NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
384303 | 1kgm | 5272 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 365 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1kgm # This FRED archive file contains, for PDB entry <1kgm>: # # - 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_1kgm _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1kgm _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3649.10 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 EVTCEPGTTFKDKCNTCRCGSDGKSAACTLKACPQ _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 LEU . 1 1 31 LYS . 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 LEU 30 30 1 1 LYS 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 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 VAL H . 2 . HN 1 1 1 1 2 1 1 2 VAL HB . 2 . HB 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 QG . 2 . HG1# 1 1 10 1 2 1 1 25 SER H . 25 . HN 1 1 11 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 11 1 2 1 1 3 THR H . 3 . 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 HA . 25 . HA 1 1 16 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 16 1 2 1 1 26 ALA H . 26 . HN 1 1 17 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 17 1 2 1 1 26 ALA MB . 26 . HB# 1 1 18 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 18 1 2 1 1 3 THR H . 3 . HN 1 1 19 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 19 1 2 1 1 10 PHE QE . 10 . HE# 1 1 20 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 20 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 21 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 21 1 2 1 1 24 LYS HA . 24 . HA 1 1 22 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 22 1 2 1 1 25 SER HA . 25 . HA 1 1 23 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 23 1 2 1 1 26 ALA H . 26 . HN 1 1 24 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 24 1 2 1 1 26 ALA MB . 26 . HB# 1 1 25 1 1 1 1 3 THR H . 3 . HN 1 1 25 1 2 1 1 3 THR HB . 3 . HB 1 1 26 1 1 1 1 3 THR H . 3 . HN 1 1 26 1 2 1 1 3 THR MG . 3 . HG2# 1 1 27 1 1 1 1 3 THR H . 3 . HN 1 1 27 1 2 1 1 4 CYS H . 4 . HN 1 1 28 1 1 1 1 3 THR H . 3 . HN 1 1 28 1 2 1 1 4 CYS HB3 . 4 . HB1 1 1 29 1 1 1 1 3 THR H . 3 . HN 1 1 29 1 2 1 1 24 LYS HA . 24 . HA 1 1 30 1 1 1 1 3 THR HA . 3 . HA 1 1 30 1 2 1 1 3 THR MG . 3 . HG2# 1 1 31 1 1 1 1 3 THR HA . 3 . HA 1 1 31 1 2 1 1 4 CYS H . 4 . HN 1 1 32 1 1 1 1 3 THR HB . 3 . HB 1 1 32 1 2 1 1 4 CYS H . 4 . HN 1 1 33 1 1 1 1 3 THR MG . 3 . HG2# 1 1 33 1 2 1 1 4 CYS H . 4 . HN 1 1 34 1 1 1 1 4 CYS H . 4 . HN 1 1 34 1 2 1 1 24 LYS HA . 24 . HA 1 1 35 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 35 1 2 1 1 5 GLU H . 5 . HN 1 1 36 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 36 1 2 1 1 10 PHE QD . 10 . HD# 1 1 37 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 37 1 2 1 1 10 PHE QE . 10 . HE# 1 1 38 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 38 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 39 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 39 1 2 1 1 5 GLU H . 5 . HN 1 1 40 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 40 1 2 1 1 10 PHE QD . 10 . HD# 1 1 41 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 41 1 2 1 1 10 PHE QE . 10 . HE# 1 1 42 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 42 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 43 1 1 1 1 5 GLU H . 5 . HN 1 1 43 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 44 1 1 1 1 5 GLU H . 5 . HN 1 1 44 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 45 1 1 1 1 5 GLU H . 5 . HN 1 1 45 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 46 1 1 1 1 5 GLU H . 5 . HN 1 1 46 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 47 1 1 1 1 5 GLU HA . 5 . HA 1 1 47 1 2 1 1 5 GLU HG2 . 5 . HG2 1 1 48 1 1 1 1 5 GLU HA . 5 . HA 1 1 48 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 49 1 1 1 1 5 GLU HA . 5 . HA 1 1 49 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 50 1 1 1 1 6 PRO HA . 6 . HA 1 1 50 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 51 1 1 1 1 6 PRO HA . 6 . HA 1 1 51 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 52 1 1 1 1 6 PRO HA . 6 . HA 1 1 52 1 2 1 1 7 GLY H . 7 . HN 1 1 53 1 1 1 1 6 PRO HA . 6 . HA 1 1 53 1 2 1 1 8 THR H . 8 . HN 1 1 54 1 1 1 1 6 PRO HA . 6 . HA 1 1 54 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 55 1 1 1 1 6 PRO HA . 6 . HA 1 1 55 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 56 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 56 1 2 1 1 7 GLY H . 7 . HN 1 1 57 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 57 1 2 1 1 21 SER HA . 21 . HA 1 1 58 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 58 1 2 1 1 23 GLY H . 23 . HN 1 1 59 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 59 1 2 1 1 7 GLY H . 7 . HN 1 1 60 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 60 1 2 1 1 21 SER HA . 21 . HA 1 1 61 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 61 1 2 1 1 23 GLY H . 23 . HN 1 1 62 1 1 1 1 6 PRO HD3 . 6 . HD1 1 1 62 1 2 1 1 23 GLY H . 23 . HN 1 1 63 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 63 1 2 1 1 21 SER HA . 21 . HA 1 1 64 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 64 1 2 1 1 23 GLY H . 23 . HN 1 1 65 1 1 1 1 6 PRO HG3 . 6 . HG1 1 1 65 1 2 1 1 21 SER HA . 21 . HA 1 1 66 1 1 1 1 6 PRO HG3 . 6 . HG1 1 1 66 1 2 1 1 23 GLY H . 23 . HN 1 1 67 1 1 1 1 7 GLY H . 7 . HN 1 1 67 1 2 1 1 8 THR H . 8 . HN 1 1 68 1 1 1 1 7 GLY H . 7 . HN 1 1 68 1 2 1 1 18 ARG QD . 18 . HD# 1 1 69 1 1 1 1 7 GLY H . 7 . HN 1 1 69 1 2 1 1 19 CYS H . 19 . HN 1 1 70 1 1 1 1 7 GLY H . 7 . HN 1 1 70 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 71 1 1 1 1 7 GLY H . 7 . HN 1 1 71 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 72 1 1 1 1 7 GLY H . 7 . HN 1 1 72 1 2 1 1 21 SER HA . 21 . HA 1 1 73 1 1 1 1 7 GLY HA2 . 7 . HA2 1 1 73 1 2 1 1 8 THR H . 8 . HN 1 1 74 1 1 1 1 7 GLY HA3 . 7 . HA1 1 1 74 1 2 1 1 8 THR H . 8 . HN 1 1 75 1 1 1 1 8 THR H . 8 . HN 1 1 75 1 2 1 1 8 THR MG . 8 . HG2# 1 1 76 1 1 1 1 8 THR H . 8 . HN 1 1 76 1 2 1 1 9 THR H . 9 . HN 1 1 77 1 1 1 1 8 THR H . 8 . HN 1 1 77 1 2 1 1 18 ARG HA . 18 . HA 1 1 78 1 1 1 1 8 THR H . 8 . HN 1 1 78 1 2 1 1 18 ARG QD . 18 . HD# 1 1 79 1 1 1 1 8 THR H . 8 . HN 1 1 79 1 2 1 1 19 CYS H . 19 . HN 1 1 80 1 1 1 1 8 THR H . 8 . HN 1 1 80 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 81 1 1 1 1 8 THR H . 8 . HN 1 1 81 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 82 1 1 1 1 8 THR HA . 8 . HA 1 1 82 1 2 1 1 8 THR MG . 8 . HG2# 1 1 83 1 1 1 1 8 THR HA . 8 . HA 1 1 83 1 2 1 1 9 THR H . 9 . HN 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 HB . 8 . HB 1 1 88 1 2 1 1 19 CYS QB . 19 . HB2 1 1 89 1 1 1 1 8 THR MG . 8 . HG2# 1 1 89 1 2 1 1 9 THR H . 9 . HN 1 1 90 1 1 1 1 8 THR MG . 8 . HG2# 1 1 90 1 2 1 1 10 PHE QD . 10 . HD# 1 1 91 1 1 1 1 9 THR H . 9 . HN 1 1 91 1 2 1 1 9 THR HB . 9 . HB 1 1 92 1 1 1 1 9 THR H . 9 . HN 1 1 92 1 2 1 1 9 THR MG . 9 . HG2# 1 1 93 1 1 1 1 9 THR H . 9 . HN 1 1 93 1 2 1 1 18 ARG HA . 18 . HA 1 1 94 1 1 1 1 9 THR H . 9 . HN 1 1 94 1 2 1 1 19 CYS H . 19 . HN 1 1 95 1 1 1 1 9 THR HA . 9 . HA 1 1 95 1 2 1 1 9 THR MG . 9 . HG2# 1 1 96 1 1 1 1 9 THR HA . 9 . HA 1 1 96 1 2 1 1 10 PHE H . 10 . HN 1 1 97 1 1 1 1 9 THR HA . 9 . HA 1 1 97 1 2 1 1 10 PHE QB . 10 . HB# 1 1 98 1 1 1 1 9 THR HA . 9 . HA 1 1 98 1 2 1 1 10 PHE QD . 10 . HD# 1 1 99 1 1 1 1 9 THR HA . 9 . HA 1 1 99 1 2 1 1 10 PHE QE . 10 . HE# 1 1 100 1 1 1 1 9 THR HA . 9 . HA 1 1 100 1 2 1 1 17 CYS H . 17 . HN 1 1 101 1 1 1 1 9 THR HA . 9 . HA 1 1 101 1 2 1 1 18 ARG H . 18 . HN 1 1 102 1 1 1 1 9 THR HA . 9 . HA 1 1 102 1 2 1 1 18 ARG HA . 18 . HA 1 1 103 1 1 1 1 9 THR HA . 9 . HA 1 1 103 1 2 1 1 18 ARG HB2 . 18 . HB2 1 1 104 1 1 1 1 9 THR HA . 9 . HA 1 1 104 1 2 1 1 19 CYS H . 19 . HN 1 1 105 1 1 1 1 9 THR HA . 9 . HA 1 1 105 1 2 1 1 19 CYS HA . 19 . HA 1 1 106 1 1 1 1 9 THR HB . 9 . HB 1 1 106 1 2 1 1 10 PHE H . 10 . HN 1 1 107 1 1 1 1 9 THR MG . 9 . HG2# 1 1 107 1 2 1 1 10 PHE H . 10 . HN 1 1 108 1 1 1 1 9 THR MG . 9 . HG2# 1 1 108 1 2 1 1 10 PHE HA . 10 . HA 1 1 109 1 1 1 1 9 THR MG . 9 . HG2# 1 1 109 1 2 1 1 18 ARG HA . 18 . HA 1 1 110 1 1 1 1 9 THR MG . 9 . HG2# 1 1 110 1 2 1 1 18 ARG QD . 18 . HD# 1 1 111 1 1 1 1 9 THR MG . 9 . HG2# 1 1 111 1 2 1 1 19 CYS H . 19 . HN 1 1 112 1 1 1 1 10 PHE H . 10 . HN 1 1 112 1 2 1 1 10 PHE QD . 10 . HD# 1 1 113 1 1 1 1 10 PHE H . 10 . HN 1 1 113 1 2 1 1 10 PHE QE . 10 . HE# 1 1 114 1 1 1 1 10 PHE H . 10 . HN 1 1 114 1 2 1 1 11 LYS H . 11 . HN 1 1 115 1 1 1 1 10 PHE H . 10 . HN 1 1 115 1 2 1 1 16 THR MG . 16 . HG2# 1 1 116 1 1 1 1 10 PHE H . 10 . HN 1 1 116 1 2 1 1 17 CYS H . 17 . HN 1 1 117 1 1 1 1 10 PHE H . 10 . HN 1 1 117 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 118 1 1 1 1 10 PHE H . 10 . HN 1 1 118 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 119 1 1 1 1 10 PHE H . 10 . HN 1 1 119 1 2 1 1 18 ARG HA . 18 . HA 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 QB . 10 . HB# 1 1 122 1 2 1 1 11 LYS H . 11 . HN 1 1 123 1 1 1 1 10 PHE QD . 10 . HD# 1 1 123 1 2 1 1 11 LYS H . 11 . HN 1 1 124 1 1 1 1 10 PHE QD . 10 . HD# 1 1 124 1 2 1 1 11 LYS HB2 . 11 . HB2 1 1 125 1 1 1 1 10 PHE QD . 10 . HD# 1 1 125 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 126 1 1 1 1 10 PHE QD . 10 . HD# 1 1 126 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 127 1 1 1 1 10 PHE QD . 10 . HD# 1 1 127 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 128 1 1 1 1 10 PHE QD . 10 . HD# 1 1 128 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 129 1 1 1 1 10 PHE QD . 10 . HD# 1 1 129 1 2 1 1 18 ARG HA . 18 . HA 1 1 130 1 1 1 1 10 PHE QD . 10 . HD# 1 1 130 1 2 1 1 19 CYS H . 19 . HN 1 1 131 1 1 1 1 10 PHE QD . 10 . HD# 1 1 131 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 132 1 1 1 1 10 PHE QD . 10 . HD# 1 1 132 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 133 1 1 1 1 10 PHE QD . 10 . HD# 1 1 133 1 2 1 1 26 ALA MB . 26 . HB# 1 1 134 1 1 1 1 10 PHE QE . 10 . HE# 1 1 134 1 2 1 1 11 LYS H . 11 . HN 1 1 135 1 1 1 1 10 PHE QE . 10 . HE# 1 1 135 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 136 1 1 1 1 10 PHE QE . 10 . HE# 1 1 136 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 137 1 1 1 1 10 PHE QE . 10 . HE# 1 1 137 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 138 1 1 1 1 10 PHE QE . 10 . HE# 1 1 138 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 139 1 1 1 1 10 PHE QE . 10 . HE# 1 1 139 1 2 1 1 18 ARG HA . 18 . HA 1 1 140 1 1 1 1 10 PHE QE . 10 . HE# 1 1 140 1 2 1 1 19 CYS H . 19 . HN 1 1 141 1 1 1 1 10 PHE QE . 10 . HE# 1 1 141 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 142 1 1 1 1 10 PHE QE . 10 . HE# 1 1 142 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 143 1 1 1 1 10 PHE QE . 10 . HE# 1 1 143 1 2 1 1 20 GLY H . 20 . HN 1 1 144 1 1 1 1 10 PHE QE . 10 . HE# 1 1 144 1 2 1 1 26 ALA MB . 26 . HB# 1 1 145 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 145 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 146 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 146 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 147 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 147 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 148 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 148 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 149 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 149 1 2 1 1 26 ALA MB . 26 . HB# 1 1 150 1 1 1 1 11 LYS H . 11 . HN 1 1 150 1 2 1 1 11 LYS HB2 . 11 . HB2 1 1 151 1 1 1 1 11 LYS H . 11 . HN 1 1 151 1 2 1 1 11 LYS HB3 . 11 . HB1 1 1 152 1 1 1 1 11 LYS H . 11 . HN 1 1 152 1 2 1 1 11 LYS HG2 . 11 . HG2 1 1 153 1 1 1 1 11 LYS H . 11 . HN 1 1 153 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 154 1 1 1 1 11 LYS H . 11 . HN 1 1 154 1 2 1 1 12 ASP H . 12 . HN 1 1 155 1 1 1 1 11 LYS HA . 11 . HA 1 1 155 1 2 1 1 11 LYS QD . 11 . HD# 1 1 156 1 1 1 1 11 LYS HA . 11 . HA 1 1 156 1 2 1 1 12 ASP H . 12 . HN 1 1 157 1 1 1 1 11 LYS HA . 11 . HA 1 1 157 1 2 1 1 16 THR MG . 16 . HG2# 1 1 158 1 1 1 1 11 LYS HA . 11 . HA 1 1 158 1 2 1 1 17 CYS H . 17 . HN 1 1 159 1 1 1 1 11 LYS HB2 . 11 . HB2 1 1 159 1 2 1 1 12 ASP H . 12 . HN 1 1 160 1 1 1 1 11 LYS HB3 . 11 . HB1 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 HA . 12 . HA 1 1 162 1 1 1 1 12 ASP H . 12 . HN 1 1 162 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 163 1 1 1 1 12 ASP H . 12 . HN 1 1 163 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 164 1 1 1 1 12 ASP H . 12 . HN 1 1 164 1 2 1 1 13 LYS H . 13 . HN 1 1 165 1 1 1 1 12 ASP H . 12 . HN 1 1 165 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 166 1 1 1 1 12 ASP H . 12 . HN 1 1 166 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 167 1 1 1 1 12 ASP HA . 12 . HA 1 1 167 1 2 1 1 13 LYS H . 13 . HN 1 1 168 1 1 1 1 12 ASP HA . 12 . HA 1 1 168 1 2 1 1 13 LYS HA . 13 . HA 1 1 169 1 1 1 1 12 ASP HA . 12 . HA 1 1 169 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 170 1 1 1 1 12 ASP HA . 12 . HA 1 1 170 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 171 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 171 1 2 1 1 13 LYS H . 13 . HN 1 1 172 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 172 1 2 1 1 13 LYS H . 13 . HN 1 1 173 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 173 1 2 1 1 15 ASN H . 15 . HN 1 1 174 1 1 1 1 13 LYS H . 13 . HN 1 1 174 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 175 1 1 1 1 13 LYS H . 13 . HN 1 1 175 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 176 1 1 1 1 13 LYS H . 13 . HN 1 1 176 1 2 1 1 14 CYS H . 14 . HN 1 1 177 1 1 1 1 13 LYS HA . 13 . HA 1 1 177 1 2 1 1 13 LYS HG3 . 13 . HG1 1 1 178 1 1 1 1 13 LYS HA . 13 . HA 1 1 178 1 2 1 1 14 CYS H . 14 . HN 1 1 179 1 1 1 1 13 LYS HA . 13 . HA 1 1 179 1 2 1 1 15 ASN H . 15 . HN 1 1 180 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 180 1 2 1 1 14 CYS H . 14 . HN 1 1 181 1 1 1 1 13 LYS HB2 . 13 . HB2 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 14 CYS H . 14 . HN 1 1 183 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 183 1 2 1 1 15 ASN H . 15 . HN 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 HB2 . 