339 1 1 27 ALA HB3 H 3.955 -3.219 -6.095 1.00 . A A . 27 ALA HB3 1 1 3 1340 1 1 27 ALA N N 4.679 -2.490 -3.430 1.00 . A A . 27 ALA N 1 1 3 1341 1 1 27 ALA O O 5.047 -0.032 -5.938 1.00 . A A . 27 ALA O 1 1 3 1342 1 1 28 CYS C C 2.402 0.297 -7.137 1.00 . A A . 28 CYS C 1 1 3 1343 1 1 28 CYS CA C 2.380 0.270 -5.608 1.00 . A A . 28 CYS CA 1 1 3 1344 1 1 28 CYS CB C 3.023 1.532 -5.025 1.00 . A A . 28 CYS CB 1 1 3 1345 1 1 28 CYS H H 2.763 -1.590 -4.605 1.00 . A A . 28 CYS H 1 1 3 1346 1 1 28 CYS HA H 1.374 0.177 -5.259 1.00 . A A . 28 CYS HA 1 1 3 1347 1 1 28 CYS HB2 H 4.037 1.316 -4.721 1.00 . A A . 28 CYS HB2 1 1 3 1348 1 1 28 CYS HB3 H 3.028 2.312 -5.773 1.00 . A A . 28 CYS HB3 1 1 3 1349 1 1 28 CYS N N 3.195 -0.862 -5.099 1.00 . A A . 28 CYS N 1 1 3 1350 1 1 28 CYS O O 3.431 0.128 -7.759 1.00 . A A . 28 CYS O 1 1 3 1351 1 1 28 CYS SG S 2.074 2.084 -3.584 1.00 . A A . 28 CYS SG 1 1 3 1352 1 1 29 THR C C 2.056 1.694 -9.781 1.00 . A A . 29 THR C 1 1 3 1353 1 1 29 THR CA C 1.207 0.540 -9.237 1.00 . A A . 29 THR CA 1 1 3 1354 1 1 29 THR CB C -0.270 0.760 -9.574 1.00 . A A . 29 THR CB 1 1 3 1355 1 1 29 THR CG2 C -0.423 0.978 -11.081 1.00 . A A . 29 THR CG2 1 1 3 1356 1 1 29 THR H H 0.444 0.635 -7.222 1.00 . A A . 29 THR H 1 1 3 1357 1 1 29 THR HA H 1.541 -0.399 -9.648 1.00 . A A . 29 THR HA 1 1 3 1358 1 1 29 THR HB H -0.634 1.629 -9.050 1.00 . A A . 29 THR HB 1 1 3 1359 1 1 29 THR HG1 H -1.944 -0.209 -9.373 1.00 . A A . 29 THR HG1 1 1 3 1360 1 1 29 THR HG21 H -1.432 0.732 -11.380 1.00 . A A . 29 THR HG21 1 1 3 1361 1 1 29 THR HG22 H 0.274 0.343 -11.609 1.00 . A A . 29 THR HG22 1 1 3 1362 1 1 29 THR HG23 H -0.219 2.011 -11.317 1.00 . A A . 29 THR HG23 1 1 3 1363 1 1 29 THR N N 1.263 0.504 -7.747 1.00 . A A . 29 THR N 1 1 3 1364 1 1 29 THR O O 2.261 1.812 -10.973 1.00 . A A . 29 THR O 1 1 3 1365 1 1 29 THR OG1 O -1.020 -0.381 -9.180 1.00 . A A . 29 THR OG1 1 1 3 1366 1 1 30 ARG C C 2.500 4.757 -10.042 1.00 . A A . 30 ARG C 1 1 3 1367 1 1 30 ARG CA C 3.381 3.697 -9.380 1.00 . A A . 30 ARG CA 1 1 3 1368 1 1 30 ARG CB C 4.375 3.111 -10.386 1.00 . A A . 30 ARG CB 1 1 3 1369 1 1 30 ARG CD C 6.799 2.563 -10.653 1.00 . A A . 30 ARG CD 1 1 3 1370 1 1 30 ARG CG C 5.798 3.510 -9.989 1.00 . A A . 30 ARG CG 1 1 3 1371 1 1 30 ARG CZ C 9.019 3.471 -10.318 1.00 . A A . 30 ARG CZ 1 1 3 1372 1 1 30 ARG H H 2.362 2.436 -7.964 1.00 . A A . 30 ARG H 1 1 3 1373 1 1 30 ARG HA H 3.915 4.126 -8.547 1.00 . A A . 30 ARG HA 1 1 3 1374 1 1 30 ARG HB2 H 4.291 2.032 -10.388 1.00 . A A . 30 ARG HB2 1 1 3 1375 1 1 30 ARG HB3 H 4.158 3.493 -11.372 1.00 . A A . 30 ARG HB3 1 1 3 1376 1 1 30 ARG HD2 H 6.441 1.543 -10.600 1.00 . A A . 30 ARG HD2 1 1 3 1377 1 1 30 ARG HD3 H 6.967 2.852 -11.678 1.00 . A A . 30 ARG HD3 1 1 3 1378 1 1 30 ARG HE H 8.155 2.254 -9.009 1.00 . A A . 30 ARG HE 1 1 3 1379 1 1 30 ARG HG2 H 5.990 4.523 -10.312 1.00 . A A . 30 ARG HG2 1 1 3 1380 1 1 30 ARG HG3 H 5.903 3.448 -8.916 1.00 . A A . 30 ARG HG3 1 1 3 1381 1 1 30 ARG HH11 H 9.368 2.324 -11.923 1.00 . A A . 30 ARG HH11 1 1 3 1382 1 1 30 ARG HH12 H 10.372 3.727 -11.772 1.00 . A A . 30 ARG HH12 1 1 3 1383 1 1 30 ARG HH21 H 8.897 4.795 -8.820 1.00 . A A . 30 ARG HH21 1 1 3 1384 1 1 30 ARG HH22 H 10.108 5.124 -10.013 1.00 . A A . 30 ARG HH22 1 1 3 1385 1 1 30 ARG N N 2.546 2.548 -8.919 1.00 . A A . 30 ARG N 1 1 3 1386 1 1 30 ARG NE N 8.053 2.718 -9.866 1.00 . A A . 30 ARG NE 1 1 3 1387 1 1 30 ARG NH1 N 9.635 3.149 -11.424 1.00 . A A . 30 ARG NH1 1 1 3 1388 1 1 30 ARG NH2 N 9.368 4.547 -9.667 1.00 . A A . 30 ARG NH2 1 1 3 1389 1 1 30 ARG O O 1.788 4.486 -10.989 1.00 . A A . 30 ARG O 1 1 3 1390 1 1 31 MET C C 2.178 8.417 -9.645 1.00 . A A . 31 MET C 1 1 3 1391 1 1 31 MET CA C 1.703 7.046 -10.136 1.00 . A A . 31 MET CA 1 1 3 1392 1 1 31 MET CB C 0.285 6.761 -9.640 1.00 . A A . 31 MET CB 1 1 3 1393 1 1 31 MET CE C -3.156 6.564 -11.610 1.00 . A A . 31 MET CE 1 1 3 1394 1 1 31 MET CG C -0.727 7.304 -10.649 1.00 . A A . 31 MET CG 1 1 3 1395 1 1 31 MET H H 3.120 6.153 -8.779 1.00 . A A . 31 MET H 1 1 3 1396 1 1 31 MET HA H 1.733 6.999 -11.213 1.00 . A A . 31 MET HA 1 1 3 1397 1 1 31 MET HB2 H 0.149 5.695 -9.531 1.00 . A A . 31 MET HB2 1 1 3 1398 1 1 31 MET HB3 H 0.134 7.243 -8.685 1.00 . A A . 31 MET HB3 1 1 3 1399 1 1 31 MET HE1 H -3.348 7.003 -12.579 1.00 . A A . 31 MET HE1 1 1 3 1400 1 1 31 MET HE2 H -3.281 7.314 -10.847 1.00 . A A . 31 MET HE2 1 1 3 1401 1 1 31 MET HE3 H -3.849 5.753 -11.432 1.00 . A A . 31 MET HE3 1 1 3 1402 1 1 31 MET HG2 H -1.504 7.844 -10.126 1.00 . A A . 31 MET HG2 1 1 3 1403 1 1 31 MET HG3 H -0.228 7.969 -11.339 1.00 . A A . 31 MET HG3 1 1 3 1404 1 1 31 MET N N 2.540 5.962 -9.544 1.00 . A A . 31 MET N 1 1 3 1405 1 1 31 MET O O 2.094 9.400 -10.355 1.00 . A A . 31 MET O 1 1 3 1406 1 1 31 MET SD S -1.463 5.927 -11.565 1.00 . A A . 31 MET SD 1 1 3 1407 1 1 32 ALA C C 1.952 10.699 -7.579 1.00 . A A . 32 ALA C 1 1 3 1408 1 1 32 ALA CA C 3.145 9.803 -7.892 1.00 . A A . 32 ALA CA 1 1 3 1409 1 1 32 ALA CB C 3.999 10.424 -8.995 1.00 . A A . 32 ALA CB 1 1 3 1410 1 1 32 ALA H H 2.719 7.691 -7.876 1.00 . A A . 32 ALA H 1 1 3 1411 1 1 32 ALA HA H 3.741 9.648 -7.007 1.00 . A A . 32 ALA HA 1 1 3 1412 1 1 32 ALA HB1 H 4.524 9.645 -9.525 1.00 . A A . 32 ALA HB1 1 1 3 1413 1 1 32 ALA HB2 H 4.712 11.105 -8.555 1.00 . A A . 32 ALA HB2 1 1 3 1414 1 1 32 ALA HB3 H 3.362 10.962 -9.682 1.00 . A A . 32 ALA HB3 1 1 3 1415 1 1 32 ALA N N 2.670 8.494 -8.434 1.00 . A A . 32 ALA N 1 1 3 1416 1 1 32 ALA O O 1.015 10.792 -8.349 1.00 . A A . 32 ALA O 1 1 3 1417 1 1 33 CYS C C 1.290 13.695 -6.019 1.00 . A A . 33 CYS C 1 1 3 1418 1 1 33 CYS CA C 0.824 12.238 -6.102 1.00 . A A . 33 CYS CA 1 1 3 1419 1 1 33 CYS CB C 0.337 11.756 -4.730 1.00 . A A . 33 CYS CB 1 1 3 1420 1 1 33 CYS H H 2.730 11.267 -5.844 1.00 . A A . 33 CYS H 1 1 3 1421 1 1 33 CYS HA H 0.038 12.131 -6.830 1.00 . A A . 33 CYS HA 1 1 3 1422 1 1 33 CYS HB2 H 0.975 12.166 -3.961 1.00 . A A . 33 CYS HB2 1 1 3 1423 1 1 33 CYS HB3 H -0.678 12.095 -4.572 1.00 . A A . 33 CYS HB3 1 1 3 1424 1 1 33 CYS N N 1.970 11.355 -6.456 1.00 . A A . 33 CYS N 1 1 3 1425 1 1 33 CYS O O 2.239 14.002 -5.324 1.00 . A A . 33 CYS O 1 1 3 1426 1 1 33 CYS SG S 0.386 9.945 -4.640 1.00 . A A . 33 CYS SG 1 1 3 1427 1 1 34 PRO C C 0.563 16.635 -5.404 1.00 . A A . 34 PRO C 1 1 3 1428 1 1 34 PRO CA C 0.954 15.988 -6.735 1.00 . A A . 34 PRO CA 1 1 3 1429 1 1 34 PRO CB C 0.125 16.556 -7.882 1.00 . A A . 34 PRO CB 1 1 3 1430 1 1 34 PRO CD C -0.547 14.255 -7.592 1.00 . A A . 34 PRO CD 1 1 3 1431 1 1 34 PRO CG C -1.028 15.615 -8.029 1.00 . A A . 34 PRO CG 1 1 3 1432 1 1 34 PRO HA H 2.003 16.125 -6.932 1.00 . A A . 34 PRO HA 1 1 3 1433 1 1 34 PRO HB2 H -0.225 17.550 -7.635 1.00 . A A . 34 PRO HB2 1 1 3 1434 1 1 34 PRO HB3 H 0.704 16.576 -8.793 1.00 . A A . 34 PRO HB3 1 1 3 1435 1 1 34 PRO HD2 H -1.321 13.741 -7.034 1.00 . A A . 34 PRO HD2 1 1 3 1436 1 1 34 PRO HD3 H -0.236 13.670 -8.443 1.00 . A A . 34 PRO HD3 1 1 3 1437 1 1 34 PRO HG2 H -1.848 15.939 -7.403 1.00 . A A . 34 PRO HG2 1 1 3 1438 1 1 34 PRO HG3 H -1.343 15.574 -9.061 1.00 . A A . 34 PRO HG3 1 1 3 1439 1 1 34 PRO N N 0.604 14.547 -6.731 1.00 . A A . 34 PRO N 1 1 3 1440 1 1 34 PRO O O 1.223 17.534 -4.923 1.00 . A A . 34 PRO O 1 1 3 1441 1 1 35 GLN C C -2.184 16.045 -2.990 1.00 . A A . 35 GLN C 1 1 3 1442 1 1 35 GLN CA C -0.937 16.767 -3.507 1.00 . A A . 35 GLN CA 1 1 3 1443 1 1 35 GLN CB C -1.256 18.231 -3.818 1.00 . A A . 35 GLN CB 1 1 3 1444 1 1 35 GLN CD C -0.688 20.419 -2.749 1.00 . A A . 35 GLN CD 1 1 3 1445 1 1 35 GLN CG C -0.115 19.121 -3.321 1.00 . A A . 35 GLN CG 1 1 3 1446 1 1 35 GLN H H -1.018 15.453 -5.214 1.00 . A A . 35 GLN H 1 1 3 1447 1 1 35 GLN HA H -0.141 16.710 -2.782 1.00 . A A . 35 GLN HA 1 1 3 1448 1 1 35 GLN HB2 H -1.371 18.355 -4.885 1.00 . A A . 35 GLN HB2 1 1 3 1449 1 1 35 GLN HB3 H -2.172 18.513 -3.322 1.00 . A A . 35 GLN HB3 1 1 3 1450 1 1 35 GLN HE21 H -1.876 19.493 -1.455 1.00 . A A . 35 GLN HE21 1 1 3 1451 1 1 35 GLN HE22 H -1.953 21.188 -1.428 1.00 . A A . 35 GLN HE22 1 1 3 1452 1 1 35 GLN HG2 H 0.438 18.600 -2.551 1.00 . A A . 35 GLN HG2 1 1 3 1453 1 1 35 GLN HG3 H 0.544 19.354 -4.143 1.00 . A A . 35 GLN HG3 1 1 3 1454 1 1 35 GLN N N -0.503 16.182 -4.808 1.00 . A A . 35 GLN N 1 1 3 1455 1 1 35 GLN NE2 N -1.579 20.362 -1.798 1.00 . A A . 35 GLN NE2 1 1 3 1456 1 1 35 GLN O O -2.026 15.068 -2.277 1.00 . A A . 35 GLN O 1 1 3 1457 1 1 35 GLN OXT O -3.276 16.481 -3.317 1.00 . A A . 35 GLN OXT 1 1 3 1458 1 1 35 GLN OE1 O -0.320 21.497 -3.173 1.00 . A A . 35 GLN OE1 1 1 4 1459 1 1 1 GLU C C 4.054 -0.965 8.665 1.00 . A A . 1 GLU C 1 1 4 1460 1 1 1 GLU CA C 4.049 -2.190 9.583 1.00 . A A . 1 GLU CA 1 1 4 1461 1 1 1 GLU CB C 3.930 -1.765 11.046 1.00 . A A . 1 GLU CB 1 1 4 1462 1 1 1 GLU CD C 2.548 0.206 11.713 1.00 . A A . 1 GLU CD 1 1 4 1463 1 1 1 GLU CG C 2.507 -1.271 11.318 1.00 . A A . 1 GLU CG 1 1 4 1464 1 1 1 GLU H1 H 5.272 -3.694 8.819 1.00 . A A . 1 GLU H1 1 1 4 1465 1 1 1 GLU H2 H 5.603 -3.286 10.434 1.00 . A A . 1 GLU H2 1 1 4 1466 1 1 1 GLU H3 H 6.093 -2.254 9.177 1.00 . A A . 1 GLU H3 1 1 4 1467 1 1 1 GLU HA H 3.237 -2.851 9.325 1.00 . A A . 1 GLU HA 1 1 4 1468 1 1 1 GLU HB2 H 4.146 -2.608 11.685 1.00 . A A . 1 GLU HB2 1 1 4 1469 1 1 1 GLU HB3 H 4.630 -0.968 11.249 1.00 . A A . 1 GLU HB3 1 1 4 1470 1 1 1 GLU HG2 H 1.908 -1.390 10.427 1.00 . A A . 1 GLU HG2 1 1 4 1471 1 1 1 GLU HG3 H 2.074 -1.845 12.123 1.00 . A A . 1 GLU HG3 1 1 4 1472 1 1 1 GLU N N 5.353 -2.911 9.497 1.00 . A A . 1 GLU N 1 1 4 1473 1 1 1 GLU O O 4.069 0.162 9.116 1.00 . A A . 1 GLU O 1 1 4 1474 1 1 1 GLU OE1 O 3.552 0.625 12.264 1.00 . A A . 1 GLU OE1 1 1 4 1475 1 1 1 GLU OE2 O 1.573 0.894 11.459 1.00 . A A . 1 GLU OE2 1 1 4 1476 1 1 2 VAL C C 2.665 0.663 6.452 1.00 . A A . 2 VAL C 1 1 4 1477 1 1 2 VAL CA C 4.031 -0.024 6.429 1.00 . A A . 2 VAL CA 1 1 4 1478 1 1 2 VAL CB C 4.309 -0.626 5.044 1.00 . A A . 2 VAL CB 1 1 4 1479 1 1 2 VAL CG1 C 3.414 -1.846 4.816 1.00 . A A . 2 VAL CG1 1 1 4 1480 1 1 2 VAL CG2 C 4.016 0.418 3.965 1.00 . A A . 2 VAL CG2 1 1 4 1481 1 1 2 VAL H H 4.015 -2.096 7.037 1.00 . A A . 2 VAL H 1 1 4 1482 1 1 2 VAL HA H 4.809 0.677 6.688 1.00 . A A . 2 VAL HA 1 1 4 1483 1 1 2 VAL HB H 5.345 -0.923 4.983 1.00 . A A . 2 VAL HB 1 1 4 1484 1 1 2 VAL HG11 H 4.028 -2.726 4.692 1.00 . A A . 2 VAL HG11 1 1 4 1485 1 1 2 VAL HG12 H 2.822 -1.695 3.925 1.00 . A A . 2 VAL HG12 1 1 4 1486 1 1 2 VAL HG13 H 2.761 -1.981 5.664 1.00 . A A . 2 VAL HG13 1 1 4 1487 1 1 2 VAL HG21 H 2.997 0.307 3.624 1.00 . A A . 2 VAL HG21 1 1 4 1488 1 1 2 VAL HG22 H 4.691 0.273 3.134 1.00 . A A . 2 VAL HG22 1 1 4 1489 1 1 2 VAL HG23 H 4.155 1.407 4.374 1.00 . A A . 2 VAL HG23 1 1 4 1490 1 1 2 VAL N N 4.035 -1.179 7.377 1.00 . A A . 2 VAL N 1 1 4 1491 1 1 2 VAL O O 2.556 1.851 6.227 1.00 . A A . 2 VAL O 1 1 4 1492 1 1 3 THR C C -0.762 -0.681 6.610 1.00 . A A . 3 THR C 1 1 4 1493 1 1 3 THR CA C 0.240 0.467 6.789 1.00 . A A . 3 THR CA 1 1 4 1494 1 1 3 THR CB C 0.127 1.480 5.629 1.00 . A A . 3 THR CB 1 1 4 1495 1 1 3 THR CG2 C -1.303 1.512 5.077 1.00 . A A . 3 THR CG2 1 1 4 1496 1 1 3 THR H H 1.772 -1.041 6.916 1.00 . A A . 3 THR H 1 1 4 1497 1 1 3 THR HA H 0.074 0.964 7.733 1.00 . A A . 3 THR HA 1 1 4 1498 1 1 3 THR HB H 0.807 1.199 4.840 1.00 . A A . 3 THR HB 1 1 4 1499 1 1 3 THR HG1 H 0.997 2.675 6.897 1.00 . A A . 3 THR HG1 1 1 4 1500 1 1 3 THR HG21 H -1.996 1.227 5.856 1.00 . A A . 3 THR HG21 1 1 4 1501 1 1 3 THR HG22 H -1.386 0.820 4.252 1.00 . A A . 3 THR HG22 1 1 4 1502 1 1 3 THR HG23 H -1.536 2.510 4.735 1.00 . A A . 3 THR HG23 1 1 4 1503 1 1 3 THR N N 1.631 -0.090 6.732 1.00 . A A . 3 THR N 1 1 4 1504 1 1 3 THR O O -1.920 -0.571 6.960 1.00 . A A . 3 THR O 1 1 4 1505 1 1 3 THR OG1 O 0.465 2.778 6.104 1.00 . A A . 3 THR OG1 1 1 4 1506 1 1 4 CYS C C -0.498 -4.247 6.094 1.00 . A A . 4 CYS C 1 1 4 1507 1 1 4 CYS CA C -1.243 -2.926 5.835 1.00 . A A . 4 CYS CA 1 1 4 1508 1 1 4 CYS CB C -1.688 -2.763 4.368 1.00 . A A . 4 CYS CB 1 1 4 1509 1 1 4 CYS H H 0.615 -1.842 5.768 1.00 . A A . 4 CYS H 1 1 4 1510 1 1 4 CYS HA H -2.098 -2.847 6.489 1.00 . A A . 4 CYS HA 1 1 4 1511 1 1 4 CYS HB2 H -2.684 -2.344 4.346 1.00 . A A . 4 CYS HB2 1 1 4 1512 1 1 4 CYS HB3 H -1.008 -2.085 3.868 1.00 . A A . 4 CYS HB3 1 1 4 1513 1 1 4 CYS N N -0.321 -1.777 6.053 1.00 . A A . 4 CYS N 1 1 4 1514 1 1 4 CYS O O 0.698 -4.266 6.312 1.00 . A A . 4 CYS O 1 1 4 1515 1 1 4 CYS SG S -1.702 -4.350 3.487 1.00 . A A . 4 CYS SG 1 1 4 1516 1 1 5 GLU C C -0.125 -7.304 4.994 1.00 . A A . 5 GLU C 1 1 4 1517 1 1 5 GLU CA C -0.544 -6.666 6.319 1.00 . A A . 5 GLU CA 1 1 4 1518 1 1 5 GLU CB C -1.613 -7.519 7.000 1.00 . A A . 5 GLU CB 1 1 4 1519 1 1 5 GLU CD C -2.774 -7.319 9.198 1.00 . A A . 5 GLU CD 1 1 4 1520 1 1 5 GLU CG C -1.416 -7.479 8.515 1.00 . A A . 5 GLU CG 1 1 4 1521 1 1 5 GLU H H -2.164 -5.309 5.896 1.00 . A A . 5 GLU H 1 1 4 1522 1 1 5 GLU HA H 0.307 -6.550 6.971 1.00 . A A . 5 GLU HA 1 1 4 1523 1 1 5 GLU HB2 H -2.591 -7.133 6.753 1.00 . A A . 5 GLU HB2 1 1 4 1524 1 1 5 GLU HB3 H -1.531 -8.539 6.654 1.00 . A A . 5 GLU HB3 1 1 4 1525 1 1 5 GLU HG2 H -0.953 -8.400 8.842 1.00 . A A . 5 GLU HG2 1 1 4 1526 1 1 5 GLU HG3 H -0.783 -6.645 8.776 1.00 . A A . 5 GLU HG3 1 1 4 1527 1 1 5 GLU N N -1.201 -5.349 6.074 1.00 . A A . 5 GLU N 1 1 4 1528 1 1 5 GLU O O -0.715 -7.047 3.965 1.00 . A A . 5 GLU O 1 1 4 1529 1 1 5 GLU OE1 O -3.772 -7.326 8.496 1.00 . A A . 5 GLU OE1 1 1 4 1530 1 1 5 GLU OE2 O -2.795 -7.191 10.410 1.00 . A A . 5 GLU OE2 1 1 4 1531 1 1 6 PRO C C 0.373 -9.828 3.341 1.00 . A A . 6 PRO C 1 1 4 1532 1 1 6 PRO CA C 1.398 -8.819 3.864 1.00 . A A . 6 PRO CA 1 1 4 1533 1 1 6 PRO CB C 2.656 -9.523 4.369 1.00 . A A . 6 PRO CB 1 1 4 1534 1 1 6 PRO CD C 1.628 -8.492 6.279 1.00 . A A . 6 PRO CD 1 1 4 1535 1 1 6 PRO CG C 2.442 -9.680 5.839 1.00 . A A . 6 PRO CG 1 1 4 1536 1 1 6 PRO HA H 1.656 -8.106 3.098 1.00 . A A . 6 PRO HA 1 1 4 1537 1 1 6 PRO HB2 H 2.757 -10.490 3.896 1.00 . A A . 6 PRO HB2 1 1 4 1538 1 1 6 PRO HB3 H 3.529 -8.917 4.184 1.00 . A A . 6 PRO HB3 1 1 4 1539 1 1 6 PRO HD2 H 0.953 -8.769 7.079 1.00 . A A . 6 PRO HD2 1 1 4 1540 1 1 6 PRO HD3 H 2.271 -7.680 6.581 1.00 . A A . 6 PRO HD3 1 1 4 1541 1 1 6 PRO HG2 H 1.902 -10.598 6.037 1.00 . A A . 6 PRO HG2 1 1 4 1542 1 1 6 PRO HG3 H 3.389 -9.685 6.356 1.00 . A A . 6 PRO HG3 1 1 4 1543 1 1 6 PRO N N 0.883 -8.124 5.071 1.00 . A A . 6 PRO N 1 1 4 1544 1 1 6 PRO O O -0.118 -10.667 4.070 1.00 . A A . 6 PRO O 1 1 4 1545 1 1 7 GLY C C -2.223 -9.961 1.137 1.00 . A A . 7 GLY C 1 1 4 1546 1 1 7 GLY CA C -0.940 -10.708 1.502 1.00 . A A . 7 GLY CA 1 1 4 1547 1 1 7 GLY H H 0.458 -9.068 1.507 1.00 . A A . 7 GLY H 1 1 4 1548 1 1 7 GLY HA2 H -0.524 -11.165 0.615 1.00 . A A . 7 GLY HA2 1 1 4 1549 1 1 7 GLY HA3 H -1.169 -11.471 2.232 1.00 . A A . 7 GLY HA3 1 1 4 1550 1 1 7 GLY N N 0.049 -9.752 2.077 1.00 . A A . 7 GLY N 1 1 4 1551 1 1 7 GLY O O -3.311 -10.487 1.268 1.00 . A A . 7 GLY O 1 1 4 1552 1 1 8 THR C C -2.963 -6.733 -0.510 1.00 . A A . 8 THR C 1 1 4 1553 1 1 8 THR CA C -3.332 -7.971 0.313 1.00 . A A . 8 THR CA 1 1 4 1554 1 1 8 THR CB C -3.953 -7.555 1.648 1.00 . A A . 8 THR CB 1 1 4 1555 1 1 8 THR CG2 C -5.317 -6.914 1.403 1.00 . A A . 8 THR CG2 1 1 4 1556 1 1 8 THR H H -1.223 -8.336 0.580 1.00 . A A . 8 THR H 1 1 4 1557 1 1 8 THR HA H -4.020 -8.595 -0.234 1.00 . A A . 8 THR HA 1 1 4 1558 1 1 8 THR HB H -3.309 -6.841 2.136 1.00 . A A . 8 THR HB 1 1 4 1559 1 1 8 THR HG1 H -3.755 -8.487 3.345 1.00 . A A . 8 THR HG1 1 1 4 1560 1 1 8 THR HG21 H -5.767 -7.347 0.523 1.00 . A A . 8 THR HG21 1 1 4 1561 1 1 8 THR HG22 H -5.195 -5.851 1.261 1.00 . A A . 8 THR HG22 1 1 4 1562 1 1 8 THR HG23 H -5.954 -7.091 2.257 1.00 . A A . 8 THR HG23 1 1 4 1563 1 1 8 THR N N -2.109 -8.742 0.680 1.00 . A A . 8 THR N 1 1 4 1564 1 1 8 THR O O -1.814 -6.348 -0.599 1.00 . A A . 8 THR O 1 1 4 1565 1 1 8 THR OG1 O -4.111 -8.696 2.478 1.00 . A A . 8 THR OG1 1 1 4 1566 1 1 9 THR C C -4.507 -3.716 -1.390 1.00 . A A . 9 THR C 1 1 4 1567 1 1 9 THR CA C -3.667 -4.882 -1.919 1.00 . A A . 9 THR CA 1 1 4 1568 1 1 9 THR CB C -4.085 -5.251 -3.342 1.00 . A A . 9 THR CB 1 1 4 1569 1 1 9 THR CG2 C -5.466 -5.903 -3.314 1.00 . A A . 9 THR CG2 1 1 4 1570 1 1 9 THR H H -4.857 -6.432 -1.010 1.00 . A A . 9 THR H 1 1 4 1571 1 1 9 THR HA H -2.617 -4.636 -1.892 1.00 . A A . 9 THR HA 1 1 4 1572 1 1 9 THR HB H -3.372 -5.946 -3.759 1.00 . A A . 9 THR HB 1 1 4 1573 1 1 9 THR HG1 H -4.535 -4.309 -4.982 1.00 . A A . 9 THR HG1 1 1 4 1574 1 1 9 THR HG21 H -6.084 -5.404 -2.583 1.00 . A A . 9 THR HG21 1 1 4 1575 1 1 9 THR HG22 H -5.365 -6.946 -3.048 1.00 . A A . 9 THR HG22 1 1 4 1576 1 1 9 THR HG23 H -5.921 -5.822 -4.289 1.00 . A A . 9 THR HG23 1 1 4 1577 1 1 9 THR N N -3.940 -6.103 -1.105 1.00 . A A . 9 THR N 1 1 4 1578 1 1 9 THR O O -5.394 -3.903 -0.581 1.00 . A A . 9 THR O 1 1 4 1579 1 1 9 THR OG1 O -4.131 -4.078 -4.143 1.00 . A A . 9 THR OG1 1 1 4 1580 1 1 10 PHE C C -4.486 -0.056 -1.961 1.00 . A A . 10 PHE C 1 1 4 1581 1 1 10 PHE CA C -5.012 -1.344 -1.333 1.00 . A A . 10 PHE CA 1 1 4 1582 1 1 10 PHE CB C -4.760 -1.318 0.173 1.00 . A A . 10 PHE CB 1 1 4 1583 1 1 10 PHE CD1 C -2.742 0.153 0.492 1.00 . A A . 10 PHE CD1 1 1 4 1584 1 1 10 PHE CD2 C -2.449 -2.254 0.508 1.00 . A A . 10 PHE CD2 1 1 4 1585 1 1 10 PHE CE1 C -1.368 0.321 0.685 1.00 . A A . 10 PHE CE1 1 1 4 1586 1 1 10 PHE CE2 C -1.074 -2.085 0.705 1.00 . A A . 10 PHE CE2 1 1 4 1587 1 1 10 PHE CG C -3.282 -1.135 0.404 1.00 . A A . 10 PHE CG 1 1 4 1588 1 1 10 PHE CZ C -0.534 -0.797 0.792 1.00 . A A . 10 PHE CZ 1 1 4 1589 1 1 10 PHE H H -3.509 -2.386 -2.479 1.00 . A A . 10 PHE H 1 1 4 1590 1 1 10 PHE HA H -6.065 -1.461 -1.533 1.00 . A A . 10 PHE HA 1 1 4 1591 1 1 10 PHE HB2 H -5.303 -0.495 0.617 1.00 . A A . 10 PHE HB2 1 1 4 1592 1 1 10 PHE HB3 H -5.083 -2.246 0.616 1.00 . A A . 10 PHE HB3 1 1 4 1593 1 1 10 PHE HD1 H -3.387 1.016 0.412 1.00 . A A . 10 PHE HD1 1 1 4 1594 1 1 10 PHE HD2 H -2.867 -3.247 0.441 1.00 . A A . 10 PHE HD2 1 1 4 1595 1 1 10 PHE HE1 H -0.950 1.316 0.754 1.00 . A A . 10 PHE HE1 1 1 4 1596 1 1 10 PHE HE2 H -0.430 -2.948 0.786 1.00 . A A . 10 PHE HE2 1 1 4 1597 1 1 10 PHE HZ H 0.525 -0.666 0.936 1.00 . A A . 10 PHE HZ 1 1 4 1598 1 1 10 PHE N N -4.232 -2.518 -1.830 1.00 . A A . 10 PHE N 1 1 4 1599 1 1 10 PHE O O -3.405 -0.014 -2.507 1.00 . A A . 10 PHE O 1 1 4 1600 1 1 11 LYS C C -3.468 2.725 -1.798 1.00 . A A . 11 LYS C 1 1 4 1601 1 1 11 LYS CA C -4.797 2.296 -2.442 1.00 . A A . 11 LYS CA 1 1 4 1602 1 1 11 LYS CB C -5.921 3.264 -2.074 1.00 . A A . 11 LYS CB 1 1 4 1603 1 1 11 LYS CD C -7.148 4.336 -3.968 1.00 . A A . 11 LYS CD 1 1 4 1604 1 1 11 LYS CE C -8.428 4.360 -3.130 1.00 . A A . 11 LYS CE 1 1 4 1605 1 1 11 LYS CG C -5.934 4.448 -3.045 1.00 . A A . 11 LYS CG 1 1 4 1606 1 1 11 LYS H H -6.106 0.934 -1.418 1.00 . A A . 11 LYS H 1 1 4 1607 1 1 11 LYS HA H -4.699 2.228 -3.513 1.00 . A A . 11 LYS HA 1 1 4 1608 1 1 11 LYS HB2 H -6.869 2.746 -2.129 1.00 . A A . 11 LYS HB2 1 1 4 1609 1 1 11 LYS HB3 H -5.769 3.621 -1.069 1.00 . A A . 11 LYS HB3 1 1 4 1610 1 1 11 LYS HD2 H -7.153 5.167 -4.659 1.00 . A A . 11 LYS HD2 1 1 4 1611 1 1 11 LYS HD3 H -7.097 3.408 -4.518 1.00 . A A . 11 LYS HD3 1 1 4 1612 1 1 11 LYS HE2 H -8.780 3.353 -2.955 1.00 . A A . 11 LYS HE2 1 1 4 1613 1 1 11 LYS HE3 H -8.255 4.867 -2.193 1.00 . A A . 11 LYS HE3 1 1 4 1614 1 1 11 LYS HG2 H -5.991 5.371 -2.485 1.00 . A A . 11 LYS HG2 1 1 4 1615 1 1 11 LYS HG3 H -5.031 4.440 -3.637 1.00 . A A . 11 LYS HG3 1 1 4 1616 1 1 11 LYS HZ1 H -9.272 6.142 -3.796 1.00 . A A . 11 LYS HZ1 1 1 4 1617 1 1 11 LYS HZ2 H -10.376 4.855 -3.666 1.00 . A A . 11 LYS HZ2 1 1 4 1618 1 1 11 LYS HZ3 H -9.270 4.903 -4.955 1.00 . A A . 11 LYS HZ3 1 1 4 1619 1 1 11 LYS N N -5.242 0.995 -1.871 1.00 . A A . 11 LYS N 1 1 4 1620 1 1 11 LYS NZ N -9.410 5.123 -3.948 1.00 . A A . 11 LYS NZ 1 1 4 1621 1 1 11 LYS O O -2.674 1.900 -1.392 1.00 . A A . 11 LYS O 1 1 4 1622 1 1 12 ASP C C -1.933 6.043 -1.195 1.00 . A A . 12 ASP C 1 1 4 1623 1 1 12 ASP CA C -1.976 4.515 -1.066 1.00 . A A . 12 ASP CA 1 1 4 1624 1 1 12 ASP CB C -0.807 3.842 -1.819 1.00 . A A . 12 ASP CB 1 1 4 1625 1 1 12 ASP CG C -0.264 4.762 -2.923 1.00 . A A . 12 ASP CG 1 1 4 1626 1 1 12 ASP H H -3.898 4.650 -2.000 1.00 . A A . 12 ASP H 1 1 4 1627 1 1 12 ASP HA H -1.946 4.235 -0.023 1.00 . A A . 12 ASP HA 1 1 4 1628 1 1 12 ASP HB2 H -0.012 3.630 -1.117 1.00 . A A . 12 ASP HB2 1 1 4 1629 1 1 12 ASP HB3 H -1.144 2.916 -2.261 1.00 . A A . 12 ASP HB3 1 1 4 1630 1 1 12 ASP N N -3.234 4.009 -1.687 1.00 . A A . 12 ASP N 1 1 4 1631 1 1 12 ASP O O -1.317 6.695 -0.390 1.00 . A A . 12 ASP O 1 1 4 1632 1 1 12 ASP OD1 O -1.066 5.364 -3.617 1.00 . A A . 12 ASP OD1 1 1 4 1633 1 1 12 ASP OD2 O 0.946 4.847 -3.052 1.00 . A A . 12 ASP OD2 1 1 4 1634 1 1 13 LYS C C -2.579 8.325 -3.988 1.00 . A A . 13 LYS C 1 1 4 1635 1 1 13 LYS CA C -2.697 8.059 -2.487 1.00 . A A . 13 LYS CA 1 1 4 1636 1 1 13 LYS CB C -1.563 8.750 -1.748 1.00 . A A . 13 LYS CB 1 1 4 1637 1 1 13 LYS CD C -2.047 10.558 -0.092 1.00 . A A . 13 LYS CD 1 1 4 1638 1 1 13 LYS CE C -2.412 10.841 1.368 1.00 . A A . 13 LYS CE 1 1 4 1639 1 1 13 LYS CG C -2.058 9.048 -0.338 1.00 . A A . 13 LYS CG 1 1 4 1640 1 1 13 LYS H H -3.086 5.984 -2.808 1.00 . A A . 13 LYS H 1 1 4 1641 1 1 13 LYS HA H -3.643 8.436 -2.128 1.00 . A A . 13 LYS HA 1 1 4 1642 1 1 13 LYS HB2 H -0.696 8.106 -1.720 1.00 . A A . 13 LYS HB2 1 1 4 1643 1 1 13 LYS HB3 H -1.315 9.677 -2.245 1.00 . A A . 13 LYS HB3 1 1 4 1644 1 1 13 LYS HD2 H -1.062 10.949 -0.300 1.00 . A A . 13 LYS HD2 1 1 4 1645 1 1 13 LYS HD3 H -2.768 11.033 -0.739 1.00 . A A . 13 LYS HD3 1 1 4 1646 1 1 13 LYS HE2 H -3.134 10.117 1.721 1.00 . A A . 13 LYS HE2 1 1 4 1647 1 1 13 LYS HE3 H -1.528 10.825 1.987 1.00 . A A . 13 LYS HE3 1 1 4 1648 1 1 13 LYS HG2 H -3.065 8.666 -0.243 1.00 . A A . 13 LYS HG2 1 1 4 1649 1 1 13 LYS HG3 H -1.422 8.556 0.378 1.00 . A A . 13 LYS HG3 1 1 4 1650 1 1 13 LYS HZ1 H -4.042 12.137 1.397 1.00 . A A . 13 LYS HZ1 1 1 4 1651 1 1 13 LYS HZ2 H -2.721 12.708 0.494 1.00 . A A . 13 LYS HZ2 1 1 4 1652 1 1 13 LYS HZ3 H -2.670 12.735 2.193 1.00 . A A . 13 LYS HZ3 1 1 4 1653 1 1 13 LYS N N -2.609 6.578 -2.211 1.00 . A A . 13 LYS N 1 1 4 1654 1 1 13 LYS NZ N -3.006 12.208 1.362 1.00 . A A . 13 LYS NZ 1 1 4 1655 1 1 13 LYS O O -3.395 9.016 -4.567 1.00 . A A . 13 LYS O 1 1 4 1656 1 1 14 CYS C C -1.411 6.675 -6.814 1.00 . A A . 14 CYS C 1 1 4 1657 1 1 14 CYS CA C -1.424 8.022 -6.085 1.00 . A A . 14 CYS CA 1 1 4 1658 1 1 14 CYS CB C -0.077 8.743 -6.253 1.00 . A A . 14 CYS CB 1 1 4 1659 1 1 14 CYS H H -0.927 7.233 -4.152 1.00 . A A . 14 CYS H 1 1 4 1660 1 1 14 CYS HA H -2.225 8.642 -6.454 1.00 . A A . 14 CYS HA 1 1 4 1661 1 1 14 CYS HB2 H 0.713 8.015 -6.294 1.00 . A A . 14 CYS HB2 1 1 4 1662 1 1 14 CYS HB3 H -0.088 9.309 -7.169 1.00 . A A . 14 CYS HB3 1 1 4 1663 1 1 14 CYS N N -1.578 7.789 -4.626 1.00 . A A . 14 CYS N 1 1 4 1664 1 1 14 CYS O O -1.257 6.609 -8.018 1.00 . A A . 14 CYS O 1 1 4 1665 1 1 14 CYS SG S 0.228 9.869 -4.867 1.00 . A A . 14 CYS SG 1 1 4 1666 1 1 15 ASN C C -1.896 3.166 -5.705 1.00 . A A . 15 ASN C 1 1 4 1667 1 1 15 ASN CA C -1.580 4.254 -6.732 1.00 . A A . 15 ASN CA 1 1 4 1668 1 1 15 ASN CB C -0.164 4.061 -7.270 1.00 . A A . 15 ASN CB 1 1 4 1669 1 1 15 ASN CG C -0.140 4.411 -8.747 1.00 . A A . 15 ASN CG 1 1 4 1670 1 1 15 ASN H H -1.703 5.675 -5.121 1.00 . A A . 15 ASN H 1 1 4 1671 1 1 15 ASN HA H -2.289 4.225 -7.545 1.00 . A A . 15 ASN HA 1 1 4 1672 1 1 15 ASN HB2 H 0.525 4.704 -6.739 1.00 . A A . 15 ASN HB2 1 1 4 1673 1 1 15 ASN HB3 H 0.131 3.030 -7.142 1.00 . A A . 15 ASN HB3 1 1 4 1674 1 1 15 ASN HD21 H -1.537 3.078 -9.220 1.00 . A A . 15 ASN HD21 1 1 4 1675 1 1 15 ASN HD22 H -0.910 3.969 -10.529 1.00 . A A . 15 ASN HD22 1 1 4 1676 1 1 15 ASN N N -1.577 5.599 -6.088 1.00 . A A . 15 ASN N 1 1 4 1677 1 1 15 ASN ND2 N -0.931 3.771 -9.568 1.00 . A A . 15 ASN ND2 1 1 4 1678 1 1 15 ASN O O -1.634 3.311 -4.530 1.00 . A A . 15 ASN O 1 1 4 1679 1 1 15 ASN OD1 O 0.606 5.272 -9.159 1.00 . A A . 15 ASN OD1 1 1 4 1680 1 1 16 THR C C -1.457 0.233 -4.828 1.00 . A A . 16 THR C 1 1 4 1681 1 1 16 THR CA C -2.749 0.967 -5.190 1.00 . A A . 16 THR CA 1 1 4 1682 1 1 16 THR CB C -3.702 0.041 -5.944 1.00 . A A . 16 THR CB 1 1 4 1683 1 1 16 THR CG2 C -3.740 -1.319 -5.254 1.00 . A A . 16 THR CG2 1 1 4 1684 1 1 16 THR H H -2.633 1.960 -7.099 1.00 . A A . 16 THR H 1 1 4 1685 1 1 16 THR HA H -3.229 1.355 -4.305 1.00 . A A . 16 THR HA 1 1 4 1686 1 1 16 THR HB H -3.356 -0.085 -6.957 1.00 . A A . 16 THR HB 1 1 4 1687 1 1 16 THR HG1 H -4.979 1.402 -6.492 1.00 . A A . 16 THR HG1 1 1 4 1688 1 1 16 THR HG21 H -4.193 -1.215 -4.281 1.00 . A A . 16 THR HG21 1 1 4 1689 1 1 16 THR HG22 H -2.732 -1.694 -5.145 1.00 . A A . 16 THR HG22 1 1 4 1690 1 1 16 THR HG23 H -4.317 -2.008 -5.851 1.00 . A A . 16 THR HG23 1 1 4 1691 1 1 16 THR N N -2.441 2.067 -6.144 1.00 . A A . 16 THR N 1 1 4 1692 1 1 16 THR O O -0.647 -0.064 -5.681 1.00 . A A . 16 THR O 1 1 4 1693 1 1 16 THR OG1 O -5.004 0.608 -5.952 1.00 . A A . 16 THR OG1 1 1 4 1694 1 1 17 CYS C C -0.299 -2.206 -2.755 1.00 . A A . 17 CYS C 1 1 4 1695 1 1 17 CYS CA C -0.006 -0.763 -3.168 1.00 . A A . 17 CYS CA 1 1 4 1696 1 1 17 CYS CB C 0.526 0.035 -1.977 1.00 . A A . 17 CYS CB 1 1 4 1697 1 1 17 CYS H H -1.918 0.194 -2.897 1.00 . A A . 17 CYS H 1 1 4 1698 1 1 17 CYS HA H 0.712 -0.743 -3.967 1.00 . A A . 17 CYS HA 1 1 4 1699 1 1 17 CYS HB2 H -0.240 0.709 -1.623 1.00 . A A . 17 CYS HB2 1 1 4 1700 1 1 17 CYS HB3 H 0.803 -0.646 -1.184 1.00 . A A . 17 CYS HB3 1 1 4 1701 1 1 17 CYS N N -1.254 -0.057 -3.573 1.00 . A A . 17 CYS N 1 1 4 1702 1 1 17 CYS O O -1.059 -2.460 -1.841 1.00 . A A . 17 CYS O 1 1 4 1703 1 1 17 CYS SG S 1.977 0.985 -2.492 1.00 . A A . 17 CYS SG 1 1 4 1704 1 1 18 ARG C C 0.989 -4.940 -1.865 1.00 . A A . 18 ARG C 1 1 4 1705 1 1 18 ARG CA C 0.094 -4.579 -3.044 1.00 . A A . 18 ARG CA 1 1 4 1706 1 1 18 ARG CB C 0.482 -5.382 -4.285 1.00 . A A . 18 ARG CB 1 1 4 1707 1 1 18 ARG CD C -0.986 -7.372 -4.628 1.00 . A A . 18 ARG CD 1 1 4 1708 1 1 18 ARG CG C 0.315 -6.875 -3.997 1.00 . A A . 18 ARG CG 1 1 4 1709 1 1 18 ARG CZ C -1.642 -9.513 -5.554 1.00 . A A . 18 ARG CZ 1 1 4 1710 1 1 18 ARG H H 0.935 -2.923 -4.135 1.00 . A A . 18 ARG H 1 1 4 1711 1 1 18 ARG HA H -0.943 -4.755 -2.794 1.00 . A A . 18 ARG HA 1 1 4 1712 1 1 18 ARG HB2 H -0.155 -5.100 -5.111 1.00 . A A . 18 ARG HB2 1 1 4 1713 1 1 18 ARG HB3 H 1.512 -5.179 -4.539 1.00 . A A . 18 ARG HB3 1 1 4 1714 1 1 18 ARG HD2 H -1.813 -7.220 -3.950 1.00 . A A . 18 ARG HD2 1 1 4 1715 1 1 18 ARG HD3 H -1.166 -6.868 -5.564 1.00 . A A . 18 ARG HD3 1 1 4 1716 1 1 18 ARG HE H 0.031 -9.267 -4.510 1.00 . A A . 18 ARG HE 1 1 4 1717 1 1 18 ARG HG2 H 1.152 -7.417 -4.413 1.00 . A A . 18 ARG HG2 1 1 4 1718 1 1 18 ARG HG3 H 0.279 -7.032 -2.929 1.00 . A A . 18 ARG HG3 1 1 4 1719 1 1 18 ARG HH11 H -2.734 -7.913 -6.066 1.00 . A A . 18 ARG HH11 1 1 4 1720 1 1 18 ARG HH12 H -3.305 -9.433 -6.666 1.00 . A A . 18 ARG HH12 1 1 4 1721 1 1 18 ARG HH21 H -0.761 -11.276 -5.203 1.00 . A A . 18 ARG HH21 1 1 4 1722 1 1 18 ARG HH22 H -2.191 -11.333 -6.178 1.00 . A A . 18 ARG HH22 1 1 4 1723 1 1 18 ARG N N 0.316 -3.152 -3.410 1.00 . A A . 18 ARG N 1 1 4 1724 1 1 18 ARG NE N -0.768 -8.826 -4.868 1.00 . A A . 18 ARG NE 1 1 4 1725 1 1 18 ARG NH1 N -2.638 -8.905 -6.141 1.00 . A A . 18 ARG NH1 1 1 4 1726 1 1 18 ARG NH2 N -1.522 -10.808 -5.653 1.00 . A A . 18 ARG NH2 1 1 4 1727 1 1 18 ARG O O 2.152 -5.254 -2.024 1.00 . A A . 18 ARG O 1 1 4 1728 1 1 19 CYS C C 2.245 -6.317 0.268 1.00 . A A . 19 CYS C 1 1 4 1729 1 1 19 CYS CA C 1.223 -5.208 0.543 1.00 . A A . 19 CYS CA 1 1 4 1730 1 1 19 CYS CB C 0.158 -5.673 1.528 1.00 . A A . 19 CYS CB 1 1 4 1731 1 1 19 CYS H H -0.496 -4.620 -0.600 1.00 . A A . 19 CYS H 1 1 4 1732 1 1 19 CYS HA H 1.714 -4.327 0.924 1.00 . A A . 19 CYS HA 1 1 4 1733 1 1 19 CYS HB2 H -0.817 -5.550 1.076 1.00 . A A . 19 CYS HB2 1 1 4 1734 1 1 19 CYS HB3 H 0.316 -6.712 1.766 1.00 . A A . 19 CYS HB3 1 1 4 1735 1 1 19 CYS N N 0.444 -4.883 -0.683 1.00 . A A . 19 CYS N 1 1 4 1736 1 1 19 CYS O O 1.922 -7.353 -0.279 1.00 . A A . 19 CYS O 1 1 4 1737 1 1 19 CYS SG S 0.240 -4.677 3.034 1.00 . A A . 19 CYS SG 1 1 4 1738 1 1 20 GLY C C 4.335 -8.317 1.328 1.00 . A A . 20 GLY C 1 1 4 1739 1 1 20 GLY CA C 4.532 -7.128 0.386 1.00 . A A . 20 GLY CA 1 1 4 1740 1 1 20 GLY H H 3.719 -5.252 1.067 1.00 . A A . 20 GLY H 1 1 4 1741 1 1 20 GLY HA2 H 4.466 -7.466 -0.639 1.00 . A A . 20 GLY HA2 1 1 4 1742 1 1 20 GLY HA3 H 5.507 -6.695 0.561 1.00 . A A . 20 GLY HA3 1 1 4 1743 1 1 20 GLY N N 3.481 -6.099 0.634 1.00 . A A . 20 GLY N 1 1 4 1744 1 1 20 GLY O O 3.224 -8.709 1.628 1.00 . A A . 20 GLY O 1 1 4 1745 1 1 21 SER C C 5.882 -9.735 4.083 1.00 . A A . 21 SER C 1 1 4 1746 1 1 21 SER CA C 5.287 -10.066 2.711 1.00 . A A . 21 SER CA 1 1 4 1747 1 1 21 SER CB C 6.083 -11.183 2.037 1.00 . A A . 21 SER CB 1 1 4 1748 1 1 21 SER H H 6.295 -8.568 1.535 1.00 . A A . 21 SER H 1 1 4 1749 1 1 21 SER HA H 4.255 -10.360 2.809 1.00 . A A . 21 SER HA 1 1 4 1750 1 1 21 SER HB2 H 6.621 -10.786 1.193 1.00 . A A . 21 SER HB2 1 1 4 1751 1 1 21 SER HB3 H 6.788 -11.598 2.745 1.00 . A A . 21 SER HB3 1 1 4 1752 1 1 21 SER HG H 5.672 -13.022 1.556 1.00 . A A . 21 SER HG 1 1 4 1753 1 1 21 SER N N 5.408 -8.898 1.793 1.00 . A A . 21 SER N 1 1 4 1754 1 1 21 SER O O 6.071 -10.603 4.912 1.00 . A A . 21 SER O 1 1 4 1755 1 1 21 SER OG O 5.190 -12.193 1.590 1.00 . A A . 21 SER OG 1 1 4 1756 1 1 22 ASP C C 5.876 -7.061 6.335 1.00 . A A . 22 ASP C 1 1 4 1757 1 1 22 ASP CA C 6.760 -8.107 5.651 1.00 . A A . 22 ASP CA 1 1 4 1758 1 1 22 ASP CB C 8.134 -7.518 5.325 1.00 . A A . 22 ASP CB 1 1 4 1759 1 1 22 ASP CG C 9.182 -8.116 6.266 1.00 . A A . 22 ASP CG 1 1 4 1760 1 1 22 ASP H H 6.018 -7.803 3.649 1.00 . A A . 22 ASP H 1 1 4 1761 1 1 22 ASP HA H 6.871 -8.976 6.280 1.00 . A A . 22 ASP HA 1 1 4 1762 1 1 22 ASP HB2 H 8.393 -7.752 4.301 1.00 . A A . 22 ASP HB2 1 1 4 1763 1 1 22 ASP HB3 H 8.106 -6.446 5.456 1.00 . A A . 22 ASP HB3 1 1 4 1764 1 1 22 ASP N N 6.179 -8.488 4.330 1.00 . A A . 22 ASP N 1 1 4 1765 1 1 22 ASP O O 6.271 -6.436 7.300 1.00 . A A . 22 ASP O 1 1 4 1766 1 1 22 ASP OD1 O 8.824 -8.448 7.384 1.00 . A A . 22 ASP OD1 1 1 4 1767 1 1 22 ASP OD2 O 10.324 -8.233 5.852 1.00 . A A . 22 ASP OD2 1 1 4 1768 1 1 23 GLY C C 4.505 -4.518 6.591 1.00 . A A . 23 GLY C 1 1 4 1769 1 1 23 GLY CA C 3.776 -5.858 6.471 1.00 . A A . 23 GLY CA 1 1 4 1770 1 1 23 GLY H H 4.381 -7.378 5.068 1.00 . A A . 23 GLY H 1 1 4 1771 1 1 23 GLY HA2 H 2.894 -5.738 5.856 1.00 . A A . 23 GLY HA2 1 1 4 1772 1 1 23 GLY HA3 H 3.488 -6.197 7.457 1.00 . A A . 23 GLY HA3 1 1 4 1773 1 1 23 GLY N N 4.682 -6.864 5.846 1.00 . A A . 23 GLY N 1 1 4 1774 1 1 23 GLY O O 4.137 -3.669 7.379 1.00 . A A . 23 GLY O 1 1 4 1775 1 1 24 LYS C C 6.900 -2.711 4.516 1.00 . A A . 24 LYS C 1 1 4 1776 1 1 24 LYS CA C 6.285 -3.035 5.882 1.00 . A A . 24 LYS CA 1 1 4 1777 1 1 24 LYS CB C 7.379 -3.272 6.923 1.00 . A A . 24 LYS CB 1 1 4 1778 1 1 24 LYS CD C 7.433 -0.773 7.071 1.00 . A A . 24 LYS CD 1 1 4 1779 1 1 24 LYS CE C 8.317 0.418 7.451 1.00 . A A . 