15 . HB2 1 1 188 1 1 1 1 14 CYS H . 14 . HN 1 1 188 1 2 1 1 33 CYS HA . 33 . HA 1 1 189 1 1 1 1 14 CYS H . 14 . HN 1 1 189 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 190 1 1 1 1 14 CYS H . 14 . HN 1 1 190 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 191 1 1 1 1 14 CYS HA . 14 . HA 1 1 191 1 2 1 1 15 ASN H . 15 . HN 1 1 192 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 192 1 2 1 1 15 ASN H . 15 . HN 1 1 193 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 193 1 2 1 1 33 CYS HA . 33 . HA 1 1 194 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 194 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 195 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 195 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 196 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 196 1 2 1 1 15 ASN H . 15 . HN 1 1 197 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 197 1 2 1 1 33 CYS HA . 33 . HA 1 1 198 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 198 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 199 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 199 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 200 1 1 1 1 15 ASN H . 15 . HN 1 1 200 1 2 1 1 16 THR H . 16 . HN 1 1 201 1 1 1 1 15 ASN HA . 15 . HA 1 1 201 1 2 1 1 16 THR H . 16 . HN 1 1 202 1 1 1 1 15 ASN HA . 15 . HA 1 1 202 1 2 1 1 29 THR MG . 29 . HG2# 1 1 203 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 203 1 2 1 1 16 THR H . 16 . HN 1 1 204 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 204 1 2 1 1 29 THR H . 29 . HN 1 1 205 1 1 1 1 15 ASN HB2 . 15 . HB2 1 1 205 1 2 1 1 30 LEU HA . 30 . HA 1 1 206 1 1 1 1 15 ASN HB3 . 15 . HB1 1 1 206 1 2 1 1 16 THR H . 16 . 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 LEU HA . 30 . HA 1 1 209 1 1 1 1 15 ASN HD21 . 15 . HD21 1 1 209 1 2 1 1 31 LYS H . 31 . HN 1 1 210 1 1 1 1 15 ASN HD22 . 15 . HD22 1 1 210 1 2 1 1 31 LYS H . 31 . HN 1 1 211 1 1 1 1 16 THR H . 16 . HN 1 1 211 1 2 1 1 16 THR HB . 16 . HB 1 1 212 1 1 1 1 16 THR H . 16 . HN 1 1 212 1 2 1 1 16 THR MG . 16 . HG2# 1 1 213 1 1 1 1 16 THR H . 16 . HN 1 1 213 1 2 1 1 17 CYS H . 17 . HN 1 1 214 1 1 1 1 16 THR H . 16 . HN 1 1 214 1 2 1 1 28 CYS HA . 28 . HA 1 1 215 1 1 1 1 16 THR H . 16 . HN 1 1 215 1 2 1 1 29 THR H . 29 . HN 1 1 216 1 1 1 1 16 THR H . 16 . HN 1 1 216 1 2 1 1 29 THR MG . 29 . HG2# 1 1 217 1 1 1 1 16 THR HA . 16 . HA 1 1 217 1 2 1 1 16 THR MG . 16 . HG2# 1 1 218 1 1 1 1 16 THR HA . 16 . HA 1 1 218 1 2 1 1 17 CYS H . 17 . HN 1 1 219 1 1 1 1 16 THR HA . 16 . HA 1 1 219 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 220 1 1 1 1 16 THR HA . 16 . HA 1 1 220 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 221 1 1 1 1 16 THR HB . 16 . HB 1 1 221 1 2 1 1 17 CYS H . 17 . HN 1 1 222 1 1 1 1 16 THR HB . 16 . HB 1 1 222 1 2 1 1 29 THR H . 29 . HN 1 1 223 1 1 1 1 16 THR HB . 16 . HB 1 1 223 1 2 1 1 29 THR MG . 29 . HG2# 1 1 224 1 1 1 1 16 THR MG . 16 . HG2# 1 1 224 1 2 1 1 29 THR H . 29 . HN 1 1 225 1 1 1 1 17 CYS H . 17 . HN 1 1 225 1 2 1 1 18 ARG H . 18 . HN 1 1 226 1 1 1 1 17 CYS HA . 17 . HA 1 1 226 1 2 1 1 18 ARG H . 18 . HN 1 1 227 1 1 1 1 17 CYS HA . 17 . HA 1 1 227 1 2 1 1 18 ARG HB2 . 18 . HB2 1 1 228 1 1 1 1 17 CYS HA . 17 . HA 1 1 228 1 2 1 1 26 ALA MB . 26 . HB# 1 1 229 1 1 1 1 17 CYS HA . 17 . HA 1 1 229 1 2 1 1 27 ALA H . 27 . HN 1 1 230 1 1 1 1 17 CYS HA . 17 . HA 1 1 230 1 2 1 1 28 CYS H . 28 . HN 1 1 231 1 1 1 1 17 CYS HA . 17 . HA 1 1 231 1 2 1 1 28 CYS HA . 28 . HA 1 1 232 1 1 1 1 17 CYS HA . 17 . HA 1 1 232 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 233 1 1 1 1 17 CYS HA . 17 . HA 1 1 233 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 234 1 1 1 1 17 CYS HA . 17 . HA 1 1 234 1 2 1 1 29 THR H . 29 . HN 1 1 235 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 235 1 2 1 1 18 ARG H . 18 . HN 1 1 236 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 236 1 2 1 1 28 CYS HA . 28 . HA 1 1 237 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 237 1 2 1 1 18 ARG H . 18 . HN 1 1 238 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 238 1 2 1 1 26 ALA MB . 26 . HB# 1 1 239 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 239 1 2 1 1 27 ALA H . 27 . HN 1 1 240 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 240 1 2 1 1 28 CYS HA . 28 . HA 1 1 241 1 1 1 1 18 ARG H . 18 . HN 1 1 241 1 2 1 1 18 ARG HB2 . 18 . HB2 1 1 242 1 1 1 1 18 ARG H . 18 . HN 1 1 242 1 2 1 1 18 ARG HB3 . 18 . HB1 1 1 243 1 1 1 1 18 ARG H . 18 . HN 1 1 243 1 2 1 1 18 ARG QD . 18 . HD# 1 1 244 1 1 1 1 18 ARG H . 18 . HN 1 1 244 1 2 1 1 18 ARG HG2 . 18 . HG2 1 1 245 1 1 1 1 18 ARG H . 18 . HN 1 1 245 1 2 1 1 18 ARG HG3 . 18 . HG1 1 1 246 1 1 1 1 18 ARG H . 18 . HN 1 1 246 1 2 1 1 19 CYS H . 19 . HN 1 1 247 1 1 1 1 18 ARG H . 18 . HN 1 1 247 1 2 1 1 26 ALA MB . 26 . HB# 1 1 248 1 1 1 1 18 ARG H . 18 . HN 1 1 248 1 2 1 1 27 ALA H . 27 . HN 1 1 249 1 1 1 1 18 ARG H . 18 . HN 1 1 249 1 2 1 1 28 CYS HA . 28 . HA 1 1 250 1 1 1 1 18 ARG HA . 18 . HA 1 1 250 1 2 1 1 19 CYS H . 19 . HN 1 1 251 1 1 1 1 18 ARG HA . 18 . HA 1 1 251 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 252 1 1 1 1 18 ARG HA . 18 . HA 1 1 252 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 253 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 253 1 2 1 1 18 ARG QD . 18 . HD# 1 1 254 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 254 1 2 1 1 19 CYS H . 19 . HN 1 1 255 1 1 1 1 18 ARG HB2 . 18 . HB2 1 1 255 1 2 1 1 27 ALA H . 27 . HN 1 1 256 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 256 1 2 1 1 18 ARG QD . 18 . HD# 1 1 257 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 257 1 2 1 1 19 CYS H . 19 . HN 1 1 258 1 1 1 1 18 ARG HB3 . 18 . HB1 1 1 258 1 2 1 1 27 ALA H . 27 . HN 1 1 259 1 1 1 1 18 ARG QD . 18 . HD# 1 1 259 1 2 1 1 19 CYS H . 19 . HN 1 1 260 1 1 1 1 18 ARG HG2 . 18 . HG2 1 1 260 1 2 1 1 19 CYS H . 19 . HN 1 1 261 1 1 1 1 18 ARG HG3 . 18 . HG1 1 1 261 1 2 1 1 19 CYS H . 19 . HN 1 1 262 1 1 1 1 19 CYS H . 19 . HN 1 1 262 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 263 1 1 1 1 19 CYS H . 19 . HN 1 1 263 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 264 1 1 1 1 19 CYS H . 19 . HN 1 1 264 1 2 1 1 20 GLY H . 20 . HN 1 1 265 1 1 1 1 19 CYS HA . 19 . HA 1 1 265 1 2 1 1 20 GLY H . 20 . HN 1 1 266 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 266 1 2 1 1 20 GLY H . 20 . HN 1 1 267 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 267 1 2 1 1 20 GLY H . 20 . HN 1 1 268 1 1 1 1 20 GLY H . 20 . HN 1 1 268 1 2 1 1 21 SER H . 21 . HN 1 1 269 1 1 1 1 20 GLY H . 20 . HN 1 1 269 1 2 1 1 23 GLY H . 23 . HN 1 1 270 1 1 1 1 20 GLY H . 20 . HN 1 1 270 1 2 1 1 25 SER H . 25 . HN 1 1 271 1 1 1 1 20 GLY H . 20 . HN 1 1 271 1 2 1 1 25 SER HA . 25 . HA 1 1 272 1 1 1 1 20 GLY H . 20 . HN 1 1 272 1 2 1 1 26 ALA HA . 26 . HA 1 1 273 1 1 1 1 20 GLY H . 20 . HN 1 1 273 1 2 1 1 26 ALA MB . 26 . HB# 1 1 274 1 1 1 1 20 GLY H . 20 . HN 1 1 274 1 2 1 1 27 ALA H . 27 . HN 1 1 275 1 1 1 1 20 GLY HA2 . 20 . HA2 1 1 275 1 2 1 1 21 SER H . 21 . HN 1 1 276 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 276 1 2 1 1 21 SER H . 21 . HN 1 1 277 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 277 1 2 1 1 23 GLY H . 23 . HN 1 1 278 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 278 1 2 1 1 25 SER H . 25 . HN 1 1 279 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 279 1 2 1 1 26 ALA HA . 26 . HA 1 1 280 1 1 1 1 21 SER H . 21 . HN 1 1 280 1 2 1 1 22 ASP H . 22 . HN 1 1 281 1 1 1 1 21 SER H . 21 . HN 1 1 281 1 2 1 1 23 GLY H . 23 . HN 1 1 282 1 1 1 1 21 SER HA . 21 . HA 1 1 282 1 2 1 1 22 ASP H . 22 . HN 1 1 283 1 1 1 1 21 SER HA . 21 . HA 1 1 283 1 2 1 1 22 ASP HA . 22 . HA 1 1 284 1 1 1 1 21 SER HA . 21 . HA 1 1 284 1 2 1 1 23 GLY H . 23 . HN 1 1 285 1 1 1 1 21 SER QB . 21 . HB# 1 1 285 1 2 1 1 22 ASP H . 22 . HN 1 1 286 1 1 1 1 22 ASP H . 22 . HN 1 1 286 1 2 1 1 23 GLY H . 23 . HN 1 1 287 1 1 1 1 22 ASP H . 22 . HN 1 1 287 1 2 1 1 23 GLY HA2 . 23 . HA2 1 1 288 1 1 1 1 22 ASP H . 22 . HN 1 1 288 1 2 1 1 23 GLY HA3 . 23 . HA1 1 1 289 1 1 1 1 22 ASP HA . 22 . HA 1 1 289 1 2 1 1 23 GLY H . 23 . HN 1 1 290 1 1 1 1 22 ASP HB2 . 22 . HB2 1 1 290 1 2 1 1 23 GLY H . 23 . HN 1 1 291 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 291 1 2 1 1 23 GLY H . 23 . HN 1 1 292 1 1 1 1 24 LYS H . 24 . HN 1 1 292 1 2 1 1 24 LYS QE . 24 . HE# 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 25 SER H . 25 . HN 1 1 300 1 1 1 1 24 LYS HB2 . 24 . HB2 1 1 300 1 2 1 1 25 SER H . 25 . HN 1 1 301 1 1 1 1 24 LYS HB3 . 24 . HB1 1 1 301 1 2 1 1 25 SER H . 25 . HN 1 1 302 1 1 1 1 25 SER H . 25 . HN 1 1 302 1 2 1 1 26 ALA H . 26 . HN 1 1 303 1 1 1 1 25 SER HA . 25 . HA 1 1 303 1 2 1 1 26 ALA H . 26 . HN 1 1 304 1 1 1 1 25 SER HA . 25 . HA 1 1 304 1 2 1 1 26 ALA MB . 26 . HB# 1 1 305 1 1 1 1 25 SER HB2 . 25 . HB2 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 HA . 26 . HA 1 1 307 1 1 1 1 25 SER HB3 . 25 . HB1 1 1 307 1 2 1 1 26 ALA H . 26 . HN 1 1 308 1 1 1 1 25 SER HB3 . 25 . HB1 1 1 308 1 2 1 1 26 ALA HA . 26 . HA 1 1 309 1 1 1 1 26 ALA H . 26 . HN 1 1 309 1 2 1 1 26 ALA MB . 26 . HB# 1 1 310 1 1 1 1 26 ALA H . 26 . HN 1 1 310 1 2 1 1 27 ALA H . 27 . HN 1 1 311 1 1 1 1 26 ALA H . 26 . HN 1 1 311 1 2 1 1 27 ALA HA . 27 . HA 1 1 312 1 1 1 1 26 ALA HA . 26 . HA 1 1 312 1 2 1 1 27 ALA H . 27 . HN 1 1 313 1 1 1 1 27 ALA H . 27 . HN 1 1 313 1 2 1 1 27 ALA MB . 27 . HB# 1 1 314 1 1 1 1 27 ALA H . 27 . HN 1 1 314 1 2 1 1 28 CYS H . 28 . HN 1 1 315 1 1 1 1 27 ALA HA . 27 . HA 1 1 315 1 2 1 1 28 CYS H . 28 . HN 1 1 316 1 1 1 1 27 ALA MB . 27 . HB# 1 1 316 1 2 1 1 28 CYS H . 28 . HN 1 1 317 1 1 1 1 27 ALA MB . 27 . HB# 1 1 317 1 2 1 1 28 CYS HA . 28 . HA 1 1 318 1 1 1 1 28 CYS HA . 28 . HA 1 1 318 1 2 1 1 29 THR H . 29 . HN 1 1 319 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 319 1 2 1 1 29 THR H . 29 . HN 1 1 320 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 320 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 321 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 321 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 322 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 322 1 2 1 1 29 THR H . 29 . HN 1 1 323 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 323 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 324 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 324 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 325 1 1 1 1 29 THR H . 29 . HN 1 1 325 1 2 1 1 29 THR MG . 29 . HG2# 1 1 326 1 1 1 1 29 THR HA . 29 . HA 1 1 326 1 2 1 1 29 THR MG . 29 . HG2# 1 1 327 1 1 1 1 29 THR HA . 29 . HA 1 1 327 1 2 1 1 30 LEU H . 30 . HN 1 1 328 1 1 1 1 30 LEU H . 30 . HN 1 1 328 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 329 1 1 1 1 30 LEU H . 30 . HN 1 1 329 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 330 1 1 1 1 30 LEU H . 30 . HN 1 1 330 1 2 1 1 30 LEU HG . 30 . HG 1 1 331 1 1 1 1 30 LEU H . 30 . HN 1 1 331 1 2 1 1 31 LYS QE . 31 . HE# 1 1 332 1 1 1 1 30 LEU HA . 30 . HA 1 1 332 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 333 1 1 1 1 30 LEU HA . 30 . HA 1 1 333 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 334 1 1 1 1 30 LEU HA . 30 . HA 1 1 334 1 2 1 1 31 LYS H . 31 . HN 1 1 335 1 1 1 1 30 LEU HB2 . 30 . HB2 1 1 335 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 336 1 1 1 1 30 LEU HB2 . 30 . HB2 1 1 336 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 337 1 1 1 1 30 LEU HB3 . 30 . HB1 1 1 337 1 2 1 1 30 LEU MD1 . 30 . HD1# 1 1 338 1 1 1 1 30 LEU HB3 . 30 . HB1 1 1 338 1 2 1 1 30 LEU MD2 . 30 . HD2# 1 1 339 1 1 1 1 31 LYS H . 31 . HN 1 1 339 1 2 1 1 31 LYS HB2 . 31 . HB2 1 1 340 1 1 1 1 31 LYS H . 31 . HN 1 1 340 1 2 1 1 31 LYS HB3 . 31 . HB1 1 1 341 1 1 1 1 31 LYS HA . 31 . HA 1 1 341 1 2 1 1 32 ALA H . 32 . HN 1 1 342 1 1 1 1 32 ALA H . 32 . HN 1 1 342 1 2 1 1 32 ALA MB . 32 . HB# 1 1 343 1 1 1 1 32 ALA HA . 32 . HA 1 1 343 1 2 1 1 33 CYS H . 33 . HN 1 1 344 1 1 1 1 32 ALA HA . 32 . HA 1 1 344 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 345 1 1 1 1 32 ALA MB . 32 . HB# 1 1 345 1 2 1 1 33 CYS H . 33 . HN 1 1 346 1 1 1 1 32 ALA MB . 32 . HB# 1 1 346 1 2 1 1 33 CYS HA . 33 . HA 1 1 347 1 1 1 1 33 CYS H . 33 . HN 1 1 347 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 348 1 1 1 1 33 CYS H . 33 . HN 1 1 348 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 349 1 1 1 1 33 CYS HA . 33 . HA 1 1 349 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 350 1 1 1 1 33 CYS HA . 33 . HA 1 1 350 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 351 1 1 1 1 33 CYS HA . 33 . HA 1 1 351 1 2 1 1 34 PRO QG . 34 . HG# 1 1 352 1 1 1 1 33 CYS HB2 . 33 . HB2 1 1 352 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 353 1 1 1 1 33 CYS HB2 . 33 . HB2 1 1 353 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 354 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 354 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 355 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 355 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 356 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 356 1 2 1 1 35 GLN H . 35 . HN 1 1 357 1 1 1 1 34 PRO HA . 34 . HA 1 1 357 1 2 1 1 34 PRO HD2 . 34 . HD2 1 1 358 1 1 1 1 34 PRO HA . 34 . HA 1 1 358 1 2 1 1 34 PRO HD3 . 34 . HD1 1 1 359 1 1 1 1 34 PRO HA . 34 . HA 1 1 359 1 2 1 1 35 GLN H . 35 . HN 1 1 360 1 1 1 1 34 PRO HB2 . 34 . HB2 1 1 360 1 2 1 1 35 GLN H . 35 . HN 1 1 361 1 1 1 1 34 PRO HB3 . 34 . HB1 1 1 361 1 2 1 1 35 GLN H . 35 . HN 1 1 362 1 1 1 1 34 PRO HD2 . 34 . HD2 1 1 362 1 2 1 1 35 GLN H . 35 . HN 1 1 363 1 1 1 1 34 PRO HD3 . 34 . HD1 1 1 363 1 2 1 1 35 GLN H . 35 . HN 1 1 364 1 1 1 1 34 PRO QG . 34 . HG# 1 1 364 1 2 1 1 35 GLN H . 35 . HN 1 1 365 1 1 1 1 35 GLN H . 35 . HN 1 1 365 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 3.5 1 1 18 1 . . . . . 1.8 1.8 5.0 1 1 19 1 . . . . . 1.8 1.8 7.15 1 1 20 1 . . . . . 1.8 1.8 5.0 1 1 21 1 . . . . . 1.8 1.8 5.0 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 3.5 1 1 25 1 . . . . . 1.8 1.8 3.5 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 3.5 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 7.15 1 1 37 1 . . . . . 1.8 1.8 7.15 1 1 38 1 . . . . . 1.8 1.8 5.0 1 1 39 1 . . . . . 1.8 1.8 5.0 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 5.0 1 1 45 1 . . . . . 1.8 1.8 5.0 1 1 46 1 . . . . . 1.8 1.8 5.0 1 1 47 1 . . . . . 1.8 1.8 3.5 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 5.0 1 1 51 1 . . . . . 1.8 1.8 5.0 1 1 52 1 . . . . . 1.8 1.8 3.5 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 5.0 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 3.5 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 3.5 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 3.5 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 5.0 1 1 90 1 . . . . . 1.8 1.8 7.15 1 1 91 1 . . . . . 1.8 1.8 3.5 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 5.0 1 1 96 1 . . . . . 1.8 1.8 3.5 1 1 97 1 . . . . . 1.8 1.8 5.0 1 1 98 1 . . . . . 1.8 1.8 7.15 1 1 99 1 . . . . . 1.8 1.8 7.15 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 3.5 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 5.0 1 1 110 1 . . . . . 1.8 1.8 5.0 1 1 111 1 . . . . . 1.8 1.8 5.0 1 1 112 1 . . . . . 1.8 1.8 5.65 1 1 113 1 . . . . . 1.8 1.8 7.15 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 3.5 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 3.5 1 1 123 1 . . . . . 1.8 1.8 7.15 1 1 124 1 . . . . . 1.8 1.8 6.0 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 5.0 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 3.5 1 1 150 1 . . . . . 1.8 1.8 3.5 1 1 151 1 . . . . . 1.8 1.8 3.5 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 3.5 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 3.5 1 1 163 1 . . . . . 1.8 1.8 3.5 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 5.0 1 1 167 1 . . . . . 1.8 1.8 3.5 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 5.0 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 5.0 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 3.5 1 1 178 1 . . . . . 1.8 1.8 5.0 1 1 179 1 . . . . . 1.8 1.8 5.0 1 1 180 1 . . . . . 1.8 1.8 3.5 1 1 181 1 . . . . . 1.8 1.8 5.0 1 1 182 1 . . . . . 1.8 1.8 3.5 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 3.5 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 3.5 1 1 202 1 . . . . . 1.8 1.8 5.0 1 1 203 1 . . . . . 1.8 1.8 3.5 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 3.5 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 3.5 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 3.5 1 1 218 1 . . . . . 1.8 1.8 3.5 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 3.5 1 1 227 1 . . . . . 1.8 1.8 5.0 1 1 228 1 . . . . . 1.8 1.8 5.0 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 3.5 1 1 232 1 . . . . . 1.8 1.8 5.0 1 1 233 1 . . . . . 1.8 1.8 5.0 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 5.0 1 1 238 1 . . . . . 1.8 1.8 3.5 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 3.5 1 1 242 1 . . . . . 1.8 1.8 3.5 1 1 243 1 . . . . . 1.8 1.8 5.0 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 3.5 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 5.0 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 3.5 1 1 263 1 . . . . . 1.8 1.8 3.5 1 1 264 1 . . . . . 1.8 1.8 5.0 1 1 265 1 . . . . . 1.8 1.8 3.5 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 5.0 1 1 271 1 . . . . . 1.8 1.8 5.0 1 1 272 1 . . . . . 1.8 1.8 3.5 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 3.5 1 1 276 1 . . . . . 1.8 1.8 3.5 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 5.0 1 1 282 1 . . . . . 1.8 1.8 5.0 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 3.5 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 3.5 1 1 304 1 . . . . . 1.8 1.8 5.0 1 1 305 1 . . . . . 1.8 1.8 5.0 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 3.5 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 3.5 1 1 313 1 . . . . . 1.8 1.8 3.5 1 1 314 1 . . . . . 1.8 1.8 5.0 1 1 315 1 . . . . . 1.8 1.8 3.5 1 1 316 1 . . . . . 1.8 1.8 5.0 1 1 317 1 . . . . . 1.8 1.8 5.0 1 1 318 1 . . . . . 1.8 1.8 3.5 1 1 319 1 . . . . . 1.8 1.8 5.0 1 1 320 1 . . . . . 1.8 1.8 5.0 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 5.0 1 1 324 1 . . . . . 1.8 1.8 5.0 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 5.0 1 1 329 1 . . . . . 1.8 1.8 5.0 1 1 330 1 . . . . . 1.8 1.8 3.5 1 1 331 1 . . . . . 1.8 1.8 5.0 1 1 332 1 . . . . . 1.8 1.8 5.0 1 1 333 1 . . . . . 1.8 1.8 5.0 1 1 334 1 . . . . . 1.8 1.8 3.5 1 1 335 1 . . . . . 1.8 1.8 3.5 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 3.5 1 1 339 1 . . . . . 1.8 1.8 3.5 1 1 340 1 . . . . . 1.8 1.8 3.5 1 1 341 1 . . . . . 1.8 1.8 5.0 1 1 342 1 . . . . . 1.8 1.8 3.5 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 1 349 1 . . . . . 1.8 1.8 3.5 1 1 350 1 . . . . . 1.8 1.8 3.5 1 1 351 1 . . . . . 1.8 1.8 5.0 1 1 352 1 . . . . . 1.8 1.8 5.0 1 1 353 1 . . . . . 1.8 1.8 5.0 1 1 354 1 . . . . . 1.8 1.8 5.0 1 1 355 1 . . . . . 1.8 1.8 5.0 1 1 356 1 . . . . . 1.8 1.8 5.0 1 1 357 1 . . . . . 1.8 1.8 5.0 1 1 358 1 . . . . . 1.8 1.8 5.0 1 1 359 1 . . . . . 1.8 1.8 3.5 1 1 360 1 . . . . . 1.8 1.8 5.0 1 1 361 1 . . . . . 1.8 1.8 5.0 1 1 362 1 . . . . . 1.8 1.8 5.0 1 1 363 1 . . . . . 1.8 1.8 5.0 1 1 364 1 . . . . . 1.8 1.8 5.0 1 1 365 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 4.968 1.401 9.505 1.00 . A A . 1 GLU C 1 1 1 2 1 1 1 GLU CA C 6.183 0.935 10.312 1.00 . A A . 1 GLU CA 1 1 1 3 1 1 1 GLU CB C 6.942 2.137 10.881 1.00 . A A . 1 GLU CB 1 1 1 4 1 1 1 GLU CD C 8.520 2.828 12.692 1.00 . A A . 1 GLU CD 1 1 1 5 1 1 1 GLU CG C 8.020 1.651 11.852 1.00 . A A . 1 GLU CG 1 1 1 6 1 1 1 GLU H1 H 7.859 -0.265 9.996 1.00 . A A . 1 GLU H1 1 1 1 7 1 1 1 GLU H2 H 7.651 0.957 8.833 1.00 . A A . 1 GLU H2 1 1 1 8 1 1 1 GLU H3 H 6.660 -0.424 8.806 1.00 . A A . 1 GLU H3 1 1 1 9 1 1 1 GLU HA H 5.878 0.280 11.112 1.00 . A A . 1 GLU HA 1 1 1 10 1 1 1 GLU HB2 H 7.404 2.685 10.073 1.00 . A A . 1 GLU HB2 1 1 1 11 1 1 1 GLU HB3 H 6.252 2.781 11.405 1.00 . A A . 1 GLU HB3 1 1 1 12 1 1 1 GLU HG2 H 7.604 0.895 12.502 1.00 . A A . 1 GLU HG2 1 1 1 13 1 1 1 GLU HG3 H 8.844 1.233 11.295 1.00 . A A . 1 GLU HG3 1 1 1 14 1 1 1 GLU N N 7.162 0.249 9.419 1.00 . A A . 1 GLU N 1 1 1 15 1 1 1 GLU O O 4.886 2.542 9.096 1.00 . A A . 1 GLU O 1 1 1 16 1 1 1 GLU OE1 O 8.222 3.956 12.334 1.00 . A A . 1 GLU OE1 1 1 1 17 1 1 1 GLU OE2 O 9.194 2.582 13.679 1.00 . A A . 1 GLU OE2 1 1 1 18 1 1 2 VAL C C 1.610 1.103 9.410 1.00 . A A . 2 VAL C 1 1 1 19 1 1 2 VAL CA C 2.819 0.931 8.487 1.00 . A A . 2 VAL CA 1 1 1 20 1 1 2 VAL CB C 2.578 -0.216 7.505 1.00 . A A . 2 VAL CB 1 1 1 21 1 1 2 VAL CG1 C 1.484 0.184 6.512 1.00 . A A . 2 VAL CG1 1 1 1 22 1 1 2 VAL CG2 C 3.868 -0.515 6.742 1.00 . A A . 2 VAL CG2 1 1 1 23 1 1 2 VAL H H 4.108 -0.388 9.607 1.00 . A A . 2 VAL H 1 1 1 24 1 1 2 VAL HA H 3.012 1.843 7.944 1.00 . A A . 2 VAL HA 1 1 1 25 1 1 2 VAL HB H 2.266 -1.095 8.050 1.00 . A A . 2 VAL HB 1 1 1 26 1 1 2 VAL HG11 H 0.620 0.539 7.052 1.00 . A A . 2 VAL HG11 1 1 1 27 1 1 2 VAL HG12 H 1.209 -0.672 5.916 1.00 . A A . 2 VAL HG12 1 1 1 28 1 1 2 VAL HG13 H 1.853 0.967 5.868 1.00 . A A . 2 VAL HG13 1 1 1 29 1 1 2 VAL HG21 H 3.629 -0.999 5.807 1.00 . A A . 2 VAL HG21 1 1 1 30 1 1 2 VAL HG22 H 4.494 -1.166 7.335 1.00 . A A . 2 VAL HG22 1 1 1 31 1 1 2 VAL HG23 H 4.393 0.409 6.545 1.00 . A A . 2 VAL HG23 1 1 1 32 1 1 2 VAL N N 4.025 0.529 9.270 1.00 . A A . 2 VAL N 1 1 1 33 1 1 2 VAL O O 1.573 0.590 10.509 1.00 . A A . 2 VAL O 1 1 1 34 1 1 3 THR C C -1.850 1.825 8.940 1.00 . A A . 3 THR C 1 1 1 35 1 1 3 THR CA C -0.599 2.034 9.796 1.00 . A A . 3 THR CA 1 1 1 36 1 1 3 THR CB C -0.506 3.485 10.267 1.00 . A A . 3 THR CB 1 1 1 37 1 1 3 THR CG2 C -0.217 4.392 9.069 1.00 . A A . 3 THR CG2 1 1 1 38 1 1 3 THR H H 0.671 2.221 8.068 1.00 . A A . 3 THR H 1 1 1 39 1 1 3 THR HA H -0.601 1.366 10.642 1.00 . A A . 3 THR HA 1 1 1 40 1 1 3 THR HB H 0.293 3.581 10.986 1.00 . A A . 3 THR HB 1 1 1 41 1 1 3 THR HG1 H -1.748 4.825 10.936 1.00 . A A . 3 THR HG1 1 1 1 42 1 1 3 THR HG21 H 0.812 4.271 8.767 1.00 . A A . 3 THR HG21 1 1 1 43 1 1 3 THR HG22 H -0.393 5.420 9.345 1.00 . A A . 3 THR HG22 1 1 1 44 1 1 3 THR HG23 H -0.867 4.123 8.250 1.00 . A A . 3 THR HG23 1 1 1 45 1 1 3 THR N N 0.618 1.822 8.961 1.00 . A A . 3 THR N 1 1 1 46 1 1 3 THR O O -2.463 2.768 8.479 1.00 . A A . 3 THR O 1 1 1 47 1 1 3 THR OG1 O -1.735 3.867 10.868 1.00 . A A . 3 THR OG1 1 1 1 48 1 1 4 CYS C C -3.924 -1.100 8.078 1.00 . A A . 4 CYS C 1 1 1 49 1 1 4 CYS CA C -3.429 0.332 7.871 1.00 . A A . 4 CYS CA 1 1 1 50 1 1 4 CYS CB C -2.940 0.510 6.435 1.00 . A A . 4 CYS CB 1 1 1 51 1 1 4 CYS H H -1.713 -0.150 9.085 1.00 . A A . 4 CYS H 1 1 1 52 1 1 4 CYS HA H -4.211 1.043 8.088 1.00 . A A . 4 CYS HA 1 1 1 53 1 1 4 CYS HB2 H -3.739 0.265 5.749 1.00 . A A . 4 CYS HB2 1 1 1 54 1 1 4 CYS HB3 H -2.632 1.534 6.283 1.00 . A A . 4 CYS HB3 1 1 1 55 1 1 4 CYS N N -2.226 0.598 8.712 1.00 . A A . 4 CYS N 1 1 1 56 1 1 4 CYS O O -3.258 -1.918 8.681 1.00 . A A . 4 CYS O 1 1 1 57 1 1 4 CYS SG S -1.533 -0.594 6.146 1.00 . A A . 4 CYS SG 1 1 1 58 1 1 5 GLU C C -5.257 -3.603 6.456 1.00 . A A . 5 GLU C 1 1 1 59 1 1 5 GLU CA C -5.612 -2.796 7.706 1.00 . A A . 5 GLU CA 1 1 1 60 1 1 5 GLU CB C -7.128 -2.634 7.831 1.00 . A A . 5 GLU CB 1 1 1 61 1 1 5 GLU CD C -8.837 -2.524 9.651 1.00 . A A . 5 GLU CD 1 1 1 62 1 1 5 GLU CG C -7.604 -3.270 9.140 1.00 . A A . 5 GLU CG 1 1 1 63 1 1 5 GLU H H -5.593 -0.741 7.067 1.00 . A A . 5 GLU H 1 1 1 64 1 1 5 GLU HA H -5.212 -3.267 8.590 1.00 . A A . 5 GLU HA 1 1 1 65 1 1 5 GLU HB2 H -7.379 -1.583 7.827 1.00 . A A . 5 GLU HB2 1 1 1 66 1 1 5 GLU HB3 H -7.611 -3.123 6.999 1.00 . A A . 5 GLU HB3 1 1 1 67 1 1 5 GLU HG2 H -7.855 -4.306 8.965 1.00 . A A . 5 GLU HG2 1 1 1 68 1 1 5 GLU HG3 H -6.818 -3.209 9.877 1.00 . A A . 5 GLU HG3 1 1 1 69 1 1 5 GLU N N -5.081 -1.413 7.563 1.00 . A A . 5 GLU N 1 1 1 70 1 1 5 GLU O O -5.038 -3.043 5.400 1.00 . A A . 5 GLU O 1 1 1 71 1 1 5 GLU OE1 O -8.836 -1.305 9.592 1.00 . A A . 5 GLU OE1 1 1 1 72 1 1 5 GLU OE2 O -9.763 -3.184 10.095 1.00 . A A . 5 GLU OE2 1 1 1 73 1 1 6 PRO C C -6.029 -5.830 4.484 1.00 . A A . 6 PRO C 1 1 1 74 1 1 6 PRO CA C -4.871 -5.786 5.484 1.00 . A A . 6 PRO CA 1 1 1 75 1 1 6 PRO CB C -4.653 -7.142 6.148 1.00 . A A . 6 PRO CB 1 1 1 76 1 1 6 PRO CD C -5.463 -5.638 7.854 1.00 . A A . 6 PRO CD 1 1 1 77 1 1 6 PRO CG C -5.436 -7.081 7.420 1.00 . A A . 6 PRO CG 1 1 1 78 1 1 6 PRO HA H -3.964 -5.460 5.000 1.00 . A A . 6 PRO HA 1 1 1 79 1 1 6 PRO HB2 H -5.021 -7.936 5.513 1.00 . A A . 6 PRO HB2 1 1 1 80 1 1 6 PRO HB3 H -3.607 -7.288 6.368 1.00 . A A . 6 PRO HB3 1 1 1 81 1 1 6 PRO HD2 H -6.433 -5.383 8.259 1.00 . A A . 6 PRO HD2 1 1 1 82 1 1 6 PRO HD3 H -4.684 -5.441 8.574 1.00 . A A . 6 PRO HD3 1 1 1 83 1 1 6 PRO HG2 H -6.441 -7.438 7.249 1.00 . A A . 6 PRO HG2 1 1 1 84 1 1 6 PRO HG3 H -4.955 -7.680 8.177 1.00 . A A . 6 PRO HG3 1 1 1 85 1 1 6 PRO N N -5.208 -4.894 6.618 1.00 . A A . 6 PRO N 1 1 1 86 1 1 6 PRO O O -7.106 -6.307 4.785 1.00 . A A . 6 PRO O 1 1 1 87 1 1 7 GLY C C -7.490 -3.916 2.167 1.00 . A A . 7 GLY C 1 1 1 88 1 1 7 GLY CA C -6.904 -5.326 2.281 1.00 . A A . 7 GLY CA 1 1 1 89 1 1 7 GLY H H -4.943 -4.941 3.082 1.00 . A A . 7 GLY H 1 1 1 90 1 1 7 GLY HA2 H -6.502 -5.631 1.325 1.00 . A A . 7 GLY HA2 1 1 1 91 1 1 7 GLY HA3 H -7.682 -6.011 2.584 1.00 . A A . 7 GLY HA3 1 1 1 92 1 1 7 GLY N N -5.818 -5.326 3.300 1.00 . A A . 7 GLY N 1 1 1 93 1 1 7 GLY O O -8.690 -3.730 2.177 1.00 . A A . 7 GLY O 1 1 1 94 1 1 8 THR C C -6.157 -0.625 1.214 1.00 . A A . 8 THR C 1 1 1 95 1 1 8 THR CA C -7.164 -1.522 1.946 1.00 . A A . 8 THR CA 1 1 1 96 1 1 8 THR CB C -7.349 -1.050 3.389 1.00 . A A . 8 THR CB 1 1 1 97 1 1 8 THR CG2 C -8.406 0.055 3.436 1.00 . A A . 8 THR CG2 1 1 1 98 1 1 8 THR H H -5.687 -3.092 2.053 1.00 . A A . 8 THR H 1 1 1 99 1 1 8 THR HA H -8.111 -1.513 1.435 1.00 . A A . 8 THR HA 1 1 1 100 1 1 8 THR HB H -6.415 -0.663 3.766 1.00 . A A . 8 THR HB 1 1 1 101 1 1 8 THR HG1 H -8.301 -1.794 4.913 1.00 . A A . 8 THR HG1 1 1 1 102 1 1 8 THR HG21 H -9.223 -0.253 4.072 1.00 . A A . 8 THR HG21 1 1 1 103 1 1 8 THR HG22 H -8.778 0.239 2.439 1.00 . A A . 8 THR HG22 1 1 1 104 1 1 8 THR HG23 H -7.965 0.959 3.827 1.00 . A A . 8 THR HG23 1 1 1 105 1 1 8 THR N N -6.650 -2.920 2.058 1.00 . A A . 8 THR N 1 1 1 106 1 1 8 THR O O -6.533 0.290 0.511 1.00 . A A . 8 THR O 1 1 1 107 1 1 8 THR OG1 O -7.771 -2.143 4.194 1.00 . A A . 8 THR OG1 1 1 1 108 1 1 9 THR C C -4.189 1.442 0.782 1.00 . A A . 9 THR C 1 1 1 109 1 1 9 THR CA C -3.837 -0.047 0.706 1.00 . A A . 9 THR CA 1 1 1 110 1 1 9 THR CB C -3.801 -0.531 -0.749 1.00 . A A . 9 THR CB 1 1 1 111 1 1 9 THR CG2 C -5.036 -0.039 -1.504 1.00 . A A . 9 THR CG2 1 1 1 112 1 1 9 THR H H -4.611 -1.620 1.960 1.00 . A A . 9 THR H 1 1 1 113 1 1 9 THR HA H -2.876 -0.219 1.166 1.00 . A A . 9 THR HA 1 1 1 114 1 1 9 THR HB H -3.781 -1.609 -0.767 1.00 . A A . 9 THR HB 1 1 1 115 1 1 9 THR HG1 H -2.431 -0.593 -2.130 1.00 . A A . 9 THR HG1 1 1 1 116 1 1 9 THR HG21 H -5.244 0.985 -1.234 1.00 . A A . 9 THR HG21 1 1 1 117 1 1 9 THR HG22 H -5.883 -0.658 -1.248 1.00 . A A . 9 THR HG22 1 1 1 118 1 1 9 THR HG23 H -4.855 -0.100 -2.567 1.00 . A A . 9 THR HG23 1 1 1 119 1 1 9 THR N N -4.883 -0.880 1.382 1.00 . A A . 9 THR N 1 1 1 120 1 1 9 THR O O -5.117 1.840 1.457 1.00 . A A . 9 THR O 1 1 1 121 1 1 9 THR OG1 O -2.631 -0.027 -1.380 1.00 . A A . 9 THR OG1 1 1 1 122 1 1 10 PHE C C -2.670 4.508 -0.647 1.00 . A A . 10 PHE C 1 1 1 123 1 1 10 PHE CA C -3.727 3.736 0.149 1.00 . A A . 10 PHE CA 1 1 1 124 1 1 10 PHE CB C -3.662 4.113 1.633 1.00 . A A . 10 PHE CB 1 1 1 125 1 1 10 PHE CD1 C -1.201 4.101 2.195 1.00 . A A . 10 PHE CD1 1 1 1 126 1 1 10 PHE CD2 C -2.575 2.243 2.931 1.00 . A A . 10 PHE CD2 1 1 1 127 1 1 10 PHE CE1 C -0.080 3.502 2.783 1.00 . A A . 10 PHE CE1 1 1 1 128 1 1 10 PHE CE2 C -1.454 1.646 3.517 1.00 . A A . 10 PHE CE2 1 1 1 129 1 1 10 PHE CG C -2.450 3.470 2.269 1.00 . A A . 10 PHE CG 1 1 1 130 1 1 10 PHE CZ C -0.207 2.274 3.443 1.00 . A A . 10 PHE CZ 1 1 1 131 1 1 10 PHE H H -2.689 1.936 -0.424 1.00 . A A . 10 PHE H 1 1 1 132 1 1 10 PHE HA H -4.713 3.938 -0.238 1.00 . A A . 10 PHE HA 1 1 1 133 1 1 10 PHE HB2 H -3.590 5.186 1.727 1.00 . A A . 10 PHE HB2 1 1 1 134 1 1 10 PHE HB3 H -4.554 3.766 2.130 1.00 . A A . 10 PHE HB3 1 1 1 135 1 1 10 PHE HD1 H -1.103 5.048 1.685 1.00 . A A . 