24 LYS CE 1 1 4 1780 1 1 24 LYS CG C 8.287 -2.043 7.008 1.00 . A A . 24 LYS CG 1 1 4 1781 1 1 24 LYS H H 5.816 -5.016 5.186 1.00 . A A . 24 LYS H 1 1 4 1782 1 1 24 LYS HA H 5.634 -2.238 6.205 1.00 . A A . 24 LYS HA 1 1 4 1783 1 1 24 LYS HB2 H 6.924 -3.451 7.887 1.00 . A A . 24 LYS HB2 1 1 4 1784 1 1 24 LYS HB3 H 7.966 -4.131 6.638 1.00 . A A . 24 LYS HB3 1 1 4 1785 1 1 24 LYS HD2 H 6.982 -0.594 6.105 1.00 . A A . 24 LYS HD2 1 1 4 1786 1 1 24 LYS HD3 H 6.659 -0.896 7.813 1.00 . A A . 24 LYS HD3 1 1 4 1787 1 1 24 LYS HE2 H 8.053 0.781 8.435 1.00 . A A . 24 LYS HE2 1 1 4 1788 1 1 24 LYS HE3 H 9.358 0.140 7.417 1.00 . A A . 24 LYS HE3 1 1 4 1789 1 1 24 LYS HG2 H 8.896 -2.111 7.896 1.00 . A A . 24 LYS HG2 1 1 4 1790 1 1 24 LYS HG3 H 8.924 -2.004 6.137 1.00 . A A . 24 LYS HG3 1 1 4 1791 1 1 24 LYS HZ1 H 8.831 2.116 6.364 1.00 . A A . 24 LYS HZ1 1 1 4 1792 1 1 24 LYS HZ2 H 7.168 1.974 6.682 1.00 . A A . 24 LYS HZ2 1 1 4 1793 1 1 24 LYS HZ3 H 7.895 0.999 5.496 1.00 . A A . 24 LYS HZ3 1 1 4 1794 1 1 24 LYS N N 5.535 -4.320 5.814 1.00 . A A . 24 LYS N 1 1 4 1795 1 1 24 LYS NZ N 8.032 1.454 6.420 1.00 . A A . 24 LYS NZ 1 1 4 1796 1 1 24 LYS O O 7.774 -1.875 4.399 1.00 . A A . 24 LYS O 1 1 4 1797 1 1 25 SER C C 5.987 -3.475 1.056 1.00 . A A . 25 SER C 1 1 4 1798 1 1 25 SER CA C 7.009 -3.098 2.128 1.00 . A A . 25 SER CA 1 1 4 1799 1 1 25 SER CB C 8.246 -3.991 2.028 1.00 . A A . 25 SER CB 1 1 4 1800 1 1 25 SER H H 5.743 -4.035 3.597 1.00 . A A . 25 SER H 1 1 4 1801 1 1 25 SER HA H 7.293 -2.063 2.034 1.00 . A A . 25 SER HA 1 1 4 1802 1 1 25 SER HB2 H 7.944 -5.027 1.993 1.00 . A A . 25 SER HB2 1 1 4 1803 1 1 25 SER HB3 H 8.793 -3.746 1.124 1.00 . A A . 25 SER HB3 1 1 4 1804 1 1 25 SER HG H 8.883 -4.481 3.798 1.00 . A A . 25 SER HG 1 1 4 1805 1 1 25 SER N N 6.450 -3.366 3.483 1.00 . A A . 25 SER N 1 1 4 1806 1 1 25 SER O O 5.825 -4.630 0.719 1.00 . A A . 25 SER O 1 1 4 1807 1 1 25 SER OG O 9.068 -3.783 3.167 1.00 . A A . 25 SER OG 1 1 4 1808 1 1 26 ALA C C 4.638 -2.102 -1.838 1.00 . A A . 26 ALA C 1 1 4 1809 1 1 26 ALA CA C 4.283 -2.816 -0.532 1.00 . A A . 26 ALA CA 1 1 4 1810 1 1 26 ALA CB C 2.963 -2.284 0.027 1.00 . A A . 26 ALA CB 1 1 4 1811 1 1 26 ALA H H 5.442 -1.584 0.804 1.00 . A A . 26 ALA H 1 1 4 1812 1 1 26 ALA HA H 4.213 -3.881 -0.690 1.00 . A A . 26 ALA HA 1 1 4 1813 1 1 26 ALA HB1 H 2.138 -2.764 -0.478 1.00 . A A . 26 ALA HB1 1 1 4 1814 1 1 26 ALA HB2 H 2.910 -1.216 -0.132 1.00 . A A . 26 ALA HB2 1 1 4 1815 1 1 26 ALA HB3 H 2.909 -2.493 1.085 1.00 . A A . 26 ALA HB3 1 1 4 1816 1 1 26 ALA N N 5.296 -2.510 0.518 1.00 . A A . 26 ALA N 1 1 4 1817 1 1 26 ALA O O 5.203 -1.027 -1.835 1.00 . A A . 26 ALA O 1 1 4 1818 1 1 27 ALA C C 3.360 -1.350 -4.793 1.00 . A A . 27 ALA C 1 1 4 1819 1 1 27 ALA CA C 4.611 -2.039 -4.260 1.00 . A A . 27 ALA CA 1 1 4 1820 1 1 27 ALA CB C 5.017 -3.176 -5.190 1.00 . A A . 27 ALA CB 1 1 4 1821 1 1 27 ALA H H 3.840 -3.552 -2.936 1.00 . A A . 27 ALA H 1 1 4 1822 1 1 27 ALA HA H 5.422 -1.335 -4.154 1.00 . A A . 27 ALA HA 1 1 4 1823 1 1 27 ALA HB1 H 4.494 -3.072 -6.131 1.00 . A A . 27 ALA HB1 1 1 4 1824 1 1 27 ALA HB2 H 4.758 -4.121 -4.737 1.00 . A A . 27 ALA HB2 1 1 4 1825 1 1 27 ALA HB3 H 6.081 -3.136 -5.363 1.00 . A A . 27 ALA HB3 1 1 4 1826 1 1 27 ALA N N 4.303 -2.688 -2.954 1.00 . A A . 27 ALA N 1 1 4 1827 1 1 27 ALA O O 2.276 -1.893 -4.740 1.00 . A A . 27 ALA O 1 1 4 1828 1 1 28 CYS C C 2.281 0.505 -7.358 1.00 . A A . 28 CYS C 1 1 4 1829 1 1 28 CYS CA C 2.293 0.537 -5.830 1.00 . A A . 28 CYS CA 1 1 4 1830 1 1 28 CYS CB C 2.410 1.974 -5.320 1.00 . A A . 28 CYS CB 1 1 4 1831 1 1 28 CYS H H 4.372 0.268 -5.341 1.00 . A A . 28 CYS H 1 1 4 1832 1 1 28 CYS HA H 1.406 0.078 -5.441 1.00 . A A . 28 CYS HA 1 1 4 1833 1 1 28 CYS HB2 H 3.423 2.158 -4.994 1.00 . A A . 28 CYS HB2 1 1 4 1834 1 1 28 CYS HB3 H 2.154 2.659 -6.117 1.00 . A A . 28 CYS HB3 1 1 4 1835 1 1 28 CYS N N 3.492 -0.162 -5.305 1.00 . A A . 28 CYS N 1 1 4 1836 1 1 28 CYS O O 3.318 0.488 -7.990 1.00 . A A . 28 CYS O 1 1 4 1837 1 1 28 CYS SG S 1.275 2.217 -3.931 1.00 . A A . 28 CYS SG 1 1 4 1838 1 1 29 THR C C 2.138 1.315 -10.063 1.00 . A A . 29 THR C 1 1 4 1839 1 1 29 THR CA C 1.025 0.457 -9.444 1.00 . A A . 29 THR CA 1 1 4 1840 1 1 29 THR CB C -0.362 1.014 -9.779 1.00 . A A . 29 THR CB 1 1 4 1841 1 1 29 THR CG2 C -1.245 -0.116 -10.313 1.00 . A A . 29 THR CG2 1 1 4 1842 1 1 29 THR H H 0.287 0.497 -7.412 1.00 . A A . 29 THR H 1 1 4 1843 1 1 29 THR HA H 1.104 -0.557 -9.796 1.00 . A A . 29 THR HA 1 1 4 1844 1 1 29 THR HB H -0.274 1.779 -10.533 1.00 . A A . 29 THR HB 1 1 4 1845 1 1 29 THR HG1 H -1.444 0.863 -8.170 1.00 . A A . 29 THR HG1 1 1 4 1846 1 1 29 THR HG21 H -2.022 -0.336 -9.595 1.00 . A A . 29 THR HG21 1 1 4 1847 1 1 29 THR HG22 H -0.642 -0.998 -10.472 1.00 . A A . 29 THR HG22 1 1 4 1848 1 1 29 THR HG23 H -1.693 0.187 -11.248 1.00 . A A . 29 THR HG23 1 1 4 1849 1 1 29 THR N N 1.112 0.491 -7.951 1.00 . A A . 29 THR N 1 1 4 1850 1 1 29 THR O O 3.218 0.828 -10.330 1.00 . A A . 29 THR O 1 1 4 1851 1 1 29 THR OG1 O -0.950 1.561 -8.606 1.00 . A A . 29 THR OG1 1 1 4 1852 1 1 30 ARG C C 2.614 4.913 -10.926 1.00 . A A . 30 ARG C 1 1 4 1853 1 1 30 ARG CA C 2.984 3.424 -10.885 1.00 . A A . 30 ARG CA 1 1 4 1854 1 1 30 ARG CB C 3.171 2.876 -12.299 1.00 . A A . 30 ARG CB 1 1 4 1855 1 1 30 ARG CD C 4.500 3.091 -14.403 1.00 . A A . 30 ARG CD 1 1 4 1856 1 1 30 ARG CG C 4.154 3.760 -13.070 1.00 . A A . 30 ARG CG 1 1 4 1857 1 1 30 ARG CZ C 5.786 4.024 -16.230 1.00 . A A . 30 ARG CZ 1 1 4 1858 1 1 30 ARG H H 1.038 2.970 -10.071 1.00 . A A . 30 ARG H 1 1 4 1859 1 1 30 ARG HA H 3.890 3.294 -10.324 1.00 . A A . 30 ARG HA 1 1 4 1860 1 1 30 ARG HB2 H 3.560 1.868 -12.245 1.00 . A A . 30 ARG HB2 1 1 4 1861 1 1 30 ARG HB3 H 2.219 2.869 -12.811 1.00 . A A . 30 ARG HB3 1 1 4 1862 1 1 30 ARG HD2 H 4.783 2.060 -14.241 1.00 . A A . 30 ARG HD2 1 1 4 1863 1 1 30 ARG HD3 H 3.663 3.149 -15.083 1.00 . A A . 30 ARG HD3 1 1 4 1864 1 1 30 ARG HE H 6.303 4.265 -14.328 1.00 . A A . 30 ARG HE 1 1 4 1865 1 1 30 ARG HG2 H 3.703 4.724 -13.256 1.00 . A A . 30 ARG HG2 1 1 4 1866 1 1 30 ARG HG3 H 5.055 3.889 -12.491 1.00 . A A . 30 ARG HG3 1 1 4 1867 1 1 30 ARG HH11 H 4.588 5.626 -16.318 1.00 . A A . 30 ARG HH11 1 1 4 1868 1 1 30 ARG HH12 H 5.273 5.117 -17.826 1.00 . A A . 30 ARG HH12 1 1 4 1869 1 1 30 ARG HH21 H 7.016 2.458 -16.442 1.00 . A A . 30 ARG HH21 1 1 4 1870 1 1 30 ARG HH22 H 6.644 3.323 -17.897 1.00 . A A . 30 ARG HH22 1 1 4 1871 1 1 30 ARG N N 1.903 2.582 -10.291 1.00 . A A . 30 ARG N 1 1 4 1872 1 1 30 ARG NE N 5.649 3.870 -14.941 1.00 . A A . 30 ARG NE 1 1 4 1873 1 1 30 ARG NH1 N 5.168 4.998 -16.839 1.00 . A A . 30 ARG NH1 1 1 4 1874 1 1 30 ARG NH2 N 6.542 3.205 -16.909 1.00 . A A . 30 ARG NH2 1 1 4 1875 1 1 30 ARG O O 3.414 5.750 -10.562 1.00 . A A . 30 ARG O 1 1 4 1876 1 1 31 MET C C 1.867 7.618 -10.648 1.00 . A A . 31 MET C 1 1 4 1877 1 1 31 MET CA C 0.985 6.680 -11.484 1.00 . A A . 31 MET CA 1 1 4 1878 1 1 31 MET CB C -0.457 6.707 -10.971 1.00 . A A . 31 MET CB 1 1 4 1879 1 1 31 MET CE C -1.676 9.758 -13.434 1.00 . A A . 31 MET CE 1 1 4 1880 1 1 31 MET CG C -1.323 7.539 -11.918 1.00 . A A . 31 MET CG 1 1 4 1881 1 1 31 MET H H 0.822 4.529 -11.685 1.00 . A A . 31 MET H 1 1 4 1882 1 1 31 MET HA H 1.000 6.994 -12.516 1.00 . A A . 31 MET HA 1 1 4 1883 1 1 31 MET HB2 H -0.840 5.702 -10.929 1.00 . A A . 31 MET HB2 1 1 4 1884 1 1 31 MET HB3 H -0.481 7.144 -9.986 1.00 . A A . 31 MET HB3 1 1 4 1885 1 1 31 MET HE1 H -1.046 9.988 -14.285 1.00 . A A . 31 MET HE1 1 1 4 1886 1 1 31 MET HE2 H -2.225 10.640 -13.148 1.00 . A A . 31 MET HE2 1 1 4 1887 1 1 31 MET HE3 H -2.370 8.972 -13.697 1.00 . A A . 31 MET HE3 1 1 4 1888 1 1 31 MET HG2 H -1.338 7.077 -12.893 1.00 . A A . 31 MET HG2 1 1 4 1889 1 1 31 MET HG3 H -2.330 7.591 -11.529 1.00 . A A . 31 MET HG3 1 1 4 1890 1 1 31 MET N N 1.426 5.239 -11.385 1.00 . A A . 31 MET N 1 1 4 1891 1 1 31 MET O O 2.694 8.329 -11.185 1.00 . A A . 31 MET O 1 1 4 1892 1 1 31 MET SD S -0.643 9.210 -12.053 1.00 . A A . 31 MET SD 1 1 4 1893 1 1 32 ALA C C 2.852 7.988 -7.143 1.00 . A A . 32 ALA C 1 1 4 1894 1 1 32 ALA CA C 2.574 8.560 -8.541 1.00 . A A . 32 ALA CA 1 1 4 1895 1 1 32 ALA CB C 1.779 9.865 -8.456 1.00 . A A . 32 ALA CB 1 1 4 1896 1 1 32 ALA H H 1.045 7.075 -8.902 1.00 . A A . 32 ALA H 1 1 4 1897 1 1 32 ALA HA H 3.504 8.739 -9.057 1.00 . A A . 32 ALA HA 1 1 4 1898 1 1 32 ALA HB1 H 1.551 10.084 -7.426 1.00 . A A . 32 ALA HB1 1 1 4 1899 1 1 32 ALA HB2 H 0.861 9.762 -9.015 1.00 . A A . 32 ALA HB2 1 1 4 1900 1 1 32 ALA HB3 H 2.366 10.670 -8.874 1.00 . A A . 32 ALA HB3 1 1 4 1901 1 1 32 ALA N N 1.714 7.644 -9.345 1.00 . A A . 32 ALA N 1 1 4 1902 1 1 32 ALA O O 2.928 6.790 -6.952 1.00 . A A . 32 ALA O 1 1 4 1903 1 1 33 CYS C C 4.601 7.560 -4.784 1.00 . A A . 33 CYS C 1 1 4 1904 1 1 33 CYS CA C 3.333 8.387 -4.786 1.00 . A A . 33 CYS CA 1 1 4 1905 1 1 33 CYS CB C 2.137 7.572 -4.307 1.00 . A A . 33 CYS CB 1 1 4 1906 1 1 33 CYS H H 2.985 9.806 -6.362 1.00 . A A . 33 CYS H 1 1 4 1907 1 1 33 CYS HA H 3.478 9.243 -4.154 1.00 . A A . 33 CYS HA 1 1 4 1908 1 1 33 CYS HB2 H 1.643 7.117 -5.150 1.00 . A A . 33 CYS HB2 1 1 4 1909 1 1 33 CYS HB3 H 2.478 6.802 -3.633 1.00 . A A . 33 CYS HB3 1 1 4 1910 1 1 33 CYS N N 3.029 8.846 -6.173 1.00 . A A . 33 CYS N 1 1 4 1911 1 1 33 CYS O O 4.631 6.433 -4.329 1.00 . A A . 33 CYS O 1 1 4 1912 1 1 33 CYS SG S 0.992 8.669 -3.433 1.00 . A A . 33 CYS SG 1 1 4 1913 1 1 34 PRO C C 7.514 7.338 -3.951 1.00 . A A . 34 PRO C 1 1 4 1914 1 1 34 PRO CA C 6.957 7.570 -5.360 1.00 . A A . 34 PRO CA 1 1 4 1915 1 1 34 PRO CB C 7.767 8.628 -6.106 1.00 . A A . 34 PRO CB 1 1 4 1916 1 1 34 PRO CD C 5.598 9.541 -5.843 1.00 . A A . 34 PRO CD 1 1 4 1917 1 1 34 PRO CG C 7.047 9.908 -5.841 1.00 . A A . 34 PRO CG 1 1 4 1918 1 1 34 PRO HA H 6.933 6.652 -5.924 1.00 . A A . 34 PRO HA 1 1 4 1919 1 1 34 PRO HB2 H 8.781 8.669 -5.736 1.00 . A A . 34 PRO HB2 1 1 4 1920 1 1 34 PRO HB3 H 7.748 8.420 -7.157 1.00 . A A . 34 PRO HB3 1 1 4 1921 1 1 34 PRO HD2 H 5.018 10.212 -5.217 1.00 . A A . 34 PRO HD2 1 1 4 1922 1 1 34 PRO HD3 H 5.209 9.522 -6.849 1.00 . A A . 34 PRO HD3 1 1 4 1923 1 1 34 PRO HG2 H 7.337 10.310 -4.880 1.00 . A A . 34 PRO HG2 1 1 4 1924 1 1 34 PRO HG3 H 7.247 10.621 -6.626 1.00 . A A . 34 PRO HG3 1 1 4 1925 1 1 34 PRO N N 5.614 8.186 -5.286 1.00 . A A . 34 PRO N 1 1 4 1926 1 1 34 PRO O O 8.529 6.694 -3.771 1.00 . A A . 34 PRO O 1 1 4 1927 1 1 35 GLN C C 7.087 6.229 -1.097 1.00 . A A . 35 GLN C 1 1 4 1928 1 1 35 GLN CA C 7.341 7.666 -1.554 1.00 . A A . 35 GLN CA 1 1 4 1929 1 1 35 GLN CB C 6.525 8.647 -0.710 1.00 . A A . 35 GLN CB 1 1 4 1930 1 1 35 GLN CD C 6.224 7.566 1.524 1.00 . A A . 35 GLN CD 1 1 4 1931 1 1 35 GLN CG C 7.020 8.608 0.736 1.00 . A A . 35 GLN CG 1 1 4 1932 1 1 35 GLN H H 6.036 8.371 -3.118 1.00 . A A . 35 GLN H 1 1 4 1933 1 1 35 GLN HA H 8.390 7.906 -1.485 1.00 . A A . 35 GLN HA 1 1 4 1934 1 1 35 GLN HB2 H 6.639 9.645 -1.105 1.00 . A A . 35 GLN HB2 1 1 4 1935 1 1 35 GLN HB3 H 5.483 8.365 -0.738 1.00 . A A . 35 GLN HB3 1 1 4 1936 1 1 35 GLN HE21 H 5.040 8.910 2.385 1.00 . A A . 35 GLN HE21 1 1 4 1937 1 1 35 GLN HE22 H 4.739 7.296 2.815 1.00 . A A . 35 GLN HE22 1 1 4 1938 1 1 35 GLN HG2 H 8.069 8.347 0.750 1.00 . A A . 35 GLN HG2 1 1 4 1939 1 1 35 GLN HG3 H 6.885 9.580 1.189 1.00 . A A . 35 GLN HG3 1 1 4 1940 1 1 35 GLN N N 6.853 7.857 -2.951 1.00 . A A . 35 GLN N 1 1 4 1941 1 1 35 GLN NE2 N 5.254 7.957 2.307 1.00 . A A . 35 GLN NE2 1 1 4 1942 1 1 35 GLN O O 8.017 5.611 -0.605 1.00 . A A . 35 GLN O 1 1 4 1943 1 1 35 GLN OXT O 5.966 5.770 -1.245 1.00 . A A . 35 GLN OXT 1 1 4 1944 1 1 35 GLN OE1 O 6.487 6.384 1.429 1.00 . A A . 35 GLN OE1 1 1 5 1945 1 1 1 GLU C C 5.347 2.194 4.521 1.00 . A A . 1 GLU C 1 1 5 1946 1 1 1 GLU CA C 6.624 2.879 5.018 1.00 . A A . 1 GLU CA 1 1 5 1947 1 1 1 GLU CB C 6.665 2.894 6.547 1.00 . A A . 1 GLU CB 1 1 5 1948 1 1 1 GLU CD C 7.730 4.727 7.868 1.00 . A A . 1 GLU CD 1 1 5 1949 1 1 1 GLU CG C 7.996 3.484 7.018 1.00 . A A . 1 GLU CG 1 1 5 1950 1 1 1 GLU H1 H 7.577 4.713 4.751 1.00 . A A . 1 GLU H1 1 1 5 1951 1 1 1 GLU H2 H 5.944 4.840 5.204 1.00 . A A . 1 GLU H2 1 1 5 1952 1 1 1 GLU H3 H 6.357 4.397 3.616 1.00 . A A . 1 GLU H3 1 1 5 1953 1 1 1 GLU HA H 7.496 2.378 4.629 1.00 . A A . 1 GLU HA 1 1 5 1954 1 1 1 GLU HB2 H 5.850 3.494 6.922 1.00 . A A . 1 GLU HB2 1 1 5 1955 1 1 1 GLU HB3 H 6.571 1.884 6.919 1.00 . A A . 1 GLU HB3 1 1 5 1956 1 1 1 GLU HG2 H 8.526 2.750 7.608 1.00 . A A . 1 GLU HG2 1 1 5 1957 1 1 1 GLU HG3 H 8.594 3.757 6.161 1.00 . A A . 1 GLU HG3 1 1 5 1958 1 1 1 GLU N N 6.625 4.316 4.616 1.00 . A A . 1 GLU N 1 1 5 1959 1 1 1 GLU O O 4.709 2.648 3.590 1.00 . A A . 1 GLU O 1 1 5 1960 1 1 1 GLU OE1 O 6.695 4.771 8.511 1.00 . A A . 1 GLU OE1 1 1 5 1961 1 1 1 GLU OE2 O 8.568 5.615 7.861 1.00 . A A . 1 GLU OE2 1 1 5 1962 1 1 2 VAL C C 2.999 -0.180 5.915 1.00 . A A . 2 VAL C 1 1 5 1963 1 1 2 VAL CA C 3.733 0.393 4.697 1.00 . A A . 2 VAL CA 1 1 5 1964 1 1 2 VAL CB C 4.229 -0.726 3.776 1.00 . A A . 2 VAL CB 1 1 5 1965 1 1 2 VAL CG1 C 3.172 -1.827 3.674 1.00 . A A . 2 VAL CG1 1 1 5 1966 1 1 2 VAL CG2 C 4.493 -0.151 2.385 1.00 . A A . 2 VAL CG2 1 1 5 1967 1 1 2 VAL H H 5.496 0.757 5.882 1.00 . A A . 2 VAL H 1 1 5 1968 1 1 2 VAL HA H 3.087 1.061 4.148 1.00 . A A . 2 VAL HA 1 1 5 1969 1 1 2 VAL HB H 5.145 -1.139 4.174 1.00 . A A . 2 VAL HB 1 1 5 1970 1 1 2 VAL HG11 H 3.503 -2.695 4.225 1.00 . A A . 2 VAL HG11 1 1 5 1971 1 1 2 VAL HG12 H 3.029 -2.093 2.636 1.00 . A A . 2 VAL HG12 1 1 5 1972 1 1 2 VAL HG13 H 2.240 -1.471 4.086 1.00 . A A . 2 VAL HG13 1 1 5 1973 1 1 2 VAL HG21 H 5.041 0.774 2.475 1.00 . A A . 2 VAL HG21 1 1 5 1974 1 1 2 VAL HG22 H 3.550 0.036 1.889 1.00 . A A . 2 VAL HG22 1 1 5 1975 1 1 2 VAL HG23 H 5.069 -0.858 1.806 1.00 . A A . 2 VAL HG23 1 1 5 1976 1 1 2 VAL N N 4.968 1.106 5.133 1.00 . A A . 2 VAL N 1 1 5 1977 1 1 2 VAL O O 3.334 -1.234 6.415 1.00 . A A . 2 VAL O 1 1 5 1978 1 1 3 THR C C 0.158 -0.978 7.130 1.00 . A A . 3 THR C 1 1 5 1979 1 1 3 THR CA C 1.240 0.009 7.576 1.00 . A A . 3 THR CA 1 1 5 1980 1 1 3 THR CB C 0.604 1.256 8.191 1.00 . A A . 3 THR CB 1 1 5 1981 1 1 3 THR CG2 C -0.016 0.902 9.544 1.00 . A A . 3 THR CG2 1 1 5 1982 1 1 3 THR H H 1.745 1.358 5.972 1.00 . A A . 3 THR H 1 1 5 1983 1 1 3 THR HA H 1.908 -0.454 8.285 1.00 . A A . 3 THR HA 1 1 5 1984 1 1 3 THR HB H -0.166 1.629 7.534 1.00 . A A . 3 THR HB 1 1 5 1985 1 1 3 THR HG1 H 1.686 2.735 7.542 1.00 . A A . 3 THR HG1 1 1 5 1986 1 1 3 THR HG21 H -0.565 1.752 9.922 1.00 . A A . 3 THR HG21 1 1 5 1987 1 1 3 THR HG22 H 0.767 0.639 10.241 1.00 . A A . 3 THR HG22 1 1 5 1988 1 1 3 THR HG23 H -0.687 0.065 9.423 1.00 . A A . 3 THR HG23 1 1 5 1989 1 1 3 THR N N 1.998 0.511 6.392 1.00 . A A . 3 THR N 1 1 5 1990 1 1 3 THR O O -0.626 -1.456 7.927 1.00 . A A . 3 THR O 1 1 5 1991 1 1 3 THR OG1 O 1.600 2.254 8.368 1.00 . A A . 3 THR OG1 1 1 5 1992 1 1 4 CYS C C -0.491 -3.686 5.676 1.00 . A A . 4 CYS C 1 1 5 1993 1 1 4 CYS CA C -0.920 -2.244 5.366 1.00 . A A . 4 CYS CA 1 1 5 1994 1 1 4 CYS CB C -0.990 -1.970 3.849 1.00 . A A . 4 CYS CB 1 1 5 1995 1 1 4 CYS H H 0.754 -0.890 5.240 1.00 . A A . 4 CYS H 1 1 5 1996 1 1 4 CYS HA H -1.875 -2.032 5.819 1.00 . A A . 4 CYS HA 1 1 5 1997 1 1 4 CYS HB2 H -1.805 -1.290 3.650 1.00 . A A . 4 CYS HB2 1 1 5 1998 1 1 4 CYS HB3 H -0.061 -1.514 3.530 1.00 . A A . 4 CYS HB3 1 1 5 1999 1 1 4 CYS N N 0.111 -1.288 5.865 1.00 . A A . 4 CYS N 1 1 5 2000 1 1 4 CYS O O 0.637 -3.944 6.046 1.00 . A A . 4 CYS O 1 1 5 2001 1 1 4 CYS SG S -1.254 -3.502 2.911 1.00 . A A . 4 CYS SG 1 1 5 2002 1 1 5 GLU C C -0.451 -6.695 4.542 1.00 . A A . 5 GLU C 1 1 5 2003 1 1 5 GLU CA C -1.039 -6.048 5.798 1.00 . A A . 5 GLU CA 1 1 5 2004 1 1 5 GLU CB C -2.360 -6.715 6.179 1.00 . A A . 5 GLU CB 1 1 5 2005 1 1 5 GLU CD C -2.182 -5.508 8.359 1.00 . A A . 5 GLU CD 1 1 5 2006 1 1 5 GLU CG C -3.105 -5.832 7.182 1.00 . A A . 5 GLU CG 1 1 5 2007 1 1 5 GLU H H -2.290 -4.392 5.218 1.00 . A A . 5 GLU H 1 1 5 2008 1 1 5 GLU HA H -0.342 -6.114 6.619 1.00 . A A . 5 GLU HA 1 1 5 2009 1 1 5 GLU HB2 H -2.965 -6.847 5.293 1.00 . A A . 5 GLU HB2 1 1 5 2010 1 1 5 GLU HB3 H -2.162 -7.678 6.626 1.00 . A A . 5 GLU HB3 1 1 5 2011 1 1 5 GLU HG2 H -3.408 -4.915 6.697 1.00 . A A . 5 GLU HG2 1 1 5 2012 1 1 5 GLU HG3 H -3.977 -6.355 7.544 1.00 . A A . 5 GLU HG3 1 1 5 2013 1 1 5 GLU N N -1.388 -4.624 5.521 1.00 . A A . 5 GLU N 1 1 5 2014 1 1 5 GLU O O -0.834 -6.366 3.439 1.00 . A A . 5 GLU O 1 1 5 2015 1 1 5 GLU OE1 O -1.197 -4.822 8.142 1.00 . A A . 5 GLU OE1 1 1 5 2016 1 1 5 GLU OE2 O -2.476 -5.953 9.456 1.00 . A A . 5 GLU OE2 1 1 5 2017 1 1 6 PRO C C 0.134 -9.157 2.853 1.00 . A A . 6 PRO C 1 1 5 2018 1 1 6 PRO CA C 1.131 -8.291 3.624 1.00 . A A . 6 PRO CA 1 1 5 2019 1 1 6 PRO CB C 2.197 -9.145 4.308 1.00 . A A . 6 PRO CB 1 1 5 2020 1 1 6 PRO CD C 0.962 -8.062 6.052 1.00 . A A . 6 PRO CD 1 1 5 2021 1 1 6 PRO CG C 1.694 -9.329 5.702 1.00 . A A . 6 PRO CG 1 1 5 2022 1 1 6 PRO HA H 1.600 -7.578 2.965 1.00 . A A . 6 PRO HA 1 1 5 2023 1 1 6 PRO HB2 H 2.287 -10.099 3.809 1.00 . A A . 6 PRO HB2 1 1 5 2024 1 1 6 PRO HB3 H 3.145 -8.631 4.321 1.00 . A A . 6 PRO HB3 1 1 5 2025 1 1 6 PRO HD2 H 0.141 -8.271 6.727 1.00 . A A . 6 PRO HD2 1 1 5 2026 1 1 6 PRO HD3 H 1.637 -7.335 6.478 1.00 . A A . 6 PRO HD3 1 1 5 2027 1 1 6 PRO HG2 H 1.019 -10.176 5.743 1.00 . A A . 6 PRO HG2 1 1 5 2028 1 1 6 PRO HG3 H 2.520 -9.474 6.382 1.00 . A A . 6 PRO HG3 1 1 5 2029 1 1 6 PRO N N 0.466 -7.595 4.754 1.00 . A A . 6 PRO N 1 1 5 2030 1 1 6 PRO O O -0.512 -10.025 3.407 1.00 . A A . 6 PRO O 1 1 5 2031 1 1 7 GLY C C -2.360 -9.154 0.921 1.00 . A A . 7 GLY C 1 1 5 2032 1 1 7 GLY CA C -0.954 -9.732 0.765 1.00 . A A . 7 GLY CA 1 1 5 2033 1 1 7 GLY H H 0.532 -8.217 1.146 1.00 . A A . 7 GLY H 1 1 5 2034 1 1 7 GLY HA2 H -0.661 -9.701 -0.277 1.00 . A A . 7 GLY HA2 1 1 5 2035 1 1 7 GLY HA3 H -0.948 -10.755 1.115 1.00 . A A . 7 GLY HA3 1 1 5 2036 1 1 7 GLY N N 0.002 -8.926 1.574 1.00 . A A . 7 GLY N 1 1 5 2037 1 1 7 GLY O O -3.249 -9.793 1.446 1.00 . A A . 7 GLY O 1 1 5 2038 1 1 8 THR C C -4.194 -6.335 -0.518 1.00 . A A . 8 THR C 1 1 5 2039 1 1 8 THR CA C -3.925 -7.333 0.607 1.00 . A A . 8 THR CA 1 1 5 2040 1 1 8 THR CB C -3.906 -6.619 1.959 1.00 . A A . 8 THR CB 1 1 5 2041 1 1 8 THR CG2 C -5.276 -6.755 2.628 1.00 . A A . 8 THR CG2 1 1 5 2042 1 1 8 THR H H -1.837 -7.442 0.056 1.00 . A A . 8 THR H 1 1 5 2043 1 1 8 THR HA H -4.683 -8.097 0.607 1.00 . A A . 8 THR HA 1 1 5 2044 1 1 8 THR HB H -3.687 -5.573 1.811 1.00 . A A . 8 THR HB 1 1 5 2045 1 1 8 THR HG1 H -2.507 -6.498 3.303 1.00 . A A . 8 THR HG1 1 1 5 2046 1 1 8 THR HG21 H -5.219 -7.492 3.415 1.00 . A A . 8 THR HG21 1 1 5 2047 1 1 8 THR HG22 H -6.005 -7.068 1.895 1.00 . A A . 8 THR HG22 1 1 5 2048 1 1 8 THR HG23 H -5.568 -5.804 3.045 1.00 . A A . 8 THR HG23 1 1 5 2049 1 1 8 THR N N -2.569 -7.945 0.473 1.00 . A A . 8 THR N 1 1 5 2050 1 1 8 THR O O -5.321 -6.144 -0.913 1.00 . A A . 8 THR O 1 1 5 2051 1 1 8 THR OG1 O -2.911 -7.201 2.788 1.00 . A A . 8 THR OG1 1 1 5 2052 1 1 9 THR C C -4.364 -3.608 -1.656 1.00 . A A . 9 THR C 1 1 5 2053 1 1 9 THR CA C -3.389 -4.696 -2.119 1.00 . A A . 9 THR CA 1 1 5 2054 1 1 9 THR CB C -3.922 -5.517 -3.315 1.00 . A A . 9 THR CB 1 1 5 2055 1 1 9 THR CG2 C -5.445 -5.380 -3.484 1.00 . A A . 9 THR CG2 1 1 5 2056 1 1 9 THR H H -2.274 -5.850 -0.684 1.00 . A A . 9 THR H 1 1 5 2057 1 1 9 THR HA H -2.448 -4.244 -2.385 1.00 . A A . 9 THR HA 1 1 5 2058 1 1 9 THR HB H -3.679 -6.559 -3.162 1.00 . A A . 9 THR HB 1 1 5 2059 1 1 9 THR HG1 H -3.124 -4.126 -4.412 1.00 . A A . 9 THR HG1 1 1 5 2060 1 1 9 THR HG21 H -5.948 -6.066 -2.821 1.00 . A A . 9 THR HG21 1 1 5 2061 1 1 9 THR HG22 H -5.711 -5.616 -4.502 1.00 . A A . 9 THR HG22 1 1 5 2062 1 1 9 THR HG23 H -5.753 -4.372 -3.261 1.00 . A A . 9 THR HG23 1 1 5 2063 1 1 9 THR N N -3.178 -5.689 -1.026 1.00 . A A . 9 THR N 1 1 5 2064 1 1 9 THR O O -5.475 -3.881 -1.250 1.00 . A A . 9 THR O 1 1 5 2065 1 1 9 THR OG1 O -3.287 -5.067 -4.502 1.00 . A A . 9 THR OG1 1 1 5 2066 1 1 10 PHE C C -4.466 0.047 -1.899 1.00 . A A . 10 PHE C 1 1 5 2067 1 1 10 PHE CA C -4.856 -1.279 -1.251 1.00 . A A . 10 PHE CA 1 1 5 2068 1 1 10 PHE CB C -4.654 -1.200 0.258 1.00 . A A . 10 PHE CB 1 1 5 2069 1 1 10 PHE CD1 C -2.239 -1.922 0.335 1.00 . A A . 10 PHE CD1 1 1 5 2070 1 1 10 PHE CD2 C -2.803 0.330 1.034 1.00 . A A . 10 PHE CD2 1 1 5 2071 1 1 10 PHE CE1 C -0.888 -1.667 0.602 1.00 . A A . 10 PHE CE1 1 1 5 2072 1 1 10 PHE CE2 C -1.453 0.586 1.301 1.00 . A A . 10 PHE CE2 1 1 5 2073 1 1 10 PHE CG C -3.197 -0.924 0.550 1.00 . A A . 10 PHE CG 1 1 5 2074 1 1 10 PHE CZ C -0.495 -0.413 1.085 1.00 . A A . 10 PHE CZ 1 1 5 2075 1 1 10 PHE H H -3.047 -2.165 -2.024 1.00 . A A . 10 PHE H 1 1 5 2076 1 1 10 PHE HA H -5.882 -1.521 -1.472 1.00 . A A . 10 PHE HA 1 1 5 2077 1 1 10 PHE HB2 H -5.262 -0.402 0.659 1.00 . A A . 10 PHE HB2 1 1 5 2078 1 1 10 PHE HB3 H -4.941 -2.136 0.708 1.00 . A A . 10 PHE HB3 1 1 5 2079 1 1 10 PHE HD1 H -2.541 -2.891 -0.036 1.00 . A A . 10 PHE HD1 1 1 5 2080 1 1 10 PHE HD2 H -3.541 1.100 1.200 1.00 . A A . 10 PHE HD2 1 1 5 2081 1 1 10 PHE HE1 H -0.149 -2.437 0.436 1.00 . A A . 10 PHE HE1 1 1 5 2082 1 1 10 PHE HE2 H -1.150 1.553 1.674 1.00 . A A . 10 PHE HE2 1 1 5 2083 1 1 10 PHE HZ H 0.546 -0.216 1.291 1.00 . A A . 10 PHE HZ 1 1 5 2084 1 1 10 PHE N N -3.951 -2.372 -1.701 1.00 . A A . 10 PHE N 1 1 5 2085 1 1 10 PHE O O -3.302 0.357 -2.051 1.00 . A A . 10 PHE O 1 1 5 2086 1 1 11 LYS C C -4.639 3.134 -1.827 1.00 . A A . 11 LYS C 1 1 5 2087 1 1 11 LYS CA C -5.139 2.153 -2.891 1.00 . A A . 11 LYS CA 1 1 5 2088 1 1 11 LYS CB C -6.475 2.622 -3.471 1.00 . A A . 11 LYS CB 1 1 5 2089 1 1 11 LYS CD C -7.582 4.398 -4.837 1.00 . A A . 11 LYS CD 1 1 5 2090 1 1 11 LYS CE C -7.257 4.595 -6.319 1.00 . A A . 11 LYS CE 1 1 5 2091 1 1 11 LYS CG C -6.309 4.015 -4.081 1.00 . A A . 11 LYS CG 1 1 5 2092 1 1 11 LYS H H -6.365 0.562 -2.113 1.00 . A A . 11 LYS H 1 1 5 2093 1 1 11 LYS HA H -4.411 2.043 -3.679 1.00 . A A . 11 LYS HA 1 1 5 2094 1 1 11 LYS HB2 H -6.796 1.929 -4.236 1.00 . A A . 11 LYS HB2 1 1 5 2095 1 1 11 LYS HB3 H -7.214 2.661 -2.686 1.00 . A A . 11 LYS HB3 1 1 5 2096 1 1 11 LYS HD2 H -8.315 3.612 -4.729 1.00 . A A . 11 LYS HD2 1 1 5 2097 1 1 11 LYS HD3 H -7.979 5.317 -4.432 1.00 . A A . 11 LYS HD3 1 1 5 2098 1 1 11 LYS HE2 H -6.271 5.025 -6.432 1.00 . A A . 11 LYS HE2 1 1 5 2099 1 1 11 LYS HE3 H -7.323 3.656 -6.847 1.00 . A A . 11 LYS HE3 1 1 5 2100 1 1 11 LYS HG2 H -6.125 4.732 -3.293 1.00 . A A . 11 LYS HG2 1 1 5 2101 1 1 11 LYS HG3 H -5.473 4.011 -4.765 1.00 . A A . 11 LYS HG3 1 1 5 2102 1 1 11 LYS HZ1 H -8.239 5.601 -7.854 1.00 . A A . 11 LYS HZ1 1 1 5 2103 1 1 11 LYS HZ2 H -8.144 6.477 -6.401 1.00 . A A . 11 LYS HZ2 1 1 5 2104 1 1 11 LYS HZ3 H -9.240 5.187 -6.550 1.00 . A A . 11 LYS HZ3 1 1 5 2105 1 1 11 LYS N N -5.437 0.835 -2.263 1.00 . A A . 11 LYS N 1 1 5 2106 1 1 11 LYS NZ N -8.299 5.536 -6.819 1.00 . A A . 11 LYS NZ 1 1 5 2107 1 1 11 LYS O O -5.378 3.544 -0.954 1.00 . A A . 11 LYS O 1 1 5 2108 1 1 12 ASP C C -2.231 5.674 -1.545 1.00 . A A . 12 ASP C 1 1 5 2109 1 1 12 ASP CA C -2.853 4.451 -0.867 1.00 . A A . 12 ASP CA 1 1 5 2110 1 1 12 ASP CB C -1.788 3.653 -0.115 1.00 . A A . 12 ASP CB 1 1 5 2111 1 1 12 ASP CG C -1.459 4.357 1.202 1.00 . A A . 12 ASP CG 1 1 5 2112 1 1 12 ASP H H -2.804 3.164 -2.591 1.00 . A A . 12 ASP H 1 1 5 2113 1 1 12 ASP HA H -3.633 4.754 -0.188 1.00 . A A . 12 ASP HA 1 1 5 2114 1 1 12 ASP HB2 H -2.162 2.659 0.092 1.00 . A A . 12 ASP HB2 1 1 5 2115 1 1 12 ASP HB3 H -0.895 3.585 -0.719 1.00 . A A . 12 ASP HB3 1 1 5 2116 1 1 12 ASP N N -3.390 3.507 -1.885 1.00 . A A . 12 ASP N 1 1 5 2117 1 1 12 ASP O O -1.329 5.558 -2.352 1.00 . A A . 12 ASP O 1 1 5 2118 1 1 12 ASP OD1 O -2.381 4.623 1.955 1.00 . A A . 12 ASP OD1 1 1 5 2119 1 1 12 ASP OD2 O -0.290 4.620 1.434 1.00 . A A . 12 ASP OD2 1 1 5 2120 1 1 13 LYS C C -2.607 8.257 -3.263 1.00 . A A . 13 LYS C 1 1 5 2121 1 1 13 LYS CA C -2.144 8.093 -1.808 1.00 . A A . 13 LYS CA 1 1 5 2122 1 1 13 LYS CB C -0.616 7.954 -1.732 1.00 . A A . 13 LYS CB 1 1 5 2123 1 1 13 LYS CD C 0.597 8.333 0.422 1.00 . A A . 13 LYS CD 1 1 5 2124 1 1 13 LYS CE C 1.939 7.719 0.825 1.00 . A A . 13 LYS CE 1 1 5 2125 1 1 13 LYS CG C -0.206 7.320 -0.397 1.00 . A A . 13 LYS CG 1 1 5 2126 1 1 13 LYS H H -3.423 6.903 -0.549 1.00 . A A . 13 LYS H 1 1 5 2127 1 1 13 LYS HA H -2.456 8.948 -1.228 1.00 . A A . 13 LYS HA 1 1 5 2128 1 1 13 LYS HB2 H -0.266 7.334 -2.543 1.00 . A A . 13 LYS HB2 1 1 5 2129 1 1 13 LYS HB3 H -0.165 8.934 -1.812 1.00 . A A . 13 LYS HB3 1 1 5 2130 1 1 13 LYS HD2 H 0.769 9.219 -0.171 1.00 . A A . 13 LYS HD2 1 1 5 2131 1 1 13 LYS HD3 H 0.042 8.598 1.311 1.00 . A A . 13 LYS HD3 1 1 5 2132 1 1 13 LYS HE2 H 1.839 6.650 0.949 1.00 . A A . 13 LYS HE2 1 1 5 2133 1 1 13 LYS HE3 H 2.693 7.945 0.088 1.00 . A A . 13 LYS HE3 1 1 5 2134 1 1 13 LYS HG2 H -1.086 7.029 0.156 1.00 . A A . 13 LYS HG2 1 1 5 2135 1 1 13 LYS HG3 H 0.405 6.450 -0.584 1.00 . A A . 13 LYS HG3 1 1 5 2136 1 1 13 LYS HZ1 H 1.413 8.557 2.658 1.00 . A A . 13 LYS HZ1 1 1 5 2137 1 1 13 LYS HZ2 H 2.786 9.258 1.944 1.00 . A A . 13 LYS HZ2 1 1 5 2138 1 1 13 LYS HZ3 H 2.893 7.729 2.677 1.00 . A A . 13 LYS HZ3 1 1 5 2139 1 1 13 LYS N N -2.701 6.844 -1.210 1.00 . A A . 13 LYS N 1 1 5 2140 1 1 13 LYS NZ N 2.283 8.365 2.123 1.00 . A A . 13 LYS NZ 1 1 5 2141 1 1 13 LYS O O -3.480 9.050 -3.554 1.00 . A A . 13 LYS O 1 1 5 2142 1 1 14 CYS C C -2.620 6.306 -6.261 1.00 . A A . 14 CYS C 1 1 5 2143 1 1 14 CYS CA C -2.441 7.674 -5.607 1.00 . A A . 14 CYS CA 1 1 5 2144 1 1 14 CYS CB C -1.276 8.402 -6.270 1.00 . A A . 14 CYS CB 1 1 5 2145 1 1 14 CYS H H -1.319 6.902 -3.948 1.00 . A A . 14 CYS H 1 1 5 2146 1 1 14 CYS HA H -3.340 8.262 -5.690 1.00 . A A . 14 CYS HA 1 1 5 2147 1 1 14 CYS HB2 H -1.431 8.415 -7.338 1.00 . A A . 14 CYS HB2 1 1 5 2148 1 1 14 CYS HB3 H -1.217 9.412 -5.893 1.00 . A A . 14 CYS HB3 1 1 5 2149 1 1 14 CYS N N -2.029 7.530 -4.184 1.00 . A A . 14 CYS N 1 1 5 2150 1 1 14 CYS O O -3.468 6.119 -7.110 1.00 . A A . 14 CYS O 1 1 5 2151 1 1 14 CYS SG S 0.261 7.518 -5.895 1.00 . A A . 14 CYS SG 1 1 5 2152 1 1 15 ASN C C -2.249 2.951 -5.470 1.00 . A A . 15 ASN C 1 1 5 2153 1 1 15 ASN CA C -1.911 4.011 -6.522 1.00 . A A . 15 ASN CA 1 1 5 2154 1 1 15 ASN CB C -0.525 3.747 -7.123 1.00 . A A . 15 ASN CB 1 1 5 2155 1 1 15 ASN CG C 0.050 5.043 -7.705 1.00 . A A . 15 ASN CG 1 1 5 2156 1 1 15 ASN H H -1.117 5.534 -5.223 1.00 . A A . 15 ASN H 1 1 5 2157 1 1 15 ASN HA H -2.654 4.015 -7.302 1.00 . A A . 15 ASN HA 1 1 5 2158 1 1 15 ASN HB2 H 0.135 3.380 -6.354 1.00 . A A . 15 ASN HB2 1 1 5 2159 1 1 15 ASN HB3 H -0.609 3.012 -7.909 1.00 . A A . 15 ASN HB3 1 1 5 2160 1 1 15 ASN HD21 H 1.926 4.386 -7.678 1.00 . A A . 15 ASN HD21 1 1 5 2161 1 1 15 ASN HD22 H 1.715 5.970 -8.276 1.00 . A A . 15 ASN HD22 1 1 5 2162 1 1 15 ASN N N -1.808 5.357 -5.895 1.00 . A A . 15 ASN N 1 1 5 2163 1 1 15 ASN ND2 N 1.336 5.141 -7.903 1.00 . A A . 15 ASN ND2 1 1 5 2164 1 1 15 ASN O O -2.589 3.263 -4.346 1.00 . A A . 15 ASN O 1 1 5 2165 1 1 15 ASN OD1 O -0.678 5.976 -7.980 1.00 . A A . 15 ASN OD1 1 1 5 2166 1 1 16 THR C C -1.219 -0.220 -4.579 1.00 . A A . 16 THR C 1 1 5 2167 1 1 16 THR CA C -2.474 0.618 -4.858 1.00 . A A . 16 THR CA 1 1 5 2168 1 1 16 THR CB C -3.562 -0.218 -5.547 1.00 . A A . 16 THR CB 1 1 5 2169 1 1 16 THR CG2 C -3.459 -1.687 -5.122 1.00 . A A . 16 THR CG2 1 1 5 2170 1 1 16 THR H H -1.883 1.473 -6.743 1.00 . A A . 16 THR H 1 1 5 2171 1 1 16 THR HA H -2.857 1.039 -3.945 1.00 . A A . 16 THR HA 1 1 5 2172 1 1 16 THR HB H -3.441 -0.151 -6.615 1.00 . A A . 16 THR HB 1 1 5 2173 1 1 16 THR HG1 H -5.159 0.831 -5.907 1.00 . A A . 16 THR HG1 1 1 5 2174 1 1 16 THR HG21 H -4.430 -2.152 -5.194 1.00 . A A . 16 THR HG21 1 1 5 2175 1 1 16 THR HG22 H -3.105 -1.742 -4.103 1.00 . A A . 16 THR HG22 1 1 5 2176 1 1 16 THR HG23 H -2.764 -2.199 -5.772 1.00 . A A . 16 THR HG23 1 1 5 2177 1 1 16 THR N N -2.159 1.701 -5.830 1.00 . A A . 16 THR N 1 1 5 2178 1 1 16 THR O O -0.473 -0.549 -5.479 1.00 . A A . 16 THR O 1 1 5 2179 1 1 16 THR OG1 O -4.840 0.286 -5.184 1.00 . A A . 16 THR OG1 1 1 5 2180 1 1 17 CYS C C -0.208 -2.811 -2.604 1.00 . A A . 17 CYS C 1 1 5 2181 1 1 17 CYS CA C 0.212 -1.396 -3.014 1.00 . A A . 17 CYS CA 1 1 5 2182 1 1 17 CYS CB C 0.881 -0.669 -1.847 1.00 . A A . 17 CYS CB 1 1 5 2183 1 1 17 CYS H H -1.608 -0.304 -2.633 1.00 . A A . 17 CYS H 1 1 5 2184 1 1 17 CYS HA H 0.884 -1.431 -3.857 1.00 . A A . 17 CYS HA 1 1 5 2185 1 1 17 CYS HB2 H 0.134 -0.120 -1.289 1.00 . A A . 17 CYS HB2 1 1 5 2186 1 1 17 CYS HB3 H 1.358 -1.391 -1.199 1.00 . A A . 17 CYS HB3 1 1 5 2187 1 1 17 CYS N N -0.990 -0.575 -3.344 1.00 . A A . 17 CYS N 1 1 5 2188 1 1 17 CYS O O -0.939 -3.004 -1.654 1.00 . A A . 17 CYS O 1 1 5 2189 1 1 17 CYS SG S 2.122 0.482 -2.489 1.00 . A A . 17 CYS SG 1 1 5 2190 1 1 18 ARG C C 0.332 -5.584 -1.583 1.00 . A A . 18 ARG C 1 1 5 2191 1 1 18 ARG CA C -0.113 -5.213 -3.000 1.00 . A A . 18 ARG CA 1 1 5 2192 1 1 18 ARG CB C 0.656 -6.046 -4.021 1.00 . A A . 18 ARG CB 1 1 5 2193 1 1 18 ARG CD C -0.982 -7.881 -3.587 1.00 . A A . 18 ARG CD 1 1 5 2194 1 1 18 ARG CG C 0.504 -7.528 -3.685 1.00 . A A . 18 ARG CG 1 1 5 2195 1 1 18 ARG CZ C -1.809 -10.005 -2.770 1.00 . A A . 18 ARG CZ 1 1 5 2196 1 1 18 ARG H H 0.837 -3.613 -4.086 1.00 . A A . 18 ARG H 1 1 5 2197 1 1 18 ARG HA H -1.171 -5.372 -3.119 1.00 . A A . 18 ARG HA 1 1 5 2198 1 1 18 ARG HB2 H 0.268 -5.854 -5.009 1.00 . A A . 18 ARG HB2 1 1 5 2199 1 1 18 ARG HB3 H 1.702 -5.778 -3.988 1.00 . A A . 18 ARG HB3 1 1 5 2200 1 1 18 ARG HD2 H -1.398 -7.494 -2.667 1.00 . A A . 18 ARG HD2 1 1 5 2201 1 1 18 ARG HD3 H -1.517 -7.491 -4.438 1.00 . A A . 18 ARG HD3 1 1 5 2202 1 1 18 ARG HE H -0.460 -9.871 -4.220 1.00 . A A . 18 ARG HE 1 1 5 2203 1 1 18 ARG HG2 H 0.967 -8.120 -4.459 1.00 . A A . 18 ARG HG2 1 1 5 2204 1 1 18 ARG HG3 H 0.983 -7.733 -2.740 1.00 . A A . 18 ARG HG3 1 1 5 2205 1 1 18 ARG HH11 H -3.368 -8.784 -3.065 1.00 . A A . 18 ARG HH11 1 1 5 2206 1 1 18 ARG HH12 H -3.633 -10.079 -1.946 1.00 . A A . 18 ARG HH12 1 1 5 2207 1 1 18 ARG HH21 H -0.434 -11.374 -2.277 1.00 . A A . 18 ARG HH21 1 1 5 2208 1 1 18 ARG HH22 H -1.973 -11.545 -1.501 1.00 . A A . 18 ARG HH22 1 1 5 2209 1 1 18 ARG N N 0.251 -3.800 -3.324 1.00 . A A . 18 ARG N 1 1 5 2210 1 1 18 ARG NE N -1.024 -9.369 -3.595 1.00 . A A . 18 ARG NE 1 1 5 2211 1 1 18 ARG NH1 N -3.032 -9.591 -2.579 1.00 . A A . 18 ARG NH1 1 1 5 2212 1 1 18 ARG NH2 N -1.372 -11.057 -2.132 1.00 . A A . 18 ARG NH2 1 1 5 2213 1 1 18 ARG O O -0.124 -6.555 -1.009 1.00 . A A . 18 ARG O 1 1 5 2214 1 1 19 CYS C C 2.573 -6.415 0.320 1.00 . A A . 19 CYS C 1 1 5 2215 1 1 19 CYS CA C 1.730 -5.135 0.345 1.00 . A A . 19 CYS CA 1 1 5 2216 1 1 19 CYS CB C 0.482 -5.313 1.208 1.00 . A A . 19 CYS CB 1 1 5 2217 1 1 19 CYS H H 1.586 -4.065 -1.515 1.00 . A A . 19 CYS H 1 1 5 2218 1 1 19 CYS HA H 2.315 -4.312 0.722 1.00 . A A . 19 CYS HA 1 1 5 2219 1 1 19 CYS HB2 H -0.397 -5.052 0.633 1.00 . A A . 19 CYS HB2 1 1 5 2220 1 1 19 CYS HB3 H 0.411 -6.340 1.536 1.00 . A A . 19 CYS HB3 1 1 5 2221 1 1 19 CYS N N 1.231 -4.830 -1.025 1.00 . A A . 19 CYS N 1 1 5 2222 1 1 19 CYS O O 2.060 -7.508 0.186 1.00 . A A . 19 CYS O 1 1 5 2223 1 1 19 CYS SG S 0.613 -4.223 2.646 1.00 . A A . 19 CYS SG 1 1 5 2224 1 1 20 GLY C C 4.386 -8.440 1.527 1.00 . A A . 20 GLY C 1 1 5 2225 1 1 20 GLY CA C 4.760 -7.473 0.402 1.00 . A A . 20 GLY CA 1 1 5 2226 1 1 20 GLY H H 4.256 -5.384 0.531 1.00 . A A . 20 GLY H 1 1 5 2227 1 1 20 GLY HA2 H 4.655 -7.973 -0.552 1.00 . A A . 20 GLY HA2 1 1 5 2228 1 1 20 GLY HA3 H 5.785 -7.157 0.532 1.00 . A A . 20 GLY HA3 1 1 5 2229 1 1 20 GLY N N 3.868 -6.278 0.433 1.00 . A A . 20 GLY N 1 1 5 2230 1 1 20 GLY O O 3.291 -8.407 2.051 1.00 . A A . 20 GLY O 1 1 5 2231 1 1 21 SER C C 5.558 -9.788 4.317 1.00 . A A . 21 SER C 1 1 5 2232 1 1 21 SER CA C 4.993 -10.282 2.983 1.00 . A A . 21 SER CA 1 1 5 2233 1 1 21 SER CB C 5.688 -11.572 2.552 1.00 . A A . 21 SER CB 1 1 5 2234 1 1 21 SER H H 6.167 -9.316 1.457 1.00 . A A . 21 SER H 1 1 5 2235 1 1 21 SER HA H 3.932 -10.446 3.060 1.00 . A A . 21 SER HA 1 1 5 2236 1 1 21 SER HB2 H 5.287 -11.902 1.608 1.00 . A A . 21 SER HB2 1 1 5 2237 1 1 21 SER HB3 H 6.749 -11.388 2.444 1.00 . A A . 21 SER HB3 1 1 5 2238 1 1 21 SER HG H 4.574 -12.914 3.412 1.00 . A A . 21 SER HG 1 1 5 2239 1 1 21 SER N N 5.291 -9.305 1.897 1.00 . A A . 21 SER N 1 1 5 2240 1 1 21 SER O O 5.313 -10.366 5.357 1.00 . A A . 21 SER O 1 1 5 2241 1 1 21 SER OG O 5.465 -12.577 3.532 1.00 . A A . 21 SER OG 1 1 5 2242 1 1 22 ASP C C 5.870 -7.344 6.312 1.00 . A A . 22 ASP C 1 1 5 2243 1 1 22 ASP CA C 6.899 -8.199 5.564 1.00 . A A . 22 ASP CA 1 1 5 2244 1 1 22 ASP CB C 8.087 -7.345 5.124 1.00 . A A . 22 ASP CB 1 1 5 2245 1 1 22 ASP CG C 9.149 -8.241 4.482 1.00 . A A . 22 ASP CG 1 1 5 2246 1 1 22 ASP H H 6.504 -8.276 3.447 1.00 . A A . 22 ASP H 1 1 5 2247 1 1 22 ASP HA H 7.240 -9.010 6.188 1.00 . A A . 22 ASP HA 1 1 5 2248 1 1 22 ASP HB2 H 7.754 -6.609 4.405 1.00 . A A . 22 ASP HB2 1 1 5 2249 1 1 22 ASP HB3 H 8.512 -6.847 5.984 1.00 . A A . 22 ASP HB3 1 1 5 2250 1 1 22 ASP N N 6.316 -8.726 4.296 1.00 . A A . 22 ASP N 1 1 5 2251 1 1 22 ASP O O 5.987 -7.113 7.500 1.00 . A A . 22 ASP O 1 1 5 2252 1 1 22 ASP OD1 O 8.942 -9.443 4.451 1.00 . A A . 22 ASP OD1 1 1 5 2253 1 1 22 ASP OD2 O 10.151 -7.709 4.033 1.00 . A A . 22 ASP OD2 1 1 5 2254 1 1 23 GLY C C 4.353 -4.599 6.439 1.00 . A A . 23 GLY C 1 1 5 2255 1 1 23 GLY CA C 3.834 -6.032 6.300 1.00 . A A . 23 GLY CA 1 1 5 2256 1 1 23 GLY H H 4.790 -7.068 4.669 1.00 . A A . 23 GLY H 1 1 5 2257 1 1 23 GLY HA2 H 2.928 -6.031 5.709 1.00 . A A . 23 GLY HA2 1 1 5 2258 1 1 23 GLY HA3 H 3.626 -6.433 7.283 1.00 . A A . 23 GLY HA3 1 1 5 2259 1 1 23 GLY N N 4.865 -6.872 5.627 1.00 . A A . 23 GLY N 1 1 5 2260 1 1 23 GLY O O 3.646 -3.713 6.876 1.00 . A A . 23 GLY O 1 1 5 2261 1 1 24 LYS C C 6.843 -2.598 4.872 1.00 . A A . 24 LYS C 1 1 5 2262 1 1 24 LYS CA C 6.145 -2.987 6.178 1.00 . A A . 24 LYS CA 1 1 5 2263 1 1 24 LYS CB C 7.153 -3.061 7.325 1.00 . A A . 24 LYS CB 1 1 5 2264 1 1 24 LYS CD C 7.567 -1.397 9.141 1.00 . A A . 24 LYS CD 1 1 5 2265 1 1 24 LYS CE C 6.100 -1.180 9.519 1.00 . A A . 24 LYS CE 1 1 5 2266 1 1 24 LYS CG C 7.673 -1.658 7.638 1.00 . A A . 24 LYS CG 1 1 5 2267 1 1 24 LYS H H 6.137 -5.092 5.718 1.00 . A A . 24 LYS H 1 1 5 2268 1 1 24 LYS HA H 5.366 -2.279 6.417 1.00 . A A . 24 LYS HA 1 1 5 2269 1 1 24 LYS HB2 H 6.672 -3.472 8.201 1.00 . A A . 24 LYS HB2 1 1 5 2270 1 1 24 LYS HB3 H 7.980 -3.694 7.037 1.00 . A A . 24 LYS HB3 1 1 5 2271 1 1 24 LYS HD2 H 7.957 -2.247 9.682 1.00 . A A . 24 LYS HD2 1 1 5 2272 1 1 24 LYS HD3 H 8.136 -0.516 9.395 1.00 . A A . 24 LYS HD3 1 1 5 2273 1 1 24 LYS HE2 H 5.530 -2.082 9.344 1.00 . A A . 24 LYS HE2 1 1 5 2274 1 1 24 LYS HE3 H 6.018 -0.876 10.551 1.00 . A A . 24 LYS HE3 1 1 5 2275 1 1 24 LYS HG2 H 8.706 -1.580 7.330 1.00 . A A . 24 LYS HG2 1 1 5 2276 1 1 24 LYS HG3 H 7.081 -0.928 7.105 1.00 . A A . 24 LYS HG3 1 1 5 2277 1 1 24 LYS HZ1 H 4.834 0.411 9.072 1.00 . A A . 24 LYS HZ1 1 1 5 2278 1 1 24 LYS HZ2 H 5.323 -0.487 7.716 1.00 . A A . 24 LYS HZ2 1 1 5 2279 1 1 24 LYS HZ3 H 6.407 0.588 8.462 1.00 . A A . 24 LYS HZ3 1 1 5 2280 1 1 24 LYS N N 5.582 -4.363 6.069 1.00 . A A . 24 LYS N 1 1 5 2281 1 1 24 LYS NZ N 5.630 -0.085 8.625 1.00 . A A . 24 LYS NZ 1 1 5 2282 1 1 24 LYS O O 7.597 -1.645 4.820 1.00 . A A . 24 LYS O 1 1 5 2283 1 1 25 SER C C 6.437 -3.582 1.359 1.00 . A A . 25 SER C 1 1 5 2284 1 1 25 SER CA C 7.250 -2.998 2.516 1.00 . A A . 25 SER CA 1 1 5 2285 1 1 25 SER CB C 8.628 -3.652 2.587 1.00 . A A . 25 SER CB 1 1 5 2286 1 1 25 SER H H 5.989 -4.091 3.882 1.00 . A A . 25 SER H 1 1 5 2287 1 1 25 SER HA H 7.353 -1.931 2.405 1.00 . A A . 25 SER HA 1 1 5 2288 1 1 25 SER HB2 H 8.604 -4.603 2.078 1.00 . A A . 25 SER HB2 1 1 5 2289 1 1 25 SER HB3 H 9.356 -3.006 2.109 1.00 . A A . 25 SER HB3 1 1 5 2290 1 1 25 SER HG H 9.585 -4.602 3.988 1.00 . A A . 25 SER HG 1 1 5 2291 1 1 25 SER N N 6.599 -3.327 3.818 1.00 . A A . 25 SER N 1 1 5 2292 1 1 25 SER O O 5.975 -4.704 1.415 1.00 . A A . 25 SER O 1 1 5 2293 1 1 25 SER OG O 8.980 -3.859 3.948 1.00 . A A . 25 SER OG 1 1 5 2294 1 1 26 ALA C C 5.699 -2.478 -2.083 1.00 . A A . 26 ALA C 1 1 5 2295 1 1 26 ALA CA C 5.471 -3.346 -0.848 1.00 . A A . 26 ALA CA 1 1 5 2296 1 1 26 ALA CB C 4.014 -3.256 -0.404 1.00 . A A . 26 ALA CB 1 1 5 2297 1 1 26 ALA H H 6.635 -1.925 0.281 1.00 . A A . 26 ALA H 1 1 5 2298 1 1 26 ALA HA H 5.731 -4.372 -1.052 1.00 . A A . 26 ALA HA 1 1 5 2299 1 1 26 ALA HB1 H 3.622 -2.281 -0.653 1.00 . A A . 26 ALA HB1 1 1 5 2300 1 1 26 ALA HB2 H 3.953 -3.407 0.664 1.00 . A A . 26 ALA HB2 1 1 5 2301 1 1 26 ALA HB3 H 3.436 -4.017 -0.908 1.00 . A A . 26 ALA HB3 1 1 5 2302 1 1 26 ALA N N 6.257 -2.829 0.309 1.00 . A A . 26 ALA N 1 1 5 2303 1 1 26 ALA O O 6.532 -1.593 -2.091 1.00 . A A . 26 ALA O 1 1 5 2304 1 1 27 ALA C C 3.752 -1.417 -4.839 1.00 . A A . 27 ALA C 1 1 5 2305 1 1 27 ALA CA C 5.117 -1.908 -4.363 1.00 . A A . 27 ALA CA 1 1 5 2306 1 1 27 ALA CB C 5.727 -2.857 -5.391 1.00 . A A . 27 ALA CB 1 1 5 2307 1 1 27 ALA H H 4.283 -3.437 -3.097 1.00 . A A . 27 ALA H 1 1 5 2308 1 1 27 ALA HA H 5.780 -1.075 -4.185 1.00 . A A . 27 ALA HA 1 1 5 2309 1 1 27 ALA HB1 H 6.794 -2.915 -5.238 1.00 . A A . 27 ALA HB1 1 1 5 2310 1 1 27 ALA HB2 H 5.525 -2.487 -6.385 1.00 . A A . 27 ALA HB2 1 1 5 2311 1 1 27 ALA HB3 H 5.291 -3.838 -5.277 1.00 . A A . 27 ALA HB3 1 1 5 2312 1 1 27 ALA N N 4.954 -2.721 -3.127 1.00 . A A . 27 ALA N 1 1 5 2313 1 1 27 ALA O O 2.751 -2.084 -4.671 1.00 . A A . 27 ALA O 1 1 5 2314 1 1 28 CYS C C 2.384 0.347 -7.439 1.00 . A A . 28 CYS C 1 1 5 2315 1 1 28 CYS CA C 2.388 0.257 -5.911 1.00 . A A . 28 CYS CA 1 1 5 2316 1 1 28 CYS CB C 2.256 1.645 -5.283 1.00 . A A . 28 CYS CB 1 1 5 2317 1 1 28 CYS H H 4.513 0.268 -5.558 1.00 . A A . 28 CYS H 1 1 5 2318 1 1 28 CYS HA H 1.593 -0.381 -5.568 1.00 . A A . 28 CYS HA 1 1 5 2319 1 1 28 CYS HB2 H 3.228 1.982 -4.946 1.00 . A A . 28 CYS HB2 1 1 5 2320 1 1 28 CYS HB3 H 1.868 2.337 -6.017 1.00 . A A . 28 CYS HB3 1 1 5 2321 1 1 28 CYS N N 3.698 -0.259 -5.430 1.00 . A A . 28 CYS N 1 1 5 2322 1 1 28 CYS O O 3.415 0.511 -8.059 1.00 . A A . 28 CYS O 1 1 5 2323 1 1 28 CYS SG S 1.124 1.565 -3.872 1.00 . A A . 28 CYS SG 1 1 5 2324 1 1 29 THR C C 1.903 1.569 -10.039 1.00 . A A . 29 THR C 1 1 5 2325 1 1 29 THR CA C 1.176 0.310 -9.542 1.00 . A A . 29 THR CA 1 1 5 2326 1 1 29 THR CB C -0.315 0.362 -9.884 1.00 . A A . 29 THR CB 1 1 5 2327 1 1 29 THR CG2 C -0.934 -1.023 -9.691 1.00 . A A . 29 THR CG2 1 1 5 2328 1 1 29 THR H H 0.412 0.096 -7.533 1.00 . A A . 29 THR H 1 1 5 2329 1 1 29 THR HA H 1.620 -0.572 -9.977 1.00 . A A . 29 THR HA 1 1 5 2330 1 1 29 THR HB H -0.439 0.667 -10.911 1.00 . A A . 29 THR HB 1 1 5 2331 1 1 29 THR HG1 H -1.700 1.676 -9.515 1.00 . A A . 29 THR HG1 1 1 5 2332 1 1 29 THR HG21 H -1.877 -1.072 -10.213 1.00 . A A . 29 THR HG21 1 1 5 2333 1 1 29 THR HG22 H -1.095 -1.201 -8.638 1.00 . A A . 29 THR HG22 1 1 5 2334 1 1 29 THR HG23 H -0.263 -1.773 -10.085 1.00 . A A . 29 THR HG23 1 1 5 2335 1 1 29 THR N N 1.235 0.234 -8.052 1.00 . A A . 29 THR N 1 1 5 2336 1 1 29 THR O O 3.116 1.616 -10.069 1.00 . A A . 29 THR O 1 1 5 2337 1 1 29 THR OG1 O -0.965 1.294 -9.030 1.00 . A A . 29 THR OG1 1 1 5 2338 1 1 30 ARG C C 0.832 4.898 -11.301 1.00 . A A . 30 ARG C 1 1 5 2339 1 1 30 ARG CA C 1.861 3.830 -10.915 1.00 . A A . 30 ARG CA 1 1 5 2340 1 1 30 ARG CB C 2.658 3.394 -12.146 1.00 . A A . 30 ARG CB 1 1 5 2341 1 1 30 ARG CD C 2.015 1.402 -13.509 1.00 . A A . 30 ARG CD 1 1 5 2342 1 1 30 ARG CG C 1.698 2.870 -13.216 1.00 . A A . 30 ARG CG 1 1 5 2343 1 1 30 ARG CZ C 2.794 0.562 -15.643 1.00 . A A . 30 ARG CZ 1 1 5 2344 1 1 30 ARG H H 0.205 2.547 -10.399 1.00 . A A . 30 ARG H 1 1 5 2345 1 1 30 ARG HA H 2.532 4.211 -10.162 1.00 . A A . 30 ARG HA 1 1 5 2346 1 1 30 ARG HB2 H 3.205 4.241 -12.537 1.00 . A A . 30 ARG HB2 1 1 5 2347 1 1 30 ARG HB3 H 3.350 2.613 -11.873 1.00 . A A . 30 ARG HB3 1 1 5 2348 1 1 30 ARG HD2 H 3.014 1.160 -13.173 1.00 . A A . 30 ARG HD2 1 1 5 2349 1 1 30 ARG HD3 H 1.291 0.758 -13.037 1.00 . A A . 30 ARG HD3 1 1 5 2350 1 1 30 ARG HE H 1.199 1.734 -15.475 1.00 . A A . 30 ARG HE 1 1 5 2351 1 1 30 ARG HG2 H 0.680 2.956 -12.861 1.00 . A A . 30 ARG HG2 1 1 5 2352 1 1 30 ARG HG3 H 1.814 3.449 -14.119 1.00 . A A . 30 ARG HG3 1 1 5 2353 1 1 30 ARG HH11 H 4.377 1.466 -14.815 1.00 . A A . 30 ARG HH11 1 1 5 2354 1 1 30 ARG HH12 H 4.741 0.214 -15.956 1.00 . A A . 30 ARG HH12 1 1 5 2355 1 1 30 ARG HH21 H 1.414 -0.510 -16.621 1.00 . A A . 30 ARG HH21 1 1 5 2356 1 1 30 ARG HH22 H 3.062 -0.903 -16.980 1.00 . A A . 30 ARG HH22 1 1 5 2357 1 1 30 ARG N N 1.183 2.592 -10.428 1.00 . A A . 30 ARG N 1 1 5 2358 1 1 30 ARG NE N 1.919 1.277 -14.991 1.00 . A A . 30 ARG NE 1 1 5 2359 1 1 30 ARG NH1 N 4.070 0.763 -15.457 1.00 . A A . 30 ARG NH1 1 1 5 2360 1 1 30 ARG NH2 N 2.392 -0.356 -16.479 1.00 . A A . 30 ARG NH2 1 1 5 2361 1 1 30 ARG O O 1.036 5.656 -12.229 1.00 . A A . 30 ARG O 1 1 5 2362 1 1 31 MET C C -0.677 7.399 -10.943 1.00 . A A . 31 MET C 1 1 5 2363 1 1 31 MET CA C -1.298 5.990 -10.954 1.00 . A A . 31 MET CA 1 1 5 2364 1 1 31 MET CB C -2.398 5.843 -9.895 1.00 . A A . 31 MET CB 1 1 5 2365 1 1 31 MET CE C -5.784 4.895 -12.030 1.00 . A A . 31 MET CE 1 1 5 2366 1 1 31 MET CG C -3.767 5.963 -10.568 1.00 . A A . 31 MET CG 1 1 5 2367 1 1 31 MET H H -0.424 4.347 -9.865 1.00 . A A . 31 MET H 1 1 5 2368 1 1 31 MET HA H -1.707 5.780 -11.931 1.00 . A A . 31 MET HA 1 1 5 2369 1 1 31 MET HB2 H -2.314 4.875 -9.422 1.00 . A A . 31 MET HB2 1 1 5 2370 1 1 31 MET HB3 H -2.300 6.615 -9.153 1.00 . A A . 31 MET HB3 1 1 5 2371 1 1 31 MET HE1 H -5.829 5.182 -13.070 1.00 . A A . 31 MET HE1 1 1 5 2372 1 1 31 MET HE2 H -6.137 5.711 -11.418 1.00 . A A . 31 MET HE2 1 1 5 2373 1 1 31 MET HE3 H -6.408 4.027 -11.862 1.00 . A A . 31 MET HE3 1 1 5 2374 1 1 31 MET HG2 H -4.534 6.041 -9.812 1.00 . A A . 31 MET HG2 1 1 5 2375 1 1 31 MET HG3 H -3.786 6.846 -11.190 1.00 . A A . 31 MET HG3 1 1 5 2376 1 1 31 MET N N -0.271 4.967 -10.607 1.00 . A A . 31 MET N 1 1 5 2377 1 1 31 MET O O -0.302 7.907 -11.980 1.00 . A A . 31 MET O 1 1 5 2378 1 1 31 MET SD S -4.074 4.501 -11.588 1.00 . A A . 31 MET SD 1 1 5 2379 1 1 32 ALA C C -0.370 10.126 -8.447 1.00 . A A . 32 ALA C 1 1 5 2380 1 1 32 ALA CA C 0.053 9.408 -9.732 1.00 . A A . 32 ALA CA 1 1 5 2381 1 1 32 ALA CB C -0.505 10.164 -10.937 1.00 . A A . 32 ALA CB 1 1 5 2382 1 1 32 ALA H H -0.846 7.600 -8.958 1.00 . A A . 32 ALA H 1 1 5 2383 1 1 32 ALA HA H 1.129 9.351 -9.797 1.00 . A A . 32 ALA HA 1 1 5 2384 1 1 32 ALA HB1 H -0.538 11.220 -10.713 1.00 . A A . 32 ALA HB1 1 1 5 2385 1 1 32 ALA HB2 H -1.503 9.810 -11.151 1.00 . A A . 32 ALA HB2 1 1 5 2386 1 1 32 ALA HB3 H 0.130 9.996 -11.793 1.00 . A A . 32 ALA HB3 1 1 5 2387 1 1 32 ALA N N -0.552 8.030 -9.789 1.00 . A A . 32 ALA N 1 1 5 2388 1 1 32 ALA O O -1.542 10.317 -8.193 1.00 . A A . 32 ALA O 1 1 5 2389 1 1 33 CYS C C 0.804 12.654 -6.374 1.00 . A A . 33 CYS C 1 1 5 2390 1 1 33 CYS CA C 0.199 11.247 -6.376 1.00 . A A . 33 CYS CA 1 1 5 2391 1 1 33 CYS CB C 0.760 10.425 -5.195 1.00 . A A . 33 CYS CB 1 1 5 2392 1 1 33 CYS H H 1.511 10.380 -7.858 1.00 . A A . 33 CYS H 1 1 5 2393 1 1 33 CYS HA H -0.876 11.310 -6.296 1.00 . A A . 33 CYS HA 1 1 5 2394 1 1 33 CYS HB2 H 1.426 11.046 -4.616 1.00 . A A . 33 CYS HB2 1 1 5 2395 1 1 33 CYS HB3 H -0.063 10.110 -4.567 1.00 . A A . 33 CYS HB3 1 1 5 2396 1 1 33 CYS N N 0.568 10.535 -7.639 1.00 . A A . 33 CYS N 1 1 5 2397 1 1 33 CYS O O 1.627 12.979 -7.206 1.00 . A A . 33 CYS O 1 1 5 2398 1 1 33 CYS SG S 1.671 8.957 -5.761 1.00 . A A . 33 CYS SG 1 1 5 2399 1 1 34 PRO C C 2.289 14.855 -4.760 1.00 . A A . 34 PRO C 1 1 5 2400 1 1 34 PRO CA C 0.861 14.838 -5.313 1.00 . A A . 34 PRO CA 1 1 5 2401 1 1 34 PRO CB C -0.111 15.480 -4.327 1.00 . A A . 34 PRO CB 1 1 5 2402 1 1 34 PRO CD C -0.626 13.119 -4.400 1.00 . A A . 34 PRO CD 1 1 5 2403 1 1 34 PRO CG C -0.654 14.344 -3.521 1.00 . A A . 34 PRO CG 1 1 5 2404 1 1 34 PRO HA H 0.813 15.343 -6.263 1.00 . A A . 34 PRO HA 1 1 5 2405 1 1 34 PRO HB2 H 0.412 16.182 -3.690 1.00 . A A . 34 PRO HB2 1 1 5 2406 1 1 34 PRO HB3 H -0.912 15.972 -4.855 1.00 . A A . 34 PRO HB3 1 1 5 2407 1 1 34 PRO HD2 H -0.314 12.253 -3.830 1.00 . A A . 34 PRO HD2 1 1 5 2408 1 1 34 PRO HD3 H -1.592 12.954 -4.852 1.00 . A A . 34 PRO HD3 1 1 5 2409 1 1 34 PRO HG2 H -0.038 14.187 -2.646 1.00 . A A . 34 PRO HG2 1 1 5 2410 1 1 34 PRO HG3 H -1.670 14.554 -3.223 1.00 . A A . 34 PRO HG3 1 1 5 2411 1 1 34 PRO N N 0.365 13.445 -5.431 1.00 . A A . 34 PRO N 1 1 5 2412 1 1 34 PRO O O 3.079 15.723 -5.079 1.00 . A A . 34 PRO O 1 1 5 2413 1 1 35 GLN C C 4.910 12.983 -4.220 1.00 . A A . 35 GLN C 1 1 5 2414 1 1 35 GLN CA C 4.001 13.867 -3.362 1.00 . A A . 35 GLN CA 1 1 5 2415 1 1 35 GLN CB C 3.835 13.269 -1.963 1.00 . A A . 35 GLN CB 1 1 5 2416 1 1 35 GLN CD C 3.846 14.423 0.254 1.00 . A A . 35 GLN CD 1 1 5 2417 1 1 35 GLN CG C 4.689 14.057 -0.968 1.00 . A A . 35 GLN CG 1 1 5 2418 1 1 35 GLN H H 1.974 13.215 -3.691 1.00 . A A . 35 GLN H 1 1 5 2419 1 1 35 GLN HA H 4.407 14.865 -3.288 1.00 . A A . 35 GLN HA 1 1 5 2420 1 1 35 GLN HB2 H 2.797 13.322 -1.671 1.00 . A A . 35 GLN HB2 1 1 5 2421 1 1 35 GLN HB3 H 4.155 12.237 -1.972 1.00 . A A . 35 GLN HB3 1 1 5 2422 1 1 35 GLN HE21 H 2.436 15.328 -0.812 1.00 . A A . 35 GLN HE21 1 1 5 2423 1 1 35 GLN HE22 H 2.181 15.317 0.866 1.00 . A A . 35 GLN HE22 1 1 5 2424 1 1 35 GLN HG2 H 5.530 13.452 -0.659 1.00 . A A . 35 GLN HG2 1 1 5 2425 1 1 35 GLN HG3 H 5.049 14.959 -1.439 1.00 . A A . 35 GLN HG3 1 1 5 2426 1 1 35 GLN N N 2.625 13.904 -3.935 1.00 . A A . 35 GLN N 1 1 5 2427 1 1 35 GLN NE2 N 2.728 15.077 0.089 1.00 . A A . 35 GLN NE2 1 1 5 2428 1 1 35 GLN O O 5.895 13.493 -4.727 1.00 . A A . 35 GLN O 1 1 5 2429 1 1 35 GLN OXT O 4.604 11.809 -4.355 1.00 . A A . 35 GLN OXT 1 1 5 2430 1 1 35 GLN OE1 O 4.207 14.111 1.372 1.00 . A A . 35 GLN OE1 1 1 6 2431 1 1 1 GLU C C 3.287 3.482 4.334 1.00 . A A . 1 GLU C 1 1 6 2432 1 1 1 GLU CA C 4.366 4.517 4.667 1.00 . A A . 1 GLU CA 1 1 6 2433 1 1 1 GLU CB C 4.368 4.831 6.166 1.00 . A A . 1 GLU CB 1 1 6 2434 1 1 1 GLU CD C 2.840 6.763 6.586 1.00 . A A . 1 GLU CD 1 1 6 2435 1 1 1 GLU CG C 2.961 5.238 6.610 1.00 . A A . 1 GLU CG 1 1 6 2436 1 1 1 GLU H1 H 3.030 5.960 3.976 1.00 . A A . 1 GLU H1 1 1 6 2437 1 1 1 GLU H2 H 4.431 5.803 3.029 1.00 . A A . 1 GLU H2 1 1 6 2438 1 1 1 GLU H3 H 4.503 6.593 4.532 1.00 . A A . 1 GLU H3 1 1 6 2439 1 1 1 GLU HA H 5.337 4.159 4.365 1.00 . A A . 1 GLU HA 1 1 6 2440 1 1 1 GLU HB2 H 4.680 3.955 6.715 1.00 . A A . 1 GLU HB2 1 1 6 2441 1 1 1 GLU HB3 H 5.054 5.640 6.361 1.00 . A A . 1 GLU HB3 1 1 6 2442 1 1 1 GLU HG2 H 2.232 4.807 5.940 1.00 . A A . 1 GLU HG2 1 1 6 2443 1 1 1 GLU HG3 H 2.784 4.882 7.614 1.00 . A A . 1 GLU HG3 1 1 6 2444 1 1 1 GLU N N 4.059 5.816 4.001 1.00 . A A . 1 GLU N 1 1 6 2445 1 1 1 GLU O O 2.261 3.800 3.765 1.00 . A A . 1 GLU O 1 1 6 2446 1 1 1 GLU OE1 O 2.758 7.313 5.500 1.00 . A A . 1 GLU OE1 1 1 6 2447 1 1 1 GLU OE2 O 2.829 7.353 7.653 1.00 . A A . 1 GLU OE2 1 1 6 2448 1 1 2 VAL C C 2.397 0.205 5.552 1.00 . A A . 2 VAL C 1 1 6 2449 1 1 2 VAL CA C 2.501 1.190 4.383 1.00 . A A . 2 VAL CA 1 1 6 2450 1 1 2 VAL CB C 3.022 0.486 3.130 1.00 . A A . 2 VAL CB 1 1 6 2451 1 1 2 VAL CG1 C 4.337 -0.222 3.452 1.00 . A A . 2 VAL CG1 1 1 6 2452 1 1 2 VAL CG2 C 2.000 -0.549 2.664 1.00 . A A . 2 VAL CG2 1 1 6 2453 1 1 2 VAL H H 4.346 2.007 5.139 1.00 . A A . 2 VAL H 1 1 6 2454 1 1 2 VAL HA H 1.540 1.637 4.181 1.00 . A A . 2 VAL HA 1 1 6 2455 1 1 2 VAL HB H 3.186 1.213 2.349 1.00 . A A . 2 VAL HB 1 1 6 2456 1 1 2 VAL HG11 H 4.990 -0.172 2.594 1.00 . A A . 2 VAL HG11 1 1 6 2457 1 1 2 VAL HG12 H 4.138 -1.256 3.695 1.00 . A A . 2 VAL HG12 1 1 6 2458 1 1 2 VAL HG13 H 4.808 0.262 4.294 1.00 . A A . 2 VAL HG13 1 1 6 2459 1 1 2 VAL HG21 H 2.265 -1.520 3.058 1.00 . A A . 2 VAL HG21 1 1 6 2460 1 1 2 VAL HG22 H 1.993 -0.588 1.585 1.00 . A A . 2 VAL HG22 1 1 6 2461 1 1 2 VAL HG23 H 1.018 -0.273 3.020 1.00 . A A . 2 VAL HG23 1 1 6 2462 1 1 2 VAL N N 3.513 2.244 4.682 1.00 . A A . 2 VAL N 1 1 6 2463 1 1 2 VAL O O 2.921 -0.890 5.499 1.00 . A A . 2 VAL O 1 1 6 2464 1 1 3 THR C C 0.606 -1.464 7.441 1.00 . A A . 3 THR C 1 1 6 2465 1 1 3 THR CA C 1.586 -0.334 7.772 1.00 . A A . 3 THR CA 1 1 6 2466 1 1 3 THR CB C 1.039 0.540 8.903 1.00 . A A . 3 THR CB 1 1 6 2467 1 1 3 THR CG2 C -0.428 0.875 8.630 1.00 . A A . 3 THR CG2 1 1 6 2468 1 1 3 THR H H 1.308 1.471 6.627 1.00 . A A . 3 THR H 1 1 6 2469 1 1 3 THR HA H 2.548 -0.738 8.050 1.00 . A A . 3 THR HA 1 1 6 2470 1 1 3 THR HB H 1.608 1.454 8.959 1.00 . A A . 3 THR HB 1 1 6 2471 1 1 3 THR HG1 H 1.102 -1.103 9.942 1.00 . A A . 3 THR HG1 1 1 6 2472 1 1 3 THR HG21 H -0.653 0.691 7.591 1.00 . A A . 3 THR HG21 1 1 6 2473 1 1 3 THR HG22 H -0.609 1.915 8.859 1.00 . A A . 3 THR HG22 1 1 6 2474 1 1 3 THR HG23 H -1.060 0.257 9.251 1.00 . A A . 3 THR HG23 1 1 6 2475 1 1 3 THR N N 1.724 0.584 6.605 1.00 . A A . 3 THR N 1 1 6 2476 1 1 3 THR O O 0.421 -2.386 8.211 1.00 . A A . 3 THR O 1 1 6 2477 1 1 3 THR OG1 O 1.145 -0.163 10.133 1.00 . A A . 3 THR OG1 1 1 6 2478 1 1 4 CYS C C -0.412 -3.849 6.230 1.00 . A A . 4 CYS C 1 1 6 2479 1 1 4 CYS CA C -0.989 -2.463 5.906 1.00 . A A . 4 CYS CA 1 1 6 2480 1 1 4 CYS CB C -1.185 -2.253 4.392 1.00 . A A . 4 CYS CB 1 1 6 2481 1 1 4 CYS H H 0.146 -0.645 5.694 1.00 . A A . 4 CYS H 1 1 6 2482 1 1 4 CYS HA H -1.928 -2.320 6.419 1.00 . A A . 4 CYS HA 1 1 6 2483 1 1 4 CYS HB2 H -2.035 -1.606 4.234 1.00 . A A . 4 CYS HB2 1 1 6 2484 1 1 4 CYS HB3 H -0.299 -1.784 3.983 1.00 . A A . 4 CYS HB3 1 1 6 2485 1 1 4 CYS N N -0.020 -1.398 6.298 1.00 . A A . 4 CYS N 1 1 6 2486 1 1 4 CYS O O 0.752 -3.991 6.548 1.00 . A A . 4 CYS O 1 1 6 2487 1 1 4 CYS SG S -1.479 -3.826 3.537 1.00 . A A . 4 CYS SG 1 1 6 2488 1 1 5 GLU C C -0.311 -6.945 5.152 1.00 . A A . 5 GLU C 1 1 6 2489 1 1 5 GLU CA C -0.737 -6.247 6.446 1.00 . A A . 5 GLU CA 1 1 6 2490 1 1 5 GLU CB C -1.935 -6.963 7.073 1.00 . A A . 5 GLU CB 1 1 6 2491 1 1 5 GLU CD C -2.174 -8.448 9.072 1.00 . A A . 5 GLU CD 1 1 6 2492 1 1 5 GLU CG C -1.736 -7.064 8.587 1.00 . A A . 5 GLU CG 1 1 6 2493 1 1 5 GLU H H -2.158 -4.727 5.886 1.00 . A A . 5 GLU H 1 1 6 2494 1 1 5 GLU HA H 0.082 -6.215 7.147 1.00 . A A . 5 GLU HA 1 1 6 2495 1 1 5 GLU HB2 H -2.836 -6.405 6.865 1.00 . A A . 5 GLU HB2 1 1 6 2496 1 1 5 GLU HB3 H -2.020 -7.956 6.658 1.00 . A A . 5 GLU HB3 1 1 6 2497 1 1 5 GLU HG2 H -0.692 -6.914 8.824 1.00 . A A . 5 GLU HG2 1 1 6 2498 1 1 5 GLU HG3 H -2.328 -6.309 9.080 1.00 . A A . 5 GLU HG3 1 1 6 2499 1 1 5 GLU N N -1.225 -4.869 6.148 1.00 . A A . 5 GLU N 1 1 6 2500 1 1 5 GLU O O -0.872 -6.706 4.103 1.00 . A A . 5 GLU O 1 1 6 2501 1 1 5 GLU OE1 O -1.955 -9.405 8.349 1.00 . A A . 5 GLU OE1 1 1 6 2502 1 1 5 GLU OE2 O -2.722 -8.526 10.159 1.00 . A A . 5 GLU OE2 1 1 6 2503 1 1 6 PRO C C 0.185 -9.559 3.600 1.00 . A A . 6 PRO C 1 1 6 2504 1 1 6 PRO CA C 1.204 -8.528 4.096 1.00 . A A . 6 PRO CA 1 1 6 2505 1 1 6 PRO CB C 2.456 -9.214 4.639 1.00 . A A . 6 PRO CB 1 1 6 2506 1 1 6 PRO CD C 1.391 -8.133 6.506 1.00 . A A . 6 PRO CD 1 1 6 2507 1 1 6 PRO CG C 2.221 -9.326 6.111 1.00 . A A . 6 PRO CG 1 1 6 2508 1 1 6 PRO HA H 1.471 -7.846 3.306 1.00 . A A . 6 PRO HA 1 1 6 2509 1 1 6 PRO HB2 H 2.570 -10.193 4.195 1.00 . A A . 6 PRO HB2 1 1 6 2510 1 1 6 PRO HB3 H 3.329 -8.608 4.451 1.00 . A A . 6 PRO HB3 1 1 6 2511 1 1 6 PRO HD2 H 0.695 -8.398 7.291 1.00 . A A . 6 PRO HD2 1 1 6 2512 1 1 6 PRO HD3 H 2.024 -7.314 6.814 1.00 . A A . 6 PRO HD3 1 1 6 2513 1 1 6 PRO HG2 H 1.687 -10.242 6.331 1.00 . A A . 6 PRO HG2 1 1 6 2514 1 1 6 PRO HG3 H 3.162 -9.307 6.641 1.00 . A A . 6 PRO HG3 1 1 6 2515 1 1 6 PRO N N 0.678 -7.787 5.273 1.00 . A A . 6 PRO N 1 1 6 2516 1 1 6 PRO O O -0.147 -10.501 4.292 1.00 . A A . 6 PRO O 1 1 6 2517 1 1 7 GLY C C -2.535 -9.619 1.348 1.00 . A A . 7 GLY C 1 1 6 2518 1 1 7 GLY CA C -1.298 -10.363 1.858 1.00 . A A . 7 GLY CA 1 1 6 2519 1 1 7 GLY H H -0.023 -8.626 1.858 1.00 . A A . 7 GLY H 1 1 6 2520 1 1 7 GLY HA2 H -0.848 -10.915 1.043 1.00 . A A . 7 GLY HA2 1 1 6 2521 1 1 7 GLY HA3 H -1.592 -11.049 2.640 1.00 . A A . 7 GLY HA3 1 1 6 2522 1 1 7 GLY N N -0.308 -9.390 2.402 1.00 . A A . 7 GLY N 1 1 6 2523 1 1 7 GLY O O -3.640 -10.119 1.417 1.00 . A A . 7 GLY O 1 1 6 2524 1 1 8 THR C C -3.075 -6.458 -0.507 1.00 . A A . 8 THR C 1 1 6 2525 1 1 8 THR CA C -3.534 -7.663 0.317 1.00 . A A . 8 THR CA 1 1 6 2526 1 1 8 THR CB C -4.288 -7.182 1.560 1.00 . A A . 8 THR CB 1 1 6 2527 1 1 8 THR CG2 C -5.787 -7.428 1.375 1.00 . A A . 8 THR CG2 1 1 6 2528 1 1 8 THR H H -1.462 -8.044 0.784 1.00 . A A . 8 THR H 1 1 6 2529 1 1 8 THR HA H -4.172 -8.302 -0.274 1.00 . A A . 8 THR HA 1 1 6 2530 1 1 8 THR HB H -4.119 -6.126 1.695 1.00 . A A . 8 THR HB 1 1 6 2531 1 1 8 THR HG1 H -3.330 -7.267 3.249 1.00 . A A . 8 THR HG1 1 1 6 2532 1 1 8 THR HG21 H -6.343 -6.701 1.948 1.00 . A A . 8 THR HG21 1 1 6 2533 1 1 8 THR HG22 H -6.033 -8.421 1.717 1.00 . A A . 8 THR HG22 1 1 6 2534 1 1 8 THR HG23 H -6.040 -7.331 0.329 1.00 . A A . 8 THR HG23 1 1 6 2535 1 1 8 THR N N -2.361 -8.430 0.833 1.00 . A A . 8 THR N 1 1 6 2536 1 1 8 THR O O -1.939 -6.034 -0.433 1.00 . A A . 8 THR O 1 1 6 2537 1 1 8 THR OG1 O -3.827 -7.884 2.704 1.00 . A A . 8 THR OG1 1 1 6 2538 1 1 9 THR C C -4.569 -3.560 -1.751 1.00 . A A . 9 THR C 1 1 6 2539 1 1 9 THR CA C -3.609 -4.701 -2.098 1.00 . A A . 9 THR CA 1 1 6 2540 1 1 9 THR CB C -3.796 -5.143 -3.552 1.00 . A A . 9 THR CB 1 1 6 2541 1 1 9 THR CG2 C -5.288 -5.271 -3.861 1.00 . A A . 9 THR CG2 1 1 6 2542 1 1 9 THR H H -4.877 -6.250 -1.308 1.00 . A A . 9 THR H 1 1 6 2543 1 1 9 THR HA H -2.583 -4.408 -1.925 1.00 . A A . 9 THR HA 1 1 6 2544 1 1 9 THR HB H -3.319 -6.099 -3.702 1.00 . A A . 9 THR HB 1 1 6 2545 1 1 9 THR HG1 H -2.565 -3.679 -3.917 1.00 . A A . 9 THR HG1 1 1 6 2546 1 1 9 THR HG21 H -5.480 -6.229 -4.323 1.00 . A A . 9 THR HG21 1 1 6 2547 1 1 9 THR HG22 H -5.586 -4.481 -4.533 1.00 . A A . 9 THR HG22 1 1 6 2548 1 1 9 THR HG23 H -5.853 -5.195 -2.943 1.00 . A A . 9 THR HG23 1 1 6 2549 1 1 9 THR N N -3.963 -5.895 -1.278 1.00 . A A . 9 THR N 1 1 6 2550 1 1 9 THR O O -5.646 -3.789 -1.237 1.00 . A A . 9 THR O 1 1 6 2551 1 1 9 THR OG1 O -3.213 -4.179 -4.419 1.00 . A A . 9 THR OG1 1 1 6 2552 1 1 10 PHE C C -4.657 0.090 -2.334 1.00 . A A . 10 PHE C 1 1 6 2553 1 1 10 PHE CA C -5.122 -1.212 -1.679 1.00 . A A . 10 PHE CA 1 1 6 2554 1 1 10 PHE CB C -5.059 -1.094 -0.158 1.00 . A A . 10 PHE CB 1 1 6 2555 1 1 10 PHE CD1 C -2.826 -2.034 0.548 1.00 . A A . 10 PHE CD1 1 1 6 2556 1 1 10 PHE CD2 C -3.088 0.370 0.395 1.00 . A A . 10 PHE CD2 1 1 6 2557 1 1 10 PHE CE1 C -1.493 -1.863 0.945 1.00 . A A . 10 PHE CE1 1 1 6 2558 1 1 10 PHE CE2 C -1.757 0.543 0.792 1.00 . A A . 10 PHE CE2 1 1 6 2559 1 1 10 PHE CG C -3.623 -0.915 0.273 1.00 . A A . 10 PHE CG 1 1 6 2560 1 1 10 PHE CZ C -0.959 -0.574 1.066 1.00 . A A . 10 PHE CZ 1 1 6 2561 1 1 10 PHE H H -3.330 -2.159 -2.429 1.00 . A A . 10 PHE H 1 1 6 2562 1 1 10 PHE HA H -6.128 -1.448 -1.986 1.00 . A A . 10 PHE HA 1 1 6 2563 1 1 10 PHE HB2 H -5.639 -0.238 0.158 1.00 . A A . 10 PHE HB2 1 1 6 2564 1 1 10 PHE HB3 H -5.462 -1.988 0.290 1.00 . A A . 10 PHE HB3 1 1 6 2565 1 1 10 PHE HD1 H -3.240 -3.029 0.454 1.00 . A A . 10 PHE HD1 1 1 6 2566 1 1 10 PHE HD2 H -3.705 1.231 0.183 1.00 . A A . 10 PHE HD2 1 1 6 2567 1 1 10 PHE HE1 H -0.879 -2.725 1.157 1.00 . A A . 10 PHE HE1 1 1 6 2568 1 1 10 PHE HE2 H -1.346 1.537 0.885 1.00 . A A . 10 PHE HE2 1 1 6 2569 1 1 10 PHE HZ H 0.069 -0.441 1.371 1.00 . A A . 10 PHE HZ 1 1 6 2570 1 1 10 PHE N N -4.202 -2.337 -2.017 1.00 . A A . 10 PHE N 1 1 6 2571 1 1 10 PHE O O -3.478 0.368 -2.426 1.00 . A A . 10 PHE O 1 1 6 2572 1 1 11 LYS C C -4.921 3.242 -2.357 1.00 . A A . 11 LYS C 1 1 6 2573 1 1 11 LYS CA C -5.219 2.187 -3.424 1.00 . A A . 11 LYS CA 1 1 6 2574 1 1 11 LYS CB C -6.451 2.584 -4.240 1.00 . A A . 11 LYS CB 1 1 6 2575 1 1 11 LYS CD C -7.303 4.928 -4.082 1.00 . A A . 11 LYS CD 1 1 6 2576 1 1 11 LYS CE C -8.695 4.657 -4.658 1.00 . A A . 11 LYS CE 1 1 6 2577 1 1 11 LYS CG C -6.281 4.013 -4.760 1.00 . A A . 11 LYS CG 1 1 6 2578 1 1 11 LYS H H -6.529 0.645 -2.682 1.00 . A A . 11 LYS H 1 1 6 2579 1 1 11 LYS HA H -4.371 2.059 -4.076 1.00 . A A . 11 LYS HA 1 1 6 2580 1 1 11 LYS HB2 H -6.562 1.906 -5.075 1.00 . A A . 11 LYS HB2 1 1 6 2581 1 1 11 LYS HB3 H -7.329 2.532 -3.614 1.00 . A A . 11 LYS HB3 1 1 6 2582 1 1 11 LYS HD2 H -7.309 4.734 -3.019 1.00 . A A . 11 LYS HD2 1 1 6 2583 1 1 11 LYS HD3 H -7.037 5.958 -4.259 1.00 . A A . 11 LYS HD3 1 1 6 2584 1 1 11 LYS HE2 H -8.731 4.942 -5.701 1.00 . A A . 11 LYS HE2 1 1 6 2585 1 1 11 LYS HE3 H -8.956 3.617 -4.541 1.00 . A A . 11 LYS HE3 1 1 6 2586 1 1 11 LYS HG2 H -5.282 4.360 -4.536 1.00 . A A . 11 LYS HG2 1 1 6 2587 1 1 11 LYS HG3 H -6.438 4.028 -5.828 1.00 . A A . 11 LYS HG3 1 1 6 2588 1 1 11 LYS HZ1 H -9.305 5.508 -2.859 1.00 . A A . 11 LYS HZ1 1 1 6 2589 1 1 11 LYS HZ2 H -10.581 5.130 -3.916 1.00 . A A . 11 LYS HZ2 1 1 6 2590 1 1 11 LYS HZ3 H -9.595 6.482 -4.217 1.00 . A A . 11 LYS HZ3 1 1 6 2591 1 1 11 LYS N N -5.585 0.892 -2.779 1.00 . A A . 11 LYS N 1 1 6 2592 1 1 11 LYS NZ N -9.613 5.508 -3.852 1.00 . A A . 11 LYS NZ 1 1 6 2593 1 1 11 LYS O O -5.811 3.732 -1.690 1.00 . A A . 11 LYS O 1 1 6 2594 1 1 12 ASP C C -2.364 5.651 -1.748 1.00 . A A . 12 ASP C 1 1 6 2595 1 1 12 ASP CA C -3.327 4.617 -1.161 1.00 . A A . 12 ASP CA 1 1 6 2596 1 1 12 ASP CB C -2.649 3.833 -0.037 1.00 . A A . 12 ASP CB 1 1 6 2597 1 1 12 ASP CG C -3.298 4.194 1.300 1.00 . A A . 12 ASP CG 1 1 6 2598 1 1 12 ASP H H -2.971 3.190 -2.734 1.00 . A A . 12 ASP H 1 1 6 2599 1 1 12 ASP HA H -4.218 5.098 -0.789 1.00 . A A . 12 ASP HA 1 1 6 2600 1 1 12 ASP HB2 H -2.762 2.774 -0.219 1.00 . A A . 12 ASP HB2 1 1 6 2601 1 1 12 ASP HB3 H -1.599 4.085 -0.005 1.00 . A A . 12 ASP HB3 1 1 6 2602 1 1 12 ASP N N -3.677 3.596 -2.188 1.00 . A A . 12 ASP N 1 1 6 2603 1 1 12 ASP O O -1.615 5.369 -2.661 1.00 . A A . 12 ASP O 1 1 6 2604 1 1 12 ASP OD1 O -3.459 5.375 1.557 1.00 . A A . 12 ASP OD1 1 1 6 2605 1 1 12 ASP OD2 O -3.621 3.283 2.045 1.00 . A A . 12 ASP OD2 1 1 6 2606 1 1 13 LYS C C -1.803 8.261 -3.188 1.00 . A A . 13 LYS C 1 1 6 2607 1 1 13 LYS CA C -1.466 7.906 -1.735 1.00 . A A . 13 LYS CA 1 1 6 2608 1 1 13 LYS CB C -0.056 7.313 -1.627 1.00 . A A . 13 LYS CB 1 1 6 2609 1 1 13 LYS CD C 1.035 7.623 0.598 1.00 . A A . 13 LYS CD 1 1 6 2610 1 1 13 LYS CE C 0.325 8.962 0.806 1.00 . A A . 13 LYS CE 1 1 6 2611 1 1 13 LYS CG C 0.145 6.702 -0.237 1.00 . A A . 13 LYS CG 1 1 6 2612 1 1 13 LYS H H -2.993 7.044 -0.485 1.00 . A A . 13 LYS H 1 1 6 2613 1 1 13 LYS HA H -1.538 8.784 -1.113 1.00 . A A . 13 LYS HA 1 1 6 2614 1 1 13 LYS HB2 H 0.076 6.549 -2.377 1.00 . A A . 13 LYS HB2 1 1 6 2615 1 1 13 LYS HB3 H 0.673 8.097 -1.779 1.00 . A A . 13 LYS HB3 1 1 6 2616 1 1 13 LYS HD2 H 1.230 7.164 1.556 1.00 . A A . 13 LYS HD2 1 1 6 2617 1 1 13 LYS HD3 H 1.968 7.790 0.081 1.00 . A A . 13 LYS HD3 1 1 6 2618 1 1 13 LYS HE2 H 0.126 9.432 -0.147 1.00 . A A . 13 LYS HE2 1 1 6 2619 1 1 13 LYS HE3 H -0.592 8.820 1.356 1.00 . A A . 13 LYS HE3 1 1 6 2620 1 1 13 LYS HG2 H -0.811 6.587 0.251 1.00 . A A . 13 LYS HG2 1 1 6 2621 1 1 13 LYS HG3 H 0.620 5.738 -0.334 1.00 . A A . 13 LYS HG3 1 1 6 2622 1 1 13 LYS HZ1 H 2.113 10.003 1.027 1.00 . A A . 13 LYS HZ1 1 1 6 2623 1 1 13 LYS HZ2 H 1.570 9.249 2.450 1.00 . A A . 13 LYS HZ2 1 1 6 2624 1 1 13 LYS HZ3 H 0.814 10.667 1.895 1.00 . A A . 13 LYS HZ3 1 1 6 2625 1 1 13 LYS N N -2.380 6.843 -1.223 1.00 . A A . 13 LYS N 1 1 6 2626 1 1 13 LYS NZ N 1.277 9.782 1.604 1.00 . A A . 13 LYS NZ 1 1 6 2627 1 1 13 LYS O O -2.423 9.272 -3.455 1.00 . A A . 13 LYS O 1 1 6 2628 1 1 14 CYS C C -1.986 6.523 -6.373 1.00 . A A . 14 CYS C 1 1 6 2629 1 1 14 CYS CA C -1.690 7.784 -5.559 1.00 . A A . 14 CYS CA 1 1 6 2630 1 1 14 CYS CB C -0.411 8.428 -6.075 1.00 . A A . 14 CYS CB 1 1 6 2631 1 1 14 CYS H H -0.883 6.654 -3.914 1.00 . A A . 14 CYS H 1 1 6 2632 1 1 14 CYS HA H -2.506 8.483 -5.627 1.00 . A A . 14 CYS HA 1 1 6 2633 1 1 14 CYS HB2 H -0.488 8.560 -7.145 1.00 . A A . 14 CYS HB2 1 1 6 2634 1 1 14 CYS HB3 H -0.271 9.385 -5.598 1.00 . A A . 14 CYS HB3 1 1 6 2635 1 1 14 CYS N N -1.394 7.457 -4.135 1.00 . A A . 14 CYS N 1 1 6 2636 1 1 14 CYS O O -2.200 6.591 -7.567 1.00 . A A . 14 CYS O 1 1 6 2637 1 1 14 CYS SG S 0.993 7.344 -5.699 1.00 . A A . 14 CYS SG 1 1 6 2638 1 1 15 ASN C C -2.291 2.905 -5.634 1.00 . A A . 15 ASN C 1 1 6 2639 1 1 15 ASN CA C -2.246 4.135 -6.549 1.00 . A A . 15 ASN CA 1 1 6 2640 1 1 15 ASN CB C -1.065 4.054 -7.517 1.00 . A A . 15 ASN CB 1 1 6 2641 1 1 15 ASN CG C 0.238 4.262 -6.745 1.00 . A A . 15 ASN CG 1 1 6 2642 1 1 15 ASN H H -1.796 5.319 -4.802 1.00 . A A . 15 ASN H 1 1 6 2643 1 1 15 ASN HA H -3.167 4.229 -7.102 1.00 . A A . 15 ASN HA 1 1 6 2644 1 1 15 ASN HB2 H -1.050 3.088 -7.994 1.00 . A A . 15 ASN HB2 1 1 6 2645 1 1 15 ASN HB3 H -1.160 4.826 -8.267 1.00 . A A . 15 ASN HB3 1 1 6 2646 1 1 15 ASN HD21 H 1.100 5.302 -8.204 1.00 . A A . 15 ASN HD21 1 1 6 2647 1 1 15 ASN HD22 H 2.052 5.073 -6.808 1.00 . A A . 15 ASN HD22 1 1 6 2648 1 1 15 ASN N N -1.982 5.372 -5.761 1.00 . A A . 15 ASN N 1 1 6 2649 1 1 15 ASN ND2 N 1.211 4.934 -7.298 1.00 . A A . 15 ASN ND2 1 1 6 2650 1 1 15 ASN O O -2.076 2.996 -4.442 1.00 . A A . 15 ASN O 1 1 6 2651 1 1 15 ASN OD1 O 0.373 3.809 -5.627 1.00 . A A . 15 ASN OD1 1 1 6 2652 1 1 16 THR C C -1.237 0.008 -5.038 1.00 . A A . 16 THR C 1 1 6 2653 1 1 16 THR CA C -2.644 0.517 -5.359 1.00 . A A . 16 THR CA 1 1 6 2654 1 1 16 THR CB C -3.396 -0.496 -6.222 1.00 . A A . 16 THR CB 1 1 6 2655 1 1 16 THR CG2 C -3.406 -1.858 -5.521 1.00 . A A . 16 THR CG2 1 1 6 2656 1 1 16 THR H H -2.750 1.709 -7.152 1.00 . A A . 16 THR H 1 1 6 2657 1 1 16 THR HA H -3.192 0.701 -4.452 1.00 . A A . 16 THR HA 1 1 6 2658 1 1 16 THR HB H -2.901 -0.593 -7.176 1.00 . A A . 16 THR HB 1 1 6 2659 1 1 16 THR HG1 H -5.327 -0.669 -6.002 1.00 . A A . 16 THR HG1 1 1 6 2660 1 1 16 THR HG21 H -3.305 -1.714 -4.455 1.00 . A A . 16 THR HG21 1 1 6 2661 1 1 16 THR HG22 H -2.583 -2.456 -5.884 1.00 . A A . 16 THR HG22 1 1 6 2662 1 1 16 THR HG23 H -4.337 -2.363 -5.730 1.00 . A A . 