10 PHE HD1 1 1 1 136 1 1 10 PHE HD2 H -3.537 1.757 2.992 1.00 . A A . 10 PHE HD2 1 1 1 137 1 1 10 PHE HE1 H 0.883 3.988 2.726 1.00 . A A . 10 PHE HE1 1 1 1 138 1 1 10 PHE HE2 H -1.552 0.701 4.024 1.00 . A A . 10 PHE HE2 1 1 1 139 1 1 10 PHE HZ H 0.658 1.811 3.898 1.00 . A A . 10 PHE HZ 1 1 1 140 1 1 10 PHE N N -3.441 2.273 0.106 1.00 . A A . 10 PHE N 1 1 1 141 1 1 10 PHE O O -1.829 3.930 -1.307 1.00 . A A . 10 PHE O 1 1 1 142 1 1 11 LYS C C -0.548 7.010 -0.428 1.00 . A A . 11 LYS C 1 1 1 143 1 1 11 LYS CA C -1.710 6.623 -1.343 1.00 . A A . 11 LYS CA 1 1 1 144 1 1 11 LYS CB C -2.476 7.865 -1.793 1.00 . A A . 11 LYS CB 1 1 1 145 1 1 11 LYS CD C -3.214 8.649 -4.045 1.00 . A A . 11 LYS CD 1 1 1 146 1 1 11 LYS CE C -4.278 9.712 -3.762 1.00 . A A . 11 LYS CE 1 1 1 147 1 1 11 LYS CG C -3.329 7.524 -3.015 1.00 . A A . 11 LYS CG 1 1 1 148 1 1 11 LYS H H -3.396 6.259 -0.053 1.00 . A A . 11 LYS H 1 1 1 149 1 1 11 LYS HA H -1.351 6.079 -2.203 1.00 . A A . 11 LYS HA 1 1 1 150 1 1 11 LYS HB2 H -3.114 8.205 -0.989 1.00 . A A . 11 LYS HB2 1 1 1 151 1 1 11 LYS HB3 H -1.777 8.645 -2.051 1.00 . A A . 11 LYS HB3 1 1 1 152 1 1 11 LYS HD2 H -2.232 9.095 -3.982 1.00 . A A . 11 LYS HD2 1 1 1 153 1 1 11 LYS HD3 H -3.365 8.246 -5.036 1.00 . A A . 11 LYS HD3 1 1 1 154 1 1 11 LYS HE2 H -4.589 9.665 -2.727 1.00 . A A . 11 LYS HE2 1 1 1 155 1 1 11 LYS HE3 H -3.901 10.695 -4.000 1.00 . A A . 11 LYS HE3 1 1 1 156 1 1 11 LYS HG2 H -2.980 6.598 -3.450 1.00 . A A . 11 LYS HG2 1 1 1 157 1 1 11 LYS HG3 H -4.361 7.416 -2.716 1.00 . A A . 11 LYS HG3 1 1 1 158 1 1 11 LYS HZ1 H -5.386 9.983 -5.503 1.00 . A A . 11 LYS HZ1 1 1 1 159 1 1 11 LYS HZ2 H -6.312 9.514 -4.159 1.00 . A A . 11 LYS HZ2 1 1 1 160 1 1 11 LYS HZ3 H -5.338 8.377 -4.960 1.00 . A A . 11 LYS HZ3 1 1 1 161 1 1 11 LYS N N -2.709 5.812 -0.591 1.00 . A A . 11 LYS N 1 1 1 162 1 1 11 LYS NZ N -5.414 9.370 -4.664 1.00 . A A . 11 LYS NZ 1 1 1 163 1 1 11 LYS O O -0.741 7.571 0.633 1.00 . A A . 11 LYS O 1 1 1 164 1 1 12 ASP C C 2.871 7.841 -0.775 1.00 . A A . 12 ASP C 1 1 1 165 1 1 12 ASP CA C 1.829 7.059 0.031 1.00 . A A . 12 ASP CA 1 1 1 166 1 1 12 ASP CB C 2.401 5.716 0.482 1.00 . A A . 12 ASP CB 1 1 1 167 1 1 12 ASP CG C 2.764 5.788 1.966 1.00 . A A . 12 ASP CG 1 1 1 168 1 1 12 ASP H H 0.796 6.255 -1.681 1.00 . A A . 12 ASP H 1 1 1 169 1 1 12 ASP HA H 1.512 7.630 0.889 1.00 . A A . 12 ASP HA 1 1 1 170 1 1 12 ASP HB2 H 1.662 4.941 0.329 1.00 . A A . 12 ASP HB2 1 1 1 171 1 1 12 ASP HB3 H 3.288 5.490 -0.093 1.00 . A A . 12 ASP HB3 1 1 1 172 1 1 12 ASP N N 0.659 6.711 -0.825 1.00 . A A . 12 ASP N 1 1 1 173 1 1 12 ASP O O 3.065 7.595 -1.949 1.00 . A A . 12 ASP O 1 1 1 174 1 1 12 ASP OD1 O 1.952 6.281 2.732 1.00 . A A . 12 ASP OD1 1 1 1 175 1 1 12 ASP OD2 O 3.849 5.348 2.312 1.00 . A A . 12 ASP OD2 1 1 1 176 1 1 13 LYS C C 4.327 9.707 -2.331 1.00 . A A . 13 LYS C 1 1 1 177 1 1 13 LYS CA C 4.586 9.600 -0.820 1.00 . A A . 13 LYS CA 1 1 1 178 1 1 13 LYS CB C 5.908 8.885 -0.528 1.00 . A A . 13 LYS CB 1 1 1 179 1 1 13 LYS CD C 7.077 6.732 -1.012 1.00 . A A . 13 LYS CD 1 1 1 180 1 1 13 LYS CE C 6.885 5.615 -2.041 1.00 . A A . 13 LYS CE 1 1 1 181 1 1 13 LYS CG C 5.727 7.381 -0.705 1.00 . A A . 13 LYS CG 1 1 1 182 1 1 13 LYS H H 3.347 8.934 0.812 1.00 . A A . 13 LYS H 1 1 1 183 1 1 13 LYS HA H 4.612 10.584 -0.388 1.00 . A A . 13 LYS HA 1 1 1 184 1 1 13 LYS HB2 H 6.667 9.241 -1.210 1.00 . A A . 13 LYS HB2 1 1 1 185 1 1 13 LYS HB3 H 6.210 9.093 0.489 1.00 . A A . 13 LYS HB3 1 1 1 186 1 1 13 LYS HD2 H 7.754 7.477 -1.408 1.00 . A A . 13 LYS HD2 1 1 1 187 1 1 13 LYS HD3 H 7.491 6.316 -0.106 1.00 . A A . 13 LYS HD3 1 1 1 188 1 1 13 LYS HE2 H 6.549 4.711 -1.553 1.00 . A A . 13 LYS HE2 1 1 1 189 1 1 13 LYS HE3 H 6.181 5.920 -2.799 1.00 . A A . 13 LYS HE3 1 1 1 190 1 1 13 LYS HG2 H 5.319 6.956 0.202 1.00 . A A . 13 LYS HG2 1 1 1 191 1 1 13 LYS HG3 H 5.050 7.200 -1.523 1.00 . A A . 13 LYS HG3 1 1 1 192 1 1 13 LYS HZ1 H 8.344 6.047 -3.461 1.00 . A A . 13 LYS HZ1 1 1 1 193 1 1 13 LYS HZ2 H 8.322 4.423 -2.961 1.00 . A A . 13 LYS HZ2 1 1 1 194 1 1 13 LYS HZ3 H 8.964 5.621 -1.941 1.00 . A A . 13 LYS HZ3 1 1 1 195 1 1 13 LYS N N 3.536 8.775 -0.136 1.00 . A A . 13 LYS N 1 1 1 196 1 1 13 LYS NZ N 8.230 5.412 -2.647 1.00 . A A . 13 LYS NZ 1 1 1 197 1 1 13 LYS O O 3.449 10.426 -2.765 1.00 . A A . 13 LYS O 1 1 1 198 1 1 14 CYS C C 4.383 7.734 -5.147 1.00 . A A . 14 CYS C 1 1 1 199 1 1 14 CYS CA C 4.866 9.084 -4.611 1.00 . A A . 14 CYS CA 1 1 1 200 1 1 14 CYS CB C 6.238 9.422 -5.194 1.00 . A A . 14 CYS CB 1 1 1 201 1 1 14 CYS H H 5.788 8.432 -2.779 1.00 . A A . 14 CYS H 1 1 1 202 1 1 14 CYS HA H 4.160 9.862 -4.851 1.00 . A A . 14 CYS HA 1 1 1 203 1 1 14 CYS HB2 H 6.909 8.589 -5.036 1.00 . A A . 14 CYS HB2 1 1 1 204 1 1 14 CYS HB3 H 6.142 9.612 -6.253 1.00 . A A . 14 CYS HB3 1 1 1 205 1 1 14 CYS N N 5.082 9.006 -3.138 1.00 . A A . 14 CYS N 1 1 1 206 1 1 14 CYS O O 4.508 7.445 -6.321 1.00 . A A . 14 CYS O 1 1 1 207 1 1 14 CYS SG S 6.903 10.893 -4.376 1.00 . A A . 14 CYS SG 1 1 1 208 1 1 15 ASN C C 2.244 5.041 -3.889 1.00 . A A . 15 ASN C 1 1 1 209 1 1 15 ASN CA C 3.374 5.568 -4.778 1.00 . A A . 15 ASN CA 1 1 1 210 1 1 15 ASN CB C 4.601 4.662 -4.674 1.00 . A A . 15 ASN CB 1 1 1 211 1 1 15 ASN CG C 5.645 5.094 -5.705 1.00 . A A . 15 ASN CG 1 1 1 212 1 1 15 ASN H H 3.760 7.143 -3.356 1.00 . A A . 15 ASN H 1 1 1 213 1 1 15 ASN HA H 3.049 5.628 -5.805 1.00 . A A . 15 ASN HA 1 1 1 214 1 1 15 ASN HB2 H 5.018 4.738 -3.681 1.00 . A A . 15 ASN HB2 1 1 1 215 1 1 15 ASN HB3 H 4.310 3.640 -4.864 1.00 . A A . 15 ASN HB3 1 1 1 216 1 1 15 ASN HD21 H 6.373 6.549 -4.562 1.00 . A A . 15 ASN HD21 1 1 1 217 1 1 15 ASN HD22 H 7.115 6.377 -6.088 1.00 . A A . 15 ASN HD22 1 1 1 218 1 1 15 ASN N N 3.845 6.900 -4.301 1.00 . A A . 15 ASN N 1 1 1 219 1 1 15 ASN ND2 N 6.445 6.088 -5.429 1.00 . A A . 15 ASN ND2 1 1 1 220 1 1 15 ASN O O 1.867 5.656 -2.912 1.00 . A A . 15 ASN O 1 1 1 221 1 1 15 ASN OD1 O 5.735 4.522 -6.774 1.00 . A A . 15 ASN OD1 1 1 1 222 1 1 16 THR C C 1.142 2.158 -2.570 1.00 . A A . 16 THR C 1 1 1 223 1 1 16 THR CA C 0.605 3.316 -3.407 1.00 . A A . 16 THR CA 1 1 1 224 1 1 16 THR CB C -0.428 2.827 -4.429 1.00 . A A . 16 THR CB 1 1 1 225 1 1 16 THR CG2 C -1.293 1.726 -3.811 1.00 . A A . 16 THR CG2 1 1 1 226 1 1 16 THR H H 2.034 3.422 -5.016 1.00 . A A . 16 THR H 1 1 1 227 1 1 16 THR HA H 0.170 4.066 -2.765 1.00 . A A . 16 THR HA 1 1 1 228 1 1 16 THR HB H 0.082 2.435 -5.295 1.00 . A A . 16 THR HB 1 1 1 229 1 1 16 THR HG1 H -1.510 3.780 -5.735 1.00 . A A . 16 THR HG1 1 1 1 230 1 1 16 THR HG21 H -2.290 1.778 -4.221 1.00 . A A . 16 THR HG21 1 1 1 231 1 1 16 THR HG22 H -1.336 1.860 -2.741 1.00 . A A . 16 THR HG22 1 1 1 232 1 1 16 THR HG23 H -0.860 0.761 -4.035 1.00 . A A . 16 THR HG23 1 1 1 233 1 1 16 THR N N 1.708 3.900 -4.225 1.00 . A A . 16 THR N 1 1 1 234 1 1 16 THR O O 1.867 1.312 -3.054 1.00 . A A . 16 THR O 1 1 1 235 1 1 16 THR OG1 O -1.252 3.916 -4.820 1.00 . A A . 16 THR OG1 1 1 1 236 1 1 17 CYS C C 0.159 0.062 -0.088 1.00 . A A . 17 CYS C 1 1 1 237 1 1 17 CYS CA C 1.290 1.032 -0.437 1.00 . A A . 17 CYS CA 1 1 1 238 1 1 17 CYS CB C 1.789 1.756 0.809 1.00 . A A . 17 CYS CB 1 1 1 239 1 1 17 CYS H H 0.214 2.821 -0.952 1.00 . A A . 17 CYS H 1 1 1 240 1 1 17 CYS HA H 2.106 0.508 -0.907 1.00 . A A . 17 CYS HA 1 1 1 241 1 1 17 CYS HB2 H 1.875 2.814 0.597 1.00 . A A . 17 CYS HB2 1 1 1 242 1 1 17 CYS HB3 H 1.089 1.606 1.614 1.00 . A A . 17 CYS HB3 1 1 1 243 1 1 17 CYS N N 0.796 2.123 -1.318 1.00 . A A . 17 CYS N 1 1 1 244 1 1 17 CYS O O -0.768 0.399 0.622 1.00 . A A . 17 CYS O 1 1 1 245 1 1 17 CYS SG S 3.410 1.104 1.276 1.00 . A A . 17 CYS SG 1 1 1 246 1 1 18 ARG C C -0.622 -2.717 1.131 1.00 . A A . 18 ARG C 1 1 1 247 1 1 18 ARG CA C -0.831 -2.146 -0.276 1.00 . A A . 18 ARG CA 1 1 1 248 1 1 18 ARG CB C -0.656 -3.233 -1.343 1.00 . A A . 18 ARG CB 1 1 1 249 1 1 18 ARG CD C -2.710 -4.312 -0.405 1.00 . A A . 18 ARG CD 1 1 1 250 1 1 18 ARG CG C -1.270 -4.552 -0.858 1.00 . A A . 18 ARG CG 1 1 1 251 1 1 18 ARG CZ C -3.233 -6.537 -1.205 1.00 . A A . 18 ARG CZ 1 1 1 252 1 1 18 ARG H H 0.992 -1.397 -1.145 1.00 . A A . 18 ARG H 1 1 1 253 1 1 18 ARG HA H -1.806 -1.697 -0.361 1.00 . A A . 18 ARG HA 1 1 1 254 1 1 18 ARG HB2 H -1.148 -2.922 -2.253 1.00 . A A . 18 ARG HB2 1 1 1 255 1 1 18 ARG HB3 H 0.395 -3.380 -1.537 1.00 . A A . 18 ARG HB3 1 1 1 256 1 1 18 ARG HD2 H -2.809 -4.520 0.652 1.00 . A A . 18 ARG HD2 1 1 1 257 1 1 18 ARG HD3 H -3.011 -3.299 -0.620 1.00 . A A . 18 ARG HD3 1 1 1 258 1 1 18 ARG HE H -4.293 -4.941 -1.725 1.00 . A A . 18 ARG HE 1 1 1 259 1 1 18 ARG HG2 H -1.261 -5.270 -1.666 1.00 . A A . 18 ARG HG2 1 1 1 260 1 1 18 ARG HG3 H -0.692 -4.933 -0.030 1.00 . A A . 18 ARG HG3 1 1 1 261 1 1 18 ARG HH11 H -3.013 -6.644 0.781 1.00 . A A . 18 ARG HH11 1 1 1 262 1 1 18 ARG HH12 H -2.750 -8.123 -0.082 1.00 . A A . 18 ARG HH12 1 1 1 263 1 1 18 ARG HH21 H -3.388 -6.731 -3.192 1.00 . A A . 18 ARG HH21 1 1 1 264 1 1 18 ARG HH22 H -2.965 -8.171 -2.330 1.00 . A A . 18 ARG HH22 1 1 1 265 1 1 18 ARG N N 0.233 -1.146 -0.578 1.00 . A A . 18 ARG N 1 1 1 266 1 1 18 ARG NE N -3.530 -5.266 -1.203 1.00 . A A . 18 ARG NE 1 1 1 267 1 1 18 ARG NH1 N -2.980 -7.149 -0.080 1.00 . A A . 18 ARG NH1 1 1 1 268 1 1 18 ARG NH2 N -3.193 -7.198 -2.330 1.00 . A A . 18 ARG NH2 1 1 1 269 1 1 18 ARG O O 0.331 -3.424 1.390 1.00 . A A . 18 ARG O 1 1 1 270 1 1 19 CYS C C -1.181 -4.467 3.388 1.00 . A A . 19 CYS C 1 1 1 271 1 1 19 CYS CA C -1.360 -2.945 3.427 1.00 . A A . 19 CYS CA 1 1 1 272 1 1 19 CYS CB C -2.661 -2.563 4.135 1.00 . A A . 19 CYS CB 1 1 1 273 1 1 19 CYS H H -2.273 -1.849 1.812 1.00 . A A . 19 CYS H 1 1 1 274 1 1 19 CYS HA H -0.520 -2.478 3.919 1.00 . A A . 19 CYS HA 1 1 1 275 1 1 19 CYS HB2 H -3.010 -1.613 3.754 1.00 . A A . 19 CYS HB2 1 1 1 276 1 1 19 CYS HB3 H -3.407 -3.324 3.952 1.00 . A A . 19 CYS HB3 1 1 1 277 1 1 19 CYS N N -1.509 -2.417 2.040 1.00 . A A . 19 CYS N 1 1 1 278 1 1 19 CYS O O -1.980 -5.181 2.816 1.00 . A A . 19 CYS O 1 1 1 279 1 1 19 CYS SG S -2.364 -2.423 5.916 1.00 . A A . 19 CYS SG 1 1 1 280 1 1 20 GLY C C -1.039 -7.164 4.661 1.00 . A A . 20 GLY C 1 1 1 281 1 1 20 GLY CA C 0.114 -6.434 3.969 1.00 . A A . 20 GLY CA 1 1 1 282 1 1 20 GLY H H 0.507 -4.367 4.428 1.00 . A A . 20 GLY H 1 1 1 283 1 1 20 GLY HA2 H 0.192 -6.776 2.945 1.00 . A A . 20 GLY HA2 1 1 1 284 1 1 20 GLY HA3 H 1.035 -6.650 4.492 1.00 . A A . 20 GLY HA3 1 1 1 285 1 1 20 GLY N N -0.129 -4.964 3.981 1.00 . A A . 20 GLY N 1 1 1 286 1 1 20 GLY O O -2.145 -6.667 4.742 1.00 . A A . 20 GLY O 1 1 1 287 1 1 21 SER C C -1.684 -9.052 7.356 1.00 . A A . 21 SER C 1 1 1 288 1 1 21 SER CA C -1.859 -9.122 5.837 1.00 . A A . 21 SER CA 1 1 1 289 1 1 21 SER CB C -1.675 -10.554 5.347 1.00 . A A . 21 SER CB 1 1 1 290 1 1 21 SER H H 0.114 -8.726 5.070 1.00 . A A . 21 SER H 1 1 1 291 1 1 21 SER HA H -2.833 -8.758 5.548 1.00 . A A . 21 SER HA 1 1 1 292 1 1 21 SER HB2 H -0.899 -10.583 4.601 1.00 . A A . 21 SER HB2 1 1 1 293 1 1 21 SER HB3 H -1.391 -11.184 6.181 1.00 . A A . 21 SER HB3 1 1 1 294 1 1 21 SER HG H -2.791 -11.016 3.823 1.00 . A A . 21 SER HG 1 1 1 295 1 1 21 SER N N -0.786 -8.345 5.153 1.00 . A A . 21 SER N 1 1 1 296 1 1 21 SER O O -2.501 -9.544 8.109 1.00 . A A . 21 SER O 1 1 1 297 1 1 21 SER OG O -2.892 -11.018 4.778 1.00 . A A . 21 SER OG 1 1 1 298 1 1 22 ASP C C -0.951 -7.019 9.807 1.00 . A A . 22 ASP C 1 1 1 299 1 1 22 ASP CA C -0.395 -8.342 9.281 1.00 . A A . 22 ASP CA 1 1 1 300 1 1 22 ASP CB C 1.123 -8.392 9.452 1.00 . A A . 22 ASP CB 1 1 1 301 1 1 22 ASP CG C 1.490 -7.969 10.877 1.00 . A A . 22 ASP CG 1 1 1 302 1 1 22 ASP H H 0.020 -8.055 7.187 1.00 . A A . 22 ASP H 1 1 1 303 1 1 22 ASP HA H -0.851 -9.175 9.793 1.00 . A A . 22 ASP HA 1 1 1 304 1 1 22 ASP HB2 H 1.474 -9.399 9.273 1.00 . A A . 22 ASP HB2 1 1 1 305 1 1 22 ASP HB3 H 1.588 -7.715 8.748 1.00 . A A . 22 ASP HB3 1 1 1 306 1 1 22 ASP N N -0.624 -8.446 7.811 1.00 . A A . 22 ASP N 1 1 1 307 1 1 22 ASP O O -0.882 -6.729 10.985 1.00 . A A . 22 ASP O 1 1 1 308 1 1 22 ASP OD1 O 0.798 -8.382 11.794 1.00 . A A . 22 ASP OD1 1 1 1 309 1 1 22 ASP OD2 O 2.458 -7.242 11.028 1.00 . A A . 22 ASP OD2 1 1 1 310 1 1 23 GLY C C -0.949 -3.963 9.798 1.00 . A A . 23 GLY C 1 1 1 311 1 1 23 GLY CA C -2.076 -4.917 9.392 1.00 . A A . 23 GLY CA 1 1 1 312 1 1 23 GLY H H -1.561 -6.473 7.997 1.00 . A A . 23 GLY H 1 1 1 313 1 1 23 GLY HA2 H -2.649 -4.478 8.586 1.00 . A A . 23 GLY HA2 1 1 1 314 1 1 23 GLY HA3 H -2.719 -5.088 10.241 1.00 . A A . 23 GLY HA3 1 1 1 315 1 1 23 GLY N N -1.510 -6.216 8.942 1.00 . A A . 23 GLY N 1 1 1 316 1 1 23 GLY O O -1.187 -2.926 10.383 1.00 . A A . 23 GLY O 1 1 1 317 1 1 24 LYS C C 2.504 -3.440 8.802 1.00 . A A . 24 LYS C 1 1 1 318 1 1 24 LYS CA C 1.406 -3.399 9.870 1.00 . A A . 24 LYS CA 1 1 1 319 1 1 24 LYS CB C 1.927 -3.949 11.196 1.00 . A A . 24 LYS CB 1 1 1 320 1 1 24 LYS CD C 3.962 -3.693 12.623 1.00 . A A . 24 LYS CD 1 1 1 321 1 1 24 LYS CE C 3.283 -4.698 13.557 1.00 . A A . 24 LYS CE 1 1 1 322 1 1 24 LYS CG C 2.899 -2.944 11.818 1.00 . A A . 24 LYS CG 1 1 1 323 1 1 24 LYS H H 0.454 -5.139 9.021 1.00 . A A . 24 LYS H 1 1 1 324 1 1 24 LYS HA H 1.053 -2.388 10.005 1.00 . A A . 24 LYS HA 1 1 1 325 1 1 24 LYS HB2 H 1.098 -4.113 11.869 1.00 . A A . 24 LYS HB2 1 1 1 326 1 1 24 LYS HB3 H 2.441 -4.883 11.023 1.00 . A A . 24 LYS HB3 1 1 1 327 1 1 24 LYS HD2 H 4.622 -4.216 11.947 1.00 . A A . 24 LYS HD2 1 1 1 328 1 1 24 LYS HD3 H 4.531 -2.987 13.209 1.00 . A A . 24 LYS HD3 1 1 1 329 1 1 24 LYS HE2 H 2.290 -4.357 13.818 1.00 . A A . 24 LYS HE2 1 1 1 330 1 1 24 LYS HE3 H 3.237 -5.671 13.092 1.00 . A A . 24 LYS HE3 1 1 1 331 1 1 24 LYS HG2 H 3.375 -2.374 11.034 1.00 . A A . 24 LYS HG2 1 1 1 332 1 1 24 LYS HG3 H 2.358 -2.277 12.472 1.00 . A A . 24 LYS HG3 1 1 1 333 1 1 24 LYS HZ1 H 3.557 -4.845 15.616 1.00 . A A . 24 LYS HZ1 1 1 1 334 1 1 24 LYS HZ2 H 4.713 -3.880 14.832 1.00 . A A . 24 LYS HZ2 1 1 1 335 1 1 24 LYS HZ3 H 4.786 -5.572 14.702 1.00 . A A . 24 LYS HZ3 1 1 1 336 1 1 24 LYS N N 0.276 -4.299 9.494 1.00 . A A . 24 LYS N 1 1 1 337 1 1 24 LYS NZ N 4.151 -4.753 14.768 1.00 . A A . 24 LYS NZ 1 1 1 338 1 1 24 LYS O O 3.598 -2.954 9.004 1.00 . A A . 24 LYS O 1 1 1 339 1 1 25 SER C C 2.668 -3.541 5.279 1.00 . A A . 25 SER C 1 1 1 340 1 1 25 SER CA C 3.246 -4.084 6.588 1.00 . A A . 25 SER CA 1 1 1 341 1 1 25 SER CB C 3.581 -5.570 6.457 1.00 . A A . 