16 THR HG23 1 1 6 2663 1 1 16 THR N N -2.576 1.756 -6.189 1.00 . A A . 16 THR N 1 1 6 2664 1 1 16 THR O O -0.361 0.004 -5.879 1.00 . A A . 16 THR O 1 1 6 2665 1 1 16 THR OG1 O -4.731 -0.046 -6.425 1.00 . A A . 16 THR OG1 1 1 6 2666 1 1 17 CYS C C 0.216 -2.323 -2.816 1.00 . A A . 17 CYS C 1 1 6 2667 1 1 17 CYS CA C 0.334 -0.936 -3.453 1.00 . A A . 17 CYS CA 1 1 6 2668 1 1 17 CYS CB C 0.881 0.076 -2.447 1.00 . A A . 17 CYS CB 1 1 6 2669 1 1 17 CYS H H -1.737 -0.416 -3.162 1.00 . A A . 17 CYS H 1 1 6 2670 1 1 17 CYS HA H 0.972 -0.974 -4.320 1.00 . A A . 17 CYS HA 1 1 6 2671 1 1 17 CYS HB2 H 0.192 0.904 -2.358 1.00 . A A . 17 CYS HB2 1 1 6 2672 1 1 17 CYS HB3 H 1.001 -0.401 -1.483 1.00 . A A . 17 CYS HB3 1 1 6 2673 1 1 17 CYS N N -1.016 -0.425 -3.825 1.00 . A A . 17 CYS N 1 1 6 2674 1 1 17 CYS O O 0.084 -2.459 -1.616 1.00 . A A . 17 CYS O 1 1 6 2675 1 1 17 CYS SG S 2.486 0.683 -3.024 1.00 . A A . 17 CYS SG 1 1 6 2676 1 1 18 ARG C C 1.026 -4.879 -1.817 1.00 . A A . 18 ARG C 1 1 6 2677 1 1 18 ARG CA C 0.164 -4.733 -3.067 1.00 . A A . 18 ARG CA 1 1 6 2678 1 1 18 ARG CB C 0.689 -5.633 -4.182 1.00 . A A . 18 ARG CB 1 1 6 2679 1 1 18 ARG CD C -0.661 -7.685 -3.710 1.00 . A A . 18 ARG CD 1 1 6 2680 1 1 18 ARG CG C 0.745 -7.080 -3.691 1.00 . A A . 18 ARG CG 1 1 6 2681 1 1 18 ARG CZ C -1.093 -10.017 -4.204 1.00 . A A . 18 ARG CZ 1 1 6 2682 1 1 18 ARG H H 0.378 -3.215 -4.579 1.00 . A A . 18 ARG H 1 1 6 2683 1 1 18 ARG HA H -0.862 -4.980 -2.843 1.00 . A A . 18 ARG HA 1 1 6 2684 1 1 18 ARG HB2 H 0.035 -5.564 -5.037 1.00 . A A . 18 ARG HB2 1 1 6 2685 1 1 18 ARG HB3 H 1.679 -5.312 -4.461 1.00 . A A . 18 ARG HB3 1 1 6 2686 1 1 18 ARG HD2 H -1.263 -7.256 -2.921 1.00 . A A . 18 ARG HD2 1 1 6 2687 1 1 18 ARG HD3 H -1.125 -7.526 -4.671 1.00 . A A . 18 ARG HD3 1 1 6 2688 1 1 18 ARG HE H 0.165 -9.442 -2.780 1.00 . A A . 18 ARG HE 1 1 6 2689 1 1 18 ARG HG2 H 1.393 -7.654 -4.337 1.00 . A A . 18 ARG HG2 1 1 6 2690 1 1 18 ARG HG3 H 1.130 -7.103 -2.682 1.00 . A A . 18 ARG HG3 1 1 6 2691 1 1 18 ARG HH11 H -2.765 -9.933 -3.107 1.00 . A A . 18 ARG HH11 1 1 6 2692 1 1 18 ARG HH12 H -2.808 -11.020 -4.455 1.00 . A A . 18 ARG HH12 1 1 6 2693 1 1 18 ARG HH21 H 0.431 -10.306 -5.470 1.00 . A A . 18 ARG HH21 1 1 6 2694 1 1 18 ARG HH22 H -0.996 -11.236 -5.788 1.00 . A A . 18 ARG HH22 1 1 6 2695 1 1 18 ARG N N 0.269 -3.351 -3.614 1.00 . A A . 18 ARG N 1 1 6 2696 1 1 18 ARG NE N -0.453 -9.141 -3.478 1.00 . A A . 18 ARG NE 1 1 6 2697 1 1 18 ARG NH1 N -2.317 -10.349 -3.898 1.00 . A A . 18 ARG NH1 1 1 6 2698 1 1 18 ARG NH2 N -0.507 -10.562 -5.235 1.00 . A A . 18 ARG NH2 1 1 6 2699 1 1 18 ARG O O 2.239 -4.909 -1.885 1.00 . A A . 18 ARG O 1 1 6 2700 1 1 19 CYS C C 2.220 -6.254 0.414 1.00 . A A . 19 CYS C 1 1 6 2701 1 1 19 CYS CA C 1.183 -5.139 0.579 1.00 . A A . 19 CYS CA 1 1 6 2702 1 1 19 CYS CB C 0.139 -5.516 1.625 1.00 . A A . 19 CYS CB 1 1 6 2703 1 1 19 CYS H H -0.573 -4.963 -0.649 1.00 . A A . 19 CYS H 1 1 6 2704 1 1 19 CYS HA H 1.661 -4.211 0.851 1.00 . A A . 19 CYS HA 1 1 6 2705 1 1 19 CYS HB2 H -0.850 -5.344 1.224 1.00 . A A . 19 CYS HB2 1 1 6 2706 1 1 19 CYS HB3 H 0.248 -6.560 1.879 1.00 . A A . 19 CYS HB3 1 1 6 2707 1 1 19 CYS N N 0.407 -4.982 -0.678 1.00 . A A . 19 CYS N 1 1 6 2708 1 1 19 CYS O O 1.906 -7.347 -0.015 1.00 . A A . 19 CYS O 1 1 6 2709 1 1 19 CYS SG S 0.376 -4.500 3.103 1.00 . A A . 19 CYS SG 1 1 6 2710 1 1 20 GLY C C 4.316 -8.116 1.648 1.00 . A A . 20 GLY C 1 1 6 2711 1 1 20 GLY CA C 4.509 -7.029 0.591 1.00 . A A . 20 GLY CA 1 1 6 2712 1 1 20 GLY H H 3.690 -5.099 1.080 1.00 . A A . 20 GLY H 1 1 6 2713 1 1 20 GLY HA2 H 4.440 -7.469 -0.395 1.00 . A A . 20 GLY HA2 1 1 6 2714 1 1 20 GLY HA3 H 5.483 -6.577 0.719 1.00 . A A . 20 GLY HA3 1 1 6 2715 1 1 20 GLY N N 3.454 -5.987 0.741 1.00 . A A . 20 GLY N 1 1 6 2716 1 1 20 GLY O O 3.382 -8.083 2.424 1.00 . A A . 20 GLY O 1 1 6 2717 1 1 21 SER C C 6.007 -9.923 3.866 1.00 . A A . 21 SER C 1 1 6 2718 1 1 21 SER CA C 5.065 -10.175 2.686 1.00 . A A . 21 SER CA 1 1 6 2719 1 1 21 SER CB C 5.473 -11.445 1.941 1.00 . A A . 21 SER CB 1 1 6 2720 1 1 21 SER H H 5.938 -9.088 1.045 1.00 . A A . 21 SER H 1 1 6 2721 1 1 21 SER HA H 4.046 -10.258 3.027 1.00 . A A . 21 SER HA 1 1 6 2722 1 1 21 SER HB2 H 6.516 -11.391 1.679 1.00 . A A . 21 SER HB2 1 1 6 2723 1 1 21 SER HB3 H 5.309 -12.303 2.578 1.00 . A A . 21 SER HB3 1 1 6 2724 1 1 21 SER HG H 5.304 -11.635 0.011 1.00 . A A . 21 SER HG 1 1 6 2725 1 1 21 SER N N 5.194 -9.082 1.682 1.00 . A A . 21 SER N 1 1 6 2726 1 1 21 SER O O 6.142 -10.742 4.753 1.00 . A A . 21 SER O 1 1 6 2727 1 1 21 SER OG O 4.699 -11.563 0.754 1.00 . A A . 21 SER OG 1 1 6 2728 1 1 22 ASP C C 6.823 -7.919 6.196 1.00 . A A . 22 ASP C 1 1 6 2729 1 1 22 ASP CA C 7.596 -8.490 5.004 1.00 . A A . 22 ASP CA 1 1 6 2730 1 1 22 ASP CB C 8.563 -7.447 4.443 1.00 . A A . 22 ASP CB 1 1 6 2731 1 1 22 ASP CG C 9.810 -8.146 3.897 1.00 . A A . 22 ASP CG 1 1 6 2732 1 1 22 ASP H H 6.540 -8.146 3.156 1.00 . A A . 22 ASP H 1 1 6 2733 1 1 22 ASP HA H 8.138 -9.376 5.293 1.00 . A A . 22 ASP HA 1 1 6 2734 1 1 22 ASP HB2 H 8.079 -6.898 3.646 1.00 . A A . 22 ASP HB2 1 1 6 2735 1 1 22 ASP HB3 H 8.852 -6.763 5.229 1.00 . A A . 22 ASP HB3 1 1 6 2736 1 1 22 ASP N N 6.662 -8.794 3.882 1.00 . A A . 22 ASP N 1 1 6 2737 1 1 22 ASP O O 7.225 -8.061 7.334 1.00 . A A . 22 ASP O 1 1 6 2738 1 1 22 ASP OD1 O 10.590 -8.634 4.698 1.00 . A A . 22 ASP OD1 1 1 6 2739 1 1 22 ASP OD2 O 9.964 -8.180 2.687 1.00 . A A . 22 ASP OD2 1 1 6 2740 1 1 23 GLY C C 4.640 -5.223 6.794 1.00 . A A . 23 GLY C 1 1 6 2741 1 1 23 GLY CA C 4.916 -6.704 7.063 1.00 . A A . 23 GLY CA 1 1 6 2742 1 1 23 GLY H H 5.406 -7.177 5.019 1.00 . A A . 23 GLY H 1 1 6 2743 1 1 23 GLY HA2 H 3.977 -7.237 7.145 1.00 . A A . 23 GLY HA2 1 1 6 2744 1 1 23 GLY HA3 H 5.469 -6.802 7.985 1.00 . A A . 23 GLY HA3 1 1 6 2745 1 1 23 GLY N N 5.715 -7.279 5.943 1.00 . A A . 23 GLY N 1 1 6 2746 1 1 23 GLY O O 3.535 -4.749 6.966 1.00 . A A . 23 GLY O 1 1 6 2747 1 1 24 LYS C C 6.164 -2.615 4.838 1.00 . A A . 24 LYS C 1 1 6 2748 1 1 24 LYS CA C 5.423 -3.036 6.110 1.00 . A A . 24 LYS CA 1 1 6 2749 1 1 24 LYS CB C 6.008 -2.322 7.329 1.00 . A A . 24 LYS CB 1 1 6 2750 1 1 24 LYS CD C 7.408 -3.880 8.689 1.00 . A A . 24 LYS CD 1 1 6 2751 1 1 24 LYS CE C 8.216 -5.103 8.249 1.00 . A A . 24 LYS CE 1 1 6 2752 1 1 24 LYS CG C 7.430 -2.826 7.581 1.00 . A A . 24 LYS CG 1 1 6 2753 1 1 24 LYS H H 6.521 -4.886 6.252 1.00 . A A . 24 LYS H 1 1 6 2754 1 1 24 LYS HA H 4.372 -2.818 6.026 1.00 . A A . 24 LYS HA 1 1 6 2755 1 1 24 LYS HB2 H 6.029 -1.257 7.147 1.00 . A A . 24 LYS HB2 1 1 6 2756 1 1 24 LYS HB3 H 5.396 -2.528 8.195 1.00 . A A . 24 LYS HB3 1 1 6 2757 1 1 24 LYS HD2 H 7.841 -3.465 9.587 1.00 . A A . 24 LYS HD2 1 1 6 2758 1 1 24 LYS HD3 H 6.388 -4.176 8.884 1.00 . A A . 24 LYS HD3 1 1 6 2759 1 1 24 LYS HE2 H 7.896 -5.979 8.794 1.00 . A A . 24 LYS HE2 1 1 6 2760 1 1 24 LYS HE3 H 8.113 -5.260 7.187 1.00 . A A . 24 LYS HE3 1 1 6 2761 1 1 24 LYS HG2 H 7.823 -3.263 6.674 1.00 . A A . 24 LYS HG2 1 1 6 2762 1 1 24 LYS HG3 H 8.058 -2.001 7.885 1.00 . A A . 24 LYS HG3 1 1 6 2763 1 1 24 LYS HZ1 H 10.173 -5.645 8.706 1.00 . A A . 24 LYS HZ1 1 1 6 2764 1 1 24 LYS HZ2 H 9.656 -4.214 9.460 1.00 . A A . 24 LYS HZ2 1 1 6 2765 1 1 24 LYS HZ3 H 10.045 -4.214 7.807 1.00 . A A . 24 LYS HZ3 1 1 6 2766 1 1 24 LYS N N 5.635 -4.487 6.380 1.00 . A A . 24 LYS N 1 1 6 2767 1 1 24 LYS NZ N 9.629 -4.768 8.580 1.00 . A A . 24 LYS NZ 1 1 6 2768 1 1 24 LYS O O 6.988 -1.723 4.857 1.00 . A A . 24 LYS O 1 1 6 2769 1 1 25 SER C C 5.800 -3.406 1.255 1.00 . A A . 25 SER C 1 1 6 2770 1 1 25 SER CA C 6.573 -2.872 2.464 1.00 . A A . 25 SER CA 1 1 6 2771 1 1 25 SER CB C 7.947 -3.536 2.554 1.00 . A A . 25 SER CB 1 1 6 2772 1 1 25 SER H H 5.211 -3.963 3.733 1.00 . A A . 25 SER H 1 1 6 2773 1 1 25 SER HA H 6.683 -1.802 2.398 1.00 . A A . 25 SER HA 1 1 6 2774 1 1 25 SER HB2 H 7.890 -4.541 2.168 1.00 . A A . 25 SER HB2 1 1 6 2775 1 1 25 SER HB3 H 8.660 -2.966 1.969 1.00 . A A . 25 SER HB3 1 1 6 2776 1 1 25 SER HG H 9.134 -4.143 3.970 1.00 . A A . 25 SER HG 1 1 6 2777 1 1 25 SER N N 5.879 -3.246 3.731 1.00 . A A . 25 SER N 1 1 6 2778 1 1 25 SER O O 5.307 -4.516 1.265 1.00 . A A . 25 SER O 1 1 6 2779 1 1 25 SER OG O 8.360 -3.579 3.913 1.00 . A A . 25 SER OG 1 1 6 2780 1 1 26 ALA C C 5.256 -2.194 -2.191 1.00 . A A . 26 ALA C 1 1 6 2781 1 1 26 ALA CA C 4.947 -3.093 -0.992 1.00 . A A . 26 ALA CA 1 1 6 2782 1 1 26 ALA CB C 3.473 -2.982 -0.610 1.00 . A A . 26 ALA CB 1 1 6 2783 1 1 26 ALA H H 6.096 -1.732 0.226 1.00 . A A . 26 ALA H 1 1 6 2784 1 1 26 ALA HA H 5.195 -4.118 -1.214 1.00 . A A . 26 ALA HA 1 1 6 2785 1 1 26 ALA HB1 H 2.898 -2.692 -1.476 1.00 . A A . 26 ALA HB1 1 1 6 2786 1 1 26 ALA HB2 H 3.357 -2.240 0.165 1.00 . A A . 26 ALA HB2 1 1 6 2787 1 1 26 ALA HB3 H 3.125 -3.936 -0.249 1.00 . A A . 26 ALA HB3 1 1 6 2788 1 1 26 ALA N N 5.691 -2.625 0.214 1.00 . A A . 26 ALA N 1 1 6 2789 1 1 26 ALA O O 5.873 -1.155 -2.060 1.00 . A A . 26 ALA O 1 1 6 2790 1 1 27 ALA C C 3.772 -1.150 -5.072 1.00 . A A . 27 ALA C 1 1 6 2791 1 1 27 ALA CA C 5.080 -1.742 -4.563 1.00 . A A . 27 ALA CA 1 1 6 2792 1 1 27 ALA CB C 5.652 -2.693 -5.605 1.00 . A A . 27 ALA CB 1 1 6 2793 1 1 27 ALA H H 4.316 -3.418 -3.445 1.00 . A A . 27 ALA H 1 1 6 2794 1 1 27 ALA HA H 5.790 -0.963 -4.340 1.00 . A A . 27 ALA HA 1 1 6 2795 1 1 27 ALA HB1 H 5.520 -2.264 -6.589 1.00 . A A . 27 ALA HB1 1 1 6 2796 1 1 27 ALA HB2 H 5.131 -3.637 -5.553 1.00 . A A . 27 ALA HB2 1 1 6 2797 1 1 27 ALA HB3 H 6.702 -2.845 -5.416 1.00 . A A . 27 ALA HB3 1 1 6 2798 1 1 27 ALA N N 4.820 -2.581 -3.360 1.00 . A A . 27 ALA N 1 1 6 2799 1 1 27 ALA O O 2.744 -1.795 -5.055 1.00 . A A . 27 ALA O 1 1 6 2800 1 1 28 CYS C C 2.451 0.498 -7.556 1.00 . A A . 28 CYS C 1 1 6 2801 1 1 28 CYS CA C 2.545 0.673 -6.039 1.00 . A A . 28 CYS CA 1 1 6 2802 1 1 28 CYS CB C 2.637 2.155 -5.671 1.00 . A A . 28 CYS CB 1 1 6 2803 1 1 28 CYS H H 4.636 0.573 -5.543 1.00 . A A . 28 CYS H 1 1 6 2804 1 1 28 CYS HA H 1.699 0.222 -5.556 1.00 . A A . 28 CYS HA 1 1 6 2805 1 1 28 CYS HB2 H 3.666 2.480 -5.743 1.00 . A A . 28 CYS HB2 1 1 6 2806 1 1 28 CYS HB3 H 2.029 2.732 -6.355 1.00 . A A . 28 CYS HB3 1 1 6 2807 1 1 28 CYS N N 3.798 0.065 -5.531 1.00 . A A . 28 CYS N 1 1 6 2808 1 1 28 CYS O O 3.432 0.602 -8.264 1.00 . A A . 28 CYS O 1 1 6 2809 1 1 28 CYS SG S 2.044 2.406 -3.979 1.00 . A A . 28 CYS SG 1 1 6 2810 1 1 29 THR C C 1.662 1.283 -10.264 1.00 . A A . 29 THR C 1 1 6 2811 1 1 29 THR CA C 1.122 0.054 -9.532 1.00 . A A . 29 THR CA 1 1 6 2812 1 1 29 THR CB C -0.384 -0.089 -9.757 1.00 . A A . 29 THR CB 1 1 6 2813 1 1 29 THR CG2 C -0.889 -1.350 -9.053 1.00 . A A . 29 THR CG2 1 1 6 2814 1 1 29 THR H H 0.495 0.155 -7.472 1.00 . A A . 29 THR H 1 1 6 2815 1 1 29 THR HA H 1.632 -0.836 -9.860 1.00 . A A . 29 THR HA 1 1 6 2816 1 1 29 THR HB H -0.584 -0.167 -10.814 1.00 . A A . 29 THR HB 1 1 6 2817 1 1 29 THR HG1 H -1.867 1.168 -9.718 1.00 . A A . 29 THR HG1 1 1 6 2818 1 1 29 THR HG21 H -0.561 -2.222 -9.599 1.00 . A A . 29 THR HG21 1 1 6 2819 1 1 29 THR HG22 H -1.968 -1.333 -9.016 1.00 . A A . 29 THR HG22 1 1 6 2820 1 1 29 THR HG23 H -0.494 -1.383 -8.049 1.00 . A A . 29 THR HG23 1 1 6 2821 1 1 29 THR N N 1.277 0.233 -8.060 1.00 . A A . 29 THR N 1 1 6 2822 1 1 29 THR O O 2.778 1.293 -10.744 1.00 . A A . 29 THR O 1 1 6 2823 1 1 29 THR OG1 O -1.049 1.050 -9.230 1.00 . A A . 29 THR OG1 1 1 6 2824 1 1 30 ARG C C 2.306 4.329 -10.128 1.00 . A A . 30 ARG C 1 1 6 2825 1 1 30 ARG CA C 1.345 3.556 -11.037 1.00 . A A . 30 ARG CA 1 1 6 2826 1 1 30 ARG CB C 0.073 4.366 -11.297 1.00 . A A . 30 ARG CB 1 1 6 2827 1 1 30 ARG CD C -1.069 5.144 -13.381 1.00 . A A . 30 ARG CD 1 1 6 2828 1 1 30 ARG CG C 0.237 5.179 -12.583 1.00 . A A . 30 ARG CG 1 1 6 2829 1 1 30 ARG CZ C -1.327 5.166 -15.789 1.00 . A A . 30 ARG CZ 1 1 6 2830 1 1 30 ARG H H -0.014 2.290 -9.946 1.00 . A A . 30 ARG H 1 1 6 2831 1 1 30 ARG HA H 1.824 3.308 -11.971 1.00 . A A . 30 ARG HA 1 1 6 2832 1 1 30 ARG HB2 H -0.767 3.693 -11.400 1.00 . A A . 30 ARG HB2 1 1 6 2833 1 1 30 ARG HB3 H -0.101 5.038 -10.468 1.00 . A A . 30 ARG HB3 1 1 6 2834 1 1 30 ARG HD2 H -1.755 4.429 -12.947 1.00 . A A . 30 ARG HD2 1 1 6 2835 1 1 30 ARG HD3 H -1.517 6.126 -13.413 1.00 . A A . 30 ARG HD3 1 1 6 2836 1 1 30 ARG HE H 0.083 4.107 -14.875 1.00 . A A . 30 ARG HE 1 1 6 2837 1 1 30 ARG HG2 H 0.480 6.202 -12.333 1.00 . A A . 30 ARG HG2 1 1 6 2838 1 1 30 ARG HG3 H 1.031 4.755 -13.178 1.00 . A A . 30 ARG HG3 1 1 6 2839 1 1 30 ARG HH11 H -3.129 4.848 -14.978 1.00 . A A . 30 ARG HH11 1 1 6 2840 1 1 30 ARG HH12 H -3.135 5.520 -16.574 1.00 . A A . 30 ARG HH12 1 1 6 2841 1 1 30 ARG HH21 H 0.321 5.590 -16.844 1.00 . A A . 30 ARG HH21 1 1 6 2842 1 1 30 ARG HH22 H -1.182 5.944 -17.628 1.00 . A A . 30 ARG HH22 1 1 6 2843 1 1 30 ARG N N 0.879 2.321 -10.346 1.00 . A A . 30 ARG N 1 1 6 2844 1 1 30 ARG NE N -0.671 4.720 -14.751 1.00 . A A . 30 ARG NE 1 1 6 2845 1 1 30 ARG NH1 N -2.632 5.180 -15.779 1.00 . A A . 30 ARG NH1 1 1 6 2846 1 1 30 ARG NH2 N -0.679 5.600 -16.836 1.00 . A A . 30 ARG NH2 1 1 6 2847 1 1 30 ARG O O 3.145 3.751 -9.465 1.00 . A A . 30 ARG O 1 1 6 2848 1 1 31 MET C C 2.789 7.920 -9.362 1.00 . A A . 31 MET C 1 1 6 2849 1 1 31 MET CA C 3.098 6.428 -9.214 1.00 . A A . 31 MET CA 1 1 6 2850 1 1 31 MET CB C 4.507 6.121 -9.721 1.00 . A A . 31 MET CB 1 1 6 2851 1 1 31 MET CE C 7.544 6.985 -9.765 1.00 . A A . 31 MET CE 1 1 6 2852 1 1 31 MET CG C 5.424 5.811 -8.535 1.00 . A A . 31 MET CG 1 1 6 2853 1 1 31 MET H H 1.507 6.077 -10.625 1.00 . A A . 31 MET H 1 1 6 2854 1 1 31 MET HA H 3.000 6.122 -8.186 1.00 . A A . 31 MET HA 1 1 6 2855 1 1 31 MET HB2 H 4.474 5.267 -10.383 1.00 . A A . 31 MET HB2 1 1 6 2856 1 1 31 MET HB3 H 4.892 6.975 -10.257 1.00 . A A . 31 MET HB3 1 1 6 2857 1 1 31 MET HE1 H 8.481 7.280 -9.313 1.00 . A A . 31 MET HE1 1 1 6 2858 1 1 31 MET HE2 H 6.783 7.705 -9.513 1.00 . A A . 31 MET HE2 1 1 6 2859 1 1 31 MET HE3 H 7.654 6.942 -10.840 1.00 . A A . 31 MET HE3 1 1 6 2860 1 1 31 MET HG2 H 5.505 6.685 -7.906 1.00 . A A . 31 MET HG2 1 1 6 2861 1 1 31 MET HG3 H 5.010 4.993 -7.965 1.00 . A A . 31 MET HG3 1 1 6 2862 1 1 31 MET N N 2.190 5.628 -10.086 1.00 . A A . 31 MET N 1 1 6 2863 1 1 31 MET O O 3.571 8.671 -9.908 1.00 . A A . 31 MET O 1 1 6 2864 1 1 31 MET SD S 7.066 5.353 -9.145 1.00 . A A . 31 MET SD 1 1 6 2865 1 1 32 ALA C C 0.837 10.367 -7.667 1.00 . A A . 32 ALA C 1 1 6 2866 1 1 32 ALA CA C 1.311 9.806 -9.009 1.00 . A A . 32 ALA CA 1 1 6 2867 1 1 32 ALA CB C 0.174 9.855 -10.026 1.00 . A A . 32 ALA CB 1 1 6 2868 1 1 32 ALA H H 1.030 7.732 -8.446 1.00 . A A . 32 ALA H 1 1 6 2869 1 1 32 ALA HA H 2.157 10.365 -9.375 1.00 . A A . 32 ALA HA 1 1 6 2870 1 1 32 ALA HB1 H 0.584 9.873 -11.024 1.00 . A A . 32 ALA HB1 1 1 6 2871 1 1 32 ALA HB2 H -0.416 10.745 -9.861 1.00 . A A . 32 ALA HB2 1 1 6 2872 1 1 32 ALA HB3 H -0.452 8.983 -9.907 1.00 . A A . 32 ALA HB3 1 1 6 2873 1 1 32 ALA N N 1.654 8.357 -8.883 1.00 . A A . 32 ALA N 1 1 6 2874 1 1 32 ALA O O -0.334 10.628 -7.477 1.00 . A A . 32 ALA O 1 1 6 2875 1 1 33 CYS C C 2.091 12.362 -5.075 1.00 . A A . 33 CYS C 1 1 6 2876 1 1 33 CYS CA C 1.300 11.094 -5.408 1.00 . A A . 33 CYS CA 1 1 6 2877 1 1 33 CYS CB C 1.576 10.002 -4.350 1.00 . A A . 33 CYS CB 1 1 6 2878 1 1 33 CYS H H 2.668 10.337 -6.898 1.00 . A A . 33 CYS H 1 1 6 2879 1 1 33 CYS HA H 0.244 11.314 -5.431 1.00 . A A . 33 CYS HA 1 1 6 2880 1 1 33 CYS HB2 H 2.176 10.424 -3.556 1.00 . A A . 33 CYS HB2 1 1 6 2881 1 1 33 CYS HB3 H 0.634 9.665 -3.938 1.00 . A A . 33 CYS HB3 1 1 6 2882 1 1 33 CYS N N 1.727 10.553 -6.734 1.00 . A A . 33 CYS N 1 1 6 2883 1 1 33 CYS O O 3.287 12.420 -5.278 1.00 . A A . 33 CYS O 1 1 6 2884 1 1 33 CYS SG S 2.458 8.580 -5.058 1.00 . A A . 33 CYS SG 1 1 6 2885 1 1 34 PRO C C 2.808 14.477 -2.896 1.00 . A A . 34 PRO C 1 1 6 2886 1 1 34 PRO CA C 2.023 14.625 -4.201 1.00 . A A . 34 PRO CA 1 1 6 2887 1 1 34 PRO CB C 0.840 15.569 -4.016 1.00 . A A . 34 PRO CB 1 1 6 2888 1 1 34 PRO CD C -0.056 13.337 -4.302 1.00 . A A . 34 PRO CD 1 1 6 2889 1 1 34 PRO CG C -0.320 14.685 -3.681 1.00 . A A . 34 PRO CG 1 1 6 2890 1 1 34 PRO HA H 2.660 14.977 -4.993 1.00 . A A . 34 PRO HA 1 1 6 2891 1 1 34 PRO HB2 H 1.037 16.260 -3.208 1.00 . A A . 34 PRO HB2 1 1 6 2892 1 1 34 PRO HB3 H 0.643 16.106 -4.931 1.00 . A A . 34 PRO HB3 1 1 6 2893 1 1 34 PRO HD2 H -0.315 12.545 -3.611 1.00 . A A . 34 PRO HD2 1 1 6 2894 1 1 34 PRO HD3 H -0.605 13.232 -5.225 1.00 . A A . 34 PRO HD3 1 1 6 2895 1 1 34 PRO HG2 H -0.407 14.587 -2.606 1.00 . A A . 34 PRO HG2 1 1 6 2896 1 1 34 PRO HG3 H -1.229 15.100 -4.087 1.00 . A A . 34 PRO HG3 1 1 6 2897 1 1 34 PRO N N 1.387 13.339 -4.571 1.00 . A A . 34 PRO N 1 1 6 2898 1 1 34 PRO O O 3.855 15.069 -2.718 1.00 . A A . 34 PRO O 1 1 6 2899 1 1 35 GLN C C 3.095 12.020 -0.332 1.00 . A A . 35 GLN C 1 1 6 2900 1 1 35 GLN CA C 3.024 13.508 -0.688 1.00 . A A . 35 GLN CA 1 1 6 2901 1 1 35 GLN CB C 2.186 14.268 0.340 1.00 . A A . 35 GLN CB 1 1 6 2902 1 1 35 GLN CD C 4.298 15.129 1.364 1.00 . A A . 35 GLN CD 1 1 6 2903 1 1 35 GLN CG C 2.939 15.524 0.783 1.00 . A A . 35 GLN CG 1 1 6 2904 1 1 35 GLN H H 1.464 13.228 -2.149 1.00 . A A . 35 GLN H 1 1 6 2905 1 1 35 GLN HA H 4.015 13.930 -0.741 1.00 . A A . 35 GLN HA 1 1 6 2906 1 1 35 GLN HB2 H 1.242 14.550 -0.102 1.00 . A A . 35 GLN HB2 1 1 6 2907 1 1 35 GLN HB3 H 2.008 13.637 1.198 1.00 . A A . 35 GLN HB3 1 1 6 2908 1 1 35 GLN HE21 H 3.684 13.337 1.959 1.00 . A A . 35 GLN HE21 1 1 6 2909 1 1 35 GLN HE22 H 5.309 13.694 2.293 1.00 . A A . 35 GLN HE22 1 1 6 2910 1 1 35 GLN HG2 H 3.085 16.174 -0.068 1.00 . A A . 35 GLN HG2 1 1 6 2911 1 1 35 GLN HG3 H 2.364 16.042 1.538 1.00 . A A . 35 GLN HG3 1 1 6 2912 1 1 35 GLN N N 2.310 13.694 -1.982 1.00 . A A . 35 GLN N 1 1 6 2913 1 1 35 GLN NE2 N 4.442 13.955 1.918 1.00 . A A . 35 GLN NE2 1 1 6 2914 1 1 35 GLN O O 2.409 11.245 -0.976 1.00 . A A . 35 GLN O 1 1 6 2915 1 1 35 GLN OXT O 3.833 11.684 0.579 1.00 . A A . 35 GLN OXT 1 1 6 2916 1 1 35 GLN OE1 O 5.239 15.896 1.315 1.00 . A A . 35 GLN OE1 1 1 7 2917 1 1 1 GLU C C 4.692 2.530 5.164 1.00 . A A . 1 GLU C 1 1 7 2918 1 1 1 GLU CA C 5.955 3.243 5.654 1.00 . A A . 1 GLU CA 1 1 7 2919 1 1 1 GLU CB C 5.616 4.243 6.761 1.00 . A A . 1 GLU CB 1 1 7 2920 1 1 1 GLU CD C 4.172 6.198 7.346 1.00 . A A . 1 GLU CD 1 1 7 2921 1 1 1 GLU CG C 4.385 5.054 6.353 1.00 . A A . 1 GLU CG 1 1 7 2922 1 1 1 GLU H1 H 6.852 3.448 3.784 1.00 . A A . 1 GLU H1 1 1 7 2923 1 1 1 GLU H2 H 7.352 4.606 4.922 1.00 . A A . 1 GLU H2 1 1 7 2924 1 1 1 GLU H3 H 5.821 4.729 4.199 1.00 . A A . 1 GLU H3 1 1 7 2925 1 1 1 GLU HA H 6.679 2.528 6.013 1.00 . A A . 1 GLU HA 1 1 7 2926 1 1 1 GLU HB2 H 5.409 3.709 7.678 1.00 . A A . 1 GLU HB2 1 1 7 2927 1 1 1 GLU HB3 H 6.449 4.911 6.912 1.00 . A A . 1 GLU HB3 1 1 7 2928 1 1 1 GLU HG2 H 4.533 5.460 5.363 1.00 . A A . 1 GLU HG2 1 1 7 2929 1 1 1 GLU HG3 H 3.515 4.414 6.353 1.00 . A A . 1 GLU HG3 1 1 7 2930 1 1 1 GLU N N 6.539 4.069 4.557 1.00 . A A . 1 GLU N 1 1 7 2931 1 1 1 GLU O O 4.091 2.918 4.183 1.00 . A A . 1 GLU O 1 1 7 2932 1 1 1 GLU OE1 O 4.727 6.126 8.430 1.00 . A A . 1 GLU OE1 1 1 7 2933 1 1 1 GLU OE2 O 3.456 7.126 7.006 1.00 . A A . 1 GLU OE2 1 1 7 2934 1 1 2 VAL C C 2.477 -0.037 6.582 1.00 . A A . 2 VAL C 1 1 7 2935 1 1 2 VAL CA C 3.061 0.754 5.408 1.00 . A A . 2 VAL CA 1 1 7 2936 1 1 2 VAL CB C 3.539 -0.190 4.304 1.00 . A A . 2 VAL CB 1 1 7 2937 1 1 2 VAL CG1 C 2.498 -1.287 4.075 1.00 . A A . 2 VAL CG1 1 1 7 2938 1 1 2 VAL CG2 C 3.732 0.601 3.009 1.00 . A A . 2 VAL CG2 1 1 7 2939 1 1 2 VAL H H 4.783 1.192 6.629 1.00 . A A . 2 VAL H 1 1 7 2940 1 1 2 VAL HA H 2.328 1.441 5.014 1.00 . A A . 2 VAL HA 1 1 7 2941 1 1 2 VAL HB H 4.477 -0.640 4.596 1.00 . A A . 2 VAL HB 1 1 7 2942 1 1 2 VAL HG11 H 2.658 -2.089 4.779 1.00 . A A . 2 VAL HG11 1 1 7 2943 1 1 2 VAL HG12 H 2.593 -1.667 3.068 1.00 . A A . 2 VAL HG12 1 1 7 2944 1 1 2 VAL HG13 H 1.508 -0.879 4.213 1.00 . A A . 2 VAL HG13 1 1 7 2945 1 1 2 VAL HG21 H 3.736 -0.078 2.170 1.00 . A A . 2 VAL HG21 1 1 7 2946 1 1 2 VAL HG22 H 4.671 1.132 3.048 1.00 . A A . 2 VAL HG22 1 1 7 2947 1 1 2 VAL HG23 H 2.923 1.308 2.897 1.00 . A A . 2 VAL HG23 1 1 7 2948 1 1 2 VAL N N 4.285 1.491 5.839 1.00 . A A . 2 VAL N 1 1 7 2949 1 1 2 VAL O O 2.970 -1.086 6.943 1.00 . A A . 2 VAL O 1 1 7 2950 1 1 3 THR C C -0.213 -1.286 7.814 1.00 . A A . 3 THR C 1 1 7 2951 1 1 3 THR CA C 0.810 -0.268 8.327 1.00 . A A . 3 THR CA 1 1 7 2952 1 1 3 THR CB C 0.118 0.816 9.156 1.00 . A A . 3 THR CB 1 1 7 2953 1 1 3 THR CG2 C -0.842 1.606 8.265 1.00 . A A . 3 THR CG2 1 1 7 2954 1 1 3 THR H H 1.042 1.305 6.870 1.00 . A A . 3 THR H 1 1 7 2955 1 1 3 THR HA H 1.567 -0.758 8.917 1.00 . A A . 3 THR HA 1 1 7 2956 1 1 3 THR HB H 0.860 1.487 9.562 1.00 . A A . 3 THR HB 1 1 7 2957 1 1 3 THR HG1 H -1.280 0.829 10.508 1.00 . A A . 3 THR HG1 1 1 7 2958 1 1 3 THR HG21 H -0.944 1.108 7.313 1.00 . A A . 3 THR HG21 1 1 7 2959 1 1 3 THR HG22 H -0.453 2.603 8.110 1.00 . A A . 3 THR HG22 1 1 7 2960 1 1 3 THR HG23 H -1.808 1.668 8.744 1.00 . A A . 3 THR HG23 1 1 7 2961 1 1 3 THR N N 1.426 0.458 7.178 1.00 . A A . 3 THR N 1 1 7 2962 1 1 3 THR O O -1.084 -1.727 8.539 1.00 . A A . 3 THR O 1 1 7 2963 1 1 3 THR OG1 O -0.606 0.209 10.218 1.00 . A A . 3 THR OG1 1 1 7 2964 1 1 4 CYS C C -0.573 -4.073 6.245 1.00 . A A . 4 CYS C 1 1 7 2965 1 1 4 CYS CA C -1.078 -2.644 6.001 1.00 . A A . 4 CYS CA 1 1 7 2966 1 1 4 CYS CB C -1.137 -2.292 4.501 1.00 . A A . 4 CYS CB 1 1 7 2967 1 1 4 CYS H H 0.595 -1.287 6.001 1.00 . A A . 4 CYS H 1 1 7 2968 1 1 4 CYS HA H -2.051 -2.510 6.447 1.00 . A A . 4 CYS HA 1 1 7 2969 1 1 4 CYS HB2 H -1.976 -1.635 4.326 1.00 . A A . 4 CYS HB2 1 1 7 2970 1 1 4 CYS HB3 H -0.223 -1.784 4.221 1.00 . A A . 4 CYS HB3 1 1 7 2971 1 1 4 CYS N N -0.114 -1.659 6.568 1.00 . A A . 4 CYS N 1 1 7 2972 1 1 4 CYS O O 0.559 -4.285 6.634 1.00 . A A . 4 CYS O 1 1 7 2973 1 1 4 CYS SG S -1.332 -3.780 3.479 1.00 . A A . 4 CYS SG 1 1 7 2974 1 1 5 GLU C C -0.399 -7.035 4.932 1.00 . A A . 5 GLU C 1 1 7 2975 1 1 5 GLU CA C -0.983 -6.466 6.226 1.00 . A A . 5 GLU CA 1 1 7 2976 1 1 5 GLU CB C -2.262 -7.212 6.611 1.00 . A A . 5 GLU CB 1 1 7 2977 1 1 5 GLU CD C -1.985 -7.004 9.085 1.00 . A A . 5 GLU CD 1 1 7 2978 1 1 5 GLU CG C -2.842 -6.596 7.885 1.00 . A A . 5 GLU CG 1 1 7 2979 1 1 5 GLU H H -2.314 -4.854 5.697 1.00 . A A . 5 GLU H 1 1 7 2980 1 1 5 GLU HA H -0.263 -6.529 7.026 1.00 . A A . 5 GLU HA 1 1 7 2981 1 1 5 GLU HB2 H -2.983 -7.130 5.809 1.00 . A A . 5 GLU HB2 1 1 7 2982 1 1 5 GLU HB3 H -2.033 -8.251 6.786 1.00 . A A . 5 GLU HB3 1 1 7 2983 1 1 5 GLU HG2 H -2.847 -5.519 7.794 1.00 . A A . 5 GLU HG2 1 1 7 2984 1 1 5 GLU HG3 H -3.851 -6.950 8.028 1.00 . A A . 5 GLU HG3 1 1 7 2985 1 1 5 GLU N N -1.408 -5.051 6.014 1.00 . A A . 5 GLU N 1 1 7 2986 1 1 5 GLU O O -0.781 -6.635 3.850 1.00 . A A . 5 GLU O 1 1 7 2987 1 1 5 GLU OE1 O -0.849 -7.394 8.871 1.00 . A A . 5 GLU OE1 1 1 7 2988 1 1 5 GLU OE2 O -2.479 -6.919 10.197 1.00 . A A . 5 GLU OE2 1 1 7 2989 1 1 6 PRO C C 0.176 -9.477 3.161 1.00 . A A . 6 PRO C 1 1 7 2990 1 1 6 PRO CA C 1.165 -8.583 3.912 1.00 . A A . 6 PRO CA 1 1 7 2991 1 1 6 PRO CB C 2.295 -9.404 4.528 1.00 . A A . 6 PRO CB 1 1 7 2992 1 1 6 PRO CD C 1.018 -8.492 6.354 1.00 . A A . 6 PRO CD 1 1 7 2993 1 1 6 PRO CG C 1.853 -9.673 5.931 1.00 . A A . 6 PRO CG 1 1 7 2994 1 1 6 PRO HA H 1.571 -7.829 3.258 1.00 . A A . 6 PRO HA 1 1 7 2995 1 1 6 PRO HB2 H 2.423 -10.331 3.986 1.00 . A A . 6 PRO HB2 1 1 7 2996 1 1 6 PRO HB3 H 3.215 -8.839 4.532 1.00 . A A . 6 PRO HB3 1 1 7 2997 1 1 6 PRO HD2 H 0.202 -8.814 6.987 1.00 . A A . 6 PRO HD2 1 1 7 2998 1 1 6 PRO HD3 H 1.628 -7.756 6.856 1.00 . A A . 6 PRO HD3 1 1 7 2999 1 1 6 PRO HG2 H 1.262 -10.580 5.965 1.00 . A A . 6 PRO HG2 1 1 7 3000 1 1 6 PRO HG3 H 2.712 -9.762 6.580 1.00 . A A . 6 PRO HG3 1 1 7 3001 1 1 6 PRO N N 0.514 -7.953 5.086 1.00 . A A . 6 PRO N 1 1 7 3002 1 1 6 PRO O O -0.735 -10.034 3.738 1.00 . A A . 6 PRO O 1 1 7 3003 1 1 7 GLY C C -1.876 -9.697 0.819 1.00 . A A . 7 GLY C 1 1 7 3004 1 1 7 GLY CA C -0.582 -10.466 1.083 1.00 . A A . 7 GLY CA 1 1 7 3005 1 1 7 GLY H H 1.089 -9.153 1.428 1.00 . A A . 7 GLY H 1 1 7 3006 1 1 7 GLY HA2 H -0.118 -10.727 0.141 1.00 . A A . 7 GLY HA2 1 1 7 3007 1 1 7 GLY HA3 H -0.809 -11.366 1.638 1.00 . A A . 7 GLY HA3 1 1 7 3008 1 1 7 GLY N N 0.349 -9.614 1.874 1.00 . A A . 7 GLY N 1 1 7 3009 1 1 7 GLY O O -2.945 -10.270 0.733 1.00 . A A . 7 GLY O 1 1 7 3010 1 1 8 THR C C -2.706 -6.412 -0.479 1.00 . A A . 8 THR C 1 1 7 3011 1 1 8 THR CA C -3.022 -7.597 0.437 1.00 . A A . 8 THR CA 1 1 7 3012 1 1 8 THR CB C -3.469 -7.102 1.816 1.00 . A A . 8 THR CB 1 1 7 3013 1 1 8 THR CG2 C -4.968 -7.348 1.987 1.00 . A A . 8 THR CG2 1 1 7 3014 1 1 8 THR H H -0.922 -7.955 0.768 1.00 . A A . 8 THR H 1 1 7 3015 1 1 8 THR HA H -3.791 -8.215 0.002 1.00 . A A . 8 THR HA 1 1 7 3016 1 1 8 THR HB H -3.272 -6.044 1.899 1.00 . A A . 8 THR HB 1 1 7 3017 1 1 8 THR HG1 H -2.902 -8.738 2.704 1.00 . A A . 8 THR HG1 1 1 7 3018 1 1 8 THR HG21 H -5.357 -7.828 1.101 1.00 . A A . 8 THR HG21 1 1 7 3019 1 1 8 THR HG22 H -5.472 -6.405 2.136 1.00 . A A . 8 THR HG22 1 1 7 3020 1 1 8 THR HG23 H -5.133 -7.984 2.843 1.00 . A A . 8 THR HG23 1 1 7 3021 1 1 8 THR N N -1.792 -8.400 0.692 1.00 . A A . 8 THR N 1 1 7 3022 1 1 8 THR O O -1.560 -6.099 -0.736 1.00 . A A . 8 THR O 1 1 7 3023 1 1 8 THR OG1 O -2.755 -7.798 2.828 1.00 . A A . 8 THR OG1 1 1 7 3024 1 1 9 THR C C -4.445 -3.445 -1.479 1.00 . A A . 9 THR C 1 1 7 3025 1 1 9 THR CA C -3.487 -4.577 -1.861 1.00 . A A . 9 THR CA 1 1 7 3026 1 1 9 THR CB C -3.787 -5.084 -3.274 1.00 . A A . 9 THR CB 1 1 7 3027 1 1 9 THR CG2 C -5.124 -5.824 -3.282 1.00 . A A . 9 THR CG2 1 1 7 3028 1 1 9 THR H H -4.632 -6.017 -0.742 1.00 . A A . 9 THR H 1 1 7 3029 1 1 9 THR HA H -2.463 -4.246 -1.795 1.00 . A A . 9 THR HA 1 1 7 3030 1 1 9 THR HB H -3.005 -5.760 -3.587 1.00 . A A . 9 THR HB 1 1 7 3031 1 1 9 THR HG1 H -4.721 -3.590 -4.096 1.00 . A A . 9 THR HG1 1 1 7 3032 1 1 9 THR HG21 H -5.921 -5.130 -3.056 1.00 . A A . 9 THR HG21 1 1 7 3033 1 1 9 THR HG22 H -5.107 -6.607 -2.537 1.00 . A A . 9 THR HG22 1 1 7 3034 1 1 9 THR HG23 H -5.291 -6.258 -4.257 1.00 . A A . 9 THR HG23 1 1 7 3035 1 1 9 THR N N -3.717 -5.748 -0.968 1.00 . A A . 9 THR N 1 1 7 3036 1 1 9 THR O O -5.391 -3.647 -0.744 1.00 . A A . 9 THR O 1 1 7 3037 1 1 9 THR OG1 O -3.847 -3.981 -4.168 1.00 . A A . 9 THR OG1 1 1 7 3038 1 1 10 PHE C C -4.656 0.160 -2.304 1.00 . A A . 10 PHE C 1 1 7 3039 1 1 10 PHE CA C -5.117 -1.126 -1.613 1.00 . A A . 10 PHE CA 1 1 7 3040 1 1 10 PHE CB C -5.007 -0.989 -0.093 1.00 . A A . 10 PHE CB 1 1 7 3041 1 1 10 PHE CD1 C -2.824 -2.049 0.590 1.00 . A A . 10 PHE CD1 1 1 7 3042 1 1 10 PHE CD2 C -2.934 0.365 0.383 1.00 . A A . 10 PHE CD2 1 1 7 3043 1 1 10 PHE CE1 C -1.476 -1.955 0.958 1.00 . A A . 10 PHE CE1 1 1 7 3044 1 1 10 PHE CE2 C -1.587 0.459 0.751 1.00 . A A . 10 PHE CE2 1 1 7 3045 1 1 10 PHE CG C -3.553 -0.888 0.302 1.00 . A A . 10 PHE CG 1 1 7 3046 1 1 10 PHE CZ C -0.857 -0.701 1.039 1.00 . A A . 10 PHE CZ 1 1 7 3047 1 1 10 PHE H H -3.443 -2.110 -2.554 1.00 . A A . 10 PHE H 1 1 7 3048 1 1 10 PHE HA H -6.133 -1.359 -1.888 1.00 . A A . 10 PHE HA 1 1 7 3049 1 1 10 PHE HB2 H -5.529 -0.099 0.225 1.00 . A A . 10 PHE HB2 1 1 7 3050 1 1 10 PHE HB3 H -5.448 -1.853 0.379 1.00 . A A . 10 PHE HB3 1 1 7 3051 1 1 10 PHE HD1 H -3.302 -3.016 0.528 1.00 . A A . 10 PHE HD1 1 1 7 3052 1 1 10 PHE HD2 H -3.497 1.261 0.161 1.00 . A A . 10 PHE HD2 1 1 7 3053 1 1 10 PHE HE1 H -0.913 -2.850 1.180 1.00 . A A . 10 PHE HE1 1 1 7 3054 1 1 10 PHE HE2 H -1.110 1.426 0.814 1.00 . A A . 10 PHE HE2 1 1 7 3055 1 1 10 PHE HZ H 0.182 -0.629 1.322 1.00 . A A . 10 PHE HZ 1 1 7 3056 1 1 10 PHE N N -4.211 -2.258 -1.964 1.00 . A A . 10 PHE N 1 1 7 3057 1 1 10 PHE O O -3.499 0.319 -2.635 1.00 . A A . 10 PHE O 1 1 7 3058 1 1 11 LYS C C -4.701 3.370 -2.149 1.00 . A A . 11 LYS C 1 1 7 3059 1 1 11 LYS CA C -5.171 2.353 -3.189 1.00 . A A . 11 LYS CA 1 1 7 3060 1 1 11 LYS CB C -6.444 2.842 -3.878 1.00 . A A . 11 LYS CB 1 1 7 3061 1 1 11 LYS CD C -7.340 4.379 -5.632 1.00 . A A . 11 LYS CD 1 1 7 3062 1 1 11 LYS CE C -7.113 4.674 -7.116 1.00 . A A . 11 LYS CE 1 1 7 3063 1 1 11 LYS CG C -6.070 3.776 -5.031 1.00 . A A . 11 LYS CG 1 1 7 3064 1 1 11 LYS H H -6.485 0.930 -2.247 1.00 . A A . 11 LYS H 1 1 7 3065 1 1 11 LYS HA H -4.401 2.180 -3.921 1.00 . A A . 11 LYS HA 1 1 7 3066 1 1 11 LYS HB2 H -6.993 1.994 -4.263 1.00 . A A . 11 LYS HB2 1 1 7 3067 1 1 11 LYS HB3 H -7.056 3.376 -3.168 1.00 . A A . 11 LYS HB3 1 1 7 3068 1 1 11 LYS HD2 H -8.157 3.680 -5.523 1.00 . A A . 11 LYS HD2 1 1 7 3069 1 1 11 LYS HD3 H -7.581 5.298 -5.118 1.00 . A A . 11 LYS HD3 1 1 7 3070 1 1 11 LYS HE2 H -6.853 5.715 -7.255 1.00 . A A . 11 LYS HE2 1 1 7 3071 1 1 11 LYS HE3 H -6.341 4.035 -7.514 1.00 . A A . 11 LYS HE3 1 1 7 3072 1 1 11 LYS HG2 H -5.435 4.568 -4.661 1.00 . A A . 11 LYS HG2 1 1 7 3073 1 1 11 LYS HG3 H -5.545 3.218 -5.791 1.00 . A A . 11 LYS HG3 1 1 7 3074 1 1 11 LYS HZ1 H -9.132 5.053 -7.454 1.00 . A A . 11 LYS HZ1 1 1 7 3075 1 1 11 LYS HZ2 H -8.717 3.407 -7.509 1.00 . A A . 11 LYS HZ2 1 1 7 3076 1 1 11 LYS HZ3 H -8.310 4.433 -8.802 1.00 . A A . 11 LYS HZ3 1 1 7 3077 1 1 11 LYS N N -5.556 1.078 -2.522 1.00 . A A . 11 LYS N 1 1 7 3078 1 1 11 LYS NZ N -8.416 4.368 -7.770 1.00 . A A . 11 LYS NZ 1 1 7 3079 1 1 11 LYS O O -5.494 3.986 -1.465 1.00 . A A . 11 LYS O 1 1 7 3080 1 1 12 ASP C C -2.026 5.579 -1.717 1.00 . A A . 12 ASP C 1 1 7 3081 1 1 12 ASP CA C -2.899 4.529 -1.028 1.00 . A A . 12 ASP CA 1 1 7 3082 1 1 12 ASP CB C -2.065 3.698 -0.050 1.00 . A A . 12 ASP CB 1 1 7 3083 1 1 12 ASP CG C -2.400 4.111 1.384 1.00 . A A . 12 ASP CG 1 1 7 3084 1 1 12 ASP H H -2.791 3.045 -2.584 1.00 . A A . 12 ASP H 1 1 7 3085 1 1 12 ASP HA H -3.715 5.001 -0.505 1.00 . A A . 12 ASP HA 1 1 7 3086 1 1 12 ASP HB2 H -2.290 2.649 -0.187 1.00 . A A . 12 ASP HB2 1 1 7 3087 1 1 12 ASP HB3 H -1.014 3.872 -0.236 1.00 . A A . 12 ASP HB3 1 1 7 3088 1 1 12 ASP N N -3.415 3.551 -2.025 1.00 . A A . 12 ASP N 1 1 7 3089 1 1 12 ASP O O -1.509 5.365 -2.796 1.00 . A A . 12 ASP O 1 1 7 3090 1 1 12 ASP OD1 O -1.928 5.154 1.806 1.00 . A A . 12 ASP OD1 1 1 7 3091 1 1 12 ASP OD2 O -3.124 3.375 2.037 1.00 . A A . 12 ASP OD2 1 1 7 3092 1 1 13 LYS C C -1.584 8.197 -3.069 1.00 . A A . 13 LYS C 1 1 7 3093 1 1 13 LYS CA C -1.015 7.783 -1.700 1.00 . A A . 13 LYS CA 1 1 7 3094 1 1 13 LYS CB C 0.387 7.171 -1.826 1.00 . A A . 13 LYS CB 1 1 7 3095 1 1 13 LYS CD C 1.872 7.121 0.191 1.00 . A A . 13 LYS CD 1 1 7 3096 1 1 13 LYS CE C 1.787 6.804 1.686 1.00 . A A . 13 LYS CE 1 1 7 3097 1 1 13 LYS CG C 0.741 6.401 -0.547 1.00 . A A . 13 LYS CG 1 1 7 3098 1 1 13 LYS H H -2.281 6.859 -0.225 1.00 . A A . 13 LYS H 1 1 7 3099 1 1 13 LYS HA H -0.980 8.637 -1.043 1.00 . A A . 13 LYS HA 1 1 7 3100 1 1 13 LYS HB2 H 0.415 6.495 -2.668 1.00 . A A . 13 LYS HB2 1 1 7 3101 1 1 13 LYS HB3 H 1.108 7.961 -1.973 1.00 . A A . 13 LYS HB3 1 1 7 3102 1 1 13 LYS HD2 H 2.824 6.788 -0.195 1.00 . A A . 13 LYS HD2 1 1 7 3103 1 1 13 LYS HD3 H 1.776 8.187 0.045 1.00 . A A . 13 LYS HD3 1 1 7 3104 1 1 13 LYS HE2 H 1.699 7.719 2.258 1.00 . A A . 13 LYS HE2 1 1 7 3105 1 1 13 LYS HE3 H 0.953 6.152 1.886 1.00 . A A . 13 LYS HE3 1 1 7 3106 1 1 13 LYS HG2 H -0.125 6.342 0.096 1.00 . A A . 13 LYS HG2 1 1 7 3107 1 1 13 LYS HG3 H 1.064 5.404 -0.805 1.00 . A A . 13 LYS HG3 1 1 7 3108 1 1 13 LYS HZ1 H 3.009 5.698 2.956 1.00 . A A . 13 LYS HZ1 1 1 7 3109 1 1 13 LYS HZ2 H 3.848 6.797 1.968 1.00 . A A . 13 LYS HZ2 1 1 7 3110 1 1 13 LYS HZ3 H 3.234 5.356 1.310 1.00 . A A . 13 LYS HZ3 1 1 7 3111 1 1 13 LYS N N -1.857 6.712 -1.096 1.00 . A A . 13 LYS N 1 1 7 3112 1 1 13 LYS NZ N 3.066 6.112 2.005 1.00 . A A . 13 LYS NZ 1 1 7 3113 1 1 13 LYS O O -2.280 9.187 -3.174 1.00 . A A . 13 LYS O 1 1 7 3114 1 1 14 CYS C C -1.922 6.647 -6.402 1.00 . A A . 14 CYS C 1 1 7 3115 1 1 14 CYS CA C -1.863 7.851 -5.449 1.00 . A A . 14 CYS CA 1 1 7 3116 1 1 14 CYS CB C -0.911 8.924 -5.978 1.00 . A A . 14 CYS CB 1 1 7 3117 1 1 14 CYS H H -0.752 6.662 -4.033 1.00 . A A . 14 CYS H 1 1 7 3118 1 1 14 CYS HA H -2.849 8.271 -5.329 1.00 . A A . 14 CYS HA 1 1 7 3119 1 1 14 CYS HB2 H -1.299 9.324 -6.903 1.00 . A A . 14 CYS HB2 1 1 7 3120 1 1 14 CYS HB3 H -0.826 9.718 -5.248 1.00 . A A . 14 CYS HB3 1 1 7 3121 1 1 14 CYS N N -1.310 7.461 -4.117 1.00 . A A . 14 CYS N 1 1 7 3122 1 1 14 CYS O O -2.036 6.801 -7.603 1.00 . A A . 14 CYS O 1 1 7 3123 1 1 14 CYS SG S 0.720 8.203 -6.273 1.00 . A A . 14 CYS SG 1 1 7 3124 1 1 15 ASN C C -2.108 2.986 -5.878 1.00 . A A . 15 ASN C 1 1 7 3125 1 1 15 ASN CA C -1.944 4.235 -6.751 1.00 . A A . 15 ASN CA 1 1 7 3126 1 1 15 ASN CB C -0.632 4.162 -7.572 1.00 . A A . 15 ASN CB 1 1 7 3127 1 1 15 ASN CG C 0.399 5.179 -7.079 1.00 . A A . 15 ASN CG 1 1 7 3128 1 1 15 ASN H H -1.790 5.349 -4.906 1.00 . A A . 15 ASN H 1 1 7 3129 1 1 15 ASN HA H -2.785 4.322 -7.421 1.00 . A A . 15 ASN HA 1 1 7 3130 1 1 15 ASN HB2 H -0.211 3.168 -7.498 1.00 . A A . 15 ASN HB2 1 1 7 3131 1 1 15 ASN HB3 H -0.857 4.372 -8.608 1.00 . A A . 15 ASN HB3 1 1 7 3132 1 1 15 ASN HD21 H 1.026 5.598 -8.915 1.00 . A A . 15 ASN HD21 1 1 7 3133 1 1 15 ASN HD22 H 1.793 6.459 -7.669 1.00 . A A . 15 ASN HD22 1 1 7 3134 1 1 15 ASN N N -1.867 5.451 -5.877 1.00 . A A . 15 ASN N 1 1 7 3135 1 1 15 ASN ND2 N 1.137 5.796 -7.959 1.00 . A A . 15 ASN ND2 1 1 7 3136 1 1 15 ASN O O -1.777 2.991 -4.709 1.00 . A A . 15 ASN O 1 1 7 3137 1 1 15 ASN OD1 O 0.542 5.404 -5.893 1.00 . A A . 15 ASN OD1 1 1 7 3138 1 1 16 THR C C -1.450 0.210 -5.105 1.00 . A A . 16 THR C 1 1 7 3139 1 1 16 THR CA C -2.802 0.679 -5.624 1.00 . A A . 16 THR CA 1 1 7 3140 1 1 16 THR CB C -3.398 -0.346 -6.590 1.00 . A A . 16 THR CB 1 1 7 3141 1 1 16 THR CG2 C -3.901 -1.556 -5.803 1.00 . A A . 16 THR CG2 1 1 7 3142 1 1 16 THR H H -2.877 1.930 -7.375 1.00 . A A . 16 THR H 1 1 7 3143 1 1 16 THR HA H -3.482 0.856 -4.806 1.00 . A A . 16 THR HA 1 1 7 3144 1 1 16 THR HB H -2.640 -0.665 -7.288 1.00 . A A . 16 THR HB 1 1 7 3145 1 1 16 THR HG1 H -4.554 -0.195 -8.147 1.00 . A A . 16 THR HG1 1 1 7 3146 1 1 16 THR HG21 H -3.082 -1.990 -5.247 1.00 . A A . 16 THR HG21 1 1 7 3147 1 1 16 THR HG22 H -4.300 -2.290 -6.489 1.00 . A A . 16 THR HG22 1 1 7 3148 1 1 16 THR HG23 H -4.675 -1.245 -5.118 1.00 . A A . 16 THR HG23 1 1 7 3149 1 1 16 THR N N -2.619 1.918 -6.432 1.00 . A A . 16 THR N 1 1 7 3150 1 1 16 THR O O -0.432 0.462 -5.711 1.00 . A A . 16 THR O 1 1 7 3151 1 1 16 THR OG1 O -4.479 0.245 -7.298 1.00 . A A . 16 THR OG1 1 1 7 3152 1 1 17 CYS C C -0.261 -2.329 -2.840 1.00 . A A . 17 CYS C 1 1 7 3153 1 1 17 CYS CA C -0.118 -0.931 -3.445 1.00 . A A . 17 CYS CA 1 1 7 3154 1 1 17 CYS CB C 0.253 0.096 -2.377 1.00 . A A . 17 CYS CB 1 1 7 3155 1 1 17 CYS H H -2.255 -0.652 -3.509 1.00 . A A . 17 CYS H 1 1 7 3156 1 1 17 CYS HA H 0.627 -0.936 -4.220 1.00 . A A . 17 CYS HA 1 1 7 3157 1 1 17 CYS HB2 H -0.562 0.194 -1.672 1.00 . A A . 17 CYS HB2 1 1 7 3158 1 1 17 CYS HB3 H 1.144 -0.228 -1.859 1.00 . A A . 17 CYS HB3 1 1 7 3159 1 1 17 CYS N N -1.422 -0.462 -3.990 1.00 . A A . 17 CYS N 1 1 7 3160 1 1 17 CYS O O -0.912 -2.519 -1.832 1.00 . A A . 17 CYS O 1 1 7 3161 1 1 17 CYS SG S 0.562 1.695 -3.171 1.00 . A A . 17 CYS SG 1 1 7 3162 1 1 18 ARG C C 1.180 -4.873 -1.727 1.00 . A A . 18 ARG C 1 1 7 3163 1 1 18 ARG CA C 0.253 -4.699 -2.923 1.00 . A A . 18 ARG CA 1 1 7 3164 1 1 18 ARG CB C 0.692 -5.597 -4.078 1.00 . A A . 18 ARG CB 1 1 7 3165 1 1 18 ARG CD C -0.700 -7.671 -4.052 1.00 . A A . 18 ARG CD 1 1 7 3166 1 1 18 ARG CG C 0.638 -7.060 -3.634 1.00 . A A . 18 ARG CG 1 1 7 3167 1 1 18 ARG CZ C -1.270 -9.407 -5.637 1.00 . A A . 18 ARG CZ 1 1 7 3168 1 1 18 ARG H H 0.865 -3.130 -4.266 1.00 . A A . 18 ARG H 1 1 7 3169 1 1 18 ARG HA H -0.761 -4.931 -2.638 1.00 . A A . 18 ARG HA 1 1 7 3170 1 1 18 ARG HB2 H 0.032 -5.451 -4.920 1.00 . A A . 18 ARG HB2 1 1 7 3171 1 1 18 ARG HB3 H 1.702 -5.348 -4.365 1.00 . A A . 18 ARG HB3 1 1 7 3172 1 1 18 ARG HD2 H -1.237 -8.026 -3.183 1.00 . A A . 18 ARG HD2 1 1 7 3173 1 1 18 ARG HD3 H -1.291 -6.948 -4.592 1.00 . A A . 18 ARG HD3 1 1 7 3174 1 1 18 ARG HE H 0.589 -9.104 -5.010 1.00 . A A . 18 ARG HE 1 1 7 3175 1 1 18 ARG HG2 H 1.446 -7.607 -4.098 1.00 . A A . 18 ARG HG2 1 1 7 3176 1 1 18 ARG HG3 H 0.737 -7.114 -2.560 1.00 . A A . 18 ARG HG3 1 1 7 3177 1 1 18 ARG HH11 H -2.317 -7.734 -5.968 1.00 . A A . 18 ARG HH11 1 1 7 3178 1 1 18 ARG HH12 H -2.978 -9.179 -6.656 1.00 . A A . 18 ARG HH12 1 1 7 3179 1 1 18 ARG HH21 H -0.438 -11.219 -5.469 1.00 . A A . 18 ARG HH21 1 1 7 3180 1 1 18 ARG HH22 H -1.913 -11.154 -6.374 1.00 . A A . 18 ARG HH22 1 1 7 3181 1 1 18 ARG N N 0.346 -3.309 -3.453 1.00 . A A . 18 ARG N 1 1 7 3182 1 1 18 ARG NE N -0.342 -8.807 -4.944 1.00 . A A . 18 ARG NE 1 1 7 3183 1 1 18 ARG NH1 N -2.266 -8.720 -6.126 1.00 . A A . 18 ARG NH1 1 1 7 3184 1 1 18 ARG NH2 N -1.201 -10.693 -5.843 1.00 . A A . 18 ARG NH2 1 1 7 3185 1 1 18 ARG O O 2.389 -4.880 -1.849 1.00 . A A . 18 ARG O 1 1 7 3186 1 1 19 CYS C C 2.406 -6.368 0.468 1.00 . A A . 19 CYS C 1 1 7 3187 1 1 19 CYS CA C 1.425 -5.204 0.656 1.00 . A A . 19 CYS CA 1 1 7 3188 1 1 19 CYS CB C 0.393 -5.529 1.729 1.00 . A A . 19 CYS CB 1 1 7 3189 1 1 19 CYS H H -0.368 -5.013 -0.507 1.00 . A A . 19 CYS H 1 1 7 3190 1 1 19 CYS HA H 1.950 -4.296 0.907 1.00 . A A . 19 CYS HA 1 1 7 3191 1 1 19 CYS HB2 H -0.599 -5.437 1.308 1.00 . A A . 19 CYS HB2 1 1 7 3192 1 1 19 CYS HB3 H 0.543 -6.539 2.072 1.00 . A A . 19 CYS HB3 1 1 7 3193 1 1 19 CYS N N 0.610 -5.019 -0.570 1.00 . A A . 19 CYS N 1 1 7 3194 1 1 19 CYS O O 2.042 -7.428 -0.003 1.00 . A A . 19 CYS O 1 1 7 3195 1 1 19 CYS SG S 0.563 -4.378 3.113 1.00 . A A . 19 CYS SG 1 1 7 3196 1 1 20 GLY C C 4.353 -8.396 1.665 1.00 . A A . 20 GLY C 1 1 7 3197 1 1 20 GLY CA C 4.648 -7.274 0.667 1.00 . A A . 20 GLY CA 1 1 7 3198 1 1 20 GLY H H 3.921 -5.317 1.203 1.00 . A A . 20 GLY H 1 1 7 3199 1 1 20 GLY HA2 H 4.594 -7.664 -0.342 1.00 . A A . 20 GLY HA2 1 1 7 3200 1 1 20 GLY HA3 H 5.639 -6.885 0.852 1.00 . A A . 20 GLY HA3 1 1 7 3201 1 1 20 GLY N N 3.646 -6.180 0.829 1.00 . A A . 20 GLY N 1 1 7 3202 1 1 20 GLY O O 3.322 -8.414 2.304 1.00 . A A . 20 GLY O 1 1 7 3203 1 1 21 SER C C 5.622 -10.118 4.127 1.00 . A A . 21 SER C 1 1 7 3204 1 1 21 SER CA C 5.017 -10.454 2.761 1.00 . A A . 21 SER CA 1 1 7 3205 1 1 21 SER CB C 5.727 -11.659 2.148 1.00 . A A . 21 SER CB 1 1 7 3206 1 1 21 SER H H 6.076 -9.303 1.277 1.00 . A A . 21 SER H 1 1 7 3207 1 1 21 SER HA H 3.962 -10.657 2.854 1.00 . A A . 21 SER HA 1 1 7 3208 1 1 21 SER HB2 H 5.398 -11.796 1.131 1.00 . A A . 21 SER HB2 1 1 7 3209 1 1 21 SER HB3 H 6.796 -11.488 2.158 1.00 . A A . 21 SER HB3 1 1 7 3210 1 1 21 SER HG H 4.701 -13.282 2.459 1.00 . A A . 21 SER HG 1 1 7 3211 1 1 21 SER N N 5.251 -9.334 1.803 1.00 . A A . 21 SER N 1 1 7 3212 1 1 21 SER O O 5.313 -10.743 5.122 1.00 . A A . 21 SER O 1 1 7 3213 1 1 21 SER OG O 5.415 -12.822 2.904 1.00 . A A . 21 SER OG 1 1 7 3214 1 1 22 ASP C C 6.428 -7.520 6.057 1.00 . A A . 22 ASP C 1 1 7 3215 1 1 22 ASP CA C 7.105 -8.768 5.483 1.00 . A A . 22 ASP CA 1 1 7 3216 1 1 22 ASP CB C 8.572 -8.487 5.155 1.00 . A A . 22 ASP CB 1 1 7 3217 1 1 22 ASP CG C 9.428 -9.681 5.584 1.00 . A A . 22 ASP CG 1 1 7 3218 1 1 22 ASP H H 6.718 -8.647 3.367 1.00 . A A . 22 ASP H 1 1 7 3219 1 1 22 ASP HA H 7.034 -9.589 6.180 1.00 . A A . 22 ASP HA 1 1 7 3220 1 1 22 ASP HB2 H 8.679 -8.330 4.091 1.00 . A A . 22 ASP HB2 1 1 7 3221 1 1 22 ASP HB3 H 8.898 -7.604 5.687 1.00 . A A . 22 ASP HB3 1 1 7 3222 1 1 22 ASP N N 6.482 -9.139 4.181 1.00 . A A . 22 ASP N 1 1 7 3223 1 1 22 ASP O O 6.928 -6.896 6.972 1.00 . A A . 22 ASP O 1 1 7 3224 1 1 22 ASP OD1 O 8.893 -10.776 5.648 1.00 . A A . 22 ASP OD1 1 1 7 3225 1 1 22 ASP OD2 O 10.604 -9.480 5.841 1.00 . A A . 22 ASP OD2 1 1 7 3226 1 1 23 GLY C C 5.504 -4.732 5.952 1.00 . A A . 23 GLY C 1 1 7 3227 1 1 23 GLY CA C 4.581 -5.949 6.045 1.00 . A A . 23 GLY CA 1 1 7 3228 1 1 23 GLY H H 4.904 -7.673 4.792 1.00 . A A . 23 GLY H 1 1 7 3229 1 1 23 GLY HA2 H 3.692 -5.776 5.454 1.00 . A A . 23 GLY HA2 1 1 7 3230 1 1 23 GLY HA3 H 4.305 -6.109 7.078 1.00 . A A . 23 GLY HA3 1 1 7 3231 1 1 23 GLY N N 5.291 -7.154 5.528 1.00 . A A . 23 GLY N 1 1 7 3232 1 1 23 GLY O O 6.628 -4.826 5.503 1.00 . A A . 23 GLY O 1 1 7 3233 1 1 24 LYS C C 6.529 -2.237 4.922 1.00 . A A . 24 LYS C 1 1 7 3234 1 1 24 LYS CA C 5.888 -2.366 6.309 1.00 . A A . 24 LYS CA 1 1 7 3235 1 1 24 LYS CB C 6.962 -2.575 7.379 1.00 . A A . 24 LYS CB 1 1 7 3236 1 1 24 LYS CD C 8.392 -1.390 9.053 1.00 . A A . 24 LYS CD 1 1 7 3237 1 1 24 LYS CE C 8.484 -0.175 9.979 1.00 . A A . 24 LYS CE 1 1 7 3238 1 1 24 LYS CG C 7.115 -1.300 8.213 1.00 . A A . 24 LYS CG 1 1 7 3239 1 1 24 LYS H H 4.126 -3.534 6.731 1.00 . A A . 24 LYS H 1 1 7 3240 1 1 24 LYS HA H 5.305 -1.488 6.538 1.00 . A A . 24 LYS HA 1 1 7 3241 1 1 24 LYS HB2 H 6.671 -3.394 8.022 1.00 . A A . 24 LYS HB2 1 1 7 3242 1 1 24 LYS HB3 H 7.902 -2.808 6.904 1.00 . A A . 24 LYS HB3 1 1 7 3243 1 1 24 LYS HD2 H 8.369 -2.294 9.645 1.00 . A A . 24 LYS HD2 1 1 7 3244 1 1 24 LYS HD3 H 9.251 -1.409 8.399 1.00 . A A . 24 LYS HD3 1 1 7 3245 1 1 24 LYS HE2 H 8.870 0.679 9.439 1.00 . A A . 24 LYS HE2 1 1 7 3246 1 1 24 LYS HE3 H 7.518 0.049 10.403 1.00 . A A . 24 LYS HE3 1 1 7 3247 1 1 24 LYS HG2 H 7.174 -0.445 7.555 1.00 . A A . 24 LYS HG2 1 1 7 3248 1 1 24 LYS HG3 H 6.263 -1.193 8.868 1.00 . A A . 24 LYS HG3 1 1 7 3249 1 1 24 LYS HZ1 H 9.577 0.212 11.709 1.00 . A A . 24 LYS HZ1 1 1 7 3250 1 1 24 LYS HZ2 H 10.341 -0.856 10.630 1.00 . A A . 24 LYS HZ2 1 1 7 3251 1 1 24 LYS HZ3 H 9.036 -1.390 11.577 1.00 . A A . 24 LYS HZ3 1 1 7 3252 1 1 24 LYS N N 5.036 -3.589 6.372 1.00 . A A . 24 LYS N 1 1 7 3253 1 1 24 LYS NZ N 9.431 -0.583 11.055 1.00 . A A . 24 LYS NZ 1 1 7 3254 1 1 24 LYS O O 7.549 -1.598 4.758 1.00 . A A . 24 LYS O 1 1 7 3255 1 1 25 SER C C 5.485 -3.198 1.513 1.00 . A A . 25 SER C 1 1 7 3256 1 1 25 SER CA C 6.516 -2.747 2.551 1.00 . A A . 25 SER CA 1 1 7 3257 1 1 25 SER CB C 7.715 -3.693 2.560 1.00 . A A . 25 SER CB 1 1 7 3258 1 1 25 SER H H 5.116 -3.349 4.077 1.00 . A A . 25 SER H 1 1 7 3259 1 1 25 SER HA H 6.842 -1.741 2.345 1.00 . A A . 25 SER HA 1 1 7 3260 1 1 25 SER HB2 H 7.374 -4.713 2.490 1.00 . A A . 25 SER HB2 1 1 7 3261 1 1 25 SER HB3 H 8.355 -3.467 1.715 1.00 . A A . 25 SER HB3 1 1 7 3262 1 1 25 SER HG H 9.373 -3.548 3.569 1.00 . A A . 25 SER HG 1 1 7 3263 1 1 25 SER N N 5.938 -2.838 3.924 1.00 . A A . 25 SER N 1 1 7 3264 1 1 25 SER O O 4.898 -4.255 1.625 1.00 . A A . 25 SER O 1 1 7 3265 1 1 25 SER OG O 8.436 -3.522 3.774 1.00 . A A . 25 SER OG 1 1 7 3266 1 1 26 ALA C C 4.580 -2.074 -1.862 1.00 . A A . 26 ALA C 1 1 7 3267 1 1 26 ALA CA C 4.263 -2.782 -0.540 1.00 . A A . 26 ALA CA 1 1 7 3268 1 1 26 ALA CB C 2.914 -2.311 0.013 1.00 . A A . 26 ALA CB 1 1 7 3269 1 1 26 ALA H H 5.741 -1.551 0.433 1.00 . A A . 26 ALA H 1 1 7 3270 1 1 26 ALA HA H 4.250 -3.851 -0.677 1.00 . A A . 26 ALA HA 1 1 7 3271 1 1 26 ALA HB1 H 2.912 -2.410 1.089 1.00 . A A . 26 ALA HB1 1 1 7 3272 1 1 26 ALA HB2 H 2.123 -2.913 -0.406 1.00 . A A . 26 ALA HB2 1 1 7 3273 1 1 26 ALA HB3 H 2.759 -1.275 -0.253 1.00 . A A . 26 ALA HB3 1 1 7 3274 1 1 26 ALA N N 5.257 -2.401 0.504 1.00 . A A . 26 ALA N 1 1 7 3275 1 1 26 ALA O O 4.999 -0.934 -1.881 1.00 . A A . 26 ALA O 1 1 7 3276 1 1 27 ALA C C 3.353 -1.590 -4.887 1.00 . A A . 27 ALA C 1 1 7 3277 1 1 27 ALA CA C 4.658 -2.107 -4.287 1.00 . A A . 27 ALA CA 1 1 7 3278 1 1 27 ALA CB C 5.241 -3.226 -5.150 1.00 . A A . 27 ALA CB 1 1 7 3279 1 1 27 ALA H H 4.030 -3.655 -2.931 1.00 . A A . 27 ALA H 1 1 7 3280 1 1 27 ALA HA H 5.372 -1.306 -4.181 1.00 . A A . 27 ALA HA 1 1 7 3281 1 1 27 ALA HB1 H 6.245 -2.963 -5.449 1.00 . A A . 27 ALA HB1 1 1 7 3282 1 1 27 ALA HB2 H 4.627 -3.360 -6.028 1.00 . A A . 27 ALA HB2 1 1 7 3283 1 1 27 ALA HB3 H 5.263 -4.143 -4.581 1.00 . A A . 27 ALA HB3 1 1 7 3284 1 1 27 ALA N N 4.377 -2.740 -2.967 1.00 . A A . 27 ALA N 1 1 7 3285 1 1 27 ALA O O 2.294 -2.124 -4.628 1.00 . A A . 27 ALA O 1 1 7 3286 1 1 28 CYS C C 2.178 -0.092 -7.790 1.00 . A A . 28 CYS C 1 1 7 3287 1 1 28 CYS CA C 2.149 -0.019 -6.262 1.00 . A A . 28 CYS CA 1 1 7 3288 1 1 28 CYS CB C 2.080 1.433 -5.787 1.00 . A A . 28 CYS CB 1 1 7 3289 1 1 28 CYS H H 4.268 -0.126 -5.870 1.00 . A A . 28 CYS H 1 1 7 3290 1 1 28 CYS HA H 1.307 -0.569 -5.881 1.00 . A A . 28 CYS HA 1 1 7 3291 1 1 28 CYS HB2 H 2.828 2.017 -6.306 1.00 . A A . 28 CYS HB2 1 1 7 3292 1 1 28 CYS HB3 H 1.099 1.837 -5.996 1.00 . A A . 28 CYS HB3 1 1 7 3293 1 1 28 CYS N N 3.408 -0.555 -5.675 1.00 . A A . 28 CYS N 1 1 7 3294 1 1 28 CYS O O 3.211 0.054 -8.413 1.00 . A A . 28 CYS O 1 1 7 3295 1 1 28 CYS SG S 2.394 1.500 -4.002 1.00 . A A . 28 CYS SG 1 1 7 3296 1 1 29 THR C C 1.772 0.739 -10.508 1.00 . A A . 29 THR C 1 1 7 3297 1 1 29 THR CA C 0.982 -0.405 -9.879 1.00 . A A . 29 THR CA 1 1 7 3298 1 1 29 THR CB C -0.504 -0.280 -10.221 1.00 . A A . 29 THR CB 1 1 7 3299 1 1 29 THR CG2 C -1.249 -1.518 -9.724 1.00 . A A . 29 THR CG2 1 1 7 3300 1 1 29 THR H H 0.224 -0.432 -7.865 1.00 . A A . 29 THR H 1 1 7 3301 1 1 29 THR HA H 1.358 -1.353 -10.220 1.00 . A A . 29 THR HA 1 1 7 3302 1 1 29 THR HB H -0.622 -0.199 -11.291 1.00 . A A . 29 THR HB 1 1 7 3303 1 1 29 THR HG1 H -1.403 1.445 -10.280 1.00 . A A . 29 THR HG1 1 1 7 3304 1 1 29 THR HG21 H -0.541 -2.310 -9.527 1.00 . A A . 29 THR HG21 1 1 7 3305 1 1 29 THR HG22 H -1.951 -1.844 -10.477 1.00 . A A . 29 THR HG22 1 1 7 3306 1 1 29 THR HG23 H -1.781 -1.279 -8.817 1.00 . A A . 29 THR HG23 1 1 7 3307 1 1 29 THR N N 1.042 -0.320 -8.393 1.00 . A A . 29 THR N 1 1 7 3308 1 1 29 THR O O 2.762 0.530 -11.182 1.00 . A A . 29 THR O 1 1 7 3309 1 1 29 THR OG1 O -1.037 0.879 -9.595 1.00 . A A . 29 THR OG1 1 1 7 3310 1 1 30 ARG C C 3.118 3.633 -9.913 1.00 . A A . 30 ARG C 1 1 7 3311 1 1 30 ARG CA C 2.069 3.104 -10.890 1.00 . A A . 30 ARG CA 1 1 7 3312 1 1 30 ARG CB C 1.001 4.160 -11.169 1.00 . A A . 30 ARG CB 1 1 7 3313 1 1 30 ARG CD C -0.521 4.791 -13.050 1.00 . A A . 30 ARG CD 1 1 7 3314 1 1 30 ARG CG C 0.908 4.393 -12.679 1.00 . A A . 30 ARG CG 1 1 7 3315 1 1 30 ARG CZ C -1.088 7.102 -13.501 1.00 . A A . 30 ARG CZ 1 1 7 3316 1 1 30 ARG H H 0.540 2.094 -9.756 1.00 . A A . 30 ARG H 1 1 7 3317 1 1 30 ARG HA H 2.536 2.810 -11.807 1.00 . A A . 30 ARG HA 1 1 7 3318 1 1 30 ARG HB2 H 0.046 3.816 -10.796 1.00 . A A . 30 ARG HB2 1 1 7 3319 1 1 30 ARG HB3 H 1.271 5.084 -10.681 1.00 . A A . 30 ARG HB3 1 1 7 3320 1 1 30 ARG HD2 H -0.976 4.024 -13.663 1.00 . A A . 30 ARG HD2 1 1 7 3321 1 1 30 ARG HD3 H -1.108 4.965 -12.162 1.00 . A A . 30 ARG HD3 1 1 7 3322 1 1 30 ARG HE H 0.253 6.104 -14.571 1.00 . A A . 30 ARG HE 1 1 7 3323 1 1 30 ARG HG2 H 1.588 5.184 -12.962 1.00 . A A . 30 ARG HG2 1 1 7 3324 1 1 30 ARG HG3 H 1.174 3.486 -13.200 1.00 . A A . 30 ARG HG3 1 1 7 3325 1 1 30 ARG HH11 H 0.194 7.734 -12.098 1.00 . A A . 30 ARG HH11 1 1 7 3326 1 1 30 ARG HH12 H -1.218 8.714 -12.321 1.00 . A A . 30 ARG HH12 1 1 7 3327 1 1 30 ARG HH21 H -2.535 6.712 -14.827 1.00 . A A . 30 ARG HH21 1 1 7 3328 1 1 30 ARG HH22 H -2.761 8.136 -13.868 1.00 . A A . 30 ARG HH22 1 1 7 3329 1 1 30 ARG N N 1.341 1.949 -10.299 1.00 . A A . 30 ARG N 1 1 7 3330 1 1 30 ARG NE N -0.377 6.057 -13.822 1.00 . A A . 30 ARG NE 1 1 7 3331 1 1 30 ARG NH1 N -0.671 7.914 -12.567 1.00 . A A . 30 ARG NH1 1 1 7 3332 1 1 30 ARG NH2 N -2.216 7.335 -14.112 1.00 . A A . 30 ARG NH2 1 1 7 3333 1 1 30 ARG O O 4.235 3.928 -10.288 1.00 . A A . 30 ARG O 1 1 7 3334 1 1 31 MET C C 4.342 5.591 -8.114 1.00 . A A . 31 MET C 1 1 7 3335 1 1 31 MET CA C 3.755 4.251 -7.660 1.00 . A A . 31 MET CA 1 1 7 3336 1 1 31 MET CB C 4.843 3.181 -7.609 1.00 . A A . 31 MET CB 1 1 7 3337 1 1 31 MET CE C 8.255 4.090 -6.415 1.00 . A A . 31 MET CE 1 1 7 3338 1 1 31 MET CG C 5.652 3.336 -6.322 1.00 . A A . 31 MET CG 1 1 7 3339 1 1 31 MET H H 1.868 3.497 -8.383 1.00 . A A . 31 MET H 1 1 7 3340 1 1 31 MET HA H 3.290 4.350 -6.692 1.00 . A A . 31 MET HA 1 1 7 3341 1 1 31 MET HB2 H 4.385 2.202 -7.633 1.00 . A A . 31 MET HB2 1 1 7 3342 1 1 31 MET HB3 H 5.495 3.296 -8.459 1.00 . A A . 31 MET HB3 1 1 7 3343 1 1 31 MET HE1 H 7.936 4.785 -7.179 1.00 . A A . 31 MET HE1 1 1 7 3344 1 1 31 MET HE2 H 9.299 3.860 -6.555 1.00 . A A . 31 MET HE2 1 1 7 3345 1 1 31 MET HE3 H 8.114 4.530 -5.437 1.00 . A A . 31 MET HE3 1 1 7 3346 1 1 31 MET HG2 H 5.774 4.385 -6.096 1.00 . A A . 31 MET HG2 1 1 7 3347 1 1 31 MET HG3 H 5.132 2.851 -5.508 1.00 . A A . 31 MET HG3 1 1 7 3348 1 1 31 MET N N 2.772 3.748 -8.663 1.00 . A A . 31 MET N 1 1 7 3349 1 1 31 MET O O 5.138 5.653 -9.030 1.00 . A A . 31 MET O 1 1 7 3350 1 1 31 MET SD S 7.278 2.573 -6.537 1.00 . A A . 31 MET SD 1 1 7 3351 1 1 32 ALA C C 3.578 9.100 -7.265 1.00 . A A . 32 ALA C 1 1 7 3352 1 1 32 ALA CA C 4.471 8.013 -7.858 1.00 . A A . 32 ALA CA 1 1 7 3353 1 1 32 ALA CB C 4.396 8.068 -9.382 1.00 . A A . 32 ALA CB 1 1 7 3354 1 1 32 ALA H H 3.312 6.582 -6.740 1.00 . A A . 32 ALA H 1 1 7 3355 1 1 32 ALA HA H 5.491 8.135 -7.530 1.00 . A A . 32 ALA HA 1 1 7 3356 1 1 32 ALA HB1 H 5.324 7.712 -9.801 1.00 . A A . 32 ALA HB1 1 1 7 3357 1 1 32 ALA HB2 H 4.226 9.088 -9.695 1.00 . A A . 32 ALA HB2 1 1 7 3358 1 1 32 ALA HB3 H 3.582 7.447 -9.724 1.00 . A A . 32 ALA HB3 1 1 7 3359 1 1 32 ALA N N 3.951 6.664 -7.476 1.00 . A A . 32 ALA N 1 1 7 3360 1 1 32 ALA O O 2.892 9.805 -7.977 1.00 . A A . 32 ALA O 1 1 7 3361 1 1 33 CYS C C 3.519 11.545 -5.069 1.00 . A A . 33 CYS C 1 1 7 3362 1 1 33 CYS CA C 2.704 10.280 -5.359 1.00 . A A . 33 CYS CA 1 1 7 3363 1 1 33 CYS CB C 2.193 9.651 -4.066 1.00 . A A . 33 CYS CB 1 1 7 3364 1 1 33 CYS H H 4.121 8.659 -5.409 1.00 . A A . 33 CYS H 1 1 7 3365 1 1 33 CYS HA H 1.876 10.502 -6.012 1.00 . A A . 33 CYS HA 1 1 7 3366 1 1 33 CYS HB2 H 3.008 9.561 -3.360 1.00 . A A . 33 CYS HB2 1 1 7 3367 1 1 33 CYS HB3 H 1.414 10.272 -3.645 1.00 . A A . 33 CYS HB3 1 1 7 3368 1 1 33 CYS N N 3.569 9.239 -5.973 1.00 . A A . 33 CYS N 1 1 7 3369 1 1 33 CYS O O 4.729 11.493 -4.962 1.00 . A A . 33 CYS O 1 1 7 3370 1 1 33 CYS SG S 1.525 8.010 -4.432 1.00 . A A . 33 CYS SG 1 1 7 3371 1 1 34 PRO C C 3.969 14.002 -3.228 1.00 . A A . 34 PRO C 1 1 7 3372 1 1 34 PRO CA C 3.485 13.943 -4.680 1.00 . A A . 34 PRO CA 1 1 7 3373 1 1 34 PRO CB C 2.381 14.966 -4.927 1.00 . A A . 34 PRO CB 1 1 7 3374 1 1 34 PRO CD C 1.367 12.777 -5.073 1.00 . A A . 34 PRO CD 1 1 7 3375 1 1 34 PRO CG C 1.104 14.217 -4.713 1.00 . A A . 34 PRO CG 1 1 7 3376 1 1 34 PRO HA H 4.301 14.108 -5.363 1.00 . A A . 34 PRO HA 1 1 7 3377 1 1 34 PRO HB2 H 2.463 15.783 -4.224 1.00 . A A . 34 PRO HB2 1 1 7 3378 1 1 34 PRO HB3 H 2.427 15.333 -5.940 1.00 . A A . 34 PRO HB3 1 1 7 3379 1 1 34 PRO HD2 H 0.864 12.117 -4.378 1.00 . A A . 34 PRO HD2 1 1 7 3380 1 1 34 PRO HD3 H 1.055 12.576 -6.087 1.00 . A A . 34 PRO HD3 1 1 7 3381 1 1 34 PRO HG2 H 0.803 14.292 -3.677 1.00 . A A . 34 PRO HG2 1 1 7 3382 1 1 34 PRO HG3 H 0.331 14.616 -5.352 1.00 . A A . 34 PRO HG3 1 1 7 3383 1 1 34 PRO N N 2.822 12.643 -4.956 1.00 . A A . 34 PRO N 1 1 7 3384 1 1 34 PRO O O 4.745 14.860 -2.858 1.00 . A A . 34 PRO O 1 1 7 3385 1 1 35 GLN C C 5.340 12.476 -0.844 1.00 . A A . 35 GLN C 1 1 7 3386 1 1 35 GLN CA C 3.951 13.109 -0.978 1.00 . A A . 35 GLN CA 1 1 7 3387 1 1 35 GLN CB C 2.906 12.271 -0.240 1.00 . A A . 35 GLN CB 1 1 7 3388 1 1 35 GLN CD C 2.024 12.411 2.094 1.00 . A A . 35 GLN CD 1 1 7 3389 1 1 35 GLN CG C 3.274 12.180 1.242 1.00 . A A . 35 GLN CG 1 1 7 3390 1 1 35 GLN H H 2.889 12.416 -2.721 1.00 . A A . 35 GLN H 1 1 7 3391 1 1 35 GLN HA H 3.956 14.115 -0.592 1.00 . A A . 35 GLN HA 1 1 7 3392 1 1 35 GLN HB2 H 1.935 12.736 -0.343 1.00 . A A . 35 GLN HB2 1 1 7 3393 1 1 35 GLN HB3 H 2.877 11.278 -0.663 1.00 . A A . 35 GLN HB3 1 1 7 3394 1 1 35 GLN HE21 H 2.996 12.260 3.819 1.00 . A A . 35 GLN HE21 1 1 7 3395 1 1 35 GLN HE22 H 1.330 12.556 3.949 1.00 . A A . 35 GLN HE22 1 1 7 3396 1 1 35 GLN HG2 H 3.678 11.200 1.453 1.00 . A A . 35 GLN HG2 1 1 7 3397 1 1 35 GLN HG3 H 4.011 12.932 1.478 1.00 . A A . 35 GLN HG3 1 1 7 3398 1 1 35 GLN N N 3.516 13.099 -2.404 1.00 . A A . 35 GLN N 1 1 7 3399 1 1 35 GLN NE2 N 2.125 12.408 3.394 1.00 . A A . 35 GLN NE2 1 1 7 3400 1 1 35 GLN O O 5.558 11.442 -1.451 1.00 . A A . 35 GLN O 1 1 7 3401 1 1 35 GLN OXT O 6.160 13.039 -0.136 1.00 . A A . 35 GLN OXT 1 1 7 3402 1 1 35 GLN OE1 O 0.944 12.596 1.569 1.00 . A A . 35 GLN OE1 1 1 8 3403 1 1 1 GLU C C 4.179 2.698 4.570 1.00 . A A . 1 GLU C 1 1 8 3404 1 1 1 GLU CA C 5.274 3.670 5.015 1.00 . A A . 1 GLU CA 1 1 8 3405 1 1 1 GLU CB C 5.303 3.780 6.539 1.00 . A A . 1 GLU CB 1 1 8 3406 1 1 1 GLU CD C 7.790 3.951 6.388 1.00 . A A . 1 GLU CD 1 1 8 3407 1 1 1 GLU CG C 6.627 3.223 7.064 1.00 . A A . 1 GLU CG 1 1 8 3408 1 1 1 GLU H1 H 5.414 5.743 5.160 1.00 . A A . 1 GLU H1 1 1 8 3409 1 1 1 GLU H2 H 3.933 5.191 4.538 1.00 . A A . 1 GLU H2 1 1 8 3410 1 1 1 GLU H3 H 5.328 5.166 3.567 1.00 . A A . 1 GLU H3 1 1 8 3411 1 1 1 GLU HA H 6.235 3.349 4.649 1.00 . A A . 1 GLU HA 1 1 8 3412 1 1 1 GLU HB2 H 5.206 4.816 6.826 1.00 . A A . 1 GLU HB2 1 1 8 3413 1 1 1 GLU HB3 H 4.485 3.212 6.958 1.00 . A A . 1 GLU HB3 1 1 8 3414 1 1 1 GLU HG2 H 6.681 3.372 8.133 1.00 . A A . 1 GLU HG2 1 1 8 3415 1 1 1 GLU HG3 H 6.687 2.169 6.844 1.00 . A A . 1 GLU HG3 1 1 8 3416 1 1 1 GLU N N 4.963 5.047 4.534 1.00 . A A . 1 GLU N 1 1 8 3417 1 1 1 GLU O O 3.413 2.980 3.671 1.00 . A A . 1 GLU O 1 1 8 3418 1 1 1 GLU OE1 O 8.219 4.962 6.918 1.00 . A A . 1 GLU OE1 1 1 8 3419 1 1 1 GLU OE2 O 8.231 3.484 5.351 1.00 . A A . 1 GLU OE2 1 1 8 3420 1 1 2 VAL C C 2.572 -0.208 6.033 1.00 . A A . 2 VAL C 1 1 8 3421 1 1 2 VAL CA C 3.053 0.567 4.805 1.00 . A A . 2 VAL CA 1 1 8 3422 1 1 2 VAL CB C 3.740 -0.361 3.797 1.00 . A A . 2 VAL CB 1 1 8 3423 1 1 2 VAL CG1 C 3.040 -1.725 3.772 1.00 . A A . 2 VAL CG1 1 1 8 3424 1 1 2 VAL CG2 C 3.661 0.269 2.408 1.00 . A A . 2 VAL CG2 1 1 8 3425 1 1 2 VAL H H 4.726 1.345 5.917 1.00 . A A . 2 VAL H 1 1 8 3426 1 1 2 VAL HA H 2.225 1.070 4.333 1.00 . A A . 2 VAL HA 1 1 8 3427 1 1 2 VAL HB H 4.775 -0.493 4.077 1.00 . A A . 2 VAL HB 1 1 8 3428 1 1 2 VAL HG11 H 3.536 -2.395 4.457 1.00 . A A . 2 VAL HG11 1 1 8 3429 1 1 2 VAL HG12 H 3.084 -2.133 2.772 1.00 . A A . 2 VAL HG12 1 1 8 3430 1 1 2 VAL HG13 H 2.008 -1.605 4.067 1.00 . A A . 2 VAL HG13 1 1 8 3431 1 1 2 VAL HG21 H 4.394 1.058 2.329 1.00 . A A . 2 VAL HG21 1 1 8 3432 1 1 2 VAL HG22 H 2.674 0.679 2.255 1.00 . A A . 2 VAL HG22 1 1 8 3433 1 1 2 VAL HG23 H 3.858 -0.483 1.659 1.00 . A A . 2 VAL HG23 1 1 8 3434 1 1 2 VAL N N 4.100 1.555 5.194 1.00 . A A . 2 VAL N 1 1 8 3435 1 1 2 VAL O O 3.108 -1.242 6.379 1.00 . A A . 2 VAL O 1 1 8 3436 1 1 3 THR C C -0.157 -1.315 7.455 1.00 . A A . 3 THR C 1 1 8 3437 1 1 3 THR CA C 1.024 -0.438 7.878 1.00 . A A . 3 THR CA 1 1 8 3438 1 1 3 THR CB C 0.568 0.663 8.837 1.00 . A A . 3 THR CB 1 1 8 3439 1 1 3 THR CG2 C 1.680 1.702 8.992 1.00 . A A . 3 THR CG2 1 1 8 3440 1 1 3 THR H H 1.130 1.106 6.381 1.00 . A A . 3 THR H 1 1 8 3441 1 1 3 THR HA H 1.797 -1.036 8.335 1.00 . A A . 3 THR HA 1 1 8 3442 1 1 3 THR HB H 0.348 0.232 9.801 1.00 . A A . 3 THR HB 1 1 8 3443 1 1 3 THR HG1 H -1.362 0.893 8.746 1.00 . A A . 3 THR HG1 1 1 8 3444 1 1 3 THR HG21 H 1.918 1.820 10.038 1.00 . A A . 3 THR HG21 1 1 8 3445 1 1 3 THR HG22 H 1.347 2.647 8.588 1.00 . A A . 3 THR HG22 1 1 8 3446 1 1 3 THR HG23 H 2.557 1.370 8.457 1.00 . A A . 3 THR HG23 1 1 8 3447 1 1 3 THR N N 1.554 0.277 6.684 1.00 . A A . 3 THR N 1 1 8 3448 1 1 3 THR O O -0.932 -1.771 8.271 1.00 . A A . 3 THR O 1 1 8 3449 1 1 3 THR OG1 O -0.598 1.288 8.318 1.00 . A A . 3 THR OG1 1 1 8 3450 1 1 4 CYS C C -1.070 -3.875 5.869 1.00 . A A . 4 CYS C 1 1 8 3451 1 1 4 CYS CA C -1.416 -2.391 5.678 1.00 . A A . 4 CYS CA 1 1 8 3452 1 1 4 CYS CB C -1.547 -1.989 4.192 1.00 . A A . 4 CYS CB 1 1 8 3453 1 1 4 CYS H H 0.349 -1.164 5.541 1.00 . A A . 4 CYS H 1 1 8 3454 1 1 4 CYS HA H -2.325 -2.148 6.206 1.00 . A A . 4 CYS HA 1 1 8 3455 1 1 4 CYS HB2 H -2.430 -1.378 4.069 1.00 . A A . 4 CYS HB2 1 1 8 3456 1 1 4 CYS HB3 H -0.677 -1.410 3.908 1.00 . A A . 4 CYS HB3 1 1 8 3457 1 1 4 CYS N N -0.292 -1.547 6.178 1.00 . A A . 4 CYS N 1 1 8 3458 1 1 4 CYS O O 0.019 -4.220 6.285 1.00 . A A . 4 CYS O 1 1 8 3459 1 1 4 CYS SG S -1.683 -3.436 3.098 1.00 . A A . 4 CYS SG 1 1 8 3460 1 1 5 GLU C C -0.761 -6.677 4.614 1.00 . A A . 5 GLU C 1 1 8 3461 1 1 5 GLU CA C -1.702 -6.209 5.725 1.00 . A A . 5 GLU CA 1 1 8 3462 1 1 5 GLU CB C -3.064 -6.896 5.602 1.00 . A A . 5 GLU CB 1 1 8 3463 1 1 5 GLU CD C -4.374 -8.875 6.389 1.00 . A A . 5 GLU CD 1 1 8 3464 1 1 5 GLU CG C -2.969 -8.321 6.151 1.00 . A A . 5 GLU CG 1 1 8 3465 1 1 5 GLU H H -2.855 -4.460 5.223 1.00 . A A . 5 GLU H 1 1 8 3466 1 1 5 GLU HA H -1.273 -6.407 6.694 1.00 . A A . 5 GLU HA 1 1 8 3467 1 1 5 GLU HB2 H -3.799 -6.340 6.168 1.00 . A A . 5 GLU HB2 1 1 8 3468 1 1 5 GLU HB3 H -3.357 -6.930 4.564 1.00 . A A . 5 GLU HB3 1 1 8 3469 1 1 5 GLU HG2 H -2.450 -8.947 5.439 1.00 . A A . 5 GLU HG2 1 1 8 3470 1 1 5 GLU HG3 H -2.425 -8.312 7.084 1.00 . A A . 5 GLU HG3 1 1 8 3471 1 1 5 GLU N N -1.985 -4.755 5.565 1.00 . A A . 5 GLU N 1 1 8 3472 1 1 5 GLU O O -0.985 -6.396 3.453 1.00 . A A . 5 GLU O 1 1 8 3473 1 1 5 GLU OE1 O -4.929 -8.599 7.440 1.00 . A A . 5 GLU OE1 1 1 8 3474 1 1 5 GLU OE2 O -4.873 -9.568 5.517 1.00 . A A . 5 GLU OE2 1 1 8 3475 1 1 6 PRO C C 0.606 -8.946 3.124 1.00 . A A . 6 PRO C 1 1 8 3476 1 1 6 PRO CA C 1.254 -7.893 4.027 1.00 . A A . 6 PRO CA 1 1 8 3477 1 1 6 PRO CB C 2.347 -8.499 4.907 1.00 . A A . 6 PRO CB 1 1 8 3478 1 1 6 PRO CD C 0.597 -7.773 6.380 1.00 . A A . 6 PRO CD 1 1 8 3479 1 1 6 PRO CG C 1.663 -8.819 6.195 1.00 . A A . 6 PRO CG 1 1 8 3480 1 1 6 PRO HA H 1.659 -7.085 3.438 1.00 . A A . 6 PRO HA 1 1 8 3481 1 1 6 PRO HB2 H 2.740 -9.397 4.453 1.00 . A A . 6 PRO HB2 1 1 8 3482 1 1 6 PRO HB3 H 3.137 -7.784 5.075 1.00 . A A . 6 PRO HB3 1 1 8 3483 1 1 6 PRO HD2 H -0.266 -8.193 6.880 1.00 . A A . 6 PRO HD2 1 1 8 3484 1 1 6 PRO HD3 H 0.984 -6.925 6.925 1.00 . A A . 6 PRO HD3 1 1 8 3485 1 1 6 PRO HG2 H 1.217 -9.804 6.144 1.00 . A A . 6 PRO HG2 1 1 8 3486 1 1 6 PRO HG3 H 2.368 -8.770 7.013 1.00 . A A . 6 PRO HG3 1 1 8 3487 1 1 6 PRO N N 0.265 -7.381 5.006 1.00 . A A . 6 PRO N 1 1 8 3488 1 1 6 PRO O O 0.258 -10.025 3.560 1.00 . A A . 6 PRO O 1 1 8 3489 1 1 7 GLY C C -1.709 -9.350 0.884 1.00 . A A . 7 GLY C 1 1 8 3490 1 1 7 GLY CA C -0.202 -9.605 0.933 1.00 . A A . 7 GLY CA 1 1 8 3491 1 1 7 GLY H H 0.716 -7.753 1.538 1.00 . A A . 7 GLY H 1 1 8 3492 1 1 7 GLY HA2 H 0.220 -9.481 -0.056 1.00 . A A . 7 GLY HA2 1 1 8 3493 1 1 7 GLY HA3 H -0.020 -10.611 1.283 1.00 . A A . 7 GLY HA3 1 1 8 3494 1 1 7 GLY N N 0.433 -8.633 1.867 1.00 . A A . 7 GLY N 1 1 8 3495 1 1 7 GLY O O -2.503 -10.208 1.214 1.00 . A A . 7 GLY O 1 1 8 3496 1 1 8 THR C C -3.865 -6.805 -0.638 1.00 . A A . 8 THR C 1 1 8 3497 1 1 8 THR CA C -3.575 -7.873 0.416 1.00 . A A . 8 THR CA 1 1 8 3498 1 1 8 THR CB C -3.933 -7.373 1.817 1.00 . A A . 8 THR CB 1 1 8 3499 1 1 8 THR CG2 C -5.264 -6.617 1.777 1.00 . A A . 8 THR CG2 1 1 8 3500 1 1 8 THR H H -1.456 -7.493 0.217 1.00 . A A . 8 THR H 1 1 8 3501 1 1 8 THR HA H -4.134 -8.765 0.192 1.00 . A A . 8 THR HA 1 1 8 3502 1 1 8 THR HB H -3.159 -6.709 2.171 1.00 . A A . 8 THR HB 1 1 8 3503 1 1 8 THR HG1 H -3.332 -8.429 3.336 1.00 . A A . 8 THR HG1 1 1 8 3504 1 1 8 THR HG21 H -5.167 -5.753 1.137 1.00 . A A . 8 THR HG21 1 1 8 3505 1 1 8 THR HG22 H -5.527 -6.300 2.775 1.00 . A A . 8 THR HG22 1 1 8 3506 1 1 8 THR HG23 H -6.035 -7.267 1.391 1.00 . A A . 8 THR HG23 1 1 8 3507 1 1 8 THR N N -2.113 -8.175 0.478 1.00 . A A . 8 THR N 1 1 8 3508 1 1 8 THR O O -4.895 -6.833 -1.272 1.00 . A A . 8 THR O 1 1 8 3509 1 1 8 THR OG1 O -4.047 -8.482 2.697 1.00 . A A . 8 THR OG1 1 1 8 3510 1 1 9 THR C C -4.196 -3.763 -1.328 1.00 . A A . 9 THR C 1 1 8 3511 1 1 9 THR CA C -3.187 -4.797 -1.843 1.00 . A A . 9 THR CA 1 1 8 3512 1 1 9 THR CB C -3.683 -5.523 -3.113 1.00 . A A . 9 THR CB 1 1 8 3513 1 1 9 THR CG2 C -5.198 -5.360 -3.296 1.00 . A A . 9 THR CG2 1 1 8 3514 1 1 9 THR H H -2.145 -5.875 -0.298 1.00 . A A . 9 THR H 1 1 8 3515 1 1 9 THR HA H -2.253 -4.309 -2.056 1.00 . A A . 9 THR HA 1 1 8 3516 1 1 9 THR HB H -3.449 -6.574 -3.034 1.00 . A A . 9 THR HB 1 1 8 3517 1 1 9 THR HG1 H -3.603 -5.069 -5.002 1.00 . A A . 9 THR HG1 1 1 8 3518 1 1 9 THR HG21 H -5.671 -5.243 -2.331 1.00 . A A . 9 THR HG21 1 1 8 3519 1 1 9 THR HG22 H -5.596 -6.238 -3.784 1.00 . A A . 9 THR HG22 1 1 8 3520 1 1 9 THR HG23 H -5.396 -4.490 -3.902 1.00 . A A . 9 THR HG23 1 1 8 3521 1 1 9 THR N N -2.968 -5.872 -0.827 1.00 . A A . 9 THR N 1 1 8 3522 1 1 9 THR O O -5.137 -4.089 -0.631 1.00 . A A . 9 THR O 1 1 8 3523 1 1 9 THR OG1 O -3.018 -4.983 -4.245 1.00 . A A . 9 THR OG1 1 1 8 3524 1 1 10 PHE C C -4.482 -0.090 -1.740 1.00 . A A . 10 PHE C 1 1 8 3525 1 1 10 PHE CA C -4.928 -1.451 -1.198 1.00 . A A . 10 PHE CA 1 1 8 3526 1 1 10 PHE CB C -4.814 -1.471 0.326 1.00 . A A . 10 PHE CB 1 1 8 3527 1 1 10 PHE CD1 C -2.343 -1.884 0.593 1.00 . A A . 10 PHE CD1 1 1 8 3528 1 1 10 PHE CD2 C -3.240 0.281 1.222 1.00 . A A . 10 PHE CD2 1 1 8 3529 1 1 10 PHE CE1 C -1.060 -1.458 0.958 1.00 . A A . 10 PHE CE1 1 1 8 3530 1 1 10 PHE CE2 C -1.956 0.706 1.586 1.00 . A A . 10 PHE CE2 1 1 8 3531 1 1 10 PHE CG C -3.432 -1.014 0.726 1.00 . A A . 10 PHE CG 1 1 8 3532 1 1 10 PHE CZ C -0.867 -0.164 1.454 1.00 . A A . 10 PHE CZ 1 1 8 3533 1 1 10 PHE H H -3.227 -2.281 -2.226 1.00 . A A . 10 PHE H 1 1 8 3534 1 1 10 PHE HA H -5.940 -1.668 -1.499 1.00 . A A . 10 PHE HA 1 1 8 3535 1 1 10 PHE HB2 H -5.552 -0.807 0.752 1.00 . A A . 10 PHE HB2 1 1 8 3536 1 1 10 PHE HB3 H -4.980 -2.474 0.689 1.00 . A A . 10 PHE HB3 1 1 8 3537 1 1 10 PHE HD1 H -2.493 -2.882 0.210 1.00 . A A . 10 PHE HD1 1 1 8 3538 1 1 10 PHE HD2 H -4.081 0.951 1.325 1.00 . A A . 10 PHE HD2 1 1 8 3539 1 1 10 PHE HE1 H -0.220 -2.129 0.856 1.00 . A A . 10 PHE HE1 1 1 8 3540 1 1 10 PHE HE2 H -1.807 1.705 1.968 1.00 . A A . 10 PHE HE2 1 1 8 3541 1 1 10 PHE HZ H 0.123 0.165 1.734 1.00 . A A . 10 PHE HZ 1 1 8 3542 1 1 10 PHE N N -3.996 -2.516 -1.666 1.00 . A A . 10 PHE N 1 1 8 3543 1 1 10 PHE O O -3.341 0.095 -2.114 1.00 . A A . 10 PHE O 1 1 8 3544 1 1 11 LYS C C -4.520 3.098 -1.125 1.00 . A A . 11 LYS C 1 1 8 3545 1 1 11 LYS CA C -4.985 2.214 -2.287 1.00 . A A . 11 LYS CA 1 1 8 3546 1 1 11 LYS CB C -6.256 2.776 -2.921 1.00 . A A . 