25 SER CB 1 1 1 342 1 1 25 SER H H 1.330 -4.400 7.522 1.00 . A A . 25 SER H 1 1 1 343 1 1 25 SER HA H 4.128 -3.530 6.870 1.00 . A A . 25 SER HA 1 1 1 344 1 1 25 SER HB2 H 2.692 -6.157 6.619 1.00 . A A . 25 SER HB2 1 1 1 345 1 1 25 SER HB3 H 3.968 -5.765 5.464 1.00 . A A . 25 SER HB3 1 1 1 346 1 1 25 SER HG H 5.397 -5.548 7.161 1.00 . A A . 25 SER HG 1 1 1 347 1 1 25 SER N N 2.220 -4.015 7.667 1.00 . A A . 25 SER N 1 1 1 348 1 1 25 SER O O 1.469 -3.517 5.085 1.00 . A A . 25 SER O 1 1 1 349 1 1 25 SER OG O 4.554 -5.918 7.435 1.00 . A A . 25 SER OG 1 1 1 350 1 1 26 ALA C C 3.970 -2.860 1.956 1.00 . A A . 26 ALA C 1 1 1 351 1 1 26 ALA CA C 2.989 -2.559 3.091 1.00 . A A . 26 ALA CA 1 1 1 352 1 1 26 ALA CB C 2.869 -1.052 3.313 1.00 . A A . 26 ALA CB 1 1 1 353 1 1 26 ALA H H 4.469 -3.124 4.554 1.00 . A A . 26 ALA H 1 1 1 354 1 1 26 ALA HA H 2.020 -2.977 2.870 1.00 . A A . 26 ALA HA 1 1 1 355 1 1 26 ALA HB1 H 2.522 -0.862 4.317 1.00 . A A . 26 ALA HB1 1 1 1 356 1 1 26 ALA HB2 H 2.165 -0.640 2.605 1.00 . A A . 26 ALA HB2 1 1 1 357 1 1 26 ALA HB3 H 3.833 -0.589 3.171 1.00 . A A . 26 ALA HB3 1 1 1 358 1 1 26 ALA N N 3.504 -3.101 4.381 1.00 . A A . 26 ALA N 1 1 1 359 1 1 26 ALA O O 5.165 -2.950 2.160 1.00 . A A . 26 ALA O 1 1 1 360 1 1 27 ALA C C 4.881 -2.013 -1.015 1.00 . A A . 27 ALA C 1 1 1 361 1 1 27 ALA CA C 4.371 -3.309 -0.394 1.00 . A A . 27 ALA CA 1 1 1 362 1 1 27 ALA CB C 3.493 -4.055 -1.396 1.00 . A A . 27 ALA CB 1 1 1 363 1 1 27 ALA H H 2.506 -2.937 0.620 1.00 . A A . 27 ALA H 1 1 1 364 1 1 27 ALA HA H 5.191 -3.931 -0.087 1.00 . A A . 27 ALA HA 1 1 1 365 1 1 27 ALA HB1 H 2.523 -4.236 -0.960 1.00 . A A . 27 ALA HB1 1 1 1 366 1 1 27 ALA HB2 H 3.957 -4.996 -1.650 1.00 . A A . 27 ALA HB2 1 1 1 367 1 1 27 ALA HB3 H 3.381 -3.455 -2.289 1.00 . A A . 27 ALA HB3 1 1 1 368 1 1 27 ALA N N 3.472 -3.014 0.760 1.00 . A A . 27 ALA N 1 1 1 369 1 1 27 ALA O O 6.059 -1.848 -1.261 1.00 . A A . 27 ALA O 1 1 1 370 1 1 28 CYS C C 5.036 -0.074 -3.269 1.00 . A A . 28 CYS C 1 1 1 371 1 1 28 CYS CA C 4.418 0.189 -1.894 1.00 . A A . 28 CYS CA 1 1 1 372 1 1 28 CYS CB C 5.455 0.775 -0.934 1.00 . A A . 28 CYS CB 1 1 1 373 1 1 28 CYS H H 3.054 -1.260 -1.076 1.00 . A A . 28 CYS H 1 1 1 374 1 1 28 CYS HA H 3.576 0.850 -1.980 1.00 . A A . 28 CYS HA 1 1 1 375 1 1 28 CYS HB2 H 5.826 -0.002 -0.284 1.00 . A A . 28 CYS HB2 1 1 1 376 1 1 28 CYS HB3 H 6.274 1.188 -1.500 1.00 . A A . 28 CYS HB3 1 1 1 377 1 1 28 CYS N N 3.997 -1.097 -1.277 1.00 . A A . 28 CYS N 1 1 1 378 1 1 28 CYS O O 6.135 -0.579 -3.376 1.00 . A A . 28 CYS O 1 1 1 379 1 1 28 CYS SG S 4.692 2.082 0.060 1.00 . A A . 28 CYS SG 1 1 1 380 1 1 29 THR C C 6.369 0.399 -5.724 1.00 . A A . 29 THR C 1 1 1 381 1 1 29 THR CA C 4.887 0.016 -5.688 1.00 . A A . 29 THR CA 1 1 1 382 1 1 29 THR CB C 4.077 0.916 -6.627 1.00 . A A . 29 THR CB 1 1 1 383 1 1 29 THR CG2 C 2.580 0.762 -6.343 1.00 . A A . 29 THR CG2 1 1 1 384 1 1 29 THR H H 3.447 0.657 -4.209 1.00 . A A . 29 THR H 1 1 1 385 1 1 29 THR HA H 4.759 -1.017 -5.967 1.00 . A A . 29 THR HA 1 1 1 386 1 1 29 THR HB H 4.272 0.630 -7.649 1.00 . A A . 29 THR HB 1 1 1 387 1 1 29 THR HG1 H 5.269 2.422 -6.927 1.00 . A A . 29 THR HG1 1 1 1 388 1 1 29 THR HG21 H 2.362 -0.270 -6.114 1.00 . A A . 29 THR HG21 1 1 1 389 1 1 29 THR HG22 H 2.015 1.065 -7.212 1.00 . A A . 29 THR HG22 1 1 1 390 1 1 29 THR HG23 H 2.308 1.383 -5.503 1.00 . A A . 29 THR HG23 1 1 1 391 1 1 29 THR N N 4.334 0.257 -4.321 1.00 . A A . 29 THR N 1 1 1 392 1 1 29 THR O O 7.191 -0.308 -6.273 1.00 . A A . 29 THR O 1 1 1 393 1 1 29 THR OG1 O 4.460 2.269 -6.433 1.00 . A A . 29 THR OG1 1 1 1 394 1 1 30 LEU C C 8.688 2.091 -6.537 1.00 . A A . 30 LEU C 1 1 1 395 1 1 30 LEU CA C 8.141 1.948 -5.114 1.00 . A A . 30 LEU CA 1 1 1 396 1 1 30 LEU CB C 8.887 0.846 -4.359 1.00 . A A . 30 LEU CB 1 1 1 397 1 1 30 LEU CD1 C 8.817 -0.339 -2.160 1.00 . A A . 30 LEU CD1 1 1 1 398 1 1 30 LEU CD2 C 9.683 1.998 -2.291 1.00 . A A . 30 LEU CD2 1 1 1 399 1 1 30 LEU CG C 8.658 1.014 -2.856 1.00 . A A . 30 LEU CG 1 1 1 400 1 1 30 LEU H H 6.031 2.060 -4.695 1.00 . A A . 30 LEU H 1 1 1 401 1 1 30 LEU HA H 8.236 2.881 -4.583 1.00 . A A . 30 LEU HA 1 1 1 402 1 1 30 LEU HB2 H 8.522 -0.120 -4.673 1.00 . A A . 30 LEU HB2 1 1 1 403 1 1 30 LEU HB3 H 9.944 0.917 -4.569 1.00 . A A . 30 LEU HB3 1 1 1 404 1 1 30 LEU HD11 H 8.549 -1.130 -2.844 1.00 . A A . 30 LEU HD11 1 1 1 405 1 1 30 LEU HD12 H 8.172 -0.376 -1.295 1.00 . A A . 30 LEU HD12 1 1 1 406 1 1 30 LEU HD13 H 9.843 -0.466 -1.849 1.00 . A A . 30 LEU HD13 1 1 1 407 1 1 30 LEU HD21 H 10.197 2.489 -3.103 1.00 . A A . 30 LEU HD21 1 1 1 408 1 1 30 LEU HD22 H 10.397 1.464 -1.682 1.00 . A A . 30 LEU HD22 1 1 1 409 1 1 30 LEU HD23 H 9.177 2.737 -1.686 1.00 . A A . 30 LEU HD23 1 1 1 410 1 1 30 LEU HG H 7.663 1.392 -2.687 1.00 . A A . 30 LEU HG 1 1 1 411 1 1 30 LEU N N 6.713 1.511 -5.134 1.00 . A A . 30 LEU N 1 1 1 412 1 1 30 LEU O O 9.226 1.161 -7.104 1.00 . A A . 30 LEU O 1 1 1 413 1 1 31 LYS C C 9.988 4.714 -8.504 1.00 . A A . 31 LYS C 1 1 1 414 1 1 31 LYS CA C 9.090 3.475 -8.487 1.00 . A A . 31 LYS CA 1 1 1 415 1 1 31 LYS CB C 7.852 3.697 -9.356 1.00 . A A . 31 LYS CB 1 1 1 416 1 1 31 LYS CD C 6.542 1.582 -9.149 1.00 . A A . 31 LYS CD 1 1 1 417 1 1 31 LYS CE C 5.095 1.800 -9.591 1.00 . A A . 31 LYS CE 1 1 1 418 1 1 31 LYS CG C 7.475 2.388 -10.052 1.00 . A A . 31 LYS CG 1 1 1 419 1 1 31 LYS H H 8.137 3.992 -6.626 1.00 . A A . 31 LYS H 1 1 1 420 1 1 31 LYS HA H 9.632 2.607 -8.828 1.00 . A A . 31 LYS HA 1 1 1 421 1 1 31 LYS HB2 H 7.030 4.023 -8.733 1.00 . A A . 31 LYS HB2 1 1 1 422 1 1 31 LYS HB3 H 8.062 4.449 -10.099 1.00 . A A . 31 LYS HB3 1 1 1 423 1 1 31 LYS HD2 H 6.788 0.532 -9.222 1.00 . A A . 31 LYS HD2 1 1 1 424 1 1 31 LYS HD3 H 6.658 1.910 -8.127 1.00 . A A . 31 LYS HD3 1 1 1 425 1 1 31 LYS HE2 H 4.486 2.095 -8.747 1.00 . A A . 31 LYS HE2 1 1 1 426 1 1 31 LYS HE3 H 5.047 2.546 -10.368 1.00 . A A . 31 LYS HE3 1 1 1 427 1 1 31 LYS HG2 H 6.976 2.608 -10.984 1.00 . A A . 31 LYS HG2 1 1 1 428 1 1 31 LYS HG3 H 8.369 1.814 -10.248 1.00 . A A . 31 LYS HG3 1 1 1 429 1 1 31 LYS HZ1 H 5.410 0.069 -10.701 1.00 . A A . 31 LYS HZ1 1 1 1 430 1 1 31 LYS HZ2 H 3.799 0.608 -10.702 1.00 . A A . 31 LYS HZ2 1 1 1 431 1 1 31 LYS HZ3 H 4.440 -0.160 -9.329 1.00 . A A . 31 LYS HZ3 1 1 1 432 1 1 31 LYS N N 8.567 3.255 -7.108 1.00 . A A . 31 LYS N 1 1 1 433 1 1 31 LYS NZ N 4.652 0.480 -10.121 1.00 . A A . 31 LYS NZ 1 1 1 434 1 1 31 LYS O O 10.962 4.781 -9.227 1.00 . A A . 31 LYS O 1 1 1 435 1 1 32 ALA C C 9.819 7.970 -6.756 1.00 . A A . 32 ALA C 1 1 1 436 1 1 32 ALA CA C 10.492 6.931 -7.655 1.00 . A A . 32 ALA CA 1 1 1 437 1 1 32 ALA CB C 10.558 7.430 -9.097 1.00 . A A . 32 ALA CB 1 1 1 438 1 1 32 ALA H H 8.877 5.611 -7.128 1.00 . A A . 32 ALA H 1 1 1 439 1 1 32 ALA HA H 11.484 6.708 -7.296 1.00 . A A . 32 ALA HA 1 1 1 440 1 1 32 ALA HB1 H 9.662 7.133 -9.621 1.00 . A A . 32 ALA HB1 1 1 1 441 1 1 32 ALA HB2 H 11.419 7.002 -9.585 1.00 . A A . 32 ALA HB2 1 1 1 442 1 1 32 ALA HB3 H 10.638 8.507 -9.101 1.00 . A A . 32 ALA HB3 1 1 1 443 1 1 32 ALA N N 9.666 5.693 -7.704 1.00 . A A . 32 ALA N 1 1 1 444 1 1 32 ALA O O 8.611 8.002 -6.625 1.00 . A A . 32 ALA O 1 1 1 445 1 1 33 CYS C C 11.101 10.737 -4.650 1.00 . A A . 33 CYS C 1 1 1 446 1 1 33 CYS CA C 9.998 9.849 -5.235 1.00 . A A . 33 CYS CA 1 1 1 447 1 1 33 CYS CB C 9.310 9.058 -4.122 1.00 . A A . 33 CYS CB 1 1 1 448 1 1 33 CYS H H 11.562 8.768 -6.252 1.00 . A A . 33 CYS H 1 1 1 449 1 1 33 CYS HA H 9.274 10.444 -5.768 1.00 . A A . 33 CYS HA 1 1 1 450 1 1 33 CYS HB2 H 8.675 8.299 -4.557 1.00 . A A . 33 CYS HB2 1 1 1 451 1 1 33 CYS HB3 H 10.060 8.588 -3.501 1.00 . A A . 33 CYS HB3 1 1 1 452 1 1 33 CYS N N 10.591 8.815 -6.132 1.00 . A A . 33 CYS N 1 1 1 453 1 1 33 CYS O O 11.729 10.382 -3.673 1.00 . A A . 33 CYS O 1 1 1 454 1 1 33 CYS SG S 8.306 10.176 -3.109 1.00 . A A . 33 CYS SG 1 1 1 455 1 1 34 PRO C C 11.897 13.496 -3.507 1.00 . A A . 34 PRO C 1 1 1 456 1 1 34 PRO CA C 12.337 12.818 -4.808 1.00 . A A . 34 PRO CA 1 1 1 457 1 1 34 PRO CB C 12.426 13.830 -5.947 1.00 . A A . 34 PRO CB 1 1 1 458 1 1 34 PRO CD C 10.583 12.356 -6.454 1.00 . A A . 34 PRO CD 1 1 1 459 1 1 34 PRO CG C 11.099 13.761 -6.633 1.00 . A A . 34 PRO CG 1 1 1 460 1 1 34 PRO HA H 13.283 12.320 -4.680 1.00 . A A . 34 PRO HA 1 1 1 461 1 1 34 PRO HB2 H 12.598 14.823 -5.552 1.00 . A A . 34 PRO HB2 1 1 1 462 1 1 34 PRO HB3 H 13.212 13.556 -6.633 1.00 . A A . 34 PRO HB3 1 1 1 463 1 1 34 PRO HD2 H 9.515 12.366 -6.279 1.00 . A A . 34 PRO HD2 1 1 1 464 1 1 34 PRO HD3 H 10.825 11.750 -7.314 1.00 . A A . 34 PRO HD3 1 1 1 465 1 1 34 PRO HG2 H 10.415 14.469 -6.183 1.00 . A A . 34 PRO HG2 1 1 1 466 1 1 34 PRO HG3 H 11.214 13.975 -7.684 1.00 . A A . 34 PRO HG3 1 1 1 467 1 1 34 PRO N N 11.298 11.865 -5.272 1.00 . A A . 34 PRO N 1 1 1 468 1 1 34 PRO O O 12.711 13.962 -2.734 1.00 . A A . 34 PRO O 1 1 1 469 1 1 35 GLN C C 8.656 13.853 -1.770 1.00 . A A . 35 GLN C 1 1 1 470 1 1 35 GLN CA C 10.127 14.203 -2.007 1.00 . A A . 35 GLN CA 1 1 1 471 1 1 35 GLN CB C 10.288 15.704 -2.250 1.00 . A A . 35 GLN CB 1 1 1 472 1 1 35 GLN CD C 9.985 17.447 -4.014 1.00 . A A . 35 GLN CD 1 1 1 473 1 1 35 GLN CG C 9.469 16.111 -3.475 1.00 . A A . 35 GLN CG 1 1 1 474 1 1 35 GLN H H 9.977 13.173 -3.896 1.00 . A A . 35 GLN H 1 1 1 475 1 1 35 GLN HA H 10.729 13.898 -1.165 1.00 . A A . 35 GLN HA 1 1 1 476 1 1 35 GLN HB2 H 9.939 16.248 -1.383 1.00 . A A . 35 GLN HB2 1 1 1 477 1 1 35 GLN HB3 H 11.329 15.932 -2.423 1.00 . A A . 35 GLN HB3 1 1 1 478 1 1 35 GLN HE21 H 8.586 17.582 -5.417 1.00 . A A . 35 GLN HE21 1 1 1 479 1 1 35 GLN HE22 H 9.693 18.869 -5.368 1.00 . A A . 35 GLN HE22 1 1 1 480 1 1 35 GLN HG2 H 9.563 15.353 -4.239 1.00 . A A . 35 GLN HG2 1 1 1 481 1 1 35 GLN HG3 H 8.430 16.215 -3.197 1.00 . A A . 35 GLN HG3 1 1 1 482 1 1 35 GLN N N 10.617 13.555 -3.259 1.00 . A A . 35 GLN N 1 1 1 483 1 1 35 GLN NE2 N 9.370 18.013 -5.017 1.00 . A A . 35 GLN NE2 1 1 1 484 1 1 35 GLN O O 8.374 13.206 -0.774 1.00 . A A . 35 GLN O 1 1 1 485 1 1 35 GLN OXT O 7.837 14.238 -2.588 1.00 . A A . 35 GLN OXT 1 1 1 486 1 1 35 GLN OE1 O 10.957 17.981 -3.518 1.00 . A A . 35 GLN OE1 1 1 2 487 1 1 1 GLU C C 4.940 1.755 9.546 1.00 . A A . 1 GLU C 1 1 2 488 1 1 1 GLU CA C 6.413 1.514 9.885 1.00 . A A . 1 GLU CA 1 1 2 489 1 1 1 GLU CB C 6.576 1.185 11.371 1.00 . A A . 1 GLU CB 1 1 2 490 1 1 1 GLU CD C 5.494 -0.489 12.876 1.00 . A A . 1 GLU CD 1 1 2 491 1 1 1 GLU CG C 6.312 -0.305 11.597 1.00 . A A . 1 GLU CG 1 1 2 492 1 1 1 GLU H1 H 8.126 2.672 10.137 1.00 . A A . 1 GLU H1 1 1 2 493 1 1 1 GLU H2 H 6.684 3.569 10.099 1.00 . A A . 1 GLU H2 1 1 2 494 1 1 1 GLU H3 H 7.328 2.931 8.663 1.00 . A A . 1 GLU H3 1 1 2 495 1 1 1 GLU HA H 6.815 0.716 9.284 1.00 . A A . 1 GLU HA 1 1 2 496 1 1 1 GLU HB2 H 7.581 1.426 11.684 1.00 . A A . 1 GLU HB2 1 1 2 497 1 1 1 GLU HB3 H 5.870 1.764 11.947 1.00 . A A . 1 GLU HB3 1 1 2 498 1 1 1 GLU HG2 H 5.764 -0.705 10.756 1.00 . A A . 1 GLU HG2 1 1 2 499 1 1 1 GLU HG3 H 7.252 -0.826 11.694 1.00 . A A . 1 GLU HG3 1 1 2 500 1 1 1 GLU N N 7.198 2.766 9.681 1.00 . A A . 1 GLU N 1 1 2 501 1 1 1 GLU O O 4.195 2.311 10.329 1.00 . A A . 1 GLU O 1 1 2 502 1 1 1 GLU OE1 O 4.641 0.344 13.134 1.00 . A A . 1 GLU OE1 1 1 2 503 1 1 1 GLU OE2 O 5.735 -1.459 13.575 1.00 . A A . 1 GLU OE2 1 1 2 504 1 1 2 VAL C C 2.171 0.788 8.963 1.00 . A A . 2 VAL C 1 1 2 505 1 1 2 VAL CA C 3.085 1.550 8.004 1.00 . A A . 2 VAL CA 1 1 2 506 1 1 2 VAL CB C 2.946 0.997 6.580 1.00 . A A . 2 VAL CB 1 1 2 507 1 1 2 VAL CG1 C 3.680 -0.338 6.466 1.00 . A A . 2 VAL CG1 1 1 2 508 1 1 2 VAL CG2 C 1.466 0.776 6.261 1.00 . A A . 2 VAL CG2 1 1 2 509 1 1 2 VAL H H 5.127 0.894 7.769 1.00 . A A . 2 VAL H 1 1 2 510 1 1 2 VAL HA H 2.846 2.602 8.014 1.00 . A A . 2 VAL HA 1 1 2 511 1 1 2 VAL HB H 3.367 1.701 5.877 1.00 . A A . 2 VAL HB 1 1 2 512 1 1 2 VAL HG11 H 4.725 -0.159 6.261 1.00 . A A . 2 VAL HG11 1 1 2 513 1 1 2 VAL HG12 H 3.250 -0.915 5.660 1.00 . A A . 2 VAL HG12 1 1 2 514 1 1 2 VAL HG13 H 3.582 -0.884 7.392 1.00 . A A . 2 VAL HG13 1 1 2 515 1 1 2 VAL HG21 H 0.860 1.333 6.960 1.00 . A A . 2 VAL HG21 1 1 2 516 1 1 2 VAL HG22 H 1.235 -0.276 6.342 1.00 . A A . 2 VAL HG22 1 1 2 517 1 1 2 VAL HG23 H 1.260 1.113 5.257 1.00 . A A . 2 VAL HG23 1 1 2 518 1 1 2 VAL N N 4.513 1.341 8.385 1.00 . A A . 2 VAL N 1 1 2 519 1 1 2 VAL O O 2.423 -0.351 9.295 1.00 . A A . 2 VAL O 1 1 2 520 1 1 3 THR C C -1.252 0.803 9.795 1.00 . A A . 3 THR C 1 1 2 521 1 1 3 THR CA C 0.176 0.714 10.336 1.00 . A A . 3 THR CA 1 1 2 522 1 1 3 THR CB C 0.301 1.474 11.657 1.00 . A A . 3 THR CB 1 1 2 523 1 1 3 THR CG2 C -0.703 0.913 12.666 1.00 . A A . 3 THR CG2 1 1 2 524 1 1 3 THR H H 0.928 2.324 9.118 1.00 . A A . 3 THR H 1 1 2 525 1 1 3 THR HA H 0.469 -0.316 10.472 1.00 . A A . 3 THR HA 1 1 2 526 1 1 3 THR HB H 0.093 2.519 11.493 1.00 . A A . 3 THR HB 1 1 2 527 1 1 3 THR HG1 H 2.229 1.700 11.523 1.00 . A A . 3 THR HG1 1 1 2 528 1 1 3 THR HG21 H -1.563 0.526 12.140 1.00 . A A . 3 THR HG21 1 1 2 529 1 1 3 THR HG22 H -1.015 1.700 13.338 1.00 . A A . 3 THR HG22 1 1 2 530 1 1 3 THR HG23 H -0.239 0.119 13.233 1.00 . A A . 3 THR HG23 1 1 2 531 1 1 3 THR N N 1.112 1.405 9.404 1.00 . A A . 3 THR N 1 1 2 532 1 1 3 THR O O -2.048 1.604 10.243 1.00 . A A . 3 THR O 1 1 2 533 1 1 3 THR OG1 O 1.620 1.325 12.165 1.00 . A A . 3 THR OG1 1 1 2 534 1 1 4 CYS C C -3.618 -1.338 8.315 1.00 . A A . 4 CYS C 1 1 2 535 1 1 4 CYS CA C -2.952 0.038 8.246 1.00 . A A . 4 CYS CA 1 1 2 536 1 1 4 CYS CB C -2.746 0.451 6.788 1.00 . A A . 4 CYS CB 1 1 2 537 1 1 4 CYS H H -0.918 -0.642 8.475 1.00 . A A . 4 CYS H 1 1 2 538 1 1 4 CYS HA H -3.553 0.775 8.754 1.00 . A A . 4 CYS HA 1 1 2 539 1 1 4 CYS HB2 H -3.674 0.334 6.246 1.00 . A A . 4 CYS HB2 1 1 2 540 1 1 4 CYS HB3 H -2.432 1.485 6.748 1.00 . A A . 4 CYS HB3 1 1 2 541 1 1 4 CYS N N -1.579 -0.008 8.826 1.00 . A A . 4 CYS N 1 1 2 542 1 1 4 CYS O O -3.022 -2.309 8.735 1.00 . A A . 4 CYS O 1 1 2 543 1 1 4 CYS SG S -1.472 -0.597 6.037 1.00 . A A . 4 CYS SG 1 1 2 544 1 1 5 GLU C C -5.242 -3.525 6.644 1.00 . A A . 5 GLU C 1 1 2 545 1 1 5 GLU CA C -5.561 -2.736 7.918 1.00 . A A . 5 GLU CA 1 1 2 546 1 1 5 GLU CB C -7.047 -2.377 7.967 1.00 . A A . 5 GLU CB 1 1 2 547 1 1 5 GLU CD C -7.879 -1.815 10.257 1.00 . A A . 5 GLU CD 1 1 2 548 1 1 5 GLU CG C -7.672 -2.944 9.245 1.00 . A A . 