11 LYS CB 1 1 8 3547 1 1 11 LYS CD C -6.469 5.233 -2.542 1.00 . A A . 11 LYS CD 1 1 8 3548 1 1 11 LYS CE C -7.881 5.662 -2.946 1.00 . A A . 11 LYS CE 1 1 8 3549 1 1 11 LYS CG C -5.965 4.159 -3.505 1.00 . A A . 11 LYS CG 1 1 8 3550 1 1 11 LYS H H -6.282 0.702 -1.466 1.00 . A A . 11 LYS H 1 1 8 3551 1 1 11 LYS HA H -4.208 2.129 -3.030 1.00 . A A . 11 LYS HA 1 1 8 3552 1 1 11 LYS HB2 H -6.589 2.114 -3.708 1.00 . A A . 11 LYS HB2 1 1 8 3553 1 1 11 LYS HB3 H -7.028 2.859 -2.170 1.00 . A A . 11 LYS HB3 1 1 8 3554 1 1 11 LYS HD2 H -6.488 4.834 -1.538 1.00 . A A . 11 LYS HD2 1 1 8 3555 1 1 11 LYS HD3 H -5.812 6.089 -2.578 1.00 . A A . 11 LYS HD3 1 1 8 3556 1 1 11 LYS HE2 H -7.851 6.614 -3.459 1.00 . A A . 11 LYS HE2 1 1 8 3557 1 1 11 LYS HE3 H -8.339 4.911 -3.571 1.00 . A A . 11 LYS HE3 1 1 8 3558 1 1 11 LYS HG2 H -4.900 4.272 -3.645 1.00 . A A . 11 LYS HG2 1 1 8 3559 1 1 11 LYS HG3 H -6.468 4.264 -4.454 1.00 . A A . 11 LYS HG3 1 1 8 3560 1 1 11 LYS HZ1 H -9.648 5.733 -1.848 1.00 . A A . 11 LYS HZ1 1 1 8 3561 1 1 11 LYS HZ2 H -8.397 6.693 -1.213 1.00 . A A . 11 LYS HZ2 1 1 8 3562 1 1 11 LYS HZ3 H -8.353 5.005 -1.029 1.00 . A A . 11 LYS HZ3 1 1 8 3563 1 1 11 LYS N N -5.368 0.867 -1.777 1.00 . A A . 11 LYS N 1 1 8 3564 1 1 11 LYS NZ N -8.626 5.782 -1.662 1.00 . A A . 11 LYS NZ 1 1 8 3565 1 1 11 LYS O O -5.061 3.047 -0.039 1.00 . A A . 11 LYS O 1 1 8 3566 1 1 12 ASP C C -2.893 6.226 -0.730 1.00 . A A . 12 ASP C 1 1 8 3567 1 1 12 ASP CA C -3.017 4.783 -0.242 1.00 . A A . 12 ASP CA 1 1 8 3568 1 1 12 ASP CB C -1.643 4.220 0.120 1.00 . A A . 12 ASP CB 1 1 8 3569 1 1 12 ASP CG C -1.056 5.018 1.286 1.00 . A A . 12 ASP CG 1 1 8 3570 1 1 12 ASP H H -3.087 3.929 -2.222 1.00 . A A . 12 ASP H 1 1 8 3571 1 1 12 ASP HA H -3.672 4.729 0.608 1.00 . A A . 12 ASP HA 1 1 8 3572 1 1 12 ASP HB2 H -1.742 3.182 0.407 1.00 . A A . 12 ASP HB2 1 1 8 3573 1 1 12 ASP HB3 H -0.985 4.299 -0.734 1.00 . A A . 12 ASP HB3 1 1 8 3574 1 1 12 ASP N N -3.515 3.904 -1.340 1.00 . A A . 12 ASP N 1 1 8 3575 1 1 12 ASP O O -3.305 7.157 -0.065 1.00 . A A . 12 ASP O 1 1 8 3576 1 1 12 ASP OD1 O -1.354 6.197 1.381 1.00 . A A . 12 ASP OD1 1 1 8 3577 1 1 12 ASP OD2 O -0.318 4.436 2.065 1.00 . A A . 12 ASP OD2 1 1 8 3578 1 1 13 LYS C C -2.784 7.892 -3.824 1.00 . A A . 13 LYS C 1 1 8 3579 1 1 13 LYS CA C -2.167 7.800 -2.422 1.00 . A A . 13 LYS CA 1 1 8 3580 1 1 13 LYS CB C -0.655 8.030 -2.463 1.00 . A A . 13 LYS CB 1 1 8 3581 1 1 13 LYS CD C 0.717 9.139 -0.694 1.00 . A A . 13 LYS CD 1 1 8 3582 1 1 13 LYS CE C 2.156 8.986 -1.193 1.00 . A A . 13 LYS CE 1 1 8 3583 1 1 13 LYS CG C -0.083 7.886 -1.053 1.00 . A A . 13 LYS CG 1 1 8 3584 1 1 13 LYS H H -2.000 5.651 -2.399 1.00 . A A . 13 LYS H 1 1 8 3585 1 1 13 LYS HA H -2.630 8.515 -1.760 1.00 . A A . 13 LYS HA 1 1 8 3586 1 1 13 LYS HB2 H -0.196 7.297 -3.115 1.00 . A A . 13 LYS HB2 1 1 8 3587 1 1 13 LYS HB3 H -0.451 9.025 -2.834 1.00 . A A . 13 LYS HB3 1 1 8 3588 1 1 13 LYS HD2 H 0.263 10.001 -1.161 1.00 . A A . 13 LYS HD2 1 1 8 3589 1 1 13 LYS HD3 H 0.721 9.269 0.378 1.00 . A A . 13 LYS HD3 1 1 8 3590 1 1 13 LYS HE2 H 2.166 8.829 -2.263 1.00 . A A . 13 LYS HE2 1 1 8 3591 1 1 13 LYS HE3 H 2.739 9.854 -0.932 1.00 . A A . 13 LYS HE3 1 1 8 3592 1 1 13 LYS HG2 H -0.892 7.761 -0.347 1.00 . A A . 13 LYS HG2 1 1 8 3593 1 1 13 LYS HG3 H 0.565 7.023 -1.013 1.00 . A A . 13 LYS HG3 1 1 8 3594 1 1 13 LYS HZ1 H 3.715 7.861 -0.397 1.00 . A A . 13 LYS HZ1 1 1 8 3595 1 1 13 LYS HZ2 H 2.440 6.930 -1.026 1.00 . A A . 13 LYS HZ2 1 1 8 3596 1 1 13 LYS HZ3 H 2.260 7.728 0.463 1.00 . A A . 13 LYS HZ3 1 1 8 3597 1 1 13 LYS N N -2.325 6.418 -1.885 1.00 . A A . 13 LYS N 1 1 8 3598 1 1 13 LYS NZ N 2.683 7.786 -0.484 1.00 . A A . 13 LYS NZ 1 1 8 3599 1 1 13 LYS O O -3.980 8.046 -3.972 1.00 . A A . 13 LYS O 1 1 8 3600 1 1 14 CYS C C -2.379 6.511 -6.924 1.00 . A A . 14 CYS C 1 1 8 3601 1 1 14 CYS CA C -2.545 7.864 -6.235 1.00 . A A . 14 CYS CA 1 1 8 3602 1 1 14 CYS CB C -1.720 8.941 -6.939 1.00 . A A . 14 CYS CB 1 1 8 3603 1 1 14 CYS H H -1.025 7.660 -4.725 1.00 . A A . 14 CYS H 1 1 8 3604 1 1 14 CYS HA H -3.584 8.151 -6.208 1.00 . A A . 14 CYS HA 1 1 8 3605 1 1 14 CYS HB2 H -0.718 8.949 -6.535 1.00 . A A . 14 CYS HB2 1 1 8 3606 1 1 14 CYS HB3 H -1.681 8.736 -7.996 1.00 . A A . 14 CYS HB3 1 1 8 3607 1 1 14 CYS N N -1.987 7.791 -4.855 1.00 . A A . 14 CYS N 1 1 8 3608 1 1 14 CYS O O -2.510 6.390 -8.127 1.00 . A A . 14 CYS O 1 1 8 3609 1 1 14 CYS SG S -2.493 10.554 -6.666 1.00 . A A . 14 CYS SG 1 1 8 3610 1 1 15 ASN C C -2.366 3.074 -5.745 1.00 . A A . 15 ASN C 1 1 8 3611 1 1 15 ASN CA C -1.916 4.134 -6.756 1.00 . A A . 15 ASN CA 1 1 8 3612 1 1 15 ASN CB C -0.412 3.970 -7.071 1.00 . A A . 15 ASN CB 1 1 8 3613 1 1 15 ASN CG C 0.383 5.236 -6.715 1.00 . A A . 15 ASN CG 1 1 8 3614 1 1 15 ASN H H -1.994 5.618 -5.196 1.00 . A A . 15 ASN H 1 1 8 3615 1 1 15 ASN HA H -2.492 4.049 -7.666 1.00 . A A . 15 ASN HA 1 1 8 3616 1 1 15 ASN HB2 H -0.020 3.140 -6.501 1.00 . A A . 15 ASN HB2 1 1 8 3617 1 1 15 ASN HB3 H -0.293 3.763 -8.126 1.00 . A A . 15 ASN HB3 1 1 8 3618 1 1 15 ASN HD21 H 1.532 4.308 -5.384 1.00 . A A . 15 ASN HD21 1 1 8 3619 1 1 15 ASN HD22 H 1.845 5.973 -5.587 1.00 . A A . 15 ASN HD22 1 1 8 3620 1 1 15 ASN N N -2.091 5.491 -6.163 1.00 . A A . 15 ASN N 1 1 8 3621 1 1 15 ASN ND2 N 1.331 5.167 -5.822 1.00 . A A . 15 ASN ND2 1 1 8 3622 1 1 15 ASN O O -3.057 3.370 -4.791 1.00 . A A . 15 ASN O 1 1 8 3623 1 1 15 ASN OD1 O 0.142 6.295 -7.260 1.00 . A A . 15 ASN OD1 1 1 8 3624 1 1 16 THR C C -1.175 -0.044 -4.555 1.00 . A A . 16 THR C 1 1 8 3625 1 1 16 THR CA C -2.395 0.773 -4.985 1.00 . A A . 16 THR CA 1 1 8 3626 1 1 16 THR CB C -3.373 -0.104 -5.765 1.00 . A A . 16 THR CB 1 1 8 3627 1 1 16 THR CG2 C -3.570 -1.424 -5.022 1.00 . A A . 16 THR CG2 1 1 8 3628 1 1 16 THR H H -1.427 1.621 -6.717 1.00 . A A . 16 THR H 1 1 8 3629 1 1 16 THR HA H -2.886 1.202 -4.127 1.00 . A A . 16 THR HA 1 1 8 3630 1 1 16 THR HB H -2.973 -0.304 -6.747 1.00 . A A . 16 THR HB 1 1 8 3631 1 1 16 THR HG1 H -4.469 1.378 -6.378 1.00 . A A . 16 THR HG1 1 1 8 3632 1 1 16 THR HG21 H -2.803 -2.124 -5.320 1.00 . A A . 16 THR HG21 1 1 8 3633 1 1 16 THR HG22 H -4.541 -1.830 -5.262 1.00 . A A . 16 THR HG22 1 1 8 3634 1 1 16 THR HG23 H -3.504 -1.250 -3.958 1.00 . A A . 16 THR HG23 1 1 8 3635 1 1 16 THR N N -1.983 1.843 -5.943 1.00 . A A . 16 THR N 1 1 8 3636 1 1 16 THR O O -0.411 -0.504 -5.376 1.00 . A A . 16 THR O 1 1 8 3637 1 1 16 THR OG1 O -4.617 0.568 -5.884 1.00 . A A . 16 THR OG1 1 1 8 3638 1 1 17 CYS C C -0.209 -2.464 -2.500 1.00 . A A . 17 CYS C 1 1 8 3639 1 1 17 CYS CA C 0.189 -1.016 -2.793 1.00 . A A . 17 CYS CA 1 1 8 3640 1 1 17 CYS CB C 0.631 -0.316 -1.509 1.00 . A A . 17 CYS CB 1 1 8 3641 1 1 17 CYS H H -1.619 0.150 -2.629 1.00 . A A . 17 CYS H 1 1 8 3642 1 1 17 CYS HA H 0.985 -0.984 -3.518 1.00 . A A . 17 CYS HA 1 1 8 3643 1 1 17 CYS HB2 H -0.235 0.091 -1.004 1.00 . A A . 17 CYS HB2 1 1 8 3644 1 1 17 CYS HB3 H 1.123 -1.031 -0.863 1.00 . A A . 17 CYS HB3 1 1 8 3645 1 1 17 CYS N N -0.987 -0.230 -3.274 1.00 . A A . 17 CYS N 1 1 8 3646 1 1 17 CYS O O -1.002 -2.732 -1.622 1.00 . A A . 17 CYS O 1 1 8 3647 1 1 17 CYS SG S 1.783 1.027 -1.903 1.00 . A A . 17 CYS SG 1 1 8 3648 1 1 18 ARG C C 0.360 -5.248 -1.562 1.00 . A A . 18 ARG C 1 1 8 3649 1 1 18 ARG CA C 0.010 -4.834 -2.997 1.00 . A A . 18 ARG CA 1 1 8 3650 1 1 18 ARG CB C 0.880 -5.595 -3.996 1.00 . A A . 18 ARG CB 1 1 8 3651 1 1 18 ARG CD C -0.520 -7.635 -3.672 1.00 . A A . 18 ARG CD 1 1 8 3652 1 1 18 ARG CG C 0.904 -7.077 -3.624 1.00 . A A . 18 ARG CG 1 1 8 3653 1 1 18 ARG CZ C -1.288 -9.415 -5.119 1.00 . A A . 18 ARG CZ 1 1 8 3654 1 1 18 ARG H H 0.987 -3.154 -3.926 1.00 . A A . 18 ARG H 1 1 8 3655 1 1 18 ARG HA H -1.031 -5.019 -3.204 1.00 . A A . 18 ARG HA 1 1 8 3656 1 1 18 ARG HB2 H 0.472 -5.479 -4.991 1.00 . A A . 18 ARG HB2 1 1 8 3657 1 1 18 ARG HB3 H 1.884 -5.203 -3.970 1.00 . A A . 18 ARG HB3 1 1 8 3658 1 1 18 ARG HD2 H -0.927 -7.709 -2.672 1.00 . A A . 18 ARG HD2 1 1 8 3659 1 1 18 ARG HD3 H -1.147 -7.012 -4.290 1.00 . A A . 18 ARG HD3 1 1 8 3660 1 1 18 ARG HE H 0.382 -9.554 -4.052 1.00 . A A . 18 ARG HE 1 1 8 3661 1 1 18 ARG HG2 H 1.528 -7.613 -4.324 1.00 . A A . 18 ARG HG2 1 1 8 3662 1 1 18 ARG HG3 H 1.301 -7.191 -2.627 1.00 . A A . 18 ARG HG3 1 1 8 3663 1 1 18 ARG HH11 H -1.512 -7.641 -6.020 1.00 . A A . 18 ARG HH11 1 1 8 3664 1 1 18 ARG HH12 H -2.501 -8.924 -6.633 1.00 . A A . 18 ARG HH12 1 1 8 3665 1 1 18 ARG HH21 H -1.271 -11.289 -4.414 1.00 . A A . 18 ARG HH21 1 1 8 3666 1 1 18 ARG HH22 H -2.365 -10.990 -5.723 1.00 . A A . 18 ARG HH22 1 1 8 3667 1 1 18 ARG N N 0.345 -3.397 -3.227 1.00 . A A . 18 ARG N 1 1 8 3668 1 1 18 ARG NE N -0.383 -8.986 -4.281 1.00 . A A . 18 ARG NE 1 1 8 3669 1 1 18 ARG NH1 N -1.808 -8.596 -5.993 1.00 . A A . 18 ARG NH1 1 1 8 3670 1 1 18 ARG NH2 N -1.671 -10.663 -5.084 1.00 . A A . 18 ARG NH2 1 1 8 3671 1 1 18 ARG O O -0.031 -6.299 -1.095 1.00 . A A . 18 ARG O 1 1 8 3672 1 1 19 CYS C C 2.349 -6.055 0.517 1.00 . A A . 19 CYS C 1 1 8 3673 1 1 19 CYS CA C 1.504 -4.778 0.527 1.00 . A A . 19 CYS CA 1 1 8 3674 1 1 19 CYS CB C 0.192 -4.988 1.291 1.00 . A A . 19 CYS CB 1 1 8 3675 1 1 19 CYS H H 1.419 -3.605 -1.272 1.00 . A A . 19 CYS H 1 1 8 3676 1 1 19 CYS HA H 2.061 -3.966 0.966 1.00 . A A . 19 CYS HA 1 1 8 3677 1 1 19 CYS HB2 H -0.640 -4.661 0.685 1.00 . A A . 19 CYS HB2 1 1 8 3678 1 1 19 CYS HB3 H 0.076 -6.035 1.528 1.00 . A A . 19 CYS HB3 1 1 8 3679 1 1 19 CYS N N 1.107 -4.436 -0.869 1.00 . A A . 19 CYS N 1 1 8 3680 1 1 19 CYS O O 1.836 -7.153 0.580 1.00 . A A . 19 CYS O 1 1 8 3681 1 1 19 CYS SG S 0.231 -4.025 2.824 1.00 . A A . 19 CYS SG 1 1 8 3682 1 1 20 GLY C C 4.152 -8.072 1.523 1.00 . A A . 20 GLY C 1 1 8 3683 1 1 20 GLY CA C 4.530 -7.114 0.393 1.00 . A A . 20 GLY CA 1 1 8 3684 1 1 20 GLY H H 4.034 -5.018 0.361 1.00 . A A . 20 GLY H 1 1 8 3685 1 1 20 GLY HA2 H 4.419 -7.618 -0.558 1.00 . A A . 20 GLY HA2 1 1 8 3686 1 1 20 GLY HA3 H 5.558 -6.803 0.520 1.00 . A A . 20 GLY HA3 1 1 8 3687 1 1 20 GLY N N 3.644 -5.915 0.422 1.00 . A A . 20 GLY N 1 1 8 3688 1 1 20 GLY O O 3.354 -7.756 2.383 1.00 . A A . 20 GLY O 1 1 8 3689 1 1 21 SER C C 5.317 -10.014 3.803 1.00 . A A . 21 SER C 1 1 8 3690 1 1 21 SER CA C 4.403 -10.233 2.596 1.00 . A A . 21 SER CA 1 1 8 3691 1 1 21 SER CB C 4.670 -11.598 1.963 1.00 . A A . 21 SER CB 1 1 8 3692 1 1 21 SER H H 5.364 -9.480 0.822 1.00 . A A . 21 SER H 1 1 8 3693 1 1 21 SER HA H 3.368 -10.157 2.884 1.00 . A A . 21 SER HA 1 1 8 3694 1 1 21 SER HB2 H 4.560 -12.368 2.707 1.00 . A A . 21 SER HB2 1 1 8 3695 1 1 21 SER HB3 H 3.961 -11.766 1.165 1.00 . A A . 21 SER HB3 1 1 8 3696 1 1 21 SER HG H 5.963 -11.972 0.557 1.00 . A A . 21 SER HG 1 1 8 3697 1 1 21 SER N N 4.723 -9.247 1.526 1.00 . A A . 21 SER N 1 1 8 3698 1 1 21 SER O O 5.420 -10.851 4.678 1.00 . A A . 21 SER O 1 1 8 3699 1 1 21 SER OG O 5.996 -11.626 1.453 1.00 . A A . 21 SER OG 1 1 8 3700 1 1 22 ASP C C 6.133 -7.937 6.137 1.00 . A A . 22 ASP C 1 1 8 3701 1 1 22 ASP CA C 6.896 -8.622 5.002 1.00 . A A . 22 ASP CA 1 1 8 3702 1 1 22 ASP CB C 7.974 -7.696 4.439 1.00 . A A . 22 ASP CB 1 1 8 3703 1 1 22 ASP CG C 8.560 -8.308 3.164 1.00 . A A . 22 ASP CG 1 1 8 3704 1 1 22 ASP H H 5.890 -8.234 3.137 1.00 . A A . 22 ASP H 1 1 8 3705 1 1 22 ASP HA H 7.345 -9.538 5.350 1.00 . A A . 22 ASP HA 1 1 8 3706 1 1 22 ASP HB2 H 7.539 -6.733 4.210 1.00 . A A . 22 ASP HB2 1 1 8 3707 1 1 22 ASP HB3 H 8.761 -7.572 5.171 1.00 . A A . 22 ASP HB3 1 1 8 3708 1 1 22 ASP N N 5.986 -8.895 3.855 1.00 . A A . 22 ASP N 1 1 8 3709 1 1 22 ASP O O 6.397 -8.165 7.301 1.00 . A A . 22 ASP O 1 1 8 3710 1 1 22 ASP OD1 O 7.803 -8.519 2.231 1.00 . A A . 22 ASP OD1 1 1 8 3711 1 1 22 ASP OD2 O 9.755 -8.553 3.143 1.00 . A A . 22 ASP OD2 1 1 8 3712 1 1 23 GLY C C 4.532 -4.889 6.694 1.00 . A A . 23 GLY C 1 1 8 3713 1 1 23 GLY CA C 4.408 -6.402 6.875 1.00 . A A . 23 GLY CA 1 1 8 3714 1 1 23 GLY H H 4.987 -6.929 4.866 1.00 . A A . 23 GLY H 1 1 8 3715 1 1 23 GLY HA2 H 3.367 -6.690 6.807 1.00 . A A . 23 GLY HA2 1 1 8 3716 1 1 23 GLY HA3 H 4.798 -6.678 7.844 1.00 . A A . 23 GLY HA3 1 1 8 3717 1 1 23 GLY N N 5.186 -7.099 5.810 1.00 . A A . 23 GLY N 1 1 8 3718 1 1 23 GLY O O 3.660 -4.135 7.074 1.00 . A A . 23 GLY O 1 1 8 3719 1 1 24 LYS C C 6.647 -2.724 4.666 1.00 . A A . 24 LYS C 1 1 8 3720 1 1 24 LYS CA C 5.792 -2.975 5.909 1.00 . A A . 24 LYS CA 1 1 8 3721 1 1 24 LYS CB C 6.513 -2.481 7.164 1.00 . A A . 24 LYS CB 1 1 8 3722 1 1 24 LYS CD C 6.411 -0.838 9.043 1.00 . A A . 24 LYS CD 1 1 8 3723 1 1 24 LYS CE C 6.306 0.685 8.938 1.00 . A A . 24 LYS CE 1 1 8 3724 1 1 24 LYS CG C 5.619 -1.484 7.903 1.00 . A A . 24 LYS CG 1 1 8 3725 1 1 24 LYS H H 6.303 -5.067 5.817 1.00 . A A . 24 LYS H 1 1 8 3726 1 1 24 LYS HA H 4.837 -2.486 5.815 1.00 . A A . 24 LYS HA 1 1 8 3727 1 1 24 LYS HB2 H 6.728 -3.321 7.808 1.00 . A A . 24 LYS HB2 1 1 8 3728 1 1 24 LYS HB3 H 7.434 -1.995 6.883 1.00 . A A . 24 LYS HB3 1 1 8 3729 1 1 24 LYS HD2 H 6.007 -1.163 9.991 1.00 . A A . 24 LYS HD2 1 1 8 3730 1 1 24 LYS HD3 H 7.446 -1.130 8.973 1.00 . A A . 24 LYS HD3 1 1 8 3731 1 1 24 LYS HE2 H 7.272 1.112 8.707 1.00 . A A . 24 LYS HE2 1 1 8 3732 1 1 24 LYS HE3 H 5.580 0.963 8.189 1.00 . A A . 24 LYS HE3 1 1 8 3733 1 1 24 LYS HG2 H 5.287 -0.720 7.215 1.00 . A A . 24 LYS HG2 1 1 8 3734 1 1 24 LYS HG3 H 4.762 -2.000 8.311 1.00 . A A . 24 LYS HG3 1 1 8 3735 1 1 24 LYS HZ1 H 5.160 0.447 10.660 1.00 . A A . 24 LYS HZ1 1 1 8 3736 1 1 24 LYS HZ2 H 5.397 2.066 10.203 1.00 . A A . 24 LYS HZ2 1 1 8 3737 1 1 24 LYS HZ3 H 6.660 1.190 10.927 1.00 . A A . 24 LYS HZ3 1 1 8 3738 1 1 24 LYS N N 5.611 -4.440 6.116 1.00 . A A . 24 LYS N 1 1 8 3739 1 1 24 LYS NZ N 5.846 1.131 10.283 1.00 . A A . 24 LYS NZ 1 1 8 3740 1 1 24 LYS O O 7.618 -1.995 4.704 1.00 . A A . 24 LYS O 1 1 8 3741 1 1 25 SER C C 6.278 -3.593 1.106 1.00 . A A . 25 SER C 1 1 8 3742 1 1 25 SER CA C 7.082 -3.124 2.320 1.00 . A A . 25 SER CA 1 1 8 3743 1 1 25 SER CB C 8.330 -3.986 2.503 1.00 . A A . 25 SER CB 1 1 8 3744 1 1 25 SER H H 5.506 -3.909 3.558 1.00 . A A . 25 SER H 1 1 8 3745 1 1 25 SER HA H 7.362 -2.089 2.211 1.00 . A A . 25 SER HA 1 1 8 3746 1 1 25 SER HB2 H 8.041 -4.983 2.799 1.00 . A A . 25 SER HB2 1 1 8 3747 1 1 25 SER HB3 H 8.875 -4.032 1.568 1.00 . A A . 25 SER HB3 1 1 8 3748 1 1 25 SER HG H 9.733 -2.776 3.100 1.00 . A A . 25 SER HG 1 1 8 3749 1 1 25 SER N N 6.292 -3.324 3.565 1.00 . A A . 25 SER N 1 1 8 3750 1 1 25 SER O O 5.853 -4.729 1.033 1.00 . A A . 25 SER O 1 1 8 3751 1 1 25 SER OG O 9.149 -3.415 3.516 1.00 . A A . 25 SER OG 1 1 8 3752 1 1 26 ALA C C 5.834 -2.432 -2.295 1.00 . A A . 26 ALA C 1 1 8 3753 1 1 26 ALA CA C 5.281 -3.126 -1.049 1.00 . A A . 26 ALA CA 1 1 8 3754 1 1 26 ALA CB C 3.854 -2.657 -0.768 1.00 . A A . 26 ALA CB 1 1 8 3755 1 1 26 ALA H H 6.410 -1.815 0.235 1.00 . A A . 26 ALA H 1 1 8 3756 1 1 26 ALA HA H 5.299 -4.197 -1.173 1.00 . A A . 26 ALA HA 1 1 8 3757 1 1 26 ALA HB1 H 3.222 -3.515 -0.590 1.00 . A A . 26 ALA HB1 1 1 8 3758 1 1 26 ALA HB2 H 3.482 -2.106 -1.619 1.00 . A A . 26 ALA HB2 1 1 8 3759 1 1 26 ALA HB3 H 3.849 -2.019 0.105 1.00 . A A . 26 ALA HB3 1 1 8 3760 1 1 26 ALA N N 6.062 -2.726 0.156 1.00 . A A . 26 ALA N 1 1 8 3761 1 1 26 ALA O O 6.695 -1.579 -2.215 1.00 . A A . 26 ALA O 1 1 8 3762 1 1 27 ALA C C 4.856 -1.036 -5.103 1.00 . A A . 27 ALA C 1 1 8 3763 1 1 27 ALA CA C 5.816 -2.148 -4.704 1.00 . A A . 27 ALA CA 1 1 8 3764 1 1 27 ALA CB C 5.789 -3.260 -5.748 1.00 . A A . 27 ALA CB 1 1 8 3765 1 1 27 ALA H H 4.635 -3.472 -3.484 1.00 . A A . 27 ALA H 1 1 8 3766 1 1 27 ALA HA H 6.816 -1.767 -4.586 1.00 . A A . 27 ALA HA 1 1 8 3767 1 1 27 ALA HB1 H 5.450 -2.857 -6.692 1.00 . A A . 27 ALA HB1 1 1 8 3768 1 1 27 ALA HB2 H 5.111 -4.037 -5.425 1.00 . A A . 27 ALA HB2 1 1 8 3769 1 1 27 ALA HB3 H 6.780 -3.670 -5.864 1.00 . A A . 27 ALA HB3 1 1 8 3770 1 1 27 ALA N N 5.336 -2.788 -3.446 1.00 . A A . 27 ALA N 1 1 8 3771 1 1 27 ALA O O 5.241 0.087 -5.357 1.00 . A A . 27 ALA O 1 1 8 3772 1 1 28 CYS C C 2.569 -0.070 -7.015 1.00 . A A . 28 CYS C 1 1 8 3773 1 1 28 CYS CA C 2.558 -0.357 -5.513 1.00 . A A . 28 CYS CA 1 1 8 3774 1 1 28 CYS CB C 2.894 0.904 -4.714 1.00 . A A . 28 CYS CB 1 1 8 3775 1 1 28 CYS H H 3.329 -2.274 -4.928 1.00 . A A . 28 CYS H 1 1 8 3776 1 1 28 CYS HA H 1.596 -0.723 -5.219 1.00 . A A . 28 CYS HA 1 1 8 3777 1 1 28 CYS HB2 H 3.673 0.679 -3.995 1.00 . A A . 28 CYS HB2 1 1 8 3778 1 1 28 CYS HB3 H 3.234 1.678 -5.387 1.00 . A A . 28 CYS HB3 1 1 8 3779 1 1 28 CYS N N 3.597 -1.357 -5.147 1.00 . A A . 28 CYS N 1 1 8 3780 1 1 28 CYS O O 3.609 0.053 -7.631 1.00 . A A . 28 CYS O 1 1 8 3781 1 1 28 CYS SG S 1.414 1.472 -3.839 1.00 . A A . 28 CYS SG 1 1 8 3782 1 1 29 THR C C 2.343 1.400 -9.449 1.00 . A A . 29 THR C 1 1 8 3783 1 1 29 THR CA C 1.328 0.322 -9.064 1.00 . A A . 29 THR CA 1 1 8 3784 1 1 29 THR CB C -0.099 0.827 -9.287 1.00 . A A . 29 THR CB 1 1 8 3785 1 1 29 THR CG2 C -0.516 0.575 -10.737 1.00 . A A . 29 THR CG2 1 1 8 3786 1 1 29 THR H H 0.582 -0.064 -7.079 1.00 . A A . 29 THR H 1 1 8 3787 1 1 29 THR HA H 1.495 -0.577 -9.634 1.00 . A A . 29 THR HA 1 1 8 3788 1 1 29 THR HB H -0.143 1.886 -9.085 1.00 . A A . 29 THR HB 1 1 8 3789 1 1 29 THR HG1 H -1.837 0.068 -8.850 1.00 . A A . 29 THR HG1 1 1 8 3790 1 1 29 THR HG21 H -1.552 0.273 -10.765 1.00 . A A . 29 THR HG21 1 1 8 3791 1 1 29 THR HG22 H 0.099 -0.208 -11.156 1.00 . A A . 29 THR HG22 1 1 8 3792 1 1 29 THR HG23 H -0.389 1.481 -11.311 1.00 . A A . 29 THR HG23 1 1 8 3793 1 1 29 THR N N 1.407 0.039 -7.603 1.00 . A A . 29 THR N 1 1 8 3794 1 1 29 THR O O 2.798 1.466 -10.574 1.00 . A A . 29 THR O 1 1 8 3795 1 1 29 THR OG1 O -0.985 0.141 -8.412 1.00 . A A . 29 THR OG1 1 1 8 3796 1 1 30 ARG C C 3.058 4.373 -9.748 1.00 . A A . 30 ARG C 1 1 8 3797 1 1 30 ARG CA C 3.690 3.323 -8.828 1.00 . A A . 30 ARG CA 1 1 8 3798 1 1 30 ARG CB C 4.849 2.615 -9.534 1.00 . A A . 30 ARG CB 1 1 8 3799 1 1 30 ARG CD C 6.585 4.396 -9.782 1.00 . A A . 30 ARG CD 1 1 8 3800 1 1 30 ARG CG C 6.180 3.147 -8.996 1.00 . A A . 30 ARG CG 1 1 8 3801 1 1 30 ARG CZ C 8.737 4.053 -10.839 1.00 . A A . 30 ARG CZ 1 1 8 3802 1 1 30 ARG H H 2.322 2.173 -7.622 1.00 . A A . 30 ARG H 1 1 8 3803 1 1 30 ARG HA H 4.040 3.784 -7.917 1.00 . A A . 30 ARG HA 1 1 8 3804 1 1 30 ARG HB2 H 4.786 1.551 -9.349 1.00 . A A . 30 ARG HB2 1 1 8 3805 1 1 30 ARG HB3 H 4.793 2.803 -10.596 1.00 . A A . 30 ARG HB3 1 1 8 3806 1 1 30 ARG HD2 H 6.215 4.335 -10.796 1.00 . A A . 30 ARG HD2 1 1 8 3807 1 1 30 ARG HD3 H 6.212 5.284 -9.296 1.00 . A A . 30 ARG HD3 1 1 8 3808 1 1 30 ARG HE H 8.557 4.642 -8.952 1.00 . A A . 30 ARG HE 1 1 8 3809 1 1 30 ARG HG2 H 6.070 3.398 -7.951 1.00 . A A . 30 ARG HG2 1 1 8 3810 1 1 30 ARG HG3 H 6.942 2.392 -9.109 1.00 . A A . 30 ARG HG3 1 1 8 3811 1 1 30 ARG HH11 H 7.661 2.395 -11.166 1.00 . A A . 30 ARG HH11 1 1 8 3812 1 1 30 ARG HH12 H 8.925 2.707 -12.310 1.00 . A A . 30 ARG HH12 1 1 8 3813 1 1 30 ARG HH21 H 9.966 5.632 -10.764 1.00 . A A . 30 ARG HH21 1 1 8 3814 1 1 30 ARG HH22 H 10.227 4.542 -12.084 1.00 . A A . 30 ARG HH22 1 1 8 3815 1 1 30 ARG N N 2.703 2.246 -8.521 1.00 . A A . 30 ARG N 1 1 8 3816 1 1 30 ARG NE N 8.074 4.392 -9.767 1.00 . A A . 30 ARG NE 1 1 8 3817 1 1 30 ARG NH1 N 8.416 2.967 -11.490 1.00 . A A . 30 ARG NH1 1 1 8 3818 1 1 30 ARG NH2 N 9.720 4.800 -11.262 1.00 . A A . 30 ARG NH2 1 1 8 3819 1 1 30 ARG O O 3.234 4.345 -10.950 1.00 . A A . 30 ARG O 1 1 8 3820 1 1 31 MET C C 2.068 7.741 -9.544 1.00 . A A . 31 MET C 1 1 8 3821 1 1 31 MET CA C 1.678 6.345 -10.037 1.00 . A A . 31 MET CA 1 1 8 3822 1 1 31 MET CB C 0.174 6.125 -9.870 1.00 . A A . 31 MET CB 1 1 8 3823 1 1 31 MET CE C -2.580 5.345 -12.764 1.00 . A A . 31 MET CE 1 1 8 3824 1 1 31 MET CG C -0.505 6.190 -11.239 1.00 . A A . 31 MET CG 1 1 8 3825 1 1 31 MET H H 2.189 5.301 -8.222 1.00 . A A . 31 MET H 1 1 8 3826 1 1 31 MET HA H 1.955 6.218 -11.071 1.00 . A A . 31 MET HA 1 1 8 3827 1 1 31 MET HB2 H -0.003 5.158 -9.422 1.00 . A A . 31 MET HB2 1 1 8 3828 1 1 31 MET HB3 H -0.232 6.897 -9.234 1.00 . A A . 31 MET HB3 1 1 8 3829 1 1 31 MET HE1 H -3.007 6.270 -12.405 1.00 . A A . 31 MET HE1 1 1 8 3830 1 1 31 MET HE2 H -3.372 4.637 -12.955 1.00 . A A . 31 MET HE2 1 1 8 3831 1 1 31 MET HE3 H -2.034 5.526 -13.678 1.00 . A A . 31 MET HE3 1 1 8 3832 1 1 31 MET HG2 H -1.168 7.042 -11.272 1.00 . A A . 31 MET HG2 1 1 8 3833 1 1 31 MET HG3 H 0.246 6.288 -12.009 1.00 . A A . 31 MET HG3 1 1 8 3834 1 1 31 MET N N 2.322 5.297 -9.193 1.00 . A A . 31 MET N 1 1 8 3835 1 1 31 MET O O 1.835 8.730 -10.212 1.00 . A A . 31 MET O 1 1 8 3836 1 1 31 MET SD S -1.457 4.676 -11.514 1.00 . A A . 31 MET SD 1 1 8 3837 1 1 32 ALA C C 1.802 9.998 -7.532 1.00 . A A . 32 ALA C 1 1 8 3838 1 1 32 ALA CA C 3.050 9.173 -7.853 1.00 . A A . 32 ALA CA 1 1 8 3839 1 1 32 ALA CB C 3.850 9.826 -8.981 1.00 . A A . 32 ALA CB 1 1 8 3840 1 1 32 ALA H H 2.830 7.026 -7.855 1.00 . A A . 32 ALA H 1 1 8 3841 1 1 32 ALA HA H 3.669 9.066 -6.976 1.00 . A A . 32 ALA HA 1 1 8 3842 1 1 32 ALA HB1 H 3.171 10.307 -9.671 1.00 . A A . 32 ALA HB1 1 1 8 3843 1 1 32 ALA HB2 H 4.418 9.071 -9.502 1.00 . A A . 32 ALA HB2 1 1 8 3844 1 1 32 ALA HB3 H 4.522 10.562 -8.566 1.00 . A A . 32 ALA HB3 1 1 8 3845 1 1 32 ALA N N 2.655 7.834 -8.381 1.00 . A A . 32 ALA N 1 1 8 3846 1 1 32 ALA O O 0.863 10.044 -8.301 1.00 . A A . 32 ALA O 1 1 8 3847 1 1 33 CYS C C 1.013 12.865 -5.584 1.00 . A A . 33 CYS C 1 1 8 3848 1 1 33 CYS CA C 0.587 11.465 -6.036 1.00 . A A . 33 CYS CA 1 1 8 3849 1 1 33 CYS CB C -0.070 10.712 -4.880 1.00 . A A . 33 CYS CB 1 1 8 3850 1 1 33 CYS H H 2.545 10.599 -5.791 1.00 . A A . 33 CYS H 1 1 8 3851 1 1 33 CYS HA H -0.095 11.525 -6.868 1.00 . A A . 33 CYS HA 1 1 8 3852 1 1 33 CYS HB2 H 0.064 9.648 -5.019 1.00 . A A . 33 CYS HB2 1 1 8 3853 1 1 33 CYS HB3 H 0.386 11.013 -3.951 1.00 . A A . 33 CYS HB3 1 1 8 3854 1 1 33 CYS N N 1.780 10.649 -6.400 1.00 . A A . 33 CYS N 1 1 8 3855 1 1 33 CYS O O 1.739 13.012 -4.622 1.00 . A A . 33 CYS O 1 1 8 3856 1 1 33 CYS SG S -1.836 11.101 -4.838 1.00 . A A . 33 CYS SG 1 1 8 3857 1 1 34 PRO C C 0.040 15.730 -4.773 1.00 . A A . 34 PRO C 1 1 8 3858 1 1 34 PRO CA C 0.873 15.255 -5.965 1.00 . A A . 34 PRO CA 1 1 8 3859 1 1 34 PRO CB C 0.498 16.021 -7.228 1.00 . A A . 34 PRO CB 1 1 8 3860 1 1 34 PRO CD C -0.333 13.753 -7.469 1.00 . A A . 34 PRO CD 1 1 8 3861 1 1 34 PRO CG C -0.543 15.183 -7.904 1.00 . A A . 34 PRO CG 1 1 8 3862 1 1 34 PRO HA H 1.927 15.363 -5.764 1.00 . A A . 34 PRO HA 1 1 8 3863 1 1 34 PRO HB2 H 0.094 16.990 -6.970 1.00 . A A . 34 PRO HB2 1 1 8 3864 1 1 34 PRO HB3 H 1.358 16.130 -7.871 1.00 . A A . 34 PRO HB3 1 1 8 3865 1 1 34 PRO HD2 H -1.279 13.300 -7.201 1.00 . A A . 34 PRO HD2 1 1 8 3866 1 1 34 PRO HD3 H 0.153 13.187 -8.250 1.00 . A A . 34 PRO HD3 1 1 8 3867 1 1 34 PRO HG2 H -1.528 15.518 -7.611 1.00 . A A . 34 PRO HG2 1 1 8 3868 1 1 34 PRO HG3 H -0.434 15.255 -8.975 1.00 . A A . 34 PRO HG3 1 1 8 3869 1 1 34 PRO N N 0.542 13.852 -6.297 1.00 . A A . 34 PRO N 1 1 8 3870 1 1 34 PRO O O 0.109 16.874 -4.369 1.00 . A A . 34 PRO O 1 1 8 3871 1 1 35 GLN C C -1.442 14.238 -1.910 1.00 . A A . 35 GLN C 1 1 8 3872 1 1 35 GLN CA C -1.589 15.259 -3.041 1.00 . A A . 35 GLN CA 1 1 8 3873 1 1 35 GLN CB C -3.024 15.271 -3.572 1.00 . A A . 35 GLN CB 1 1 8 3874 1 1 35 GLN CD C -4.411 15.577 -1.515 1.00 . A A . 35 GLN CD 1 1 8 3875 1 1 35 GLN CG C -3.860 16.267 -2.765 1.00 . A A . 35 GLN CG 1 1 8 3876 1 1 35 GLN H H -0.793 13.941 -4.548 1.00 . A A . 35 GLN H 1 1 8 3877 1 1 35 GLN HA H -1.315 16.245 -2.699 1.00 . A A . 35 GLN HA 1 1 8 3878 1 1 35 GLN HB2 H -3.020 15.564 -4.612 1.00 . A A . 35 GLN HB2 1 1 8 3879 1 1 35 GLN HB3 H -3.452 14.285 -3.477 1.00 . A A . 35 GLN HB3 1 1 8 3880 1 1 35 GLN HE21 H -3.222 16.569 -0.270 1.00 . A A . 35 GLN HE21 1 1 8 3881 1 1 35 GLN HE22 H -4.277 15.459 0.462 1.00 . A A . 35 GLN HE22 1 1 8 3882 1 1 35 GLN HG2 H -3.240 17.103 -2.472 1.00 . A A . 35 GLN HG2 1 1 8 3883 1 1 35 GLN HG3 H -4.682 16.622 -3.369 1.00 . A A . 35 GLN HG3 1 1 8 3884 1 1 35 GLN N N -0.751 14.859 -4.207 1.00 . A A . 35 GLN N 1 1 8 3885 1 1 35 GLN NE2 N -3.930 15.894 -0.344 1.00 . A A . 35 GLN NE2 1 1 8 3886 1 1 35 GLN O O -1.611 13.059 -2.176 1.00 . A A . 35 GLN O 1 1 8 3887 1 1 35 GLN OXT O -1.162 14.653 -0.796 1.00 . A A . 35 GLN OXT 1 1 8 3888 1 1 35 GLN OE1 O -5.287 14.741 -1.605 1.00 . A A . 35 GLN OE1 1 1 9 3889 1 1 1 GLU C C 6.552 2.107 5.974 1.00 . A A . 1 GLU C 1 1 9 3890 1 1 1 GLU CA C 8.043 2.438 6.064 1.00 . A A . 1 GLU CA 1 1 9 3891 1 1 1 GLU CB C 8.444 3.419 4.962 1.00 . A A . 1 GLU CB 1 1 9 3892 1 1 1 GLU CD C 8.589 5.756 5.834 1.00 . A A . 1 GLU CD 1 1 9 3893 1 1 1 GLU CG C 7.682 4.733 5.148 1.00 . A A . 1 GLU CG 1 1 9 3894 1 1 1 GLU H1 H 9.767 1.295 6.302 1.00 . A A . 1 GLU H1 1 1 9 3895 1 1 1 GLU H2 H 9.020 1.115 4.786 1.00 . A A . 1 GLU H2 1 1 9 3896 1 1 1 GLU H3 H 8.345 0.381 6.162 1.00 . A A . 1 GLU H3 1 1 9 3897 1 1 1 GLU HA H 8.280 2.852 7.031 1.00 . A A . 1 GLU HA 1 1 9 3898 1 1 1 GLU HB2 H 9.507 3.608 5.017 1.00 . A A . 1 GLU HB2 1 1 9 3899 1 1 1 GLU HB3 H 8.201 2.998 3.999 1.00 . A A . 1 GLU HB3 1 1 9 3900 1 1 1 GLU HG2 H 7.377 5.111 4.183 1.00 . A A . 1 GLU HG2 1 1 9 3901 1 1 1 GLU HG3 H 6.810 4.560 5.760 1.00 . A A . 1 GLU HG3 1 1 9 3902 1 1 1 GLU N N 8.856 1.215 5.809 1.00 . A A . 1 GLU N 1 1 9 3903 1 1 1 GLU O O 5.721 2.781 6.548 1.00 . A A . 1 GLU O 1 1 9 3904 1 1 1 GLU OE1 O 9.747 5.440 6.052 1.00 . A A . 1 GLU OE1 1 1 9 3905 1 1 1 GLU OE2 O 8.111 6.839 6.131 1.00 . A A . 1 GLU OE2 1 1 9 3906 1 1 2 VAL C C 4.324 -0.080 6.382 1.00 . A A . 2 VAL C 1 1 9 3907 1 1 2 VAL CA C 4.770 0.700 5.137 1.00 . A A . 2 VAL CA 1 1 9 3908 1 1 2 VAL CB C 4.691 -0.165 3.862 1.00 . A A . 2 VAL CB 1 1 9 3909 1 1 2 VAL CG1 C 3.719 -1.336 4.056 1.00 . A A . 2 VAL CG1 1 1 9 3910 1 1 2 VAL CG2 C 4.200 0.697 2.696 1.00 . A A . 2 VAL CG2 1 1 9 3911 1 1 2 VAL H H 6.891 0.537 4.804 1.00 . A A . 2 VAL H 1 1 9 3912 1 1 2 VAL HA H 4.166 1.585 5.017 1.00 . A A . 2 VAL HA 1 1 9 3913 1 1 2 VAL HB H 5.673 -0.551 3.633 1.00 . A A . 2 VAL HB 1 1 9 3914 1 1 2 VAL HG11 H 3.756 -1.981 3.191 1.00 . A A . 2 VAL HG11 1 1 9 3915 1 1 2 VAL HG12 H 2.716 -0.955 4.180 1.00 . A A . 2 VAL HG12 1 1 9 3916 1 1 2 VAL HG13 H 4.002 -1.897 4.935 1.00 . A A . 2 VAL HG13 1 1 9 3917 1 1 2 VAL HG21 H 3.704 0.070 1.970 1.00 . A A . 2 VAL HG21 1 1 9 3918 1 1 2 VAL HG22 H 5.041 1.191 2.232 1.00 . A A . 2 VAL HG22 1 1 9 3919 1 1 2 VAL HG23 H 3.506 1.439 3.064 1.00 . A A . 2 VAL HG23 1 1 9 3920 1 1 2 VAL N N 6.207 1.071 5.259 1.00 . A A . 2 VAL N 1 1 9 3921 1 1 2 VAL O O 5.040 -0.918 6.895 1.00 . A A . 2 VAL O 1 1 9 3922 1 1 3 THR C C 1.254 -1.120 7.732 1.00 . A A . 3 THR C 1 1 9 3923 1 1 3 THR CA C 2.629 -0.541 8.058 1.00 . A A . 3 THR CA 1 1 9 3924 1 1 3 THR CB C 2.519 0.515 9.166 1.00 . A A . 3 THR CB 1 1 9 3925 1 1 3 THR CG2 C 3.679 1.507 9.060 1.00 . A A . 3 THR CG2 1 1 9 3926 1 1 3 THR H H 2.580 0.859 6.421 1.00 . A A . 3 THR H 1 1 9 3927 1 1 3 THR HA H 3.313 -1.323 8.350 1.00 . A A . 3 THR HA 1 1 9 3928 1 1 3 THR HB H 2.555 0.028 10.128 1.00 . A A . 3 THR HB 1 1 9 3929 1 1 3 THR HG1 H 0.725 0.959 9.770 1.00 . A A . 3 THR HG1 1 1 9 3930 1 1 3 THR HG21 H 3.341 2.403 8.560 1.00 . A A . 3 THR HG21 1 1 9 3931 1 1 3 THR HG22 H 4.483 1.061 8.492 1.00 . A A . 3 THR HG22 1 1 9 3932 1 1 3 THR HG23 H 4.031 1.756 10.049 1.00 . A A . 3 THR HG23 1 1 9 3933 1 1 3 THR N N 3.141 0.185 6.858 1.00 . A A . 3 THR N 1 1 9 3934 1 1 3 THR O O 0.359 -1.134 8.553 1.00 . A A . 3 THR O 1 1 9 3935 1 1 3 THR OG1 O 1.286 1.209 9.033 1.00 . A A . 3 THR OG1 1 1 9 3936 1 1 4 CYS C C -0.324 -3.631 6.431 1.00 . A A . 4 CYS C 1 1 9 3937 1 1 4 CYS CA C -0.236 -2.133 6.111 1.00 . A A . 4 CYS CA 1 1 9 3938 1 1 4 CYS CB C -0.300 -1.876 4.598 1.00 . A A . 4 CYS CB 1 1 9 3939 1 1 4 CYS H H 1.816 -1.533 5.879 1.00 . A A . 4 CYS H 1 1 9 3940 1 1 4 CYS HA H -1.035 -1.602 6.603 1.00 . A A . 4 CYS HA 1 1 9 3941 1 1 4 CYS HB2 H -1.333 -1.851 4.283 1.00 . A A . 4 CYS HB2 1 1 9 3942 1 1 4 CYS HB3 H 0.163 -0.921 4.380 1.00 . A A . 4 CYS HB3 1 1 9 3943 1 1 4 CYS N N 1.080 -1.575 6.523 1.00 . A A . 4 CYS N 1 1 9 3944 1 1 4 CYS O O 0.497 -4.178 7.140 1.00 . A A . 4 CYS O 1 1 9 3945 1 1 4 CYS SG S 0.569 -3.185 3.687 1.00 . A A . 4 CYS SG 1 1 9 3946 1 1 5 GLU C C -0.933 -6.559 4.974 1.00 . A A . 5 GLU C 1 1 9 3947 1 1 5 GLU CA C -1.468 -5.756 6.165 1.00 . A A . 5 GLU CA 1 1 9 3948 1 1 5 GLU CB C -2.974 -5.969 6.325 1.00 . A A . 5 GLU CB 1 1 9 3949 1 1 5 GLU CD C -3.474 -5.767 8.763 1.00 . A A . 5 GLU CD 1 1 9 3950 1 1 5 GLU CG C -3.507 -5.041 7.418 1.00 . A A . 5 GLU CG 1 1 9 3951 1 1 5 GLU H H -1.964 -3.833 5.333 1.00 . A A . 5 GLU H 1 1 9 3952 1 1 5 GLU HA H -0.957 -6.032 7.072 1.00 . A A . 5 GLU HA 1 1 9 3953 1 1 5 GLU HB2 H -3.470 -5.750 5.391 1.00 . A A . 5 GLU HB2 1 1 9 3954 1 1 5 GLU HB3 H -3.165 -6.995 6.603 1.00 . A A . 5 GLU HB3 1 1 9 3955 1 1 5 GLU HG2 H -2.892 -4.155 7.470 1.00 . A A . 5 GLU HG2 1 1 9 3956 1 1 5 GLU HG3 H -4.524 -4.760 7.187 1.00 . A A . 5 GLU HG3 1 1 9 3957 1 1 5 GLU N N -1.316 -4.296 5.903 1.00 . A A . 5 GLU N 1 1 9 3958 1 1 5 GLU O O -1.418 -6.426 3.869 1.00 . A A . 5 GLU O 1 1 9 3959 1 1 5 GLU OE1 O -2.449 -6.350 9.073 1.00 . A A . 5 GLU OE1 1 1 9 3960 1 1 5 GLU OE2 O -4.474 -5.727 9.460 1.00 . A A . 5 GLU OE2 1 1 9 3961 1 1 6 PRO C C -0.293 -9.296 3.718 1.00 . A A . 6 PRO C 1 1 9 3962 1 1 6 PRO CA C 0.671 -8.196 4.169 1.00 . A A . 6 PRO CA 1 1 9 3963 1 1 6 PRO CB C 1.902 -8.796 4.849 1.00 . A A . 6 PRO CB 1 1 9 3964 1 1 6 PRO CD C 0.686 -7.597 6.545 1.00 . A A . 6 PRO CD 1 1 9 3965 1 1 6 PRO CG C 1.581 -8.785 6.308 1.00 . A A . 6 PRO CG 1 1 9 3966 1 1 6 PRO HA H 0.972 -7.582 3.335 1.00 . A A . 6 PRO HA 1 1 9 3967 1 1 6 PRO HB2 H 2.064 -9.809 4.504 1.00 . A A . 6 PRO HB2 1 1 9 3968 1 1 6 PRO HB3 H 2.772 -8.190 4.662 1.00 . A A . 6 PRO HB3 1 1 9 3969 1 1 6 PRO HD2 H -0.059 -7.829 7.295 1.00 . A A . 6 PRO HD2 1 1 9 3970 1 1 6 PRO HD3 H 1.267 -6.735 6.835 1.00 . A A . 6 PRO HD3 1 1 9 3971 1 1 6 PRO HG2 H 1.069 -9.698 6.579 1.00 . A A . 6 PRO HG2 1 1 9 3972 1 1 6 PRO HG3 H 2.487 -8.679 6.885 1.00 . A A . 6 PRO HG3 1 1 9 3973 1 1 6 PRO N N 0.057 -7.368 5.239 1.00 . A A . 6 PRO N 1 1 9 3974 1 1 6 PRO O O -0.510 -10.264 4.421 1.00 . A A . 6 PRO O 1 1 9 3975 1 1 7 GLY C C -2.592 -9.808 0.837 1.00 . A A . 7 GLY C 1 1 9 3976 1 1 7 GLY CA C -1.811 -10.236 2.089 1.00 . A A . 7 GLY CA 1 1 9 3977 1 1 7 GLY H H -0.690 -8.391 1.985 1.00 . A A . 7 GLY H 1 1 9 3978 1 1 7 GLY HA2 H -1.245 -11.128 1.862 1.00 . A A . 7 GLY HA2 1 1 9 3979 1 1 7 GLY HA3 H -2.513 -10.454 2.883 1.00 . A A . 7 GLY HA3 1 1 9 3980 1 1 7 GLY N N -0.874 -9.170 2.549 1.00 . A A . 7 GLY N 1 1 9 3981 1 1 7 GLY O O -3.160 -10.638 0.155 1.00 . A A . 7 GLY O 1 1 9 3982 1 1 8 THR C C -2.968 -6.772 -1.216 1.00 . A A . 8 THR C 1 1 9 3983 1 1 8 THR CA C -3.424 -8.136 -0.694 1.00 . A A . 8 THR CA 1 1 9 3984 1 1 8 THR CB C -4.880 -8.069 -0.225 1.00 . A A . 8 THR CB 1 1 9 3985 1 1 8 THR CG2 C -5.809 -7.992 -1.437 1.00 . A A . 8 THR CG2 1 1 9 3986 1 1 8 THR H H -2.200 -7.865 1.068 1.00 . A A . 8 THR H 1 1 9 3987 1 1 8 THR HA H -3.325 -8.883 -1.466 1.00 . A A . 8 THR HA 1 1 9 3988 1 1 8 THR HB H -5.021 -7.192 0.387 1.00 . A A . 