5 GLU CG 1 1 2 549 1 1 5 GLU H H -5.308 -0.629 7.551 1.00 . A A . 5 GLU H 1 1 2 550 1 1 5 GLU HA H -5.286 -3.301 8.794 1.00 . A A . 5 GLU HA 1 1 2 551 1 1 5 GLU HB2 H -7.157 -1.303 7.958 1.00 . A A . 5 GLU HB2 1 1 2 552 1 1 5 GLU HB3 H -7.547 -2.797 7.108 1.00 . A A . 5 GLU HB3 1 1 2 553 1 1 5 GLU HG2 H -8.625 -3.395 9.010 1.00 . A A . 5 GLU HG2 1 1 2 554 1 1 5 GLU HG3 H -7.015 -3.689 9.669 1.00 . A A . 5 GLU HG3 1 1 2 555 1 1 5 GLU N N -4.851 -1.426 7.892 1.00 . A A . 5 GLU N 1 1 2 556 1 1 5 GLU O O -5.066 -2.948 5.588 1.00 . A A . 5 GLU O 1 1 2 557 1 1 5 GLU OE1 O -8.612 -0.892 9.941 1.00 . A A . 5 GLU OE1 1 1 2 558 1 1 5 GLU OE2 O -7.301 -1.893 11.327 1.00 . A A . 5 GLU OE2 1 1 2 559 1 1 6 PRO C C -6.065 -5.743 4.667 1.00 . A A . 6 PRO C 1 1 2 560 1 1 6 PRO CA C -4.871 -5.696 5.625 1.00 . A A . 6 PRO CA 1 1 2 561 1 1 6 PRO CB C -4.624 -7.060 6.263 1.00 . A A . 6 PRO CB 1 1 2 562 1 1 6 PRO CD C -5.374 -5.587 8.019 1.00 . A A . 6 PRO CD 1 1 2 563 1 1 6 PRO CG C -5.371 -7.021 7.558 1.00 . A A . 6 PRO CG 1 1 2 564 1 1 6 PRO HA H -3.984 -5.359 5.114 1.00 . A A . 6 PRO HA 1 1 2 565 1 1 6 PRO HB2 H -5.007 -7.846 5.626 1.00 . A A . 6 PRO HB2 1 1 2 566 1 1 6 PRO HB3 H -3.571 -7.202 6.448 1.00 . A A . 6 PRO HB3 1 1 2 567 1 1 6 PRO HD2 H -6.324 -5.338 8.475 1.00 . A A . 6 PRO HD2 1 1 2 568 1 1 6 PRO HD3 H -4.560 -5.405 8.704 1.00 . A A . 6 PRO HD3 1 1 2 569 1 1 6 PRO HG2 H -6.385 -7.366 7.407 1.00 . A A . 6 PRO HG2 1 1 2 570 1 1 6 PRO HG3 H -4.874 -7.638 8.289 1.00 . A A . 6 PRO HG3 1 1 2 571 1 1 6 PRO N N -5.174 -4.820 6.784 1.00 . A A . 6 PRO N 1 1 2 572 1 1 6 PRO O O -7.156 -6.129 5.038 1.00 . A A . 6 PRO O 1 1 2 573 1 1 7 GLY C C -7.601 -3.963 2.371 1.00 . A A . 7 GLY C 1 1 2 574 1 1 7 GLY CA C -6.992 -5.362 2.460 1.00 . A A . 7 GLY CA 1 1 2 575 1 1 7 GLY H H -4.981 -5.036 3.163 1.00 . A A . 7 GLY H 1 1 2 576 1 1 7 GLY HA2 H -6.620 -5.659 1.489 1.00 . A A . 7 GLY HA2 1 1 2 577 1 1 7 GLY HA3 H -7.748 -6.060 2.790 1.00 . A A . 7 GLY HA3 1 1 2 578 1 1 7 GLY N N -5.868 -5.347 3.440 1.00 . A A . 7 GLY N 1 1 2 579 1 1 7 GLY O O -8.788 -3.779 2.553 1.00 . A A . 7 GLY O 1 1 2 580 1 1 8 THR C C -6.340 -0.676 1.259 1.00 . A A . 8 THR C 1 1 2 581 1 1 8 THR CA C -7.330 -1.582 1.997 1.00 . A A . 8 THR CA 1 1 2 582 1 1 8 THR CB C -7.504 -1.125 3.447 1.00 . A A . 8 THR CB 1 1 2 583 1 1 8 THR CG2 C -8.221 0.225 3.474 1.00 . A A . 8 THR CG2 1 1 2 584 1 1 8 THR H H -5.844 -3.144 1.954 1.00 . A A . 8 THR H 1 1 2 585 1 1 8 THR HA H -8.283 -1.582 1.496 1.00 . A A . 8 THR HA 1 1 2 586 1 1 8 THR HB H -6.536 -1.023 3.913 1.00 . A A . 8 THR HB 1 1 2 587 1 1 8 THR HG1 H -9.185 -1.785 4.175 1.00 . A A . 8 THR HG1 1 1 2 588 1 1 8 THR HG21 H -8.604 0.410 4.467 1.00 . A A . 8 THR HG21 1 1 2 589 1 1 8 THR HG22 H -9.039 0.212 2.769 1.00 . A A . 8 THR HG22 1 1 2 590 1 1 8 THR HG23 H -7.525 1.007 3.205 1.00 . A A . 8 THR HG23 1 1 2 591 1 1 8 THR N N -6.797 -2.972 2.095 1.00 . A A . 8 THR N 1 1 2 592 1 1 8 THR O O -6.729 0.223 0.542 1.00 . A A . 8 THR O 1 1 2 593 1 1 8 THR OG1 O -8.274 -2.087 4.158 1.00 . A A . 8 THR OG1 1 1 2 594 1 1 9 THR C C -4.417 1.408 0.764 1.00 . A A . 9 THR C 1 1 2 595 1 1 9 THR CA C -4.029 -0.075 0.751 1.00 . A A . 9 THR CA 1 1 2 596 1 1 9 THR CB C -3.960 -0.607 -0.685 1.00 . A A . 9 THR CB 1 1 2 597 1 1 9 THR CG2 C -5.227 -0.221 -1.450 1.00 . A A . 9 THR CG2 1 1 2 598 1 1 9 THR H H -4.786 -1.642 2.022 1.00 . A A . 9 THR H 1 1 2 599 1 1 9 THR HA H -3.073 -0.209 1.232 1.00 . A A . 9 THR HA 1 1 2 600 1 1 9 THR HB H -3.871 -1.683 -0.665 1.00 . A A . 9 THR HB 1 1 2 601 1 1 9 THR HG1 H -2.900 -0.241 -2.273 1.00 . A A . 9 THR HG1 1 1 2 602 1 1 9 THR HG21 H -6.037 -0.873 -1.158 1.00 . A A . 9 THR HG21 1 1 2 603 1 1 9 THR HG22 H -5.050 -0.320 -2.511 1.00 . A A . 9 THR HG22 1 1 2 604 1 1 9 THR HG23 H -5.487 0.802 -1.223 1.00 . A A . 9 THR HG23 1 1 2 605 1 1 9 THR N N -5.065 -0.910 1.435 1.00 . A A . 9 THR N 1 1 2 606 1 1 9 THR O O -5.334 1.820 1.446 1.00 . A A . 9 THR O 1 1 2 607 1 1 9 THR OG1 O -2.828 -0.048 -1.335 1.00 . A A . 9 THR OG1 1 1 2 608 1 1 10 PHE C C -3.008 4.415 -0.890 1.00 . A A . 10 PHE C 1 1 2 609 1 1 10 PHE CA C -4.025 3.674 -0.016 1.00 . A A . 10 PHE CA 1 1 2 610 1 1 10 PHE CB C -3.929 4.146 1.438 1.00 . A A . 10 PHE CB 1 1 2 611 1 1 10 PHE CD1 C -1.455 4.117 1.940 1.00 . A A . 10 PHE CD1 1 1 2 612 1 1 10 PHE CD2 C -2.858 2.375 2.877 1.00 . A A . 10 PHE CD2 1 1 2 613 1 1 10 PHE CE1 C -0.335 3.547 2.558 1.00 . A A . 10 PHE CE1 1 1 2 614 1 1 10 PHE CE2 C -1.739 1.807 3.494 1.00 . A A . 10 PHE CE2 1 1 2 615 1 1 10 PHE CG C -2.717 3.530 2.100 1.00 . A A . 10 PHE CG 1 1 2 616 1 1 10 PHE CZ C -0.477 2.391 3.335 1.00 . A A . 10 PHE CZ 1 1 2 617 1 1 10 PHE H H -2.970 1.862 -0.518 1.00 . A A . 10 PHE H 1 1 2 618 1 1 10 PHE HA H -5.025 3.833 -0.387 1.00 . A A . 10 PHE HA 1 1 2 619 1 1 10 PHE HB2 H -3.841 5.222 1.461 1.00 . A A . 10 PHE HB2 1 1 2 620 1 1 10 PHE HB3 H -4.819 3.847 1.972 1.00 . A A . 10 PHE HB3 1 1 2 621 1 1 10 PHE HD1 H -1.347 5.009 1.340 1.00 . A A . 10 PHE HD1 1 1 2 622 1 1 10 PHE HD2 H -3.830 1.924 3.000 1.00 . A A . 10 PHE HD2 1 1 2 623 1 1 10 PHE HE1 H 0.637 4.000 2.434 1.00 . A A . 10 PHE HE1 1 1 2 624 1 1 10 PHE HE2 H -1.849 0.916 4.092 1.00 . A A . 10 PHE HE2 1 1 2 625 1 1 10 PHE HZ H 0.388 1.948 3.815 1.00 . A A . 10 PHE HZ 1 1 2 626 1 1 10 PHE N N -3.711 2.216 0.017 1.00 . A A . 10 PHE N 1 1 2 627 1 1 10 PHE O O -2.219 3.810 -1.588 1.00 . A A . 10 PHE O 1 1 2 628 1 1 11 LYS C C -1.100 7.287 -0.789 1.00 . A A . 11 LYS C 1 1 2 629 1 1 11 LYS CA C -2.054 6.496 -1.687 1.00 . A A . 11 LYS CA 1 1 2 630 1 1 11 LYS CB C -2.919 7.444 -2.517 1.00 . A A . 11 LYS CB 1 1 2 631 1 1 11 LYS CD C -3.478 8.054 -4.877 1.00 . A A . 11 LYS CD 1 1 2 632 1 1 11 LYS CE C -4.860 8.538 -4.431 1.00 . A A . 11 LYS CE 1 1 2 633 1 1 11 LYS CG C -3.008 6.928 -3.955 1.00 . A A . 11 LYS CG 1 1 2 634 1 1 11 LYS H H -3.665 6.190 -0.287 1.00 . A A . 11 LYS H 1 1 2 635 1 1 11 LYS HA H -1.501 5.837 -2.337 1.00 . A A . 11 LYS HA 1 1 2 636 1 1 11 LYS HB2 H -3.910 7.493 -2.090 1.00 . A A . 11 LYS HB2 1 1 2 637 1 1 11 LYS HB3 H -2.476 8.429 -2.517 1.00 . A A . 11 LYS HB3 1 1 2 638 1 1 11 LYS HD2 H -2.776 8.875 -4.830 1.00 . A A . 11 LYS HD2 1 1 2 639 1 1 11 LYS HD3 H -3.537 7.688 -5.890 1.00 . A A . 11 LYS HD3 1 1 2 640 1 1 11 LYS HE2 H -5.561 7.714 -4.426 1.00 . A A . 11 LYS HE2 1 1 2 641 1 1 11 LYS HE3 H -4.804 8.993 -3.454 1.00 . A A . 11 LYS HE3 1 1 2 642 1 1 11 LYS HG2 H -2.034 6.583 -4.274 1.00 . A A . 11 LYS HG2 1 1 2 643 1 1 11 LYS HG3 H -3.711 6.111 -4.001 1.00 . A A . 11 LYS HG3 1 1 2 644 1 1 11 LYS HZ1 H -4.440 10.158 -5.668 1.00 . A A . 11 LYS HZ1 1 1 2 645 1 1 11 LYS HZ2 H -6.028 10.138 -5.067 1.00 . A A . 11 LYS HZ2 1 1 2 646 1 1 11 LYS HZ3 H -5.574 9.074 -6.311 1.00 . A A . 11 LYS HZ3 1 1 2 647 1 1 11 LYS N N -3.020 5.719 -0.856 1.00 . A A . 11 LYS N 1 1 2 648 1 1 11 LYS NZ N -5.255 9.554 -5.446 1.00 . A A . 11 LYS NZ 1 1 2 649 1 1 11 LYS O O -1.511 8.139 -0.026 1.00 . A A . 11 LYS O 1 1 2 650 1 1 12 ASP C C 2.343 8.206 -0.869 1.00 . A A . 12 ASP C 1 1 2 651 1 1 12 ASP CA C 1.151 7.747 -0.025 1.00 . A A . 12 ASP CA 1 1 2 652 1 1 12 ASP CB C 1.603 6.736 1.029 1.00 . A A . 12 ASP CB 1 1 2 653 1 1 12 ASP CG C 2.018 7.478 2.300 1.00 . A A . 12 ASP CG 1 1 2 654 1 1 12 ASP H H 0.484 6.320 -1.494 1.00 . A A . 12 ASP H 1 1 2 655 1 1 12 ASP HA H 0.680 8.591 0.452 1.00 . A A . 12 ASP HA 1 1 2 656 1 1 12 ASP HB2 H 0.787 6.061 1.254 1.00 . A A . 12 ASP HB2 1 1 2 657 1 1 12 ASP HB3 H 2.445 6.173 0.651 1.00 . A A . 12 ASP HB3 1 1 2 658 1 1 12 ASP N N 0.172 7.011 -0.873 1.00 . A A . 12 ASP N 1 1 2 659 1 1 12 ASP O O 2.467 7.851 -2.024 1.00 . A A . 12 ASP O 1 1 2 660 1 1 12 ASP OD1 O 1.838 8.684 2.344 1.00 . A A . 12 ASP OD1 1 1 2 661 1 1 12 ASP OD2 O 2.509 6.828 3.208 1.00 . A A . 12 ASP OD2 1 1 2 662 1 1 13 LYS C C 4.083 9.738 -2.515 1.00 . A A . 13 LYS C 1 1 2 663 1 1 13 LYS CA C 4.411 9.492 -1.035 1.00 . A A . 13 LYS CA 1 1 2 664 1 1 13 LYS CB C 5.466 8.403 -0.871 1.00 . A A . 13 LYS CB 1 1 2 665 1 1 13 LYS CD C 6.002 6.028 -1.370 1.00 . A A . 13 LYS CD 1 1 2 666 1 1 13 LYS CE C 6.553 5.762 0.034 1.00 . A A . 13 LYS CE 1 1 2 667 1 1 13 LYS CG C 4.881 7.064 -1.288 1.00 . A A . 13 LYS CG 1 1 2 668 1 1 13 LYS H H 3.082 9.256 0.642 1.00 . A A . 13 LYS H 1 1 2 669 1 1 13 LYS HA H 4.766 10.399 -0.587 1.00 . A A . 13 LYS HA 1 1 2 670 1 1 13 LYS HB2 H 6.320 8.632 -1.493 1.00 . A A . 13 LYS HB2 1 1 2 671 1 1 13 LYS HB3 H 5.772 8.353 0.162 1.00 . A A . 13 LYS HB3 1 1 2 672 1 1 13 LYS HD2 H 5.615 5.110 -1.788 1.00 . A A . 13 LYS HD2 1 1 2 673 1 1 13 LYS HD3 H 6.794 6.406 -1.998 1.00 . A A . 13 LYS HD3 1 1 2 674 1 1 13 LYS HE2 H 6.135 6.467 0.739 1.00 . A A . 13 LYS HE2 1 1 2 675 1 1 13 LYS HE3 H 6.337 4.750 0.338 1.00 . A A . 13 LYS HE3 1 1 2 676 1 1 13 LYS HG2 H 4.145 6.748 -0.560 1.00 . A A . 13 LYS HG2 1 1 2 677 1 1 13 LYS HG3 H 4.415 7.170 -2.251 1.00 . A A . 13 LYS HG3 1 1 2 678 1 1 13 LYS HZ1 H 8.420 6.205 0.843 1.00 . A A . 13 LYS HZ1 1 1 2 679 1 1 13 LYS HZ2 H 8.220 6.722 -0.764 1.00 . A A . 13 LYS HZ2 1 1 2 680 1 1 13 LYS HZ3 H 8.465 5.076 -0.423 1.00 . A A . 13 LYS HZ3 1 1 2 681 1 1 13 LYS N N 3.215 8.992 -0.292 1.00 . A A . 13 LYS N 1 1 2 682 1 1 13 LYS NZ N 8.025 5.956 -0.087 1.00 . A A . 13 LYS NZ 1 1 2 683 1 1 13 LYS O O 3.232 10.544 -2.837 1.00 . A A . 13 LYS O 1 1 2 684 1 1 14 CYS C C 3.895 8.047 -5.539 1.00 . A A . 14 CYS C 1 1 2 685 1 1 14 CYS CA C 4.460 9.309 -4.866 1.00 . A A . 14 CYS CA 1 1 2 686 1 1 14 CYS CB C 5.809 9.709 -5.478 1.00 . A A . 14 CYS CB 1 1 2 687 1 1 14 CYS H H 5.444 8.432 -3.161 1.00 . A A . 14 CYS H 1 1 2 688 1 1 14 CYS HA H 3.762 10.124 -4.971 1.00 . A A . 14 CYS HA 1 1 2 689 1 1 14 CYS HB2 H 5.640 10.174 -6.440 1.00 . A A . 14 CYS HB2 1 1 2 690 1 1 14 CYS HB3 H 6.305 10.409 -4.822 1.00 . A A . 14 CYS HB3 1 1 2 691 1 1 14 CYS N N 4.751 9.072 -3.423 1.00 . A A . 14 CYS N 1 1 2 692 1 1 14 CYS O O 4.165 7.783 -6.694 1.00 . A A . 14 CYS O 1 1 2 693 1 1 14 CYS SG S 6.855 8.246 -5.700 1.00 . A A . 14 CYS SG 1 1 2 694 1 1 15 ASN C C 1.457 5.415 -4.562 1.00 . A A . 15 ASN C 1 1 2 695 1 1 15 ASN CA C 2.522 6.046 -5.466 1.00 . A A . 15 ASN CA 1 1 2 696 1 1 15 ASN CB C 3.699 5.093 -5.643 1.00 . A A . 15 ASN CB 1 1 2 697 1 1 15 ASN CG C 4.246 5.211 -7.068 1.00 . A A . 15 ASN CG 1 1 2 698 1 1 15 ASN H H 2.887 7.505 -3.909 1.00 . A A . 15 ASN H 1 1 2 699 1 1 15 ASN HA H 2.099 6.279 -6.429 1.00 . A A . 15 ASN HA 1 1 2 700 1 1 15 ASN HB2 H 4.469 5.349 -4.937 1.00 . A A . 15 ASN HB2 1 1 2 701 1 1 15 ASN HB3 H 3.371 4.079 -5.470 1.00 . A A . 15 ASN HB3 1 1 2 702 1 1 15 ASN HD21 H 5.941 6.068 -6.491 1.00 . A A . 15 ASN HD21 1 1 2 703 1 1 15 ASN HD22 H 5.777 5.830 -8.172 1.00 . A A . 15 ASN HD22 1 1 2 704 1 1 15 ASN N N 3.104 7.276 -4.838 1.00 . A A . 15 ASN N 1 1 2 705 1 1 15 ASN ND2 N 5.418 5.747 -7.259 1.00 . A A . 15 ASN ND2 1 1 2 706 1 1 15 ASN O O 0.294 5.763 -4.625 1.00 . A A . 15 ASN O 1 1 2 707 1 1 15 ASN OD1 O 3.600 4.807 -8.015 1.00 . A A . 15 ASN OD1 1 1 2 708 1 1 16 THR C C 1.534 2.781 -1.964 1.00 . A A . 16 THR C 1 1 2 709 1 1 16 THR CA C 0.843 3.818 -2.842 1.00 . A A . 16 THR CA 1 1 2 710 1 1 16 THR CB C -0.167 3.177 -3.813 1.00 . A A . 16 THR CB 1 1 2 711 1 1 16 THR CG2 C -0.723 1.863 -3.247 1.00 . A A . 16 THR CG2 1 1 2 712 1 1 16 THR H H 2.779 4.204 -3.704 1.00 . A A . 16 THR H 1 1 2 713 1 1 16 THR HA H 0.348 4.542 -2.216 1.00 . A A . 16 THR HA 1 1 2 714 1 1 16 THR HB H 0.324 2.977 -4.752 1.00 . A A . 16 THR HB 1 1 2 715 1 1 16 THR HG1 H -2.056 3.581 -4.073 1.00 . A A . 16 THR HG1 1 1 2 716 1 1 16 THR HG21 H 0.094 1.230 -2.933 1.00 . A A . 16 THR HG21 1 1 2 717 1 1 16 THR HG22 H -1.295 1.358 -4.009 1.00 . A A . 16 THR HG22 1 1 2 718 1 1 16 THR HG23 H -1.360 2.075 -2.402 1.00 . A A . 16 THR HG23 1 1 2 719 1 1 16 THR N N 1.840 4.481 -3.733 1.00 . A A . 16 THR N 1 1 2 720 1 1 16 THR O O 2.722 2.553 -2.060 1.00 . A A . 16 THR O 1 1 2 721 1 1 16 THR OG1 O -1.239 4.085 -4.032 1.00 . A A . 16 THR OG1 1 1 2 722 1 1 17 CYS C C 0.341 0.106 0.182 1.00 . A A . 17 CYS C 1 1 2 723 1 1 17 CYS CA C 1.384 1.175 -0.173 1.00 . A A . 17 CYS CA 1 1 2 724 1 1 17 CYS CB C 1.749 2.003 1.054 1.00 . A A . 17 CYS CB 1 1 2 725 1 1 17 CYS H H -0.160 2.397 -1.019 1.00 . A A . 17 CYS H 1 1 2 726 1 1 17 CYS HA H 2.266 0.731 -0.603 1.00 . A A . 17 CYS HA 1 1 2 727 1 1 17 CYS HB2 H 1.285 2.976 0.975 1.00 . A A . 17 CYS HB2 1 1 2 728 1 1 17 CYS HB3 H 1.388 1.507 1.932 1.00 . A A . 17 CYS HB3 1 1 2 729 1 1 17 CYS N N 0.791 2.176 -1.088 1.00 . A A . 17 CYS N 1 1 2 730 1 1 17 CYS O O -0.362 0.217 1.166 1.00 . A A . 17 CYS O 1 1 2 731 1 1 17 CYS SG S 3.545 2.211 1.161 1.00 . A A . 17 CYS SG 1 1 2 732 1 1 18 ARG C C -0.545 -2.573 1.080 1.00 . A A . 18 ARG C 1 1 2 733 1 1 18 ARG CA C -0.772 -1.991 -0.318 1.00 . A A . 18 ARG CA 1 1 2 734 1 1 18 ARG CB C -0.544 -3.062 -1.386 1.00 . A A . 18 ARG CB 1 1 2 735 1 1 18 ARG CD C -2.883 -3.936 -1.344 1.00 . A A . 18 ARG CD 1 1 2 736 1 1 18 ARG CG C -1.416 -4.279 -1.079 1.00 . A A . 18 ARG CG 1 1 2 737 1 1 18 ARG CZ C -4.183 -4.812 -3.186 1.00 . A A . 18 ARG CZ 1 1 2 738 1 1 18 ARG H H 0.804 -0.996 -1.406 1.00 . A A . 18 ARG H 1 1 2 739 1 1 18 ARG HA H -1.773 -1.600 -0.402 1.00 . A A . 18 ARG HA 1 1 2 740 1 1 18 ARG HB2 H -0.807 -2.664 -2.356 1.00 . A A . 18 ARG HB2 1 1 2 741 1 1 18 ARG HB3 H 0.496 -3.356 -1.385 1.00 . A A . 18 ARG HB3 1 1 2 742 1 1 18 ARG HD2 H -3.431 -3.880 -0.412 1.00 . A A . 18 ARG HD2 1 1 2 743 1 1 18 ARG HD3 H -2.961 -3.006 -1.885 1.00 . A A . 18 ARG HD3 1 1 2 744 1 1 18 ARG HE H -3.128 -5.978 -1.976 1.00 . A A . 18 ARG HE 1 1 2 745 1 1 18 ARG HG2 H -1.119 -5.104 -1.709 1.00 . A A . 18 ARG HG2 1 1 2 746 1 1 18 ARG HG3 H -1.296 -4.557 -0.042 1.00 . A A . 18 ARG HG3 1 1 2 747 1 1 18 ARG HH11 H -5.224 -3.403 -2.218 1.00 . A A . 18 ARG HH11 1 1 2 748 1 1 18 ARG HH12 H -5.724 -3.720 -3.847 1.00 . A A . 18 ARG HH12 1 1 2 749 1 1 18 ARG HH21 H -3.322 -6.161 -4.389 1.00 . A A . 18 ARG HH21 1 1 2 750 1 1 18 ARG HH22 H -4.650 -5.284 -5.073 1.00 . A A . 18 ARG HH22 1 1 2 751 1 1 18 ARG N N 0.231 -0.924 -0.613 1.00 . A A . 18 ARG N 1 1 2 752 1 1 18 ARG NE N -3.391 -5.057 -2.180 1.00 . A A . 18 ARG NE 1 1 2 753 1 1 18 ARG NH1 N -5.116 -3.908 -3.075 1.00 . A A . 18 ARG NH1 1 1 2 754 1 1 18 ARG NH2 N -4.041 -5.469 -4.303 1.00 . A A . 18 ARG NH2 1 1 2 755 1 1 18 ARG O O 0.449 -3.222 1.337 1.00 . A A . 18 ARG O 1 1 2 756 1 1 19 CYS C C -1.059 -4.403 3.324 1.00 . A A . 19 CYS C 1 1 2 757 1 1 19 CYS CA C -1.304 -2.889 3.367 1.00 . A A . 19 CYS CA 1 1 2 758 1 1 19 CYS CB C -2.631 -2.580 4.063 1.00 . A A . 19 CYS CB 1 1 2 759 1 1 19 CYS H H -2.257 -1.824 1.751 1.00 . A A . 19 CYS H 1 1 2 760 1 1 19 CYS HA H -0.496 -2.390 3.876 1.00 . A A . 19 CYS HA 1 1 2 761 1 1 19 CYS HB2 H -3.036 -1.657 3.670 1.00 . A A . 19 CYS HB2 1 1 2 762 1 1 19 CYS HB3 H -3.328 -3.386 3.884 1.00 . A A . 19 CYS HB3 1 1 2 763 1 1 19 CYS N N -1.462 -2.349 1.984 1.00 . A A . 19 CYS N 1 1 2 764 1 1 19 CYS O O -1.730 -5.132 2.621 1.00 . A A . 19 CYS O 1 1 2 765 1 1 19 CYS SG S -2.353 -2.405 5.843 1.00 . A A . 19 CYS SG 1 1 2 766 1 1 20 GLY C C -1.062 -7.123 4.441 1.00 . A A . 20 GLY C 1 1 2 767 1 1 20 GLY CA C 0.199 -6.338 4.077 1.00 . A A . 20 GLY CA 1 1 2 768 1 1 20 GLY H H 0.432 -4.269 4.628 1.00 . A A . 20 GLY H 1 1 2 769 1 1 20 GLY HA2 H 0.539 -6.638 3.094 1.00 . A A . 20 GLY HA2 1 1 2 770 1 1 20 GLY HA3 H 0.970 -6.545 4.805 1.00 . A A . 20 GLY HA3 1 1 2 771 1 1 20 GLY N N -0.098 -4.877 4.072 1.00 . A A . 20 GLY N 1 1 2 772 1 1 20 GLY O O -2.160 -6.605 4.404 1.00 . A A . 20 GLY O 1 1 2 773 1 1 21 SER C C -2.327 -9.169 6.667 1.00 . A A . 21 SER C 1 1 2 774 1 1 21 SER CA C -2.100 -9.198 5.152 1.00 . A A . 21 SER CA 1 1 2 775 1 1 21 SER CB C -1.754 -10.612 4.691 1.00 . A A . 21 SER CB 1 1 2 776 1 1 21 SER H H -0.016 -8.770 4.809 1.00 . A A . 21 SER H 1 1 2 777 1 1 21 SER HA H -2.977 -8.846 4.634 1.00 . A A . 21 SER HA 1 1 2 778 1 1 21 SER HB2 H -1.074 -11.066 5.392 1.00 . A A . 21 SER HB2 1 1 2 779 1 1 21 SER HB3 H -2.658 -11.203 4.635 1.00 . A A . 21 SER HB3 1 1 2 780 1 1 21 SER HG H -0.544 -11.304 3.333 1.00 . A A . 21 SER HG 1 1 2 781 1 1 21 SER N N -0.912 -8.372 4.788 1.00 . A A . 21 SER N 1 1 2 782 1 1 21 SER O O -3.414 -9.430 7.145 1.00 . A A . 21 SER O 1 1 2 783 1 1 21 SER OG O -1.134 -10.551 3.413 1.00 . A A . 21 SER OG 1 1 2 784 1 1 22 ASP C C -1.363 -7.372 9.412 1.00 . A A . 22 ASP C 1 1 2 785 1 1 22 ASP CA C -1.477 -8.813 8.906 1.00 . A A . 22 ASP CA 1 1 2 786 1 1 22 ASP CB C -0.336 -9.666 9.461 1.00 . A A . 22 ASP CB 1 1 2 787 1 1 22 ASP CG C 0.972 -9.275 8.772 1.00 . A A . 22 ASP CG 1 1 2 788 1 1 22 ASP H H -0.445 -8.648 7.021 1.00 . A A . 22 ASP H 1 1 2 789 1 1 22 ASP HA H -2.427 -9.238 9.192 1.00 . A A . 22 ASP HA 1 1 2 790 1 1 22 ASP HB2 H -0.248 -9.498 10.526 1.00 . A A . 22 ASP HB2 1 1 2 791 1 1 22 ASP HB3 H -0.542 -10.710 9.273 1.00 . A A . 22 ASP HB3 1 1 2 792 1 1 22 ASP N N -1.313 -8.855 7.425 1.00 . A A . 22 ASP N 1 1 2 793 1 1 22 ASP O O -1.271 -7.126 10.598 1.00 . A A . 22 ASP O 1 1 2 794 1 1 22 ASP OD1 O 1.209 -9.757 7.676 1.00 . A A . 22 ASP OD1 1 1 2 795 1 1 22 ASP OD2 O 1.715 -8.499 9.350 1.00 . A A . 22 ASP OD2 1 1 2 796 1 1 23 GLY C C 0.192 -4.679 9.321 1.00 . A A . 23 GLY C 1 1 2 797 1 1 23 GLY CA C -1.259 -4.995 8.949 1.00 . A A . 23 GLY CA 1 1 2 798 1 1 23 GLY H H -1.443 -6.639 7.569 1.00 . A A . 23 GLY H 1 1 2 799 1 1 23 GLY HA2 H -1.573 -4.352 8.139 1.00 . A A . 23 GLY HA2 1 1 2 800 1 1 23 GLY HA3 H -1.892 -4.829 9.809 1.00 . A A . 23 GLY HA3 1 1 2 801 1 1 23 GLY N N -1.367 -6.419 8.520 1.00 . A A . 23 GLY N 1 1 2 802 1 1 23 GLY O O 1.057 -5.529 9.262 1.00 . A A . 23 GLY O 1 1 2 803 1 1 24 LYS C C 2.820 -3.389 8.934 1.00 . A A . 24 LYS C 1 1 2 804 1 1 24 LYS CA C 1.858 -3.087 10.083 1.00 . A A . 24 LYS CA 1 1 2 805 1 1 24 LYS CB C 2.188 -3.954 11.297 1.00 . A A . 24 LYS CB 1 1 2 806 1 1 24 LYS CD C 0.030 -3.689 12.521 1.00 . A A . 24 LYS CD 1 1 2 807 1 1 24 LYS CE C -0.419 -4.116 13.920 1.00 . A A . 24 LYS CE 1 1 2 808 1 1 24 LYS CG C 1.525 -3.364 12.541 1.00 . A A . 24 LYS CG 1 1 2 809 1 1 24 LYS H H -0.251 -2.790 9.746 1.00 . A A . 24 LYS H 1 1 2 810 1 1 24 LYS HA H 1.911 -2.043 10.351 1.00 . A A . 24 LYS HA 1 1 2 811 1 1 24 LYS HB2 H 1.821 -4.958 11.134 1.00 . A A . 24 LYS HB2 1 1 2 812 1 1 24 LYS HB3 H 3.258 -3.981 11.441 1.00 . A A . 24 LYS HB3 1 1 2 813 1 1 24 LYS HD2 H -0.523 -2.813 12.215 1.00 . A A . 24 LYS HD2 1 1 2 814 1 1 24 LYS HD3 H -0.154 -4.494 11.826 1.00 . A A . 24 LYS HD3 1 1 2 815 1 1 24 LYS HE2 H 0.409 -4.058 14.613 1.00 . A A . 24 LYS HE2 1 1 2 816 1 1 24 LYS HE3 H -1.238 -3.501 14.257 1.00 . A A . 24 LYS HE3 1 1 2 817 1 1 24 LYS HG2 H 1.976 -3.790 13.427 1.00 . A A . 24 LYS HG2 1 1 2 818 1 1 24 LYS HG3 H 1.657 -2.293 12.547 1.00 . A A . 24 LYS HG3 1 1 2 819 1 1 24 LYS HZ1 H -0.056 -6.128 13.529 1.00 . A A . 24 LYS HZ1 1 1 2 820 1 1 24 LYS HZ2 H -1.574 -5.581 12.996 1.00 . A A . 24 LYS HZ2 1 1 2 821 1 1 24 LYS HZ3 H -1.298 -5.856 14.651 1.00 . A A . 24 LYS HZ3 1 1 2 822 1 1 24 LYS N N 0.463 -3.460 9.705 1.00 . A A . 24 LYS N 1 1 2 823 1 1 24 LYS NZ N -0.871 -5.527 13.763 1.00 . A A . 24 LYS NZ 1 1 2 824 1 1 24 LYS O O 3.992 -3.629 9.140 1.00 . A A . 24 LYS O 1 1 2 825 1 1 25 SER C C 2.551 -3.202 5.271 1.00 . A A . 25 SER C 1 1 2 826 1 1 25 SER CA C 3.223 -3.655 6.566 1.00 . A A . 25 SER CA 1 1 2 827 1 1 25 SER CB C 3.413 -5.172 6.566 1.00 . A A . 25 SER CB 1 1 2 828 1 1 25 SER H H 1.385 -3.175 7.582 1.00 . A A . 25 SER H 1 1 2 829 1 1 25 SER HA H 4.174 -3.164 6.692 1.00 . A A . 25 SER HA 1 1 2 830 1 1 25 SER HB2 H 2.481 -5.654 6.818 1.00 . A A . 25 SER HB2 1 1 2 831 1 1 25 SER HB3 H 3.730 -5.494 5.582 1.00 . A A . 25 SER HB3 1 1 2 832 1 1 25 SER HG H 5.050 -6.078 7.102 1.00 . A A . 25 SER HG 1 1 2 833 1 1 25 SER N N 2.334 -3.375 7.726 1.00 . A A . 25 SER N 1 1 2 834 1 1 25 SER O O 1.345 -3.242 5.140 1.00 . A A . 25 SER O 1 1 2 835 1 1 25 SER OG O 4.396 -5.522 7.532 1.00 . A A . 25 SER OG 1 1 2 836 1 1 26 ALA C C 3.652 -2.656 1.859 1.00 . A A . 26 ALA C 1 1 2 837 1 1 26 ALA CA C 2.722 -2.318 3.029 1.00 . A A . 26 ALA CA 1 1 2 838 1 1 26 ALA CB C 2.570 -0.804 3.174 1.00 . A A . 26 ALA CB 1 1 2 839 1 1 26 ALA H H 4.293 -2.745 4.438 1.00 . A A . 26 ALA H 1 1 2 840 1 1 26 ALA HA H 1.756 -2.771 2.886 1.00 . A A . 26 ALA HA 1 1 2 841 1 1 26 ALA HB1 H 3.548 -0.350 3.241 1.00 . A A . 26 ALA HB1 1 1 2 842 1 1 26 ALA HB2 H 2.009 -0.583 4.068 1.00 . A A . 26 ALA HB2 1 1 2 843 1 1 26 ALA HB3 H 2.050 -0.410 2.314 1.00 . A A . 26 ALA HB3 1 1 2 844 1 1 26 ALA N N 3.322 -2.771 4.313 1.00 . A A . 26 ALA N 1 1 2 845 1 1 26 ALA O O 4.845 -2.432 1.919 1.00 . A A . 26 ALA O 1 1 2 846 1 1 27 ALA C C 4.649 -2.248 -0.889 1.00 . A A . 27 ALA C 1 1 2 847 1 1 27 ALA CA C 3.976 -3.521 -0.382 1.00 . A A . 27 ALA CA 1 1 2 848 1 1 27 ALA CB C 3.020 -4.091 -1.432 1.00 . A A . 27 ALA CB 1 1 2 849 1 1 27 ALA H H 2.150 -3.348 0.757 1.00 . A A . 27 ALA H 1 1 2 850 1 1 27 ALA HA H 4.714 -4.256 -0.111 1.00 . A A . 27 ALA HA 1 1 2 851 1 1 27 ALA HB1 H 3.590 -4.582 -2.208 1.00 . A A . 27 ALA HB1 1 1 2 852 1 1 27 ALA HB2 H 2.442 -3.290 -1.864 1.00 . A A . 27 ALA HB2 1 1 2 853 1 1 27 ALA HB3 H 2.357 -4.805 -0.966 1.00 . A A . 27 ALA HB3 1 1 2 854 1 1 27 ALA N N 3.116 -3.184 0.790 1.00 . A A . 27 ALA N 1 1 2 855 1 1 27 ALA O O 5.853 -2.102 -0.838 1.00 . A A . 27 ALA O 1 1 2 856 1 1 28 CYS C C 5.316 -0.206 -3.067 1.00 . A A . 28 CYS C 1 1 2 857 1 1 28 CYS CA C 4.427 -0.021 -1.832 1.00 . A A . 28 CYS CA 1 1 2 858 1 1 28 CYS CB C 5.251 0.510 -0.657 1.00 . A A . 28 CYS CB 1 1 2 859 1 1 28 CYS H H 2.898 -1.459 -1.354 1.00 . A A . 28 CYS H 1 1 2 860 1 1 28 CYS HA H 3.628 0.668 -2.051 1.00 . A A . 28 CYS HA 1 1 2 861 1 1 28 CYS HB2 H 6.163 -0.060 -0.569 1.00 . A A . 28 CYS HB2 1 1 2 862 1 1 28 CYS HB3 H 5.492 1.549 -0.828 1.00 . A A . 28 CYS HB3 1 1 2 863 1 1 28 CYS N N 3.866 -1.316 -1.349 1.00 . A A . 28 CYS N 1 1 2 864 1 1 28 CYS O O 6.450 -0.631 -2.973 1.00 . A A . 28 CYS O 1 1 2 865 1 1 28 CYS SG S 4.293 0.360 0.872 1.00 . A A . 28 CYS SG 1 1 2 866 1 1 29 THR C C 6.680 1.146 -5.516 1.00 . A A . 29 THR C 1 1 2 867 1 1 29 THR CA C 5.637 0.015 -5.468 1.00 . A A . 29 THR CA 1 1 2 868 1 1 29 THR CB C 4.660 0.108 -6.661 1.00 . A A . 29 THR CB 1 1 2 869 1 1 29 THR CG2 C 3.524 1.111 -6.394 1.00 . A A . 29 THR CG2 1 1 2 870 1 1 29 THR H H 3.902 0.493 -4.261 1.00 . A A . 29 THR H 1 1 2 871 1 1 29 THR HA H 6.136 -0.942 -5.482 1.00 . A A . 29 THR HA 1 1 2 872 1 1 29 THR HB H 4.232 -0.867 -6.843 1.00 . A A . 29 THR HB 1 1 2 873 1 1 29 THR HG1 H 6.120 -0.075 -7.933 1.00 . A A . 29 THR HG1 1 1 2 874 1 1 29 THR HG21 H 3.768 1.725 -5.540 1.00 . A A . 29 THR HG21 1 1 2 875 1 1 29 THR HG22 H 2.608 0.575 -6.198 1.00 . A A . 29 THR HG22 1 1 2 876 1 1 29 THR HG23 H 3.391 1.742 -7.262 1.00 . A A . 29 THR HG23 1 1 2 877 1 1 29 THR N N 4.812 0.140 -4.222 1.00 . A A . 29 THR N 1 1 2 878 1 1 29 THR O O 7.843 0.931 -5.245 1.00 . A A . 29 THR O 1 1 2 879 1 1 29 THR OG1 O 5.378 0.522 -7.815 1.00 . A A . 29 THR OG1 1 1 2 880 1 1 30 LEU C C 8.637 3.166 -6.115 1.00 . A A . 30 LEU C 1 1 2 881 1 1 30 LEU CA C 7.171 3.535 -5.909 1.00 . A A . 30 LEU CA 1 1 2 882 1 1 30 LEU CB C 7.014 4.272 -4.572 1.00 . A A . 30 LEU CB 1 1 2 883 1 1 30 LEU CD1 C 7.538 3.830 -2.176 1.00 . A A . 30 LEU CD1 1 1 2 884 1 1 30 LEU CD2 C 5.355 3.092 -3.131 1.00 . A A . 30 LEU CD2 1 1 2 885 1 1 30 LEU CG C 6.846 3.280 -3.421 1.00 . A A . 30 LEU CG 1 1 2 886 1 1 30 LEU H H 5.315 2.473 -6.045 1.00 . A A . 30 LEU H 1 1 2 887 1 1 30 LEU HA H 6.852 4.187 -6.704 1.00 . A A . 30 LEU HA 1 1 2 888 1 1 30 LEU HB2 H 7.892 4.873 -4.395 1.00 . A A . 30 LEU HB2 1 1 2 889 1 1 30 LEU HB3 H 6.151 4.913 -4.618 1.00 . A A . 30 LEU HB3 1 1 2 890 1 1 30 LEU HD11 H 7.801 4.865 -2.339 1.00 . A A . 30 LEU HD11 1 1 2 891 1 1 30 LEU HD12 H 8.432 3.258 -1.978 1.00 . A A . 30 LEU HD12 1 1 2 892 1 1 30 LEU HD13 H 6.870 3.758 -1.331 1.00 . A A . 30 LEU HD13 1 1 2 893 1 1 30 LEU HD21 H 5.216 2.898 -2.077 1.00 . A A . 30 LEU HD21 1 1 2 894 1 1 30 LEU HD22 H 4.978 2.260 -3.704 1.00 . A A . 30 LEU HD22 1 1 2 895 1 1 30 LEU HD23 H 4.820 3.989 -3.405 1.00 . A A . 30 LEU HD23 1 1 2 896 1 1 30 LEU HG H 7.291 2.335 -3.684 1.00 . A A . 30 LEU HG 1 1 2 897 1 1 30 LEU N N 6.256 2.345 -5.843 1.00 . A A . 30 LEU N 1 1 2 898 1 1 30 LEU O O 9.312 2.711 -5.212 1.00 . A A . 30 LEU O 1 1 2 899 1 1 31 LYS C C 11.340 4.402 -7.078 1.00 . A A . 31 LYS C 1 1 2 900 1 1 31 LYS CA C 10.586 3.156 -7.538 1.00 . A A . 31 LYS CA 1 1 2 901 1 1 31 LYS CB C 10.727 2.964 -9.058 1.00 . A A . 31 LYS CB 1 1 2 902 1 1 31 LYS CD C 9.781 0.899 -10.119 1.00 . A A . 31 LYS CD 1 1 2 903 1 1 31 LYS CE C 8.513 0.050 -10.010 1.00 . A A . 31 LYS CE 1 1 2 904 1 1 31 LYS CG C 9.468 2.320 -9.664 1.00 . A A . 31 LYS CG 1 1 2 905 1 1 31 LYS H H 8.601 3.836 -7.979 1.00 . A A . 31 LYS H 1 1 2 906 1 1 31 LYS HA H 10.920 2.280 -7.003 1.00 . A A . 31 LYS HA 1 1 2 907 1 1 31 LYS HB2 H 10.893 3.924 -9.523 1.00 . A A . 31 LYS HB2 1 1 2 908 1 1 31 LYS HB3 H 11.575 2.328 -9.252 1.00 . A A . 31 LYS HB3 1 1 2 909 1 1 31 LYS HD2 H 10.121 0.915 -11.145 1.00 . A A . 31 LYS HD2 1 1 2 910 1 1 31 LYS HD3 H 10.550 0.477 -9.489 1.00 . A A . 31 LYS HD3 1 1 2 911 1 1 31 LYS HE2 H 8.494 -0.475 -9.064 1.00 . A A . 31 LYS HE2 1 1 2 912 1 1 31 LYS HE3 H 7.635 0.671 -10.113 1.00 . A A . 31 LYS HE3 1 1 2 913 1 1 31 LYS HG2 H 8.678 2.285 -8.933 1.00 . A A . 31 LYS HG2 1 1 2 914 1 1 31 LYS HG3 H 9.143 2.901 -10.513 1.00 . A A . 31 LYS HG3 1 1 2 915 1 1 31 LYS HZ1 H 7.694 -1.419 -11.236 1.00 . A A . 31 LYS HZ1 1 1 2 916 1 1 31 LYS HZ2 H 9.361 -1.593 -10.965 1.00 . A A . 31 LYS HZ2 1 1 2 917 1 1 31 LYS HZ3 H 8.791 -0.394 -12.025 1.00 . A A . 31 LYS HZ3 1 1 2 918 1 1 31 LYS N N 9.151 3.424 -7.283 1.00 . A A . 31 LYS N 1 1 2 919 1 1 31 LYS NZ N 8.596 -0.912 -11.144 1.00 . A A . 31 LYS NZ 1 1 2 920 1 1 31 LYS O O 12.008 5.064 -7.848 1.00 . A A . 31 LYS O 1 1 2 921 1 1 32 ALA C C 10.933 7.179 -5.637 1.00 . A A . 32 ALA C 1 1 2 922 1 1 32 ALA CA C 11.793 5.977 -5.255 1.00 . A A . 32 ALA CA 1 1 2 923 1 1 32 ALA CB C 13.182 6.095 -5.867 1.00 . A A . 32 ALA CB 1 1 2 924 1 1 32 ALA H H 10.587 4.206 -5.257 1.00 . A A . 32 ALA H 1 1 2 925 1 1 32 ALA HA H 11.865 5.896 -4.182 1.00 . A A . 32 ALA HA 1 1 2 926 1 1 32 ALA HB1 H 13.153 6.802 -6.682 1.00 . A A . 32 ALA HB1 1 1 2 927 1 1 32 ALA HB2 H 13.495 5.130 -6.233 1.00 . A A . 32 ALA HB2 1 1 2 928 1 1 32 ALA HB3 H 13.873 6.440 -5.113 1.00 . A A . 32 ALA HB3 1 1 2 929 1 1 32 ALA N N 11.170 4.746 -5.824 1.00 . A A . 32 ALA N 1 1 2 930 1 1 32 ALA O O 10.339 7.216 -6.696 1.00 . A A . 32 ALA O 1 1 2 931 1 1 33 CYS C C 10.867 10.600 -5.219 1.00 . A A . 33 CYS C 1 1 2 932 1 1 33 CYS CA C 10.005 9.342 -5.111 1.00 . A A . 33 CYS CA 1 1 2 933 1 1 33 CYS CB C 9.012 9.473 -3.952 1.00 . A A . 33 CYS CB 1 1 2 934 1 1 33 CYS H H 11.327 8.106 -3.932 1.00 . A A . 33 CYS H 1 1 2 935 1 1 33 CYS HA H 9.472 9.173 -6.032 1.00 . A A . 33 CYS HA 1 1 2 936 1 1 33 CYS HB2 H 9.553 9.491 -3.016 1.00 . A A . 33 CYS HB2 1 1 2 937 1 1 33 CYS HB3 H 8.453 10.393 -4.063 1.00 . A A . 33 CYS HB3 1 1 2 938 1 1 33 CYS N N 10.846 8.156 -4.784 1.00 . A A . 33 CYS N 1 1 2 939 1 1 33 CYS O O 11.234 11.191 -4.223 1.00 . A A . 33 CYS O 1 1 2 940 1 1 33 CYS SG S 7.869 8.068 -3.960 1.00 . A A . 33 CYS SG 1 1 2 941 1 1 34 PRO C C 11.145 13.441 -6.458 1.00 . A A . 34 PRO C 1 1 2 942 1 1 34 PRO CA C 11.974 12.176 -6.694 1.00 . A A . 34 PRO CA 1 1 2 943 1 1 34 PRO CB C 12.351 12.043 -8.164 1.00 . A A . 34 PRO CB 1 1 2 944 1 1 34 PRO CD C 10.742 10.301 -7.674 1.00 . A A . 34 PRO CD 1 1 2 945 1 1 34 PRO CG C 11.280 11.188 -8.769 1.00 . A A . 34 PRO CG 1 1 2 946 1 1 34 PRO HA H 12.857 12.177 -6.081 1.00 . A A . 34 PRO HA 1 1 2 947 1 1 34 PRO HB2 H 12.368 13.017 -8.635 1.00 . A A . 34 PRO HB2 1 1 2 948 1 1 34 PRO HB3 H 13.310 11.558 -8.264 1.00 . A A . 34 PRO HB3 1 1 2 949 1 1 34 PRO HD2 H 9.664 10.239 -7.735 1.00 . A A . 34 PRO HD2 1 1 2 950 1 1 34 PRO HD3 H 11.187 9.318 -7.730 1.00 . A A . 34 PRO HD3 1 1 2 951 1 1 34 PRO HG2 H 10.490 11.813 -9.161 1.00 . A A . 34 PRO HG2 1 1 2 952 1 1 34 PRO HG3 H 11.697 10.579 -9.556 1.00 . A A . 34 PRO HG3 1 1 2 953 1 1 34 PRO N N 11.152 10.970 -6.436 1.00 . A A . 34 PRO N 1 1 2 954 1 1 34 PRO O O 11.607 14.402 -5.875 1.00 . A A . 34 PRO O 1 1 2 955 1 1 35 GLN C C 7.582 14.226 -6.702 1.00 . A A . 35 GLN C 1 1 2 956 1 1 35 GLN CA C 9.055 14.643 -6.720 1.00 . A A . 35 GLN CA 1 1 2 957 1 1 35 GLN CB C 9.344 15.539 -7.926 1.00 . A A . 35 GLN CB 1 1 2 958 1 1 35 GLN CD C 10.403 17.723 -8.534 1.00 . A A . 35 GLN CD 1 1 2 959 1 1 35 GLN CG C 9.635 16.964 -7.449 1.00 . A A . 35 GLN CG 1 1 2 960 1 1 35 GLN H H 9.577 12.658 -7.379 1.00 . A A . 