8 THR HB 1 1 9 3989 1 1 8 THR HG1 H -4.990 -9.998 -0.009 1.00 . A A . 8 THR HG1 1 1 9 3990 1 1 8 THR HG21 H -6.738 -8.492 -1.210 1.00 . A A . 8 THR HG21 1 1 9 3991 1 1 8 THR HG22 H -5.338 -8.472 -2.282 1.00 . A A . 8 THR HG22 1 1 9 3992 1 1 8 THR HG23 H -6.007 -6.957 -1.674 1.00 . A A . 8 THR HG23 1 1 9 3993 1 1 8 THR N N -2.649 -8.540 0.518 1.00 . A A . 8 THR N 1 1 9 3994 1 1 8 THR O O -2.114 -6.125 -0.641 1.00 . A A . 8 THR O 1 1 9 3995 1 1 8 THR OG1 O -5.184 -9.230 0.534 1.00 . A A . 8 THR OG1 1 1 9 3996 1 1 9 THR C C -4.213 -3.958 -2.549 1.00 . A A . 9 THR C 1 1 9 3997 1 1 9 THR CA C -3.151 -5.010 -2.878 1.00 . A A . 9 THR CA 1 1 9 3998 1 1 9 THR CB C -3.066 -5.236 -4.390 1.00 . A A . 9 THR CB 1 1 9 3999 1 1 9 THR CG2 C -4.359 -5.888 -4.885 1.00 . A A . 9 THR CG2 1 1 9 4000 1 1 9 THR H H -4.225 -6.873 -2.751 1.00 . A A . 9 THR H 1 1 9 4001 1 1 9 THR HA H -2.190 -4.704 -2.499 1.00 . A A . 9 THR HA 1 1 9 4002 1 1 9 THR HB H -2.234 -5.885 -4.611 1.00 . A A . 9 THR HB 1 1 9 4003 1 1 9 THR HG1 H -2.289 -4.125 -5.785 1.00 . A A . 9 THR HG1 1 1 9 4004 1 1 9 THR HG21 H -4.263 -6.962 -4.830 1.00 . A A . 9 THR HG21 1 1 9 4005 1 1 9 THR HG22 H -4.541 -5.593 -5.907 1.00 . A A . 9 THR HG22 1 1 9 4006 1 1 9 THR HG23 H -5.183 -5.568 -4.265 1.00 . A A . 9 THR HG23 1 1 9 4007 1 1 9 THR N N -3.539 -6.332 -2.308 1.00 . A A . 9 THR N 1 1 9 4008 1 1 9 THR O O -5.325 -4.280 -2.179 1.00 . A A . 9 THR O 1 1 9 4009 1 1 9 THR OG1 O -2.882 -3.988 -5.043 1.00 . A A . 9 THR OG1 1 1 9 4010 1 1 10 PHE C C -4.257 -0.252 -2.613 1.00 . A A . 10 PHE C 1 1 9 4011 1 1 10 PHE CA C -4.863 -1.633 -2.349 1.00 . A A . 10 PHE CA 1 1 9 4012 1 1 10 PHE CB C -5.145 -1.804 -0.856 1.00 . A A . 10 PHE CB 1 1 9 4013 1 1 10 PHE CD1 C -2.782 -2.380 -0.196 1.00 . A A . 10 PHE CD1 1 1 9 4014 1 1 10 PHE CD2 C -3.801 -0.395 0.750 1.00 . A A . 10 PHE CD2 1 1 9 4015 1 1 10 PHE CE1 C -1.607 -2.118 0.514 1.00 . A A . 10 PHE CE1 1 1 9 4016 1 1 10 PHE CE2 C -2.623 -0.134 1.463 1.00 . A A . 10 PHE CE2 1 1 9 4017 1 1 10 PHE CG C -3.879 -1.520 -0.080 1.00 . A A . 10 PHE CG 1 1 9 4018 1 1 10 PHE CZ C -1.526 -0.998 1.344 1.00 . A A . 10 PHE CZ 1 1 9 4019 1 1 10 PHE H H -2.972 -2.464 -2.961 1.00 . A A . 10 PHE H 1 1 9 4020 1 1 10 PHE HA H -5.771 -1.768 -2.915 1.00 . A A . 10 PHE HA 1 1 9 4021 1 1 10 PHE HB2 H -5.920 -1.113 -0.553 1.00 . A A . 10 PHE HB2 1 1 9 4022 1 1 10 PHE HB3 H -5.467 -2.815 -0.663 1.00 . A A . 10 PHE HB3 1 1 9 4023 1 1 10 PHE HD1 H -2.839 -3.248 -0.832 1.00 . A A . 10 PHE HD1 1 1 9 4024 1 1 10 PHE HD2 H -4.646 0.270 0.842 1.00 . A A . 10 PHE HD2 1 1 9 4025 1 1 10 PHE HE1 H -0.762 -2.783 0.422 1.00 . A A . 10 PHE HE1 1 1 9 4026 1 1 10 PHE HE2 H -2.560 0.732 2.105 1.00 . A A . 10 PHE HE2 1 1 9 4027 1 1 10 PHE HZ H -0.616 -0.801 1.892 1.00 . A A . 10 PHE HZ 1 1 9 4028 1 1 10 PHE N N -3.876 -2.704 -2.670 1.00 . A A . 10 PHE N 1 1 9 4029 1 1 10 PHE O O -3.069 -0.114 -2.820 1.00 . A A . 10 PHE O 1 1 9 4030 1 1 11 LYS C C -4.204 2.813 -1.496 1.00 . A A . 11 LYS C 1 1 9 4031 1 1 11 LYS CA C -4.537 2.146 -2.836 1.00 . A A . 11 LYS CA 1 1 9 4032 1 1 11 LYS CB C -5.673 2.885 -3.546 1.00 . A A . 11 LYS CB 1 1 9 4033 1 1 11 LYS CD C -6.588 5.024 -2.639 1.00 . A A . 11 LYS CD 1 1 9 4034 1 1 11 LYS CE C -6.062 6.239 -1.875 1.00 . A A . 11 LYS CE 1 1 9 4035 1 1 11 LYS CG C -5.452 4.397 -3.448 1.00 . A A . 11 LYS CG 1 1 9 4036 1 1 11 LYS H H -6.020 0.639 -2.420 1.00 . A A . 11 LYS H 1 1 9 4037 1 1 11 LYS HA H -3.663 2.111 -3.469 1.00 . A A . 11 LYS HA 1 1 9 4038 1 1 11 LYS HB2 H -5.695 2.592 -4.586 1.00 . A A . 11 LYS HB2 1 1 9 4039 1 1 11 LYS HB3 H -6.613 2.630 -3.081 1.00 . A A . 11 LYS HB3 1 1 9 4040 1 1 11 LYS HD2 H -7.378 5.333 -3.308 1.00 . A A . 11 LYS HD2 1 1 9 4041 1 1 11 LYS HD3 H -6.973 4.299 -1.938 1.00 . A A . 11 LYS HD3 1 1 9 4042 1 1 11 LYS HE2 H -5.289 5.940 -1.179 1.00 . A A . 11 LYS HE2 1 1 9 4043 1 1 11 LYS HE3 H -5.686 6.982 -2.560 1.00 . A A . 11 LYS HE3 1 1 9 4044 1 1 11 LYS HG2 H -4.508 4.594 -2.961 1.00 . A A . 11 LYS HG2 1 1 9 4045 1 1 11 LYS HG3 H -5.441 4.825 -4.440 1.00 . A A . 11 LYS HG3 1 1 9 4046 1 1 11 LYS HZ1 H -6.930 7.454 -0.424 1.00 . A A . 11 LYS HZ1 1 1 9 4047 1 1 11 LYS HZ2 H -7.747 5.986 -0.680 1.00 . A A . 11 LYS HZ2 1 1 9 4048 1 1 11 LYS HZ3 H -7.883 7.246 -1.812 1.00 . A A . 11 LYS HZ3 1 1 9 4049 1 1 11 LYS N N -5.065 0.772 -2.597 1.00 . A A . 11 LYS N 1 1 9 4050 1 1 11 LYS NZ N -7.244 6.771 -1.142 1.00 . A A . 11 LYS NZ 1 1 9 4051 1 1 11 LYS O O -5.079 3.112 -0.708 1.00 . A A . 11 LYS O 1 1 9 4052 1 1 12 ASP C C -2.590 5.203 -0.061 1.00 . A A . 12 ASP C 1 1 9 4053 1 1 12 ASP CA C -2.562 3.678 0.062 1.00 . A A . 12 ASP CA 1 1 9 4054 1 1 12 ASP CB C -1.139 3.189 0.339 1.00 . A A . 12 ASP CB 1 1 9 4055 1 1 12 ASP CG C -0.776 3.477 1.797 1.00 . A A . 12 ASP CG 1 1 9 4056 1 1 12 ASP H H -2.255 2.786 -1.876 1.00 . A A . 12 ASP H 1 1 9 4057 1 1 12 ASP HA H -3.219 3.355 0.849 1.00 . A A . 12 ASP HA 1 1 9 4058 1 1 12 ASP HB2 H -1.084 2.123 0.156 1.00 . A A . 12 ASP HB2 1 1 9 4059 1 1 12 ASP HB3 H -0.447 3.706 -0.311 1.00 . A A . 12 ASP HB3 1 1 9 4060 1 1 12 ASP N N -2.946 3.040 -1.230 1.00 . A A . 12 ASP N 1 1 9 4061 1 1 12 ASP O O -3.114 5.894 0.789 1.00 . A A . 12 ASP O 1 1 9 4062 1 1 12 ASP OD1 O -1.657 3.385 2.636 1.00 . A A . 12 ASP OD1 1 1 9 4063 1 1 12 ASP OD2 O 0.378 3.785 2.049 1.00 . A A . 12 ASP OD2 1 1 9 4064 1 1 13 LYS C C -2.728 7.609 -2.581 1.00 . A A . 13 LYS C 1 1 9 4065 1 1 13 LYS CA C -2.021 7.214 -1.281 1.00 . A A . 13 LYS CA 1 1 9 4066 1 1 13 LYS CB C -0.532 7.609 -1.332 1.00 . A A . 13 LYS CB 1 1 9 4067 1 1 13 LYS CD C 1.085 8.141 0.496 1.00 . A A . 13 LYS CD 1 1 9 4068 1 1 13 LYS CE C 1.867 7.565 1.679 1.00 . A A . 13 LYS CE 1 1 9 4069 1 1 13 LYS CG C 0.184 7.057 -0.099 1.00 . A A . 13 LYS CG 1 1 9 4070 1 1 13 LYS H H -1.609 5.157 -1.781 1.00 . A A . 13 LYS H 1 1 9 4071 1 1 13 LYS HA H -2.495 7.690 -0.437 1.00 . A A . 13 LYS HA 1 1 9 4072 1 1 13 LYS HB2 H -0.075 7.202 -2.224 1.00 . A A . 13 LYS HB2 1 1 9 4073 1 1 13 LYS HB3 H -0.438 8.688 -1.345 1.00 . A A . 13 LYS HB3 1 1 9 4074 1 1 13 LYS HD2 H 1.775 8.489 -0.259 1.00 . A A . 13 LYS HD2 1 1 9 4075 1 1 13 LYS HD3 H 0.477 8.966 0.837 1.00 . A A . 13 LYS HD3 1 1 9 4076 1 1 13 LYS HE2 H 1.251 7.558 2.566 1.00 . A A . 13 LYS HE2 1 1 9 4077 1 1 13 LYS HE3 H 2.213 6.569 1.451 1.00 . A A . 13 LYS HE3 1 1 9 4078 1 1 13 LYS HG2 H -0.547 6.752 0.636 1.00 . A A . 13 LYS HG2 1 1 9 4079 1 1 13 LYS HG3 H 0.787 6.207 -0.383 1.00 . A A . 13 LYS HG3 1 1 9 4080 1 1 13 LYS HZ1 H 3.826 7.957 2.265 1.00 . A A . 13 LYS HZ1 1 1 9 4081 1 1 13 LYS HZ2 H 2.760 9.260 2.491 1.00 . A A . 13 LYS HZ2 1 1 9 4082 1 1 13 LYS HZ3 H 3.308 8.869 0.931 1.00 . A A . 13 LYS HZ3 1 1 9 4083 1 1 13 LYS N N -2.027 5.732 -1.109 1.00 . A A . 13 LYS N 1 1 9 4084 1 1 13 LYS NZ N 3.028 8.482 1.854 1.00 . A A . 13 LYS NZ 1 1 9 4085 1 1 13 LYS O O -3.834 8.112 -2.575 1.00 . A A . 13 LYS O 1 1 9 4086 1 1 14 CYS C C -2.673 6.597 -5.946 1.00 . A A . 14 CYS C 1 1 9 4087 1 1 14 CYS CA C -2.660 7.801 -5.003 1.00 . A A . 14 CYS CA 1 1 9 4088 1 1 14 CYS CB C -1.656 8.828 -5.496 1.00 . A A . 14 CYS CB 1 1 9 4089 1 1 14 CYS H H -1.175 7.036 -3.662 1.00 . A A . 14 CYS H 1 1 9 4090 1 1 14 CYS HA H -3.637 8.240 -4.895 1.00 . A A . 14 CYS HA 1 1 9 4091 1 1 14 CYS HB2 H -0.924 8.966 -4.725 1.00 . A A . 14 CYS HB2 1 1 9 4092 1 1 14 CYS HB3 H -1.167 8.463 -6.387 1.00 . A A . 14 CYS HB3 1 1 9 4093 1 1 14 CYS N N -2.076 7.414 -3.689 1.00 . A A . 14 CYS N 1 1 9 4094 1 1 14 CYS O O -3.353 6.585 -6.953 1.00 . A A . 14 CYS O 1 1 9 4095 1 1 14 CYS SG S -2.418 10.422 -5.839 1.00 . A A . 14 CYS SG 1 1 9 4096 1 1 15 ASN C C -1.933 3.115 -5.693 1.00 . A A . 15 ASN C 1 1 9 4097 1 1 15 ASN CA C -1.812 4.400 -6.519 1.00 . A A . 15 ASN CA 1 1 9 4098 1 1 15 ASN CB C -0.425 4.481 -7.186 1.00 . A A . 15 ASN CB 1 1 9 4099 1 1 15 ASN CG C 0.532 5.341 -6.347 1.00 . A A . 15 ASN CG 1 1 9 4100 1 1 15 ASN H H -1.336 5.646 -4.834 1.00 . A A . 15 ASN H 1 1 9 4101 1 1 15 ASN HA H -2.582 4.435 -7.272 1.00 . A A . 15 ASN HA 1 1 9 4102 1 1 15 ASN HB2 H -0.012 3.488 -7.276 1.00 . A A . 15 ASN HB2 1 1 9 4103 1 1 15 ASN HB3 H -0.526 4.920 -8.168 1.00 . A A . 15 ASN HB3 1 1 9 4104 1 1 15 ASN HD21 H 0.572 6.827 -7.667 1.00 . A A . 15 ASN HD21 1 1 9 4105 1 1 15 ASN HD22 H 1.519 7.064 -6.268 1.00 . A A . 15 ASN HD22 1 1 9 4106 1 1 15 ASN N N -1.892 5.598 -5.638 1.00 . A A . 15 ASN N 1 1 9 4107 1 1 15 ASN ND2 N 0.906 6.507 -6.798 1.00 . A A . 15 ASN ND2 1 1 9 4108 1 1 15 ASN O O -1.784 3.124 -4.487 1.00 . A A . 15 ASN O 1 1 9 4109 1 1 15 ASN OD1 O 0.940 4.945 -5.273 1.00 . A A . 15 ASN OD1 1 1 9 4110 1 1 16 THR C C -1.040 0.421 -4.838 1.00 . A A . 16 THR C 1 1 9 4111 1 1 16 THR CA C -2.332 0.724 -5.597 1.00 . A A . 16 THR CA 1 1 9 4112 1 1 16 THR CB C -2.577 -0.334 -6.676 1.00 . A A . 16 THR CB 1 1 9 4113 1 1 16 THR CG2 C -3.528 -1.405 -6.142 1.00 . A A . 16 THR CG2 1 1 9 4114 1 1 16 THR H H -2.316 2.030 -7.311 1.00 . A A . 16 THR H 1 1 9 4115 1 1 16 THR HA H -3.171 0.760 -4.920 1.00 . A A . 16 THR HA 1 1 9 4116 1 1 16 THR HB H -1.640 -0.795 -6.948 1.00 . A A . 16 THR HB 1 1 9 4117 1 1 16 THR HG1 H -2.575 0.115 -8.570 1.00 . A A . 16 THR HG1 1 1 9 4118 1 1 16 THR HG21 H -4.521 -0.990 -6.048 1.00 . A A . 16 THR HG21 1 1 9 4119 1 1 16 THR HG22 H -3.186 -1.739 -5.174 1.00 . A A . 16 THR HG22 1 1 9 4120 1 1 16 THR HG23 H -3.550 -2.241 -6.825 1.00 . A A . 16 THR HG23 1 1 9 4121 1 1 16 THR N N -2.202 2.011 -6.338 1.00 . A A . 16 THR N 1 1 9 4122 1 1 16 THR O O -0.055 1.118 -4.972 1.00 . A A . 16 THR O 1 1 9 4123 1 1 16 THR OG1 O -3.151 0.285 -7.820 1.00 . A A . 16 THR OG1 1 1 9 4124 1 1 17 CYS C C 0.054 -2.403 -2.734 1.00 . A A . 17 CYS C 1 1 9 4125 1 1 17 CYS CA C 0.186 -0.975 -3.274 1.00 . A A . 17 CYS CA 1 1 9 4126 1 1 17 CYS CB C 0.245 0.028 -2.117 1.00 . A A . 17 CYS CB 1 1 9 4127 1 1 17 CYS H H -1.847 -1.163 -3.958 1.00 . A A . 17 CYS H 1 1 9 4128 1 1 17 CYS HA H 1.061 -0.885 -3.894 1.00 . A A . 17 CYS HA 1 1 9 4129 1 1 17 CYS HB2 H -0.759 0.339 -1.861 1.00 . A A . 17 CYS HB2 1 1 9 4130 1 1 17 CYS HB3 H 0.706 -0.442 -1.259 1.00 . A A . 17 CYS HB3 1 1 9 4131 1 1 17 CYS N N -1.040 -0.616 -4.045 1.00 . A A . 17 CYS N 1 1 9 4132 1 1 17 CYS O O -0.682 -2.655 -1.803 1.00 . A A . 17 CYS O 1 1 9 4133 1 1 17 CYS SG S 1.215 1.484 -2.595 1.00 . A A . 17 CYS SG 1 1 9 4134 1 1 18 ARG C C 1.343 -4.879 -1.469 1.00 . A A . 18 ARG C 1 1 9 4135 1 1 18 ARG CA C 0.657 -4.742 -2.814 1.00 . A A . 18 ARG CA 1 1 9 4136 1 1 18 ARG CB C 1.348 -5.601 -3.870 1.00 . A A . 18 ARG CB 1 1 9 4137 1 1 18 ARG CD C 0.040 -7.712 -4.141 1.00 . A A . 18 ARG CD 1 1 9 4138 1 1 18 ARG CG C 1.253 -7.071 -3.464 1.00 . A A . 18 ARG CG 1 1 9 4139 1 1 18 ARG CZ C 0.503 -10.053 -4.556 1.00 . A A . 18 ARG CZ 1 1 9 4140 1 1 18 ARG H H 1.345 -3.122 -4.061 1.00 . A A . 18 ARG H 1 1 9 4141 1 1 18 ARG HA H -0.376 -5.041 -2.711 1.00 . A A . 18 ARG HA 1 1 9 4142 1 1 18 ARG HB2 H 0.863 -5.457 -4.825 1.00 . A A . 18 ARG HB2 1 1 9 4143 1 1 18 ARG HB3 H 2.386 -5.315 -3.945 1.00 . A A . 18 ARG HB3 1 1 9 4144 1 1 18 ARG HD2 H -0.873 -7.243 -3.799 1.00 . A A . 18 ARG HD2 1 1 9 4145 1 1 18 ARG HD3 H 0.124 -7.638 -5.214 1.00 . A A . 18 ARG HD3 1 1 9 4146 1 1 18 ARG HE H -0.214 -9.397 -2.824 1.00 . A A . 18 ARG HE 1 1 9 4147 1 1 18 ARG HG2 H 2.151 -7.586 -3.765 1.00 . A A . 18 ARG HG2 1 1 9 4148 1 1 18 ARG HG3 H 1.142 -7.140 -2.392 1.00 . A A . 18 ARG HG3 1 1 9 4149 1 1 18 ARG HH11 H 1.554 -8.766 -5.670 1.00 . A A . 18 ARG HH11 1 1 9 4150 1 1 18 ARG HH12 H 1.609 -10.419 -6.184 1.00 . A A . 18 ARG HH12 1 1 9 4151 1 1 18 ARG HH21 H -0.450 -11.555 -3.634 1.00 . A A . 18 ARG HH21 1 1 9 4152 1 1 18 ARG HH22 H 0.472 -11.998 -5.033 1.00 . A A . 18 ARG HH22 1 1 9 4153 1 1 18 ARG N N 0.756 -3.339 -3.308 1.00 . A A . 18 ARG N 1 1 9 4154 1 1 18 ARG NE N 0.079 -9.141 -3.724 1.00 . A A . 18 ARG NE 1 1 9 4155 1 1 18 ARG NH1 N 1.282 -9.720 -5.547 1.00 . A A . 18 ARG NH1 1 1 9 4156 1 1 18 ARG NH2 N 0.147 -11.299 -4.395 1.00 . A A . 18 ARG NH2 1 1 9 4157 1 1 18 ARG O O 2.537 -5.088 -1.373 1.00 . A A . 18 ARG O 1 1 9 4158 1 1 19 CYS C C 2.209 -5.972 0.973 1.00 . A A . 19 CYS C 1 1 9 4159 1 1 19 CYS CA C 1.087 -4.924 0.946 1.00 . A A . 19 CYS CA 1 1 9 4160 1 1 19 CYS CB C -0.132 -5.416 1.716 1.00 . A A . 19 CYS CB 1 1 9 4161 1 1 19 CYS H H -0.394 -4.632 -0.571 1.00 . A A . 19 CYS H 1 1 9 4162 1 1 19 CYS HA H 1.423 -3.978 1.336 1.00 . A A . 19 CYS HA 1 1 9 4163 1 1 19 CYS HB2 H -0.850 -5.813 1.013 1.00 . A A . 19 CYS HB2 1 1 9 4164 1 1 19 CYS HB3 H 0.166 -6.191 2.393 1.00 . A A . 19 CYS HB3 1 1 9 4165 1 1 19 CYS N N 0.564 -4.783 -0.434 1.00 . A A . 19 CYS N 1 1 9 4166 1 1 19 CYS O O 1.966 -7.155 0.835 1.00 . A A . 19 CYS O 1 1 9 4167 1 1 19 CYS SG S -0.909 -4.059 2.629 1.00 . A A . 19 CYS SG 1 1 9 4168 1 1 20 GLY C C 4.197 -7.743 1.984 1.00 . A A . 20 GLY C 1 1 9 4169 1 1 20 GLY CA C 4.569 -6.515 1.152 1.00 . A A . 20 GLY CA 1 1 9 4170 1 1 20 GLY H H 3.607 -4.588 1.231 1.00 . A A . 20 GLY H 1 1 9 4171 1 1 20 GLY HA2 H 4.795 -6.821 0.140 1.00 . A A . 20 GLY HA2 1 1 9 4172 1 1 20 GLY HA3 H 5.436 -6.041 1.589 1.00 . A A . 20 GLY HA3 1 1 9 4173 1 1 20 GLY N N 3.432 -5.546 1.134 1.00 . A A . 20 GLY N 1 1 9 4174 1 1 20 GLY O O 3.214 -7.749 2.693 1.00 . A A . 20 GLY O 1 1 9 4175 1 1 21 SER C C 5.141 -9.818 4.143 1.00 . A A . 21 SER C 1 1 9 4176 1 1 21 SER CA C 4.684 -10.010 2.695 1.00 . A A . 21 SER CA 1 1 9 4177 1 1 21 SER CB C 5.484 -11.125 2.020 1.00 . A A . 21 SER CB 1 1 9 4178 1 1 21 SER H H 5.777 -8.753 1.327 1.00 . A A . 21 SER H 1 1 9 4179 1 1 21 SER HA H 3.631 -10.236 2.657 1.00 . A A . 21 SER HA 1 1 9 4180 1 1 21 SER HB2 H 5.469 -10.985 0.952 1.00 . A A . 21 SER HB2 1 1 9 4181 1 1 21 SER HB3 H 6.509 -11.095 2.371 1.00 . A A . 21 SER HB3 1 1 9 4182 1 1 21 SER HG H 4.850 -12.453 3.292 1.00 . A A . 21 SER HG 1 1 9 4183 1 1 21 SER N N 4.985 -8.782 1.904 1.00 . A A . 21 SER N 1 1 9 4184 1 1 21 SER O O 4.821 -10.601 5.016 1.00 . A A . 21 SER O 1 1 9 4185 1 1 21 SER OG O 4.898 -12.380 2.336 1.00 . A A . 21 SER OG 1 1 9 4186 1 1 22 ASP C C 5.567 -7.372 6.417 1.00 . A A . 22 ASP C 1 1 9 4187 1 1 22 ASP CA C 6.360 -8.524 5.794 1.00 . A A . 22 ASP CA 1 1 9 4188 1 1 22 ASP CB C 7.833 -8.142 5.645 1.00 . A A . 22 ASP CB 1 1 9 4189 1 1 22 ASP CG C 8.562 -9.221 4.843 1.00 . A A . 22 ASP CG 1 1 9 4190 1 1 22 ASP H H 6.126 -8.158 3.682 1.00 . A A . 22 ASP H 1 1 9 4191 1 1 22 ASP HA H 6.267 -9.415 6.392 1.00 . A A . 22 ASP HA 1 1 9 4192 1 1 22 ASP HB2 H 7.910 -7.194 5.129 1.00 . A A . 22 ASP HB2 1 1 9 4193 1 1 22 ASP HB3 H 8.283 -8.058 6.625 1.00 . A A . 22 ASP HB3 1 1 9 4194 1 1 22 ASP N N 5.884 -8.777 4.403 1.00 . A A . 22 ASP N 1 1 9 4195 1 1 22 ASP O O 5.639 -7.129 7.606 1.00 . A A . 22 ASP O 1 1 9 4196 1 1 22 ASP OD1 O 8.111 -10.354 4.865 1.00 . A A . 22 ASP OD1 1 1 9 4197 1 1 22 ASP OD2 O 9.560 -8.895 4.220 1.00 . A A . 22 ASP OD2 1 1 9 4198 1 1 23 GLY C C 4.842 -4.247 6.154 1.00 . A A . 23 GLY C 1 1 9 4199 1 1 23 GLY CA C 4.008 -5.532 6.172 1.00 . A A . 23 GLY CA 1 1 9 4200 1 1 23 GLY H H 4.762 -6.879 4.670 1.00 . A A . 23 GLY H 1 1 9 4201 1 1 23 GLY HA2 H 3.121 -5.395 5.569 1.00 . A A . 23 GLY HA2 1 1 9 4202 1 1 23 GLY HA3 H 3.722 -5.755 7.191 1.00 . A A . 23 GLY HA3 1 1 9 4203 1 1 23 GLY N N 4.808 -6.664 5.625 1.00 . A A . 23 GLY N 1 1 9 4204 1 1 23 GLY O O 4.469 -3.250 6.738 1.00 . A A . 23 GLY O 1 1 9 4205 1 1 24 LYS C C 7.447 -2.864 4.056 1.00 . A A . 24 LYS C 1 1 9 4206 1 1 24 LYS CA C 6.810 -3.026 5.440 1.00 . A A . 24 LYS CA 1 1 9 4207 1 1 24 LYS CB C 7.887 -3.240 6.506 1.00 . A A . 24 LYS CB 1 1 9 4208 1 1 24 LYS CD C 8.592 -2.662 8.836 1.00 . A A . 24 LYS CD 1 1 9 4209 1 1 24 LYS CE C 9.319 -1.350 9.142 1.00 . A A . 24 LYS CE 1 1 9 4210 1 1 24 LYS CG C 7.540 -2.420 7.751 1.00 . A A . 24 LYS CG 1 1 9 4211 1 1 24 LYS H H 6.254 -5.069 5.020 1.00 . A A . 24 LYS H 1 1 9 4212 1 1 24 LYS HA H 6.220 -2.159 5.685 1.00 . A A . 24 LYS HA 1 1 9 4213 1 1 24 LYS HB2 H 7.937 -4.288 6.763 1.00 . A A . 24 LYS HB2 1 1 9 4214 1 1 24 LYS HB3 H 8.843 -2.917 6.121 1.00 . A A . 24 LYS HB3 1 1 9 4215 1 1 24 LYS HD2 H 8.109 -3.025 9.732 1.00 . A A . 24 LYS HD2 1 1 9 4216 1 1 24 LYS HD3 H 9.305 -3.394 8.490 1.00 . A A . 24 LYS HD3 1 1 9 4217 1 1 24 LYS HE2 H 10.270 -1.320 8.630 1.00 . A A . 24 LYS HE2 1 1 9 4218 1 1 24 LYS HE3 H 8.709 -0.506 8.857 1.00 . A A . 24 LYS HE3 1 1 9 4219 1 1 24 LYS HG2 H 7.520 -1.370 7.495 1.00 . A A . 24 LYS HG2 1 1 9 4220 1 1 24 LYS HG3 H 6.571 -2.719 8.119 1.00 . A A . 24 LYS HG3 1 1 9 4221 1 1 24 LYS HZ1 H 8.600 -1.274 11.095 1.00 . A A . 24 LYS HZ1 1 1 9 4222 1 1 24 LYS HZ2 H 10.125 -0.555 10.889 1.00 . A A . 24 LYS HZ2 1 1 9 4223 1 1 24 LYS HZ3 H 9.976 -2.247 10.902 1.00 . A A . 24 LYS HZ3 1 1 9 4224 1 1 24 LYS N N 5.966 -4.257 5.488 1.00 . A A . 24 LYS N 1 1 9 4225 1 1 24 LYS NZ N 9.520 -1.358 10.618 1.00 . A A . 24 LYS NZ 1 1 9 4226 1 1 24 LYS O O 8.580 -2.447 3.929 1.00 . A A . 24 LYS O 1 1 9 4227 1 1 25 SER C C 6.176 -3.268 0.606 1.00 . A A . 25 SER C 1 1 9 4228 1 1 25 SER CA C 7.281 -3.048 1.641 1.00 . A A . 25 SER CA 1 1 9 4229 1 1 25 SER CB C 8.343 -4.140 1.526 1.00 . A A . 25 SER CB 1 1 9 4230 1 1 25 SER H H 5.809 -3.518 3.144 1.00 . A A . 25 SER H 1 1 9 4231 1 1 25 SER HA H 7.732 -2.077 1.513 1.00 . A A . 25 SER HA 1 1 9 4232 1 1 25 SER HB2 H 7.964 -5.059 1.948 1.00 . A A . 25 SER HB2 1 1 9 4233 1 1 25 SER HB3 H 8.583 -4.298 0.481 1.00 . A A . 25 SER HB3 1 1 9 4234 1 1 25 SER HG H 10.255 -4.223 1.875 1.00 . A A . 25 SER HG 1 1 9 4235 1 1 25 SER N N 6.723 -3.188 3.018 1.00 . A A . 25 SER N 1 1 9 4236 1 1 25 SER O O 5.756 -4.380 0.362 1.00 . A A . 25 SER O 1 1 9 4237 1 1 25 SER OG O 9.507 -3.743 2.238 1.00 . A A . 25 SER OG 1 1 9 4238 1 1 26 ALA C C 5.157 -2.014 -2.407 1.00 . A A . 26 ALA C 1 1 9 4239 1 1 26 ALA CA C 4.627 -2.389 -1.023 1.00 . A A . 26 ALA CA 1 1 9 4240 1 1 26 ALA CB C 3.516 -1.431 -0.590 1.00 . A A . 26 ALA CB 1 1 9 4241 1 1 26 ALA H H 6.052 -1.330 0.195 1.00 . A A . 26 ALA H 1 1 9 4242 1 1 26 ALA HA H 4.263 -3.403 -1.020 1.00 . A A . 26 ALA HA 1 1 9 4243 1 1 26 ALA HB1 H 2.882 -1.211 -1.437 1.00 . A A . 26 ALA HB1 1 1 9 4244 1 1 26 ALA HB2 H 3.953 -0.516 -0.220 1.00 . A A . 26 ALA HB2 1 1 9 4245 1 1 26 ALA HB3 H 2.928 -1.892 0.190 1.00 . A A . 26 ALA HB3 1 1 9 4246 1 1 26 ALA N N 5.702 -2.222 -0.007 1.00 . A A . 26 ALA N 1 1 9 4247 1 1 26 ALA O O 6.001 -1.150 -2.547 1.00 . A A . 26 ALA O 1 1 9 4248 1 1 27 ALA C C 4.382 -1.150 -5.366 1.00 . A A . 27 ALA C 1 1 9 4249 1 1 27 ALA CA C 5.154 -2.340 -4.802 1.00 . A A . 27 ALA CA 1 1 9 4250 1 1 27 ALA CB C 4.865 -3.596 -5.620 1.00 . A A . 27 ALA CB 1 1 9 4251 1 1 27 ALA H H 3.996 -3.354 -3.295 1.00 . A A . 27 ALA H 1 1 9 4252 1 1 27 ALA HA H 6.209 -2.137 -4.792 1.00 . A A . 27 ALA HA 1 1 9 4253 1 1 27 ALA HB1 H 5.343 -4.447 -5.158 1.00 . A A . 27 ALA HB1 1 1 9 4254 1 1 27 ALA HB2 H 5.246 -3.468 -6.622 1.00 . A A . 27 ALA HB2 1 1 9 4255 1 1 27 ALA HB3 H 3.797 -3.761 -5.660 1.00 . A A . 27 ALA HB3 1 1 9 4256 1 1 27 ALA N N 4.673 -2.658 -3.429 1.00 . A A . 27 ALA N 1 1 9 4257 1 1 27 ALA O O 4.950 -0.146 -5.744 1.00 . A A . 27 ALA O 1 1 9 4258 1 1 28 CYS C C 2.455 0.003 -7.463 1.00 . A A . 28 CYS C 1 1 9 4259 1 1 28 CYS CA C 2.242 -0.157 -5.954 1.00 . A A . 28 CYS CA 1 1 9 4260 1 1 28 CYS CB C 2.691 1.103 -5.208 1.00 . A A . 28 CYS CB 1 1 9 4261 1 1 28 CYS H H 2.663 -2.091 -5.107 1.00 . A A . 28 CYS H 1 1 9 4262 1 1 28 CYS HA H 1.204 -0.355 -5.747 1.00 . A A . 28 CYS HA 1 1 9 4263 1 1 28 CYS HB2 H 3.633 1.447 -5.612 1.00 . A A . 28 CYS HB2 1 1 9 4264 1 1 28 CYS HB3 H 1.945 1.876 -5.332 1.00 . A A . 28 CYS HB3 1 1 9 4265 1 1 28 CYS N N 3.086 -1.266 -5.422 1.00 . A A . 28 CYS N 1 1 9 4266 1 1 28 CYS O O 3.562 -0.072 -7.958 1.00 . A A . 28 CYS O 1 1 9 4267 1 1 28 CYS SG S 2.888 0.737 -3.445 1.00 . A A . 28 CYS SG 1 1 9 4268 1 1 29 THR C C 2.329 1.640 -10.002 1.00 . A A . 29 THR C 1 1 9 4269 1 1 29 THR CA C 1.519 0.384 -9.670 1.00 . A A . 29 THR CA 1 1 9 4270 1 1 29 THR CB C 0.080 0.527 -10.166 1.00 . A A . 29 THR CB 1 1 9 4271 1 1 29 THR CG2 C -0.486 -0.855 -10.499 1.00 . A A . 29 THR CG2 1 1 9 4272 1 1 29 THR H H 0.514 0.273 -7.769 1.00 . A A . 29 THR H 1 1 9 4273 1 1 29 THR HA H 1.976 -0.486 -10.109 1.00 . A A . 29 THR HA 1 1 9 4274 1 1 29 THR HB H 0.063 1.143 -11.051 1.00 . A A . 29 THR HB 1 1 9 4275 1 1 29 THR HG1 H -1.535 1.415 -9.546 1.00 . A A . 29 THR HG1 1 1 9 4276 1 1 29 THR HG21 H -0.450 -1.010 -11.567 1.00 . A A . 29 THR HG21 1 1 9 4277 1 1 29 THR HG22 H -1.509 -0.915 -10.160 1.00 . A A . 29 THR HG22 1 1 9 4278 1 1 29 THR HG23 H 0.102 -1.614 -10.004 1.00 . A A . 29 THR HG23 1 1 9 4279 1 1 29 THR N N 1.396 0.220 -8.193 1.00 . A A . 29 THR N 1 1 9 4280 1 1 29 THR O O 2.993 1.712 -11.017 1.00 . A A . 29 THR O 1 1 9 4281 1 1 29 THR OG1 O -0.708 1.131 -9.150 1.00 . A A . 29 THR OG1 1 1 9 4282 1 1 30 ARG C C 4.050 4.141 -8.303 1.00 . A A . 30 ARG C 1 1 9 4283 1 1 30 ARG CA C 3.047 3.880 -9.427 1.00 . A A . 30 ARG CA 1 1 9 4284 1 1 30 ARG CB C 1.997 4.989 -9.475 1.00 . A A . 30 ARG CB 1 1 9 4285 1 1 30 ARG CD C 1.185 5.763 -11.707 1.00 . A A . 30 ARG CD 1 1 9 4286 1 1 30 ARG CG C 2.288 5.915 -10.657 1.00 . A A . 30 ARG CG 1 1 9 4287 1 1 30 ARG CZ C 0.655 7.689 -13.081 1.00 . A A . 30 ARG CZ 1 1 9 4288 1 1 30 ARG H H 1.739 2.553 -8.343 1.00 . A A . 30 ARG H 1 1 9 4289 1 1 30 ARG HA H 3.554 3.814 -10.374 1.00 . A A . 30 ARG HA 1 1 9 4290 1 1 30 ARG HB2 H 1.015 4.551 -9.592 1.00 . A A . 30 ARG HB2 1 1 9 4291 1 1 30 ARG HB3 H 2.032 5.559 -8.557 1.00 . A A . 30 ARG HB3 1 1 9 4292 1 1 30 ARG HD2 H 1.599 5.387 -12.633 1.00 . A A . 30 ARG HD2 1 1 9 4293 1 1 30 ARG HD3 H 0.408 5.108 -11.347 1.00 . A A . 30 ARG HD3 1 1 9 4294 1 1 30 ARG HE H 0.280 7.631 -11.132 1.00 . A A . 30 ARG HE 1 1 9 4295 1 1 30 ARG HG2 H 2.320 6.939 -10.314 1.00 . A A . 30 ARG HG2 1 1 9 4296 1 1 30 ARG HG3 H 3.237 5.650 -11.095 1.00 . A A . 30 ARG HG3 1 1 9 4297 1 1 30 ARG HH11 H 0.113 6.014 -14.035 1.00 . A A . 30 ARG HH11 1 1 9 4298 1 1 30 ARG HH12 H 0.360 7.402 -15.040 1.00 . A A . 30 ARG HH12 1 1 9 4299 1 1 30 ARG HH21 H 1.199 9.493 -12.404 1.00 . A A . 30 ARG HH21 1 1 9 4300 1 1 30 ARG HH22 H 0.977 9.370 -14.118 1.00 . A A . 30 ARG HH22 1 1 9 4301 1 1 30 ARG N N 2.280 2.630 -9.156 1.00 . A A . 30 ARG N 1 1 9 4302 1 1 30 ARG NE N 0.644 7.138 -11.897 1.00 . A A . 30 ARG NE 1 1 9 4303 1 1 30 ARG NH1 N 0.353 6.979 -14.134 1.00 . A A . 30 ARG NH1 1 1 9 4304 1 1 30 ARG NH2 N 0.968 8.948 -13.211 1.00 . A A . 30 ARG NH2 1 1 9 4305 1 1 30 ARG O O 5.245 4.009 -8.478 1.00 . A A . 30 ARG O 1 1 9 4306 1 1 31 MET C C 3.711 5.216 -4.766 1.00 . A A . 31 MET C 1 1 9 4307 1 1 31 MET CA C 4.495 4.783 -6.011 1.00 . A A . 31 MET CA 1 1 9 4308 1 1 31 MET CB C 5.395 5.919 -6.498 1.00 . A A . 31 MET CB 1 1 9 4309 1 1 31 MET CE C 8.748 5.990 -4.156 1.00 . A A . 31 MET CE 1 1 9 4310 1 1 31 MET CG C 6.831 5.659 -6.046 1.00 . A A . 31 MET CG 1 1 9 4311 1 1 31 MET H H 2.608 4.612 -7.035 1.00 . A A . 31 MET H 1 1 9 4312 1 1 31 MET HA H 5.091 3.911 -5.795 1.00 . A A . 31 MET HA 1 1 9 4313 1 1 31 MET HB2 H 5.359 5.969 -7.577 1.00 . A A . 31 MET HB2 1 1 9 4314 1 1 31 MET HB3 H 5.051 6.855 -6.083 1.00 . A A . 31 MET HB3 1 1 9 4315 1 1 31 MET HE1 H 9.130 5.180 -3.551 1.00 . A A . 31 MET HE1 1 1 9 4316 1 1 31 MET HE2 H 9.024 6.932 -3.707 1.00 . A A . 31 MET HE2 1 1 9 4317 1 1 31 MET HE3 H 9.166 5.932 -5.151 1.00 . A A . 31 MET HE3 1 1 9 4318 1 1 31 MET HG2 H 7.115 4.652 -6.308 1.00 . A A . 31 MET HG2 1 1 9 4319 1 1 31 MET HG3 H 7.494 6.359 -6.534 1.00 . A A . 31 MET HG3 1 1 9 4320 1 1 31 MET N N 3.572 4.512 -7.150 1.00 . A A . 31 MET N 1 1 9 4321 1 1 31 MET O O 3.612 4.483 -3.802 1.00 . A A . 31 MET O 1 1 9 4322 1 1 31 MET SD S 6.946 5.871 -4.252 1.00 . A A . 31 MET SD 1 1 9 4323 1 1 32 ALA C C 2.160 8.410 -3.686 1.00 . A A . 32 ALA C 1 1 9 4324 1 1 32 ALA CA C 2.382 6.894 -3.593 1.00 . A A . 32 ALA CA 1 1 9 4325 1 1 32 ALA CB C 3.249 6.566 -2.375 1.00 . A A . 32 ALA CB 1 1 9 4326 1 1 32 ALA H H 3.250 6.973 -5.568 1.00 . A A . 32 ALA H 1 1 9 4327 1 1 32 ALA HA H 1.438 6.379 -3.522 1.00 . A A . 32 ALA HA 1 1 9 4328 1 1 32 ALA HB1 H 2.872 5.677 -1.893 1.00 . A A . 32 ALA HB1 1 1 9 4329 1 1 32 ALA HB2 H 3.222 7.393 -1.680 1.00 . A A . 32 ALA HB2 1 1 9 4330 1 1 32 ALA HB3 H 4.267 6.398 -2.694 1.00 . A A . 32 ALA HB3 1 1 9 4331 1 1 32 ALA N N 3.157 6.404 -4.779 1.00 . A A . 32 ALA N 1 1 9 4332 1 1 32 ALA O O 3.093 9.178 -3.814 1.00 . A A . 32 ALA O 1 1 9 4333 1 1 33 CYS C C -0.663 10.645 -2.967 1.00 . A A . 33 CYS C 1 1 9 4334 1 1 33 CYS CA C 0.640 10.303 -3.711 1.00 . A A . 33 CYS CA 1 1 9 4335 1 1 33 CYS CB C 0.554 10.575 -5.219 1.00 . A A . 33 CYS CB 1 1 9 4336 1 1 33 CYS H H 0.199 8.212 -3.532 1.00 . A A . 33 CYS H 1 1 9 4337 1 1 33 CYS HA H 1.460 10.862 -3.291 1.00 . A A . 33 CYS HA 1 1 9 4338 1 1 33 CYS HB2 H 1.467 11.027 -5.513 1.00 . A A . 33 CYS HB2 1 1 9 4339 1 1 33 CYS HB3 H 0.449 9.637 -5.744 1.00 . A A . 33 CYS HB3 1 1 9 4340 1 1 33 CYS N N 0.930 8.844 -3.626 1.00 . A A . 33 CYS N 1 1 9 4341 1 1 33 CYS O O -1.475 9.792 -2.698 1.00 . A A . 33 CYS O 1 1 9 4342 1 1 33 CYS SG S -0.842 11.675 -5.650 1.00 . A A . 33 CYS SG 1 1 9 4343 1 1 34 PRO C C -3.082 12.790 -2.875 1.00 . A A . 34 PRO C 1 1 9 4344 1 1 34 PRO CA C -1.962 12.405 -1.911 1.00 . A A . 34 PRO CA 1 1 9 4345 1 1 34 PRO CB C -1.405 13.630 -1.197 1.00 . A A . 34 PRO CB 1 1 9 4346 1 1 34 PRO CD C 0.145 12.964 -2.967 1.00 . A A . 34 PRO CD 1 1 9 4347 1 1 34 PRO CG C -0.230 14.079 -2.019 1.00 . A A . 34 PRO CG 1 1 9 4348 1 1 34 PRO HA H -2.303 11.680 -1.191 1.00 . A A . 34 PRO HA 1 1 9 4349 1 1 34 PRO HB2 H -2.155 14.409 -1.155 1.00 . A A . 34 PRO HB2 1 1 9 4350 1 1 34 PRO HB3 H -1.080 13.368 -0.202 1.00 . A A . 34 PRO HB3 1 1 9 4351 1 1 34 PRO HD2 H 0.023 13.291 -3.988 1.00 . A A . 34 PRO HD2 1 1 9 4352 1 1 34 PRO HD3 H 1.154 12.624 -2.797 1.00 . A A . 34 PRO HD3 1 1 9 4353 1 1 34 PRO HG2 H -0.500 14.958 -2.583 1.00 . A A . 34 PRO HG2 1 1 9 4354 1 1 34 PRO HG3 H 0.604 14.298 -1.373 1.00 . A A . 34 PRO HG3 1 1 9 4355 1 1 34 PRO N N -0.790 11.900 -2.652 1.00 . A A . 34 PRO N 1 1 9 4356 1 1 34 PRO O O -3.504 13.927 -2.938 1.00 . A A . 34 PRO O 1 1 9 4357 1 1 35 GLN C C -4.216 13.195 -5.595 1.00 . A A . 35 GLN C 1 1 9 4358 1 1 35 GLN CA C -4.659 12.129 -4.588 1.00 . A A . 35 GLN CA 1 1 9 4359 1 1 35 GLN CB C -5.812 12.648 -3.728 1.00 . A A . 35 GLN CB 1 1 9 4360 1 1 35 GLN CD C -6.915 10.573 -2.875 1.00 . A A . 35 GLN CD 1 1 9 4361 1 1 35 GLN CG C -7.021 11.722 -3.879 1.00 . A A . 35 GLN CG 1 1 9 4362 1 1 35 GLN H H -3.198 10.941 -3.540 1.00 . A A . 35 GLN H 1 1 9 4363 1 1 35 GLN HA H -4.957 11.227 -5.098 1.00 . A A . 35 GLN HA 1 1 9 4364 1 1 35 GLN HB2 H -5.505 12.673 -2.693 1.00 . A A . 35 GLN HB2 1 1 9 4365 1 1 35 GLN HB3 H -6.081 13.643 -4.049 1.00 . A A . 35 GLN HB3 1 1 9 4366 1 1 35 GLN HE21 H -7.875 11.550 -1.435 1.00 . A A . 35 GLN HE21 1 1 9 4367 1 1 35 GLN HE22 H -7.364 9.983 -1.031 1.00 . A A . 35 GLN HE22 1 1 9 4368 1 1 35 GLN HG2 H -7.927 12.281 -3.695 1.00 . A A . 35 GLN HG2 1 1 9 4369 1 1 35 GLN HG3 H -7.044 11.321 -4.881 1.00 . A A . 35 GLN HG3 1 1 9 4370 1 1 35 GLN N N -3.561 11.843 -3.620 1.00 . A A . 35 GLN N 1 1 9 4371 1 1 35 GLN NE2 N -7.427 10.714 -1.681 1.00 . A A . 35 GLN NE2 1 1 9 4372 1 1 35 GLN O O -4.784 13.232 -6.675 1.00 . A A . 35 GLN O 1 1 9 4373 1 1 35 GLN OXT O -3.319 13.953 -5.270 1.00 . A A . 35 GLN OXT 1 1 9 4374 1 1 35 GLN OE1 O -6.363 9.534 -3.179 1.00 . A A . 35 GLN OE1 1 1 10 4375 1 1 1 GLU C C 5.300 2.781 3.671 1.00 . A A . 1 GLU C 1 1 10 4376 1 1 1 GLU CA C 6.585 3.593 3.857 1.00 . A A . 1 GLU CA 1 1 10 4377 1 1 1 GLU CB C 6.497 4.924 3.108 1.00 . A A . 1 GLU CB 1 1 10 4378 1 1 1 GLU CD C 7.620 7.156 3.004 1.00 . A A . 1 GLU CD 1 1 10 4379 1 1 1 GLU CG C 7.837 5.656 3.205 1.00 . A A . 1 GLU CG 1 1 10 4380 1 1 1 GLU H1 H 8.606 3.100 3.767 1.00 . A A . 1 GLU H1 1 1 10 4381 1 1 1 GLU H2 H 7.843 3.181 2.250 1.00 . A A . 1 GLU H2 1 1 10 4382 1 1 1 GLU H3 H 7.569 1.853 3.274 1.00 . A A . 1 GLU H3 1 1 10 4383 1 1 1 GLU HA H 6.769 3.772 4.904 1.00 . A A . 1 GLU HA 1 1 10 4384 1 1 1 GLU HB2 H 6.262 4.737 2.069 1.00 . A A . 1 GLU HB2 1 1 10 4385 1 1 1 GLU HB3 H 5.723 5.536 3.548 1.00 . A A . 1 GLU HB3 1 1 10 4386 1 1 1 GLU HG2 H 8.271 5.482 4.180 1.00 . A A . 1 GLU HG2 1 1 10 4387 1 1 1 GLU HG3 H 8.505 5.286 2.443 1.00 . A A . 1 GLU HG3 1 1 10 4388 1 1 1 GLU N N 7.738 2.877 3.240 1.00 . A A . 1 GLU N 1 1 10 4389 1 1 1 GLU O O 4.359 3.224 3.043 1.00 . A A . 1 GLU O 1 1 10 4390 1 1 1 GLU OE1 O 6.976 7.517 2.031 1.00 . A A . 1 GLU OE1 1 1 10 4391 1 1 1 GLU OE2 O 8.100 7.920 3.825 1.00 . A A . 1 GLU OE2 1 1 10 4392 1 1 2 VAL C C 3.454 0.422 5.448 1.00 . A A . 2 VAL C 1 1 10 4393 1 1 2 VAL CA C 4.033 0.751 4.067 1.00 . A A . 2 VAL CA 1 1 10 4394 1 1 2 VAL CB C 4.514 -0.518 3.351 1.00 . A A . 2 VAL CB 1 1 10 4395 1 1 2 VAL CG1 C 3.613 -1.707 3.706 1.00 . A A . 2 VAL CG1 1 1 10 4396 1 1 2 VAL CG2 C 4.463 -0.288 1.840 1.00 . A A . 2 VAL CG2 1 1 10 4397 1 1 2 VAL H H 6.026 1.256 4.715 1.00 . A A . 2 VAL H 1 1 10 4398 1 1 2 VAL HA H 3.298 1.257 3.463 1.00 . A A . 2 VAL HA 1 1 10 4399 1 1 2 VAL HB H 5.529 -0.736 3.649 1.00 . A A . 2 VAL HB 1 1 10 4400 1 1 2 VAL HG11 H 3.882 -2.085 4.682 1.00 . A A . 2 VAL HG11 1 1 10 4401 1 1 2 VAL HG12 H 3.740 -2.488 2.971 1.00 . A A . 2 VAL HG12 1 1 10 4402 1 1 2 VAL HG13 H 2.581 -1.387 3.716 1.00 . A A . 2 VAL HG13 1 1 10 4403 1 1 2 VAL HG21 H 3.435 -0.295 1.509 1.00 . A A . 2 VAL HG21 1 1 10 4404 1 1 2 VAL HG22 H 5.009 -1.073 1.338 1.00 . A A . 2 VAL HG22 1 1 10 4405 1 1 2 VAL HG23 H 4.909 0.667 1.608 1.00 . A A . 2 VAL HG23 1 1 10 4406 1 1 2 VAL N N 5.255 1.593 4.212 1.00 . A A . 2 VAL N 1 1 10 4407 1 1 2 VAL O O 4.125 -0.122 6.302 1.00 . A A . 2 VAL O 1 1 10 4408 1 1 3 THR C C 0.311 -0.378 6.769 1.00 . A A . 3 THR C 1 1 10 4409 1 1 3 THR CA C 1.582 0.446 6.982 1.00 . A A . 3 THR CA 1 1 10 4410 1 1 3 THR CB C 1.253 1.812 7.584 1.00 . A A . 3 THR CB 1 1 10 4411 1 1 3 THR CG2 C 2.495 2.702 7.535 1.00 . A A . 3 THR CG2 1 1 10 4412 1 1 3 THR H H 1.687 1.179 4.959 1.00 . A A . 3 THR H 1 1 10 4413 1 1 3 THR HA H 2.272 -0.084 7.620 1.00 . A A . 3 THR HA 1 1 10 4414 1 1 3 THR HB H 0.943 1.689 8.610 1.00 . A A . 3 THR HB 1 1 10 4415 1 1 3 THR HG1 H 0.599 2.978 6.170 1.00 . A A . 3 THR HG1 1 1 10 4416 1 1 3 THR HG21 H 3.330 2.177 7.976 1.00 . A A . 3 THR HG21 1 1 10 4417 1 1 3 THR HG22 H 2.308 3.610 8.086 1.00 . A A . 3 THR HG22 1 1 10 4418 1 1 3 THR HG23 H 2.723 2.944 6.507 1.00 . A A . 3 THR HG23 1 1 10 4419 1 1 3 THR N N 2.211 0.744 5.665 1.00 . A A . 3 THR N 1 1 10 4420 1 1 3 THR O O -0.597 -0.362 7.577 1.00 . A A . 3 THR O 1 1 10 4421 1 1 3 THR OG1 O 0.203 2.417 6.840 1.00 . A A . 3 THR OG1 1 1 10 4422 1 1 4 CYS C C -0.690 -3.387 5.783 1.00 . A A . 4 CYS C 1 1 10 4423 1 1 4 CYS CA C -0.963 -1.923 5.400 1.00 . A A . 4 CYS CA 1 1 10 4424 1 1 4 CYS CB C -1.209 -1.724 3.885 1.00 . A A . 4 CYS CB 1 1 10 4425 1 1 4 CYS H H 0.991 -1.086 5.045 1.00 . A A . 4 CYS H 1 1 10 4426 1 1 4 CYS HA H -1.808 -1.547 5.958 1.00 . A A . 4 CYS HA 1 1 10 4427 1 1 4 CYS HB2 H -2.123 -1.166 3.748 1.00 . A A . 4 CYS HB2 1 1 10 4428 1 1 4 CYS HB3 H -0.385 -1.156 3.470 1.00 . A A . 4 CYS HB3 1 1 10 4429 1 1 4 CYS N N 0.244 -1.094 5.682 1.00 . A A . 4 CYS N 1 1 10 4430 1 1 4 CYS O O 0.380 -3.727 6.248 1.00 . A A . 4 CYS O 1 1 10 4431 1 1 4 CYS SG S -1.350 -3.303 2.995 1.00 . A A . 4 CYS SG 1 1 10 4432 1 1 5 GLU C C -0.595 -6.352 4.829 1.00 . A A . 5 GLU C 1 1 10 4433 1 1 5 GLU CA C -1.430 -5.688 5.924 1.00 . A A . 5 GLU CA 1 1 10 4434 1 1 5 GLU CB C -2.831 -6.297 5.986 1.00 . A A . 5 GLU CB 1 1 10 4435 1 1 5 GLU CD C -3.943 -4.325 7.043 1.00 . A A . 5 GLU CD 1 1 10 4436 1 1 5 GLU CG C -3.551 -5.791 7.238 1.00 . A A . 5 GLU CG 1 1 10 4437 1 1 5 GLU H H -2.497 -3.966 5.193 1.00 . A A . 5 GLU H 1 1 10 4438 1 1 5 GLU HA H -0.943 -5.780 6.881 1.00 . A A . 5 GLU HA 1 1 10 4439 1 1 5 GLU HB2 H -3.389 -6.007 5.106 1.00 . A A . 5 GLU HB2 1 1 10 4440 1 1 5 GLU HB3 H -2.755 -7.372 6.026 1.00 . A A . 5 GLU HB3 1 1 10 4441 1 1 5 GLU HG2 H -4.440 -6.383 7.407 1.00 . A A . 5 GLU HG2 1 1 10 4442 1 1 5 GLU HG3 H -2.894 -5.876 8.090 1.00 . A A . 5 GLU HG3 1 1 10 4443 1 1 5 GLU N N -1.644 -4.256 5.581 1.00 . A A . 5 GLU N 1 1 10 4444 1 1 5 GLU O O -0.722 -6.025 3.667 1.00 . A A . 5 GLU O 1 1 10 4445 1 1 5 GLU OE1 O -4.842 -4.071 6.257 1.00 . A A . 5 GLU OE1 1 1 10 4446 1 1 5 GLU OE2 O -3.338 -3.481 7.682 1.00 . A A . 5 GLU OE2 1 1 10 4447 1 1 6 PRO C C 0.299 -8.878 3.356 1.00 . A A . 6 PRO C 1 1 10 4448 1 1 6 PRO CA C 1.121 -7.972 4.279 1.00 . A A . 6 PRO CA 1 1 10 4449 1 1 6 PRO CB C 2.051 -8.782 5.182 1.00 . A A . 6 PRO CB 1 1 10 4450 1 1 6 PRO CD C 0.447 -7.717 6.618 1.00 . A A . 6 PRO CD 1 1 10 4451 1 1 6 PRO CG C 1.293 -8.952 6.458 1.00 . A A . 6 PRO CG 1 1 10 4452 1 1 6 PRO HA H 1.693 -7.265 3.703 1.00 . A A . 6 PRO HA 1 1 10 4453 1 1 6 PRO HB2 H 2.262 -9.744 4.738 1.00 . A A . 6 PRO HB2 1 1 10 4454 1 1 6 PRO HB3 H 2.965 -8.240 5.366 1.00 . A A . 6 PRO HB3 1 1 10 4455 1 1 6 PRO HD2 H -0.498 -7.963 7.086 1.00 . A A . 6 PRO HD2 1 1 10 4456 1 1 6 PRO HD3 H 0.973 -6.965 7.185 1.00 . A A . 6 PRO HD3 1 1 10 4457 1 1 6 PRO HG2 H 0.666 -9.831 6.400 1.00 . A A . 6 PRO HG2 1 1 10 4458 1 1 6 PRO HG3 H 1.977 -9.034 7.289 1.00 . A A . 6 PRO HG3 1 1 10 4459 1 1 6 PRO N N 0.242 -7.261 5.239 1.00 . A A . 6 PRO N 1 1 10 4460 1 1 6 PRO O O -0.324 -9.826 3.793 1.00 . A A . 6 PRO O 1 1 10 4461 1 1 7 GLY C C -1.950 -8.961 1.126 1.00 . A A . 7 GLY C 1 1 10 4462 1 1 7 GLY CA C -0.494 -9.424 1.128 1.00 . A A . 7 GLY CA 1 1 10 4463 1 1 7 GLY H H 0.796 -7.814 1.751 1.00 . A A . 7 GLY H 1 1 10 4464 1 1 7 GLY HA2 H -0.079 -9.321 0.133 1.00 . A A . 7 GLY HA2 1 1 10 4465 1 1 7 GLY HA3 H -0.449 -10.459 1.435 1.00 . A A . 7 GLY HA3 1 1 10 4466 1 1 7 GLY N N 0.289 -8.586 2.081 1.00 . A A . 7 GLY N 1 1 10 4467 1 1 7 GLY O O -2.798 -9.547 1.770 1.00 . A A . 7 GLY O 1 1 10 4468 1 1 8 THR C C -3.926 -6.435 -0.774 1.00 . A A . 8 THR C 1 1 10 4469 1 1 8 THR CA C -3.663 -7.412 0.387 1.00 . A A . 8 THR CA 1 1 10 4470 1 1 8 THR CB C -3.848 -6.696 1.724 1.00 . A A . 8 THR CB 1 1 10 4471 1 1 8 THR CG2 C -5.330 -6.383 1.932 1.00 . A A . 8 THR CG2 1 1 10 4472 1 1 8 THR H H -1.554 -7.451 -0.094 1.00 . A A . 8 THR H 1 1 10 4473 1 1 8 THR HA H -4.345 -8.245 0.330 1.00 . A A . 8 THR HA 1 1 10 4474 1 1 8 THR HB H -3.288 -5.773 1.719 1.00 . A A . 8 THR HB 1 1 10 4475 1 1 8 THR HG1 H -3.923 -7.357 3.552 1.00 . A A . 8 THR HG1 1 1 10 4476 1 1 8 THR HG21 H -5.580 -6.502 2.976 1.00 . A A . 8 THR HG21 1 1 10 4477 1 1 8 THR HG22 H -5.927 -7.061 1.339 1.00 . A A . 8 THR HG22 1 1 10 4478 1 1 8 THR HG23 H -5.531 -5.367 1.627 1.00 . A A . 8 THR HG23 1 1 10 4479 1 1 8 THR N N -2.251 -7.909 0.412 1.00 . A A . 8 THR N 1 1 10 4480 1 1 8 THR O O -5.061 -6.192 -1.113 1.00 . A A . 8 THR O 1 1 10 4481 1 1 8 THR OG1 O -3.383 -7.529 2.775 1.00 . A A . 8 THR OG1 1 1 10 4482 1 1 9 THR C C -4.191 -3.879 -2.172 1.00 . A A . 9 THR C 1 1 10 4483 1 1 9 THR CA C -3.083 -4.886 -2.489 1.00 . A A . 9 THR CA 1 1 10 4484 1 1 9 THR CB C -3.397 -5.717 -3.748 1.00 . A A . 9 THR CB 1 1 10 4485 1 1 9 THR CG2 C -4.717 -6.479 -3.599 1.00 . A A . 9 THR CG2 1 1 10 4486 1 1 9 THR H H -1.993 -6.064 -1.058 1.00 . A A . 9 THR H 1 1 10 4487 1 1 9 THR HA H -2.163 -4.346 -2.643 1.00 . A A . 9 THR HA 1 1 10 4488 1 1 9 THR HB H -2.598 -6.425 -3.913 1.00 . A A . 9 THR HB 1 1 10 4489 1 1 9 THR HG1 H -2.630 -4.427 -4.985 1.00 . A A . 9 THR HG1 1 1 10 4490 1 1 9 THR HG21 H -4.606 -7.247 -2.849 1.00 . A A . 9 THR HG21 1 1 10 4491 1 1 9 THR HG22 H -4.973 -6.936 -4.543 1.00 . A A . 9 THR HG22 1 1 10 4492 1 1 9 THR HG23 H -5.500 -5.800 -3.308 1.00 . A A . 9 THR HG23 1 1 10 4493 1 1 9 THR N N -2.897 -5.864 -1.364 1.00 . A A . 9 THR N 1 1 10 4494 1 1 9 THR O O -5.353 -4.203 -2.063 1.00 . A A . 9 THR O 1 1 10 4495 1 1 9 THR OG1 O -3.485 -4.848 -4.868 1.00 . A A . 9 THR OG1 1 1 10 4496 1 1 10 PHE C C -4.538 -0.286 -2.389 1.00 . A A . 10 PHE C 1 1 10 4497 1 1 10 PHE CA C -4.849 -1.611 -1.688 1.00 . A A . 10 PHE CA 1 1 10 4498 1 1 10 PHE CB C -4.756 -1.452 -0.172 1.00 . A A . 10 PHE CB 1 1 10 4499 1 1 10 PHE CD1 C -2.339 -2.097 0.133 1.00 . A A . 10 PHE CD1 1 1 10 4500 1 1 10 PHE CD2 C -3.010 0.177 0.634 1.00 . A A . 10 PHE CD2 1 1 10 4501 1 1 10 PHE CE1 C -1.020 -1.785 0.481 1.00 . A A . 10 PHE CE1 1 1 10 4502 1 1 10 PHE CE2 C -1.690 0.489 0.983 1.00 . A A . 10 PHE CE2 1 1 10 4503 1 1 10 PHE CG C -3.334 -1.115 0.208 1.00 . A A . 10 PHE CG 1 1 10 4504 1 1 10 PHE CZ C -0.696 -0.493 0.906 1.00 . A A . 10 PHE CZ 1 1 10 4505 1 1 10 PHE H H -2.880 -2.389 -2.102 1.00 . A A . 10 PHE H 1 1 10 4506 1 1 10 PHE HA H -5.832 -1.961 -1.959 1.00 . A A . 10 PHE HA 1 1 10 4507 1 1 10 PHE HB2 H -5.413 -0.659 0.149 1.00 . A A . 10 PHE HB2 1 1 10 4508 1 1 10 PHE HB3 H -5.044 -2.378 0.304 1.00 . A A . 10 PHE HB3 1 1 10 4509 1 1 10 PHE HD1 H -2.589 -3.094 -0.195 1.00 . A A . 10 PHE HD1 1 1 10 4510 1 1 10 PHE HD2 H -3.778 0.934 0.693 1.00 . A A . 10 PHE HD2 1 1 10 4511 1 1 10 PHE HE1 H -0.252 -2.543 0.421 1.00 . A A . 10 PHE HE1 1 1 10 4512 1 1 10 PHE HE2 H -1.440 1.487 1.312 1.00 . A A . 10 PHE HE2 1 1 10 4513 1 1 10 PHE HZ H 0.323 -0.254 1.175 1.00 . A A . 10 PHE HZ 1 1 10 4514 1 1 10 PHE N N -3.826 -2.639 -2.014 1.00 . A A . 10 PHE N 1 1 10 4515 1 1 10 PHE O O -3.426 -0.038 -2.809 1.00 . A A . 10 PHE O 1 1 10 4516 1 1 11 LYS C C -5.090 2.974 -2.125 1.00 . A A . 11 LYS C 1 1 10 4517 1 1 11 LYS CA C -5.292 1.881 -3.179 1.00 . A A . 11 LYS CA 1 1 10 4518 1 1 11 LYS CB C -6.570 2.133 -3.982 1.00 . A A . 11 LYS CB 1 1 10 4519 1 1 11 LYS CD C -7.403 3.247 -6.058 1.00 . A A . 11 LYS CD 1 1 10 4520 1 1 11 LYS CE C -7.918 4.659 -6.351 1.00 . A A . 11 LYS CE 1 1 10 4521 1 1 11 LYS CG C -6.355 3.304 -4.945 1.00 . A A . 11 LYS CG 1 1 10 4522 1 1 11 LYS H H -6.405 0.343 -2.160 1.00 . A A . 11 LYS H 1 1 10 4523 1 1 11 LYS HA H -4.443 1.829 -3.839 1.00 . A A . 11 LYS HA 1 1 10 4524 1 1 11 LYS HB2 H -6.819 1.246 -4.546 1.00 . A A . 11 LYS HB2 1 1 10 4525 1 1 11 LYS HB3 H -7.379 2.370 -3.307 1.00 . A A . 11 LYS HB3 1 1 10 4526 1 1 11 LYS HD2 H -6.958 2.833 -6.952 1.00 . A A . 11 LYS HD2 1 1 10 4527 1 1 11 LYS HD3 H -8.228 2.624 -5.744 1.00 . A A . 11 LYS HD3 1 1 10 4528 1 1 11 LYS HE2 H -8.997 4.657 -6.419 1.00 . A A . 11 LYS HE2 1 1 10 4529 1 1 11 LYS HE3 H -7.589 5.344 -5.586 1.00 . A A . 11 LYS HE3 1 1 10 4530 1 1 11 LYS HG2 H -6.451 4.236 -4.405 1.00 . A A . 11 LYS HG2 1 1 10 4531 1 1 11 LYS HG3 H -5.368 3.238 -5.378 1.00 . A A . 11 LYS HG3 1 1 10 4532 1 1 11 LYS HZ1 H -6.458 4.458 -7.821 1.00 . A A . 11 LYS HZ1 1 1 10 4533 1 1 11 LYS HZ2 H -7.062 6.037 -7.655 1.00 . A A . 11 LYS HZ2 1 1 10 4534 1 1 11 LYS HZ3 H -7.996 4.844 -8.423 1.00 . A A . 11 LYS HZ3 1 1 10 4535 1 1 11 LYS N N -5.518 0.567 -2.511 1.00 . A A . 11 LYS N 1 1 10 4536 1 1 11 LYS NZ N -7.312 5.027 -7.661 1.00 . A A . 11 LYS NZ 1 1 10 4537 1 1 11 LYS O O -6.021 3.646 -1.728 1.00 . A A . 11 LYS O 1 1 10 4538 1 1 12 ASP C C -2.901 5.394 -1.270 1.00 . A A . 12 ASP C 1 1 10 4539 1 1 12 ASP CA C -3.622 4.203 -0.640 1.00 . A A . 12 ASP CA 1 1 10 4540 1 1 12 ASP CB C -2.723 3.529 0.393 1.00 . A A . 12 ASP CB 1 1 10 4541 1 1 12 ASP CG C -3.251 3.822 1.798 1.00 . A A . 12 ASP CG 1 1 10 4542 1 1 12 ASP H H -3.140 2.605 -1.999 1.00 . A A . 12 ASP H 1 1 10 4543 1 1 12 ASP HA H -4.544 4.517 -0.179 1.00 . A A . 12 ASP HA 1 1 10 4544 1 1 12 ASP HB2 H -2.719 2.460 0.223 1.00 . A A . 12 ASP HB2 1 1 10 4545 1 1 12 ASP HB3 H -1.717 3.915 0.298 1.00 . A A . 12 ASP HB3 1 1 10 4546 1 1 12 ASP N N -3.879 3.157 -1.668 1.00 . A A . 12 ASP N 1 1 10 4547 1 1 12 ASP O O -2.394 5.312 -2.371 1.00 . A A . 12 ASP O 1 1 10 4548 1 1 12 ASP OD1 O -4.006 4.770 1.939 1.00 . A A . 12 ASP OD1 1 1 10 4549 1 1 12 ASP OD2 O -2.891 3.094 2.708 1.00 . A A . 12 ASP OD2 1 1 10 4550 1 1 13 LYS C C -2.757 8.048 -2.501 1.00 . A A . 13 LYS C 1 1 10 4551 1 1 13 LYS CA C -2.143 7.684 -1.141 1.00 . A A . 13 LYS CA 1 1 10 4552 1 1 13 LYS CB C -0.684 7.241 -1.282 1.00 . A A . 13 LYS CB 1 1 10 4553 1 1 13 LYS CD C 0.668 7.608 0.790 1.00 . A A . 13 LYS CD 1 1 10 4554 1 1 13 LYS CE C 1.445 6.872 1.883 1.00 . A A . 13 LYS CE 1 1 10 4555 1 1 13 LYS CG C -0.208 6.611 0.029 1.00 . A A . 13 LYS CG 1 1 10 4556 1 1 13 LYS H H -3.252 6.542 0.311 1.00 . A A . 13 LYS H 1 1 10 4557 1 1 13 LYS HA H -2.212 8.519 -0.461 1.00 . A A . 13 LYS HA 1 1 10 4558 1 1 13 LYS HB2 H -0.605 6.510 -2.074 1.00 . A A . 13 LYS HB2 1 1 10 4559 1 1 13 LYS HB3 H -0.066 8.097 -1.514 1.00 . A A . 13 LYS HB3 1 1 10 4560 1 1 13 LYS HD2 H 1.361 8.074 0.104 1.00 . A A . 13 LYS HD2 1 1 10 4561 1 1 13 LYS HD3 H 0.045 8.364 1.241 1.00 . A A . 13 LYS HD3 1 1 10 4562 1 1 13 LYS HE2 H 1.342 5.802 1.759 1.00 . A A . 13 LYS HE2 1 1 10 4563 1 1 13 LYS HE3 H 2.485 7.156 1.862 1.00 . A A . 13 LYS HE3 1 1 10 4564 1 1 13 LYS HG2 H -1.061 6.345 0.635 1.00 . A A . 13 LYS HG2 1 1 10 4565 1 1 13 LYS HG3 H 0.368 5.723 -0.190 1.00 . A A . 13 LYS HG3 1 1 10 4566 1 1 13 LYS HZ1 H -0.191 7.075 3.154 1.00 . A A . 13 LYS HZ1 1 1 10 4567 1 1 13 LYS HZ2 H 0.938 8.341 3.267 1.00 . A A . 13 LYS HZ2 1 1 10 4568 1 1 13 LYS HZ3 H 1.283 6.826 3.957 1.00 . A A . 13 LYS HZ3 1 1 10 4569 1 1 13 LYS N N -2.842 6.496 -0.578 1.00 . A A . 13 LYS N 1 1 10 4570 1 1 13 LYS NZ N 0.822 7.311 3.162 1.00 . A A . 13 LYS NZ 1 1 10 4571 1 1 13 LYS O O -3.865 8.543 -2.570 1.00 . A A . 13 LYS O 1 1 10 4572 1 1 14 CYS C C -2.369 6.975 -5.884 1.00 . A A . 14 CYS C 1 1 10 4573 1 1 14 CYS CA C -2.635 8.131 -4.914 1.00 . A A . 14 CYS CA 1 1 10 4574 1 1 14 CYS CB C -1.916 9.416 -5.347 1.00 . A A . 14 CYS CB 1 1 10 4575 1 1 14 CYS H H -1.179 7.397 -3.525 1.00 . A A . 14 CYS H 1 1 10 4576 1 1 14 CYS HA H -3.695 8.314 -4.831 1.00 . A A . 14 CYS HA 1 1 10 4577 1 1 14 CYS HB2 H -2.499 9.911 -6.110 1.00 . A A . 14 CYS HB2 1 1 10 4578 1 1 14 CYS HB3 H -1.815 10.072 -4.492 1.00 . A A . 14 CYS HB3 1 1 10 4579 1 1 14 CYS N N -2.064 7.802 -3.583 1.00 . A A . 14 CYS N 1 1 10 4580 1 1 14 CYS O O -2.361 7.143 -7.088 1.00 . A A . 14 CYS O 1 1 10 4581 1 1 14 CYS SG S -0.273 9.031 -6.007 1.00 . A A . 14 CYS SG 1 1 10 4582 1 1 15 ASN C C -2.269 3.326 -5.499 1.00 . A A . 15 ASN C 1 1 10 4583 1 1 15 ASN CA C -1.883 4.619 -6.232 1.00 . A A . 15 ASN CA 1 1 10 4584 1 1 15 ASN CB C -0.378 4.669 -6.511 1.00 . A A . 15 ASN CB 1 1 10 4585 1 1 15 ASN CG C 0.383 4.786 -5.192 1.00 . A A . 15 ASN CG 1 1 10 4586 1 1 15 ASN H H -2.162 5.689 -4.383 1.00 . A A . 15 ASN H 1 1 10 4587 1 1 15 ASN HA H -2.432 4.705 -7.157 1.00 . A A . 15 ASN HA 1 1 10 4588 1 1 15 ASN HB2 H -0.073 3.772 -7.026 1.00 . A A . 15 ASN HB2 1 1 10 4589 1 1 15 ASN HB3 H -0.156 5.527 -7.127 1.00 . A A . 15 ASN HB3 1 1 10 4590 1 1 15 ASN HD21 H 1.398 6.393 -5.772 1.00 . A A . 15 ASN HD21 1 1 10 4591 1 1 15 ASN HD22 H 1.743 5.839 -4.197 1.00 . A A . 15 ASN HD22 1 1 10 4592 1 1 15 ASN N N -2.150 5.798 -5.358 1.00 . A A . 15 ASN N 1 1 10 4593 1 1 15 ASN ND2 N 1.246 5.753 -5.040 1.00 . A A . 15 ASN ND2 1 1 10 4594 1 1 15 ASN O O -3.112 3.332 -4.624 1.00 . A A . 15 ASN O 1 1 10 4595 1 1 15 ASN OD1 O 0.191 3.994 -4.291 1.00 . A A . 15 ASN OD1 1 1 10 4596 1 1 16 THR C C -0.793 0.380 -4.429 1.00 . A A . 16 THR C 1 1 10 4597 1 1 16 THR CA C -2.014 0.936 -5.165 1.00 . A A . 16 THR CA 1 1 10 4598 1 1 16 THR CB C -2.430 -0.006 -6.296 1.00 . A A . 16 THR CB 1 1 10 4599 1 1 16 THR CG2 C -3.548 -0.928 -5.810 1.00 . A A . 16 THR CG2 1 1 10 4600 1 1 16 THR H H -0.994 2.230 -6.555 1.00 . A A . 16 THR H 1 1 10 4601 1 1 16 THR HA H -2.836 1.081 -4.483 1.00 . A A . 16 THR HA 1 1 10 4602 1 1 16 THR HB H -1.584 -0.604 -6.596 1.00 . A A . 16 THR HB 1 1 10 4603 1 1 16 THR HG1 H -3.479 1.437 -7.070 1.00 . A A . 16 THR HG1 1 1 10 4604 1 1 16 THR HG21 H -3.746 -0.734 -4.766 1.00 . A A . 16 THR HG21 1 1 10 4605 1 1 16 THR HG22 H -3.245 -1.957 -5.935 1.00 . A A . 16 THR HG22 1 1 10 4606 1 1 16 THR HG23 H -4.443 -0.743 -6.386 1.00 . A A . 16 THR HG23 1 1 10 4607 1 1 16 THR N N -1.668 2.220 -5.847 1.00 . A A . 16 THR N 1 1 10 4608 1 1 16 THR O O 0.186 1.067 -4.240 1.00 . A A . 16 THR O 1 1 10 4609 1 1 16 THR OG1 O -2.890 0.757 -7.403 1.00 . A A . 16 THR OG1 1 1 10 4610 1 1 17 CYS C C -0.065 -2.869 -2.774 1.00 . A A . 17 CYS C 1 1 10 4611 1 1 17 CYS CA C 0.317 -1.480 -3.304 1.00 . A A . 17 CYS CA 1 1 10 4612 1 1 17 CYS CB C 0.645 -0.533 -2.147 1.00 . A A . 17 CYS CB 1 1 10 4613 1 1 17 CYS H H -1.647 -1.399 -4.194 1.00 . A A . 17 CYS H 1 1 10 4614 1 1 17 CYS HA H 1.165 -1.556 -3.966 1.00 . A A . 17 CYS HA 1 1 10 4615 1 1 17 CYS HB2 H 0.102 0.394 -2.268 1.00 . A A . 17 CYS HB2 1 1 10 4616 1 1 17 CYS HB3 H 0.362 -0.999 -1.214 1.00 . A A . 17 CYS HB3 1 1 10 4617 1 1 17 CYS N N -0.844 -0.864 -4.021 1.00 . A A . 17 CYS N 1 1 10 4618 1 1 17 CYS O O -0.782 -3.003 -1.803 1.00 . A A . 17 CYS O 1 1 10 4619 1 1 17 CYS SG S 2.425 -0.199 -2.130 1.00 . A A . 17 CYS SG 1 1 10 4620 1 1 18 ARG C C 0.394 -5.505 -1.498 1.00 . A A . 18 ARG C 1 1 10 4621 1 1 18 ARG CA C 0.095 -5.297 -2.985 1.00 . A A . 18 ARG CA 1 1 10 4622 1 1 18 ARG CB C 1.030 -6.165 -3.816 1.00 . A A . 18 ARG CB 1 1 10 4623 1 1 18 ARG CD C -0.379 -8.066 -3.023 1.00 . A A . 18 ARG CD 1 1 10 4624 1 1 18 ARG CG C 0.300 -7.432 -4.238 1.00 . A A . 18 ARG CG 1 1 10 4625 1 1 18 ARG CZ C -2.288 -9.556 -3.034 1.00 . A A . 18 ARG CZ 1 1 10 4626 1 1 18 ARG H H 0.987 -3.756 -4.199 1.00 . A A . 18 ARG H 1 1 10 4627 1 1 18 ARG HA H -0.928 -5.545 -3.208 1.00 . A A . 18 ARG HA 1 1 10 4628 1 1 18 ARG HB2 H 1.342 -5.619 -4.695 1.00 . A A . 18 ARG HB2 1 1 10 4629 1 1 18 ARG HB3 H 1.896 -6.430 -3.228 1.00 . A A . 18 ARG HB3 1 1 10 4630 1 1 18 ARG HD2 H 0.363 -8.409 -2.314 1.00 . A A . 18 ARG HD2 1 1 10 4631 1 1 18 ARG HD3 H -1.050 -7.362 -2.556 1.00 . A A . 18 ARG HD3 1 1 10 4632 1 1 18 ARG HE H -0.798 -9.722 -4.335 1.00 . A A . 18 ARG HE 1 1 10 4633 1 1 18 ARG HG2 H -0.444 -7.183 -4.978 1.00 . A A . 18 ARG HG2 1 1 10 4634 1 1 18 ARG HG3 H 1.007 -8.128 -4.655 1.00 . A A . 18 ARG HG3 1 1 10 4635 1 1 18 ARG HH11 H -1.481 -10.070 -1.277 1.00 . A A . 18 ARG HH11 1 1 10 4636 1 1 18 ARG HH12 H -3.199 -10.254 -1.394 1.00 . A A . 18 ARG HH12 1 1 10 4637 1 1 18 ARG HH21 H -3.363 -9.123 -4.668 1.00 . A A . 18 ARG HH21 1 1 10 4638 1 1 18 ARG HH22 H -4.265 -9.718 -3.315 1.00 . A A . 18 ARG HH22 1 1 10 4639 1 1 18 ARG N N 0.414 -3.900 -3.417 1.00 . A A . 18 ARG N 1 1 10 4640 1 1 18 ARG NE N -1.148 -9.218 -3.571 1.00 . A A . 18 ARG NE 1 1 10 4641 1 1 18 ARG NH1 N -2.326 -9.994 -1.806 1.00 . A A . 18 ARG NH1 1 1 10 4642 1 1 18 ARG NH2 N -3.391 -9.458 -3.726 1.00 . A A . 18 ARG NH2 1 1 10 4643 1 1 18 ARG O O -0.217 -6.319 -0.835 1.00 . A A . 18 ARG O 1 1 10 4644 1 1 19 CYS C C 2.544 -6.239 0.622 1.00 . A A . 19 CYS C 1 1 10 4645 1 1 19 CYS CA C 1.746 -4.943 0.445 1.00 . A A . 19 CYS CA 1 1 10 4646 1 1 19 CYS CB C 0.443 -4.990 1.249 1.00 . A A . 19 CYS CB 1 1 10 4647 1 1 19 CYS H H 1.834 -4.167 -1.566 1.00 . A A . 19 CYS H 1 1 10 4648 1 1 19 CYS HA H 2.339 -4.098 0.758 1.00 . A A . 19 CYS HA 1 1 10 4649 1 1 19 CYS HB2 H -0.388 -4.700 0.621 1.00 . A A . 19 CYS HB2 1 1 10 4650 1 1 19 CYS HB3 H 0.284 -5.992 1.620 1.00 . A A . 19 CYS HB3 1 1 10 4651 1 1 19 CYS N N 1.353 -4.792 -0.991 1.00 . A A . 19 CYS N 1 1 10 4652 1 1 19 CYS O O 1.991 -7.299 0.838 1.00 . A A . 19 CYS O 1 1 10 4653 1 1 19 CYS SG S 0.562 -3.844 2.644 1.00 . A A . 19 CYS SG 1 1 10 4654 1 1 20 GLY C C 4.219 -8.197 1.863 1.00 . A A . 20 GLY C 1 1 10 4655 1 1 20 GLY CA C 4.691 -7.375 0.666 1.00 . A A . 20 GLY CA 1 1 10 4656 1 1 20 GLY H H 4.262 -5.291 0.337 1.00 . A A . 20 GLY H 1 1 10 4657 1 1 20 GLY HA2 H 4.618 -7.972 -0.233 1.00 . A A . 20 GLY HA2 1 1 10 4658 1 1 20 GLY HA3 H 5.720 -7.079 0.820 1.00 . A A . 20 GLY HA3 1 1 10 4659 1 1 20 GLY N N 3.843 -6.157 0.519 1.00 . A A . 20 GLY N 1 1 10 4660 1 1 20 GLY O O 3.404 -7.758 2.647 1.00 . A A . 20 GLY O 1 1 10 4661 1 1 21 SER C C 4.978 -9.763 4.450 1.00 . A A . 21 SER C 1 1 10 4662 1 1 21 SER CA C 4.307 -10.244 3.159 1.00 . A A . 21 SER CA 1 1 10 4663 1 1 21 SER CB C 4.784 -11.650 2.800 1.00 . A A . 21 SER CB 1 1 10 4664 1 1 21 SER H H 5.384 -9.726 1.367 1.00 . A A . 21 SER H 1 1 10 4665 1 1 21 SER HA H 3.235 -10.234 3.262 1.00 . A A . 21 SER HA 1 1 10 4666 1 1 21 SER HB2 H 5.855 -11.651 2.688 1.00 . A A . 21 SER HB2 1 1 10 4667 1 1 21 SER HB3 H 4.505 -12.336 3.589 1.00 . A A . 21 SER HB3 1 1 10 4668 1 1 21 SER HG H 3.489 -12.680 1.774 1.00 . A A . 21 SER HG 1 1 10 4669 1 1 21 SER N N 4.726 -9.391 2.012 1.00 . A A . 21 SER N 1 1 10 4670 1 1 21 SER O O 4.673 -10.226 5.531 1.00 . A A . 21 SER O 1 1 10 4671 1 1 21 SER OG O 4.185 -12.049 1.573 1.00 . A A . 21 SER OG 1 1 10 4672 1 1 22 ASP C C 5.754 -7.248 6.252 1.00 . A A . 22 ASP C 1 1 10 4673 1 1 22 ASP CA C 6.591 -8.331 5.562 1.00 . A A . 22 ASP CA 1 1 10 4674 1 1 22 ASP CB C 7.910 -7.750 5.050 1.00 . A A . 22 ASP CB 1 1 10 4675 1 1 22 ASP CG C 7.630 -6.769 3.912 1.00 . A A . 22 ASP CG 1 1 10 4676 1 1 22 ASP H H 6.126 -8.483 3.461 1.00 . A A . 22 ASP H 1 1 10 4677 1 1 22 ASP HA H 6.790 -9.142 6.244 1.00 . A A . 22 ASP HA 1 1 10 4678 1 1 22 ASP HB2 H 8.412 -7.232 5.857 1.00 . A A . 22 ASP HB2 1 1 10 4679 1 1 22 ASP HB3 H 8.539 -8.551 4.686 1.00 . A A . 22 ASP HB3 1 1 10 4680 1 1 22 ASP N N 5.893 -8.840 4.343 1.00 . A A . 22 ASP N 1 1 10 4681 1 1 22 ASP O O 6.026 -6.862 7.371 1.00 . A A . 22 ASP O 1 1 10 4682 1 1 22 ASP OD1 O 7.402 -5.608 4.202 1.00 . A A . 22 ASP OD1 1 1 10 4683 1 1 22 ASP OD2 O 7.645 -7.198 2.770 1.00 . A A . 22 ASP OD2 1 1 10 4684 1 1 23 GLY C C 4.589 -4.361 6.215 1.00 . A A . 23 GLY C 1 1 10 4685 1 1 23 GLY CA C 3.875 -5.718 6.228 1.00 . A A . 23 GLY CA 1 1 10 4686 1 1 23 GLY H H 4.521 -7.096 4.702 1.00 . A A . 23 GLY H 1 1 10 4687 1 1 23 GLY HA2 H 2.946 -5.640 5.678 1.00 . A A . 23 GLY HA2 1 1 10 4688 1 1 23 GLY HA3 H 3.664 -5.998 7.251 1.00 . A A . 23 GLY HA3 1 1 10 4689 1 1 23 GLY N N 4.732 -6.765 5.600 1.00 . A A . 23 GLY N 1 1 10 4690 1 1 23 GLY O O 4.077 -3.382 6.720 1.00 . A A . 23 GLY O 1 1 10 4691 1 1 24 LYS C C 7.194 -2.789 4.266 1.00 . A A . 24 LYS C 1 1 10 4692 1 1 24 LYS CA C 6.486 -2.978 5.613 1.00 . A A . 24 LYS CA 1 1 10 4693 1 1 24 LYS CB C 7.494 -3.051 6.767 1.00 . A A . 24 LYS CB 1 1 10 4694 1 1 24 LYS CD C 9.905 -2.809 6.155 1.00 . A A . 24 LYS CD 1 1 10 4695 1 1 24 LYS CE C 10.464 -2.429 7.527 1.00 . A A . 24 LYS CE 1 1 10 4696 1 1 24 LYS CG C 8.754 -3.803 6.327 1.00 . A A . 24 LYS CG 1 1 10 4697 1 1 24 LYS H H 6.166 -5.082 5.241 1.00 . A A . 24 LYS H 1 1 10 4698 1 1 24 LYS HA H 5.795 -2.167 5.784 1.00 . A A . 24 LYS HA 1 1 10 4699 1 1 24 LYS HB2 H 7.764 -2.049 7.070 1.00 . A A . 24 LYS HB2 1 1 10 4700 1 1 24 LYS HB3 H 7.044 -3.567 7.601 1.00 . A A . 24 LYS HB3 1 1 10 4701 1 1 24 LYS HD2 H 10.684 -3.260 5.560 1.00 . A A . 24 LYS HD2 1 1 10 4702 1 1 24 LYS HD3 H 9.542 -1.921 5.660 1.00 . A A . 24 LYS HD3 1 1 10 4703 1 1 24 LYS HE2 H 9.898 -1.608 7.948 1.00 . A A . 24 LYS HE2 1 1 10 4704 1 1 24 LYS HE3 H 10.447 -3.279 8.191 1.00 . A A . 24 LYS HE3 1 1 10 4705 1 1 24 LYS HG2 H 9.018 -4.534 7.077 1.00 . A A . 24 LYS HG2 1 1 10 4706 1 1 24 LYS HG3 H 8.568 -4.302 5.388 1.00 . A A . 24 LYS HG3 1 1 10 4707 1 1 24 LYS HZ1 H 11.885 -1.304 6.505 1.00 . A A . 24 LYS HZ1 1 1 10 4708 1 1 24 LYS HZ2 H 12.429 -2.841 6.979 1.00 . A A . 24 LYS HZ2 1 1 10 4709 1 1 24 LYS HZ3 H 12.277 -1.599 8.127 1.00 . A A . 24 LYS HZ3 1 1 10 4710 1 1 24 LYS N N 5.762 -4.286 5.645 1.00 . A A . 24 LYS N 1 1 10 4711 1 1 24 LYS NZ N 11.870 -2.011 7.265 1.00 . A A . 24 LYS NZ 1 1 10 4712 1 1 24 LYS O O 8.125 -2.020 4.143 1.00 . A A . 24 LYS O 1 1 10 4713 1 1 25 SER C C 6.399 -3.775 0.845 1.00 . A A . 25 SER C 1 1 10 4714 1 1 25 SER CA C 7.394 -3.345 1.919 1.00 . A A . 25 SER CA 1 1 10 4715 1 1 25 SER CB C 8.600 -4.284 1.953 1.00 . A A . 25 SER CB 1 1 10 4716 1 1 25 SER H H 5.997 -4.093 3.374 1.00 . A A . 25 SER H 1 1 10 4717 1 1 25 SER HA H 7.717 -2.329 1.754 1.00 . A A . 25 SER HA 1 1 10 4718 1 1 25 SER HB2 H 8.267 -5.295 2.124 1.00 . A A . 25 SER HB2 1 1 10 4719 1 1 25 SER HB3 H 9.121 -4.233 1.004 1.00 . A A . 25 SER HB3 1 1 10 4720 1 1 25 SER HG H 9.373 -2.946 3.138 1.00 . A A . 25 SER HG 1 1 10 4721 1 1 25 SER N N 6.755 -3.482 3.256 1.00 . A A . 25 SER N 1 1 10 4722 1 1 25 SER O O 5.871 -4.867 0.879 1.00 . A A . 25 SER O 1 1 10 4723 1 1 25 SER OG O 9.469 -3.893 3.007 1.00 . A A . 25 SER OG 1 1 10 4724 1 1 26 ALA C C 5.623 -2.888 -2.534 1.00 . A A . 26 ALA C 1 1 10 4725 1 1 26 ALA CA C 5.128 -3.288 -1.144 1.00 . A A . 26 ALA CA 1 1 10 4726 1 1 26 ALA CB C 3.874 -2.502 -0.771 1.00 . A A . 26 ALA CB 1 1 10 4727 1 1 26 ALA H H 6.536 -2.034 -0.099 1.00 . A A . 26 ALA H 1 1 10 4728 1 1 26 ALA HA H 4.920 -4.344 -1.111 1.00 . A A . 26 ALA HA 1 1 10 4729 1 1 26 ALA HB1 H 3.095 -2.700 -1.491 1.00 . A A . 26 ALA HB1 1 1 10 4730 1 1 26 ALA HB2 H 4.102 -1.446 -0.765 1.00 . A A . 26 ALA HB2 1 1 10 4731 1 1 26 ALA HB3 H 3.542 -2.802 0.211 1.00 . A A . 26 ALA HB3 1 1 10 4732 1 1 26 ALA N N 6.116 -2.919 -0.094 1.00 . A A . 26 ALA N 1 1 10 4733 1 1 26 ALA O O 6.673 -2.295 -2.691 1.00 . A A . 26 ALA O 1 1 10 4734 1 1 27 ALA C C 4.649 -1.523 -5.325 1.00 . A A . 27 ALA C 1 1 10 4735 1 1 27 ALA CA C 5.266 -2.860 -4.935 1.00 . A A . 27 ALA CA 1 1 10 4736 1 1 27 ALA CB C 4.687 -3.975 -5.804 1.00 . A A . 27 ALA CB 1 1 10 4737 1 1 27 ALA H H 4.020 -3.687 -3.386 1.00 . A A . 27 ALA H 1 1 10 4738 1 1 27 ALA HA H 6.338 -2.830 -5.029 1.00 . A A . 27 ALA HA 1 1 10 4739 1 1 27 ALA HB1 H 3.900 -4.479 -5.264 1.00 . A A . 27 ALA HB1 1 1 10 4740 1 1 27 ALA HB2 H 5.466 -4.680 -6.050 1.00 . A A . 27 ALA HB2 1 1 10 4741 1 1 27 ALA HB3 H 4.285 -3.550 -6.711 1.00 . A A . 27 ALA HB3 1 1 10 4742 1 1 27 ALA N N 4.864 -3.212 -3.544 1.00 . A A . 27 ALA N 1 1 10 4743 1 1 27 ALA O O 5.301 -0.652 -5.866 1.00 . A A . 27 ALA O 1 1 10 4744 1 1 28 CYS C C 2.698 0.119 -6.909 1.00 . A A . 28 CYS C 1 1 10 4745 1 1 28 CYS CA C 2.698 -0.096 -5.394 1.00 . A A . 28 CYS CA 1 1 10 4746 1 1 28 CYS CB C 3.499 1.003 -4.689 1.00 . A A . 28 CYS CB 1 1 10 4747 1 1 28 CYS H H 2.894 -2.089 -4.616 1.00 . A A . 28 CYS H 1 1 10 4748 1 1 28 CYS HA H 1.693 -0.118 -5.021 1.00 . A A . 28 CYS HA 1 1 10 4749 1 1 28 CYS HB2 H 4.478 0.627 -4.430 1.00 . A A . 28 CYS HB2 1 1 10 4750 1 1 28 CYS HB3 H 3.601 1.852 -5.351 1.00 . A A . 28 CYS HB3 1 1 10 4751 1 1 28 CYS N N 3.390 -1.365 -5.051 1.00 . A A . 28 CYS N 1 1 10 4752 1 1 28 CYS O O 3.710 -0.023 -7.565 1.00 . A A . 28 CYS O 1 1 10 4753 1 1 28 CYS SG S 2.638 1.514 -3.181 1.00 . A A . 28 CYS SG 1 1 10 4754 1 1 29 THR C C 2.440 1.853 -9.318 1.00 . A A . 29 THR C 1 1 10 4755 1 1 29 THR CA C 1.516 0.697 -8.941 1.00 . A A . 29 THR CA 1 1 10 4756 1 1 29 THR CB C 0.062 1.066 -9.234 1.00 . A A . 29 THR CB 1 1 10 4757 1 1 29 THR CG2 C -0.727 -0.193 -9.592 1.00 . A A . 29 THR CG2 1 1 10 4758 1 1 29 THR H H 0.763 0.584 -6.924 1.00 . A A . 29 THR H 1 1 10 4759 1 1 29 THR HA H 1.788 -0.198 -9.477 1.00 . A A . 29 THR HA 1 1 10 4760 1 1 29 THR HB H 0.030 1.755 -10.063 1.00 . A A . 29 THR HB 1 1 10 4761 1 1 29 THR HG1 H -1.128 2.351 -8.393 1.00 . A A . 29 THR HG1 1 1 10 4762 1 1 29 THR HG21 H -1.125 -0.094 -10.591 1.00 . A A . 29 THR HG21 1 1 10 4763 1 1 29 THR HG22 H -1.539 -0.322 -8.891 1.00 . A A . 29 THR HG22 1 1 10 4764 1 1 29 THR HG23 H -0.074 -1.052 -9.548 1.00 . A A . 29 THR HG23 1 1 10 4765 1 1 29 THR N N 1.571 0.468 -7.470 1.00 . A A . 29 THR N 1 1 10 4766 1 1 29 THR O O 2.897 1.960 -10.440 1.00 . A A . 29 THR O 1 1 10 4767 1 1 29 THR OG1 O -0.511 1.679 -8.090 1.00 . A A . 29 THR OG1 1 1 10 4768 1 1 30 ARG C C 2.868 4.907 -9.541 1.00 . A A . 30 ARG C 1 1 10 4769 1 1 30 ARG CA C 3.602 3.890 -8.667 1.00 . A A . 30 ARG CA 1 1 10 4770 1 1 30 ARG CB C 4.811 3.311 -9.407 1.00 . A A . 30 ARG CB 1 1 10 4771 1 1 30 ARG CD C 7.066 3.290 -8.331 1.00 . A A . 30 ARG CD 1 1 10 4772 1 1 30 ARG CG C 6.052 4.148 -9.091 1.00 . A A . 30 ARG CG 1 1 10 4773 1 1 30 ARG CZ C 9.486 3.318 -8.251 1.00 . A A . 30 ARG CZ 1 1 10 4774 1 1 30 ARG H H 2.322 2.614 -7.493 1.00 . A A . 30 ARG H 1 1 10 4775 1 1 30 ARG HA H 3.920 4.349 -7.744 1.00 . A A . 30 ARG HA 1 1 10 4776 1 1 30 ARG HB2 H 4.974 2.290 -9.086 1.00 . A A . 30 ARG HB2 1 1 10 4777 1 1 30 ARG HB3 H 4.626 3.331 -10.471 1.00 . A A . 30 ARG HB3 1 1 10 4778 1 1 30 ARG HD2 H 6.987 3.471 -7.268 1.00 . A A . 30 ARG HD2 1 1 10 4779 1 1 30 ARG HD3 H 6.914 2.244 -8.551 1.00 . A A . 30 ARG HD3 1 1 10 4780 1 1 30 ARG HE H 8.451 4.328 -9.612 1.00 . A A . 30 ARG HE 1 1 10 4781 1 1 30 ARG HG2 H 6.493 4.498 -10.014 1.00 . A A . 30 ARG HG2 1 1 10 4782 1 1 30 ARG HG3 H 5.771 4.993 -8.483 1.00 . A A . 30 ARG HG3 1 1 10 4783 1 1 30 ARG HH11 H 8.863 1.422 -8.078 1.00 . A A . 30 ARG HH11 1 1 10 4784 1 1 30 ARG HH12 H 10.442 1.754 -7.447 1.00 . A A . 30 ARG HH12 1 1 10 4785 1 1 30 ARG HH21 H 10.364 5.117 -8.284 1.00 . A A . 30 ARG HH21 1 1 10 4786 1 1 30 ARG HH22 H 11.291 3.844 -7.564 1.00 . A A . 30 ARG HH22 1 1 10 4787 1 1 30 ARG N N 2.711 2.724 -8.385 1.00 . A A . 30 ARG N 1 1 10 4788 1 1 30 ARG NE N 8.395 3.729 -8.838 1.00 . A A . 30 ARG NE 1 1 10 4789 1 1 30 ARG NH1 N 9.607 2.067 -7.898 1.00 . A A . 30 ARG NH1 1 1 10 4790 1 1 30 ARG NH2 N 10.455 4.158 -8.014 1.00 . A A . 30 ARG NH2 1 1 10 4791 1 1 30 ARG O O 2.620 4.672 -10.708 1.00 . A A . 30 ARG O 1 1 10 4792 1 1 31 MET C C 2.361 8.461 -9.496 1.00 . A A . 31 MET C 1 1 10 4793 1 1 31 MET CA C 1.794 7.064 -9.784 1.00 . A A . 31 MET CA 1 1 10 4794 1 1 31 MET CB C 0.334 6.963 -9.335 1.00 . A A . 31 MET CB 1 1 10 4795 1 1 31 MET CE C -1.058 9.573 -9.203 1.00 . A A . 31 MET CE 1 1 10 4796 1 1 31 MET CG C -0.588 7.244 -10.524 1.00 . A A . 31 MET CG 1 1 10 4797 1 1 31 MET H H 2.723 6.202 -8.042 1.00 . A A . 31 MET H 1 1 10 4798 1 1 31 MET HA H 1.869 6.841 -10.836 1.00 . A A . 31 MET HA 1 1 10 4799 1 1 31 MET HB2 H 0.144 5.967 -8.958 1.00 . A A . 31 MET HB2 1 1 10 4800 1 1 31 MET HB3 H 0.142 7.682 -8.556 1.00 . A A . 31 MET HB3 1 1 10 4801 1 1 31 MET HE1 H -1.527 10.546 -9.261 1.00 . A A . 31 MET HE1 1 1 10 4802 1 1 31 MET HE2 H -0.172 9.640 -8.591 1.00 . A A . 31 MET HE2 1 1 10 4803 1 1 31 MET HE3 H -1.743 8.861 -8.762 1.00 . A A . 31 MET HE3 1 1 10 4804 1 1 31 MET HG2 H -0.227 6.714 -11.393 1.00 . A A . 31 MET HG2 1 1 10 4805 1 1 31 MET HG3 H -1.589 6.912 -10.289 1.00 . A A . 31 MET HG3 1 1 10 4806 1 1 31 MET N N 2.516 6.034 -8.985 1.00 . A A . 31 MET N 1 1 10 4807 1 1 31 MET O O 3.069 9.025 -10.307 1.00 . A A . 31 MET O 1 1 10 4808 1 1 31 MET SD S -0.607 9.022 -10.866 1.00 . A A . 31 MET SD 1 1 10 4809 1 1 32 ALA C C 1.764 10.984 -6.863 1.00 . A A . 32 ALA C 1 1 10 4810 1 1 32 ALA CA C 2.580 10.385 -8.007 1.00 . A A . 32 ALA CA 1 1 10 4811 1 1 32 ALA CB C 2.386 11.234 -9.263 1.00 . A A . 32 ALA CB 1 1 10 4812 1 1 32 ALA H H 1.491 8.541 -7.705 1.00 . A A . 32 ALA H 1 1 10 4813 1 1 32 ALA HA H 3.626 10.340 -7.746 1.00 . A A . 32 ALA HA 1 1 10 4814 1 1 32 ALA HB1 H 1.907 12.164 -8.995 1.00 . A A . 32 ALA HB1 1 1 10 4815 1 1 32 ALA HB2 H 1.764 10.697 -9.965 1.00 . A A . 32 ALA HB2 1 1 10 4816 1 1 32 ALA HB3 H 3.346 11.437 -9.711 1.00 . A A . 32 ALA HB3 1 1 10 4817 1 1 32 ALA N N 2.059 9.020 -8.348 1.00 . A A . 32 ALA N 1 1 10 4818 1 1 32 ALA O O 0.813 11.706 -7.087 1.00 . A A . 32 ALA O 1 1 10 4819 1 1 33 CYS C C 2.083 12.399 -3.846 1.00 . A A . 33 CYS C 1 1 10 4820 1 1 33 CYS CA C 1.317 11.252 -4.513 1.00 . A A . 33 CYS CA 1 1 10 4821 1 1 33 CYS CB C 1.125 10.098 -3.519 1.00 . A A . 33 CYS CB 1 1 10 4822 1 1 33 CYS H H 2.870 10.098 -5.470 1.00 . A A . 33 CYS H 1 1 10 4823 1 1 33 CYS HA H 0.360 11.593 -4.870 1.00 . A A . 33 CYS HA 1 1 10 4824 1 1 33 CYS HB2 H 2.009 10.006 -2.904 1.00 . A A . 33 CYS HB2 1 1 10 4825 1 1 33 CYS HB3 H 0.272 10.313 -2.886 1.00 . A A . 33 CYS HB3 1 1 10 4826 1 1 33 CYS N N 2.107 10.689 -5.643 1.00 . A A . 33 CYS N 1 1 10 4827 1 1 33 CYS O O 3.124 12.189 -3.255 1.00 . A A . 33 CYS O 1 1 10 4828 1 1 33 CYS SG S 0.840 8.534 -4.395 1.00 . A A . 33 CYS SG 1 1 10 4829 1 1 34 PRO C C 2.008 14.755 -1.832 1.00 . A A . 34 PRO C 1 1 10 4830 1 1 34 PRO CA C 2.173 14.776 -3.353 1.00 . A A . 34 PRO CA 1 1 10 4831 1 1 34 PRO CB C 1.403 15.941 -3.967 1.00 . A A . 34 PRO CB 1 1 10 4832 1 1 34 PRO CD C 0.288 13.912 -4.655 1.00 . A A . 34 PRO CD 1 1 10 4833 1 1 34 PRO CG C 0.074 15.372 -4.348 1.00 . A A . 34 PRO CG 1 1 10 4834 1 1 34 PRO HA H 3.212 14.832 -3.625 1.00 . A A . 34 PRO HA 1 1 10 4835 1 1 34 PRO HB2 H 1.282 16.732 -3.239 1.00 . A A . 34 PRO HB2 1 1 10 4836 1 1 34 PRO HB3 H 1.912 16.309 -4.844 1.00 . A A . 34 PRO HB3 1 1 10 4837 1 1 34 PRO HD2 H -0.534 13.321 -4.270 1.00 . A A . 34 PRO HD2 1 1 10 4838 1 1 34 PRO HD3 H 0.404 13.761 -5.717 1.00 . A A . 34 PRO HD3 1 1 10 4839 1 1 34 PRO HG2 H -0.621 15.481 -3.526 1.00 . A A . 34 PRO HG2 1 1 10 4840 1 1 34 PRO HG3 H -0.306 15.875 -5.222 1.00 . A A . 34 PRO HG3 1 1 10 4841 1 1 34 PRO N N 1.536 13.580 -3.959 1.00 . A A . 34 PRO N 1 1 10 4842 1 1 34 PRO O O 2.905 15.107 -1.093 1.00 . A A . 34 PRO O 1 1 10 4843 1 1 35 GLN C C 1.669 13.388 0.778 1.00 . A A . 35 GLN C 1 1 10 4844 1 1 35 GLN CA C 0.634 14.297 0.110 1.00 . A A . 35 GLN CA 1 1 10 4845 1 1 35 GLN CB C -0.772 13.718 0.271 1.00 . A A . 35 GLN CB 1 1 10 4846 1 1 35 GLN CD C -3.008 14.815 0.451 1.00 . A A . 35 GLN CD 1 1 10 4847 1 1 35 GLN CG C -1.629 14.678 1.099 1.00 . A A . 35 GLN CG 1 1 10 4848 1 1 35 GLN H H 0.157 14.064 -1.978 1.00 . A A . 35 GLN H 1 1 10 4849 1 1 35 GLN HA H 0.674 15.289 0.531 1.00 . A A . 35 GLN HA 1 1 10 4850 1 1 35 GLN HB2 H -1.219 13.583 -0.703 1.00 . A A . 35 GLN HB2 1 1 10 4851 1 1 35 GLN HB3 H -0.714 12.765 0.776 1.00 . A A . 35 GLN HB3 1 1 10 4852 1 1 35 GLN HE21 H -3.093 12.909 -0.101 1.00 . A A . 35 GLN HE21 1 1 10 4853 1 1 35 GLN HE22 H -4.444 13.849 -0.523 1.00 . A A . 35 GLN HE22 1 1 10 4854 1 1 35 GLN HG2 H -1.739 14.290 2.101 1.00 . A A . 35 GLN HG2 1 1 10 4855 1 1 35 GLN HG3 H -1.153 15.646 1.136 1.00 . A A . 35 GLN HG3 1 1 10 4856 1 1 35 GLN N N 0.865 14.344 -1.362 1.00 . A A . 35 GLN N 1 1 10 4857 1 1 35 GLN NE2 N -3.561 13.771 -0.103 1.00 . A A . 35 GLN NE2 1 1 10 4858 1 1 35 GLN O O 2.239 12.562 0.083 1.00 . A A . 35 GLN O 1 1 10 4859 1 1 35 GLN OXT O 1.874 13.532 1.971 1.00 . A A . 35 GLN OXT 1 1 10 4860 1 1 35 GLN OE1 O -3.587 15.883 0.449 1.00 . A A . 35 GLN OE1 1 1 stop_ save_
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