35 GLN H 1 1 2 961 1 1 35 GLN HA H 9.314 15.156 -5.809 1.00 . A A . 35 GLN HA 1 1 2 962 1 1 35 GLN HB2 H 10.201 15.155 -8.463 1.00 . A A . 35 GLN HB2 1 1 2 963 1 1 35 GLN HB3 H 8.485 15.550 -8.581 1.00 . A A . 35 GLN HB3 1 1 2 964 1 1 35 GLN HE21 H 9.395 19.413 -8.261 1.00 . A A . 35 GLN HE21 1 1 2 965 1 1 35 GLN HE22 H 10.591 19.467 -9.467 1.00 . A A . 35 GLN HE22 1 1 2 966 1 1 35 GLN HG2 H 8.704 17.471 -7.243 1.00 . A A . 35 GLN HG2 1 1 2 967 1 1 35 GLN HG3 H 10.232 16.926 -6.549 1.00 . A A . 35 GLN HG3 1 1 2 968 1 1 35 GLN N N 9.925 13.445 -6.911 1.00 . A A . 35 GLN N 1 1 2 969 1 1 35 GLN NE2 N 10.105 18.971 -8.774 1.00 . A A . 35 GLN NE2 1 1 2 970 1 1 35 GLN O O 6.747 15.084 -6.466 1.00 . A A . 35 GLN O 1 1 2 971 1 1 35 GLN OXT O 7.315 13.057 -6.926 1.00 . A A . 35 GLN OXT 1 1 2 972 1 1 35 GLN OE1 O 11.282 17.175 -9.169 1.00 . A A . 35 GLN OE1 1 1 3 973 1 1 1 GLU C C 4.395 1.374 10.359 1.00 . A A . 1 GLU C 1 1 3 974 1 1 1 GLU CA C 5.709 1.218 11.129 1.00 . A A . 1 GLU CA 1 1 3 975 1 1 1 GLU CB C 6.816 2.040 10.471 1.00 . A A . 1 GLU CB 1 1 3 976 1 1 1 GLU CD C 6.458 4.137 11.779 1.00 . A A . 1 GLU CD 1 1 3 977 1 1 1 GLU CG C 6.385 3.505 10.389 1.00 . A A . 1 GLU CG 1 1 3 978 1 1 1 GLU H1 H 5.365 -0.836 11.086 1.00 . A A . 1 GLU H1 1 1 3 979 1 1 1 GLU H2 H 6.808 -0.391 11.866 1.00 . A A . 1 GLU H2 1 1 3 980 1 1 1 GLU H3 H 6.705 -0.341 10.171 1.00 . A A . 1 GLU H3 1 1 3 981 1 1 1 GLU HA H 5.585 1.522 12.156 1.00 . A A . 1 GLU HA 1 1 3 982 1 1 1 GLU HB2 H 7.721 1.963 11.059 1.00 . A A . 1 GLU HB2 1 1 3 983 1 1 1 GLU HB3 H 7.001 1.665 9.476 1.00 . A A . 1 GLU HB3 1 1 3 984 1 1 1 GLU HG2 H 7.043 4.037 9.716 1.00 . A A . 1 GLU HG2 1 1 3 985 1 1 1 GLU HG3 H 5.371 3.562 10.023 1.00 . A A . 1 GLU HG3 1 1 3 986 1 1 1 GLU N N 6.183 -0.194 11.058 1.00 . A A . 1 GLU N 1 1 3 987 1 1 1 GLU O O 3.567 2.200 10.687 1.00 . A A . 1 GLU O 1 1 3 988 1 1 1 GLU OE1 O 6.870 3.449 12.700 1.00 . A A . 1 GLU OE1 1 1 3 989 1 1 1 GLU OE2 O 6.099 5.297 11.902 1.00 . A A . 1 GLU OE2 1 1 3 990 1 1 2 VAL C C 1.725 0.553 9.473 1.00 . A A . 2 VAL C 1 1 3 991 1 1 2 VAL CA C 2.939 0.687 8.548 1.00 . A A . 2 VAL CA 1 1 3 992 1 1 2 VAL CB C 2.993 -0.481 7.562 1.00 . A A . 2 VAL CB 1 1 3 993 1 1 2 VAL CG1 C 1.667 -0.573 6.806 1.00 . A A . 2 VAL CG1 1 1 3 994 1 1 2 VAL CG2 C 4.132 -0.255 6.565 1.00 . A A . 2 VAL CG2 1 1 3 995 1 1 2 VAL H H 4.880 -0.076 9.090 1.00 . A A . 2 VAL H 1 1 3 996 1 1 2 VAL HA H 2.904 1.623 8.011 1.00 . A A . 2 VAL HA 1 1 3 997 1 1 2 VAL HB H 3.163 -1.401 8.103 1.00 . A A . 2 VAL HB 1 1 3 998 1 1 2 VAL HG11 H 1.663 0.144 5.997 1.00 . A A . 2 VAL HG11 1 1 3 999 1 1 2 VAL HG12 H 0.852 -0.359 7.481 1.00 . A A . 2 VAL HG12 1 1 3 1000 1 1 2 VAL HG13 H 1.550 -1.568 6.405 1.00 . A A . 2 VAL HG13 1 1 3 1001 1 1 2 VAL HG21 H 4.071 0.748 6.169 1.00 . A A . 2 VAL HG21 1 1 3 1002 1 1 2 VAL HG22 H 4.050 -0.966 5.757 1.00 . A A . 2 VAL HG22 1 1 3 1003 1 1 2 VAL HG23 H 5.080 -0.386 7.066 1.00 . A A . 2 VAL HG23 1 1 3 1004 1 1 2 VAL N N 4.199 0.585 9.338 1.00 . A A . 2 VAL N 1 1 3 1005 1 1 2 VAL O O 1.566 -0.435 10.163 1.00 . A A . 2 VAL O 1 1 3 1006 1 1 3 THR C C -1.610 1.462 9.527 1.00 . A A . 3 THR C 1 1 3 1007 1 1 3 THR CA C -0.334 1.463 10.372 1.00 . A A . 3 THR CA 1 1 3 1008 1 1 3 THR CB C -0.271 2.718 11.245 1.00 . A A . 3 THR CB 1 1 3 1009 1 1 3 THR CG2 C -0.348 3.964 10.361 1.00 . A A . 3 THR CG2 1 1 3 1010 1 1 3 THR H H 1.014 2.322 8.927 1.00 . A A . 3 THR H 1 1 3 1011 1 1 3 THR HA H -0.293 0.581 10.991 1.00 . A A . 3 THR HA 1 1 3 1012 1 1 3 THR HB H 0.657 2.729 11.794 1.00 . A A . 3 THR HB 1 1 3 1013 1 1 3 THR HG1 H -1.637 3.623 12.293 1.00 . A A . 3 THR HG1 1 1 3 1014 1 1 3 THR HG21 H -0.339 3.669 9.321 1.00 . A A . 3 THR HG21 1 1 3 1015 1 1 3 THR HG22 H 0.501 4.600 10.561 1.00 . A A . 3 THR HG22 1 1 3 1016 1 1 3 THR HG23 H -1.260 4.501 10.574 1.00 . A A . 3 THR HG23 1 1 3 1017 1 1 3 THR N N 0.868 1.536 9.491 1.00 . A A . 3 THR N 1 1 3 1018 1 1 3 THR O O -2.267 2.473 9.376 1.00 . A A . 3 THR O 1 1 3 1019 1 1 3 THR OG1 O -1.362 2.714 12.155 1.00 . A A . 3 THR OG1 1 1 3 1020 1 1 4 CYS C C -3.837 -1.114 8.252 1.00 . A A . 4 CYS C 1 1 3 1021 1 1 4 CYS CA C -3.197 0.271 8.138 1.00 . A A . 4 CYS CA 1 1 3 1022 1 1 4 CYS CB C -2.719 0.524 6.708 1.00 . A A . 4 CYS CB 1 1 3 1023 1 1 4 CYS H H -1.420 -0.468 9.107 1.00 . A A . 4 CYS H 1 1 3 1024 1 1 4 CYS HA H -3.896 1.037 8.436 1.00 . A A . 4 CYS HA 1 1 3 1025 1 1 4 CYS HB2 H -3.544 0.384 6.022 1.00 . A A . 4 CYS HB2 1 1 3 1026 1 1 4 CYS HB3 H -2.348 1.536 6.627 1.00 . A A . 4 CYS HB3 1 1 3 1027 1 1 4 CYS N N -1.965 0.335 8.973 1.00 . A A . 4 CYS N 1 1 3 1028 1 1 4 CYS O O -3.253 -2.037 8.783 1.00 . A A . 4 CYS O 1 1 3 1029 1 1 4 CYS SG S -1.392 -0.640 6.303 1.00 . A A . 4 CYS SG 1 1 3 1030 1 1 5 GLU C C -5.340 -3.437 6.608 1.00 . A A . 5 GLU C 1 1 3 1031 1 1 5 GLU CA C -5.705 -2.595 7.832 1.00 . A A . 5 GLU CA 1 1 3 1032 1 1 5 GLU CB C -7.201 -2.281 7.842 1.00 . A A . 5 GLU CB 1 1 3 1033 1 1 5 GLU CD C -7.474 -2.574 10.307 1.00 . A A . 5 GLU CD 1 1 3 1034 1 1 5 GLU CG C -7.565 -1.578 9.151 1.00 . A A . 5 GLU CG 1 1 3 1035 1 1 5 GLU H H -5.487 -0.512 7.328 1.00 . A A . 5 GLU H 1 1 3 1036 1 1 5 GLU HA H -5.428 -3.107 8.739 1.00 . A A . 5 GLU HA 1 1 3 1037 1 1 5 GLU HB2 H -7.439 -1.638 7.007 1.00 . A A . 5 GLU HB2 1 1 3 1038 1 1 5 GLU HB3 H -7.763 -3.199 7.761 1.00 . A A . 5 GLU HB3 1 1 3 1039 1 1 5 GLU HG2 H -6.880 -0.760 9.323 1.00 . A A . 5 GLU HG2 1 1 3 1040 1 1 5 GLU HG3 H -8.573 -1.196 9.086 1.00 . A A . 5 GLU HG3 1 1 3 1041 1 1 5 GLU N N -5.033 -1.267 7.755 1.00 . A A . 5 GLU N 1 1 3 1042 1 1 5 GLU O O -5.112 -2.908 5.537 1.00 . A A . 5 GLU O 1 1 3 1043 1 1 5 GLU OE1 O -7.370 -3.759 10.037 1.00 . A A . 5 GLU OE1 1 1 3 1044 1 1 5 GLU OE2 O -7.509 -2.135 11.445 1.00 . A A . 5 GLU OE2 1 1 3 1045 1 1 6 PRO C C -6.105 -5.726 4.699 1.00 . A A . 6 PRO C 1 1 3 1046 1 1 6 PRO CA C -4.954 -5.655 5.706 1.00 . A A . 6 PRO CA 1 1 3 1047 1 1 6 PRO CB C -4.753 -6.991 6.415 1.00 . A A . 6 PRO CB 1 1 3 1048 1 1 6 PRO CD C -5.557 -5.429 8.068 1.00 . A A . 6 PRO CD 1 1 3 1049 1 1 6 PRO CG C -5.549 -6.884 7.676 1.00 . A A . 6 PRO CG 1 1 3 1050 1 1 6 PRO HA H -4.040 -5.351 5.221 1.00 . A A . 6 PRO HA 1 1 3 1051 1 1 6 PRO HB2 H -5.121 -7.801 5.801 1.00 . A A . 6 PRO HB2 1 1 3 1052 1 1 6 PRO HB3 H -3.711 -7.137 6.649 1.00 . A A . 6 PRO HB3 1 1 3 1053 1 1 6 PRO HD2 H -6.524 -5.151 8.468 1.00 . A A . 6 PRO HD2 1 1 3 1054 1 1 6 PRO HD3 H -4.773 -5.222 8.780 1.00 . A A . 6 PRO HD3 1 1 3 1055 1 1 6 PRO HG2 H -6.558 -7.230 7.505 1.00 . A A . 6 PRO HG2 1 1 3 1056 1 1 6 PRO HG3 H -5.086 -7.467 8.456 1.00 . A A . 6 PRO HG3 1 1 3 1057 1 1 6 PRO N N -5.295 -4.724 6.809 1.00 . A A . 6 PRO N 1 1 3 1058 1 1 6 PRO O O -7.213 -6.095 5.032 1.00 . A A . 6 PRO O 1 1 3 1059 1 1 7 GLY C C -7.553 -4.010 2.327 1.00 . A A . 7 GLY C 1 1 3 1060 1 1 7 GLY CA C -6.928 -5.399 2.443 1.00 . A A . 7 GLY CA 1 1 3 1061 1 1 7 GLY H H -4.950 -5.062 3.228 1.00 . A A . 7 GLY H 1 1 3 1062 1 1 7 GLY HA2 H -6.506 -5.689 1.489 1.00 . A A . 7 GLY HA2 1 1 3 1063 1 1 7 GLY HA3 H -7.687 -6.110 2.738 1.00 . A A . 7 GLY HA3 1 1 3 1064 1 1 7 GLY N N -5.850 -5.364 3.472 1.00 . A A . 7 GLY N 1 1 3 1065 1 1 7 GLY O O -8.757 -3.856 2.316 1.00 . A A . 7 GLY O 1 1 3 1066 1 1 8 THR C C -6.264 -0.682 1.453 1.00 . A A . 8 THR C 1 1 3 1067 1 1 8 THR CA C -7.276 -1.606 2.139 1.00 . A A . 8 THR CA 1 1 3 1068 1 1 8 THR CB C -7.511 -1.159 3.584 1.00 . A A . 8 THR CB 1 1 3 1069 1 1 8 THR CG2 C -8.386 0.095 3.596 1.00 . A A . 8 THR CG2 1 1 3 1070 1 1 8 THR H H -5.770 -3.144 2.264 1.00 . A A . 8 THR H 1 1 3 1071 1 1 8 THR HA H -8.207 -1.607 1.600 1.00 . A A . 8 THR HA 1 1 3 1072 1 1 8 THR HB H -6.564 -0.936 4.050 1.00 . A A . 8 THR HB 1 1 3 1073 1 1 8 THR HG1 H -7.855 -2.168 5.211 1.00 . A A . 8 THR HG1 1 1 3 1074 1 1 8 THR HG21 H -9.276 -0.093 4.177 1.00 . A A . 8 THR HG21 1 1 3 1075 1 1 8 THR HG22 H -8.663 0.351 2.584 1.00 . A A . 8 THR HG22 1 1 3 1076 1 1 8 THR HG23 H -7.835 0.913 4.037 1.00 . A A . 8 THR HG23 1 1 3 1077 1 1 8 THR N N -6.736 -2.993 2.248 1.00 . A A . 8 THR N 1 1 3 1078 1 1 8 THR O O -6.633 0.244 0.761 1.00 . A A . 8 THR O 1 1 3 1079 1 1 8 THR OG1 O -8.159 -2.200 4.301 1.00 . A A . 8 THR OG1 1 1 3 1080 1 1 9 THR C C -4.361 1.410 1.078 1.00 . A A . 9 THR C 1 1 3 1081 1 1 9 THR CA C -3.950 -0.064 1.019 1.00 . A A . 9 THR CA 1 1 3 1082 1 1 9 THR CB C -3.845 -0.543 -0.434 1.00 . A A . 9 THR CB 1 1 3 1083 1 1 9 THR CG2 C -5.086 -0.117 -1.219 1.00 . A A . 9 THR CG2 1 1 3 1084 1 1 9 THR H H -4.725 -1.674 2.217 1.00 . A A . 9 THR H 1 1 3 1085 1 1 9 THR HA H -3.003 -0.204 1.517 1.00 . A A . 9 THR HA 1 1 3 1086 1 1 9 THR HB H -3.766 -1.619 -0.450 1.00 . A A . 9 THR HB 1 1 3 1087 1 1 9 THR HG1 H -2.060 0.225 -0.338 1.00 . A A . 9 THR HG1 1 1 3 1088 1 1 9 THR HG21 H -5.918 -0.750 -0.947 1.00 . A A . 9 THR HG21 1 1 3 1089 1 1 9 THR HG22 H -4.892 -0.213 -2.277 1.00 . A A . 9 THR HG22 1 1 3 1090 1 1 9 THR HG23 H -5.323 0.910 -0.988 1.00 . A A . 9 THR HG23 1 1 3 1091 1 1 9 THR N N -4.994 -0.925 1.648 1.00 . A A . 9 THR N 1 1 3 1092 1 1 9 THR O O -5.264 1.787 1.798 1.00 . A A . 9 THR O 1 1 3 1093 1 1 9 THR OG1 O -2.690 0.026 -1.034 1.00 . A A . 9 THR OG1 1 1 3 1094 1 1 10 PHE C C -3.094 4.471 -0.572 1.00 . A A . 10 PHE C 1 1 3 1095 1 1 10 PHE CA C -4.041 3.699 0.348 1.00 . A A . 10 PHE CA 1 1 3 1096 1 1 10 PHE CB C -3.868 4.148 1.803 1.00 . A A . 10 PHE CB 1 1 3 1097 1 1 10 PHE CD1 C -1.372 4.067 2.175 1.00 . A A . 10 PHE CD1 1 1 3 1098 1 1 10 PHE CD2 C -2.759 2.344 3.168 1.00 . A A . 10 PHE CD2 1 1 3 1099 1 1 10 PHE CE1 C -0.233 3.467 2.726 1.00 . A A . 10 PHE CE1 1 1 3 1100 1 1 10 PHE CE2 C -1.621 1.744 3.718 1.00 . A A . 10 PHE CE2 1 1 3 1101 1 1 10 PHE CG C -2.636 3.505 2.398 1.00 . A A . 10 PHE CG 1 1 3 1102 1 1 10 PHE CZ C -0.357 2.304 3.497 1.00 . A A . 10 PHE CZ 1 1 3 1103 1 1 10 PHE H H -2.966 1.923 -0.235 1.00 . A A . 10 PHE H 1 1 3 1104 1 1 10 PHE HA H -5.064 3.844 0.038 1.00 . A A . 10 PHE HA 1 1 3 1105 1 1 10 PHE HB2 H -3.763 5.223 1.836 1.00 . A A . 10 PHE HB2 1 1 3 1106 1 1 10 PHE HB3 H -4.735 3.854 2.374 1.00 . A A . 10 PHE HB3 1 1 3 1107 1 1 10 PHE HD1 H -1.278 4.964 1.581 1.00 . A A . 10 PHE HD1 1 1 3 1108 1 1 10 PHE HD2 H -3.734 1.911 3.338 1.00 . A A . 10 PHE HD2 1 1 3 1109 1 1 10 PHE HE1 H 0.741 3.900 2.555 1.00 . A A . 10 PHE HE1 1 1 3 1110 1 1 10 PHE HE2 H -1.718 0.848 4.312 1.00 . A A . 10 PHE HE2 1 1 3 1111 1 1 10 PHE HZ H 0.521 1.839 3.921 1.00 . A A . 10 PHE HZ 1 1 3 1112 1 1 10 PHE N N -3.696 2.247 0.333 1.00 . A A . 10 PHE N 1 1 3 1113 1 1 10 PHE O O -2.294 3.894 -1.281 1.00 . A A . 10 PHE O 1 1 3 1114 1 1 11 LYS C C -1.147 7.195 -0.640 1.00 . A A . 11 LYS C 1 1 3 1115 1 1 11 LYS CA C -2.287 6.575 -1.453 1.00 . A A . 11 LYS CA 1 1 3 1116 1 1 11 LYS CB C -3.187 7.663 -2.038 1.00 . A A . 11 LYS CB 1 1 3 1117 1 1 11 LYS CD C -4.509 8.344 -4.052 1.00 . A A . 11 LYS CD 1 1 3 1118 1 1 11 LYS CE C -3.810 8.862 -5.311 1.00 . A A . 11 LYS CE 1 1 3 1119 1 1 11 LYS CG C -3.669 7.229 -3.425 1.00 . A A . 11 LYS CG 1 1 3 1120 1 1 11 LYS H H -3.833 6.220 0.005 1.00 . A A . 11 LYS H 1 1 3 1121 1 1 11 LYS HA H -1.891 5.961 -2.245 1.00 . A A . 11 LYS HA 1 1 3 1122 1 1 11 LYS HB2 H -4.037 7.812 -1.389 1.00 . A A . 11 LYS HB2 1 1 3 1123 1 1 11 LYS HB3 H -2.631 8.585 -2.124 1.00 . A A . 11 LYS HB3 1 1 3 1124 1 1 11 LYS HD2 H -5.483 7.955 -4.313 1.00 . A A . 11 LYS HD2 1 1 3 1125 1 1 11 LYS HD3 H -4.622 9.152 -3.345 1.00 . A A . 11 LYS HD3 1 1 3 1126 1 1 11 LYS HE2 H -4.128 9.873 -5.526 1.00 . A A . 11 LYS HE2 1 1 3 1127 1 1 11 LYS HE3 H -2.739 8.819 -5.192 1.00 . A A . 11 LYS HE3 1 1 3 1128 1 1 11 LYS HG2 H -2.814 7.026 -4.054 1.00 . A A . 11 LYS HG2 1 1 3 1129 1 1 11 LYS HG3 H -4.269 6.337 -3.334 1.00 . A A . 11 LYS HG3 1 1 3 1130 1 1 11 LYS HZ1 H -3.739 7.033 -6.302 1.00 . A A . 11 LYS HZ1 1 1 3 1131 1 1 11 LYS HZ2 H -4.016 8.363 -7.321 1.00 . A A . 11 LYS HZ2 1 1 3 1132 1 1 11 LYS HZ3 H -5.264 7.775 -6.330 1.00 . A A . 11 LYS HZ3 1 1 3 1133 1 1 11 LYS N N -3.180 5.772 -0.571 1.00 . A A . 11 LYS N 1 1 3 1134 1 1 11 LYS NZ N -4.240 7.938 -6.398 1.00 . A A . 11 LYS NZ 1 1 3 1135 1 1 11 LYS O O -1.321 8.190 0.034 1.00 . A A . 11 LYS O 1 1 3 1136 1 1 12 ASP C C 2.329 7.429 -0.910 1.00 . A A . 12 ASP C 1 1 3 1137 1 1 12 ASP CA C 1.173 7.169 0.051 1.00 . A A . 12 ASP CA 1 1 3 1138 1 1 12 ASP CB C 1.553 6.080 1.051 1.00 . A A . 12 ASP CB 1 1 3 1139 1 1 12 ASP CG C 2.194 6.719 2.284 1.00 . A A . 12 ASP CG 1 1 3 1140 1 1 12 ASP H H 0.142 5.817 -1.259 1.00 . A A . 12 ASP H 1 1 3 1141 1 1 12 ASP HA H 0.893 8.073 0.568 1.00 . A A . 12 ASP HA 1 1 3 1142 1 1 12 ASP HB2 H 0.665 5.535 1.345 1.00 . A A . 12 ASP HB2 1 1 3 1143 1 1 12 ASP HB3 H 2.258 5.403 0.591 1.00 . A A . 12 ASP HB3 1 1 3 1144 1 1 12 ASP N N 0.019 6.616 -0.705 1.00 . A A . 12 ASP N 1 1 3 1145 1 1 12 ASP O O 2.267 7.092 -2.076 1.00 . A A . 12 ASP O 1 1 3 1146 1 1 12 ASP OD1 O 2.055 7.921 2.444 1.00 . A A . 12 ASP OD1 1 1 3 1147 1 1 12 ASP OD2 O 2.813 5.996 3.047 1.00 . A A . 12 ASP OD2 1 1 3 1148 1 1 13 LYS C C 4.049 8.867 -2.650 1.00 . A A . 13 LYS C 1 1 3 1149 1 1 13 LYS CA C 4.546 8.280 -1.329 1.00 . A A . 13 LYS CA 1 1 3 1150 1 1 13 LYS CB C 5.210 6.922 -1.566 1.00 . A A . 13 LYS CB 1 1 3 1151 1 1 13 LYS CD C 6.320 5.236 -0.085 1.00 . A A . 13 LYS CD 1 1 3 1152 1 1 13 LYS CE C 7.225 5.981 0.901 1.00 . A A . 13 LYS CE 1 1 3 1153 1 1 13 LYS CG C 5.045 6.048 -0.324 1.00 . A A . 13 LYS CG 1 1 3 1154 1 1 13 LYS H H 3.424 8.274 0.511 1.00 . A A . 13 LYS H 1 1 3 1155 1 1 13 LYS HA H 5.239 8.943 -0.851 1.00 . A A . 13 LYS HA 1 1 3 1156 1 1 13 LYS HB2 H 4.744 6.437 -2.413 1.00 . A A . 13 LYS HB2 1 1 3 1157 1 1 13 LYS HB3 H 6.263 7.066 -1.765 1.00 . A A . 13 LYS HB3 1 1 3 1158 1 1 13 LYS HD2 H 6.059 4.271 0.324 1.00 . A A . 13 LYS HD2 1 1 3 1159 1 1 13 LYS HD3 H 6.843 5.102 -1.019 1.00 . A A . 13 LYS HD3 1 1 3 1160 1 1 13 LYS HE2 H 7.389 6.996 0.565 1.00 . A A . 13 LYS HE2 1 1 3 1161 1 1 13 LYS HE3 H 6.790 5.975 1.889 1.00 . A A . 13 LYS HE3 1 1 3 1162 1 1 13 LYS HG2 H 4.843 6.675 0.531 1.00 . A A . 13 LYS HG2 1 1 3 1163 1 1 13 LYS HG3 H 4.218 5.385 -0.475 1.00 . A A . 13 LYS HG3 1 1 3 1164 1 1 13 LYS HZ1 H 9.306 5.884 0.909 1.00 . A A . 13 LYS HZ1 1 1 3 1165 1 1 13 LYS HZ2 H 8.559 4.620 0.055 1.00 . A A . 13 LYS HZ2 1 1 3 1166 1 1 13 LYS HZ3 H 8.553 4.622 1.755 1.00 . A A . 13 LYS HZ3 1 1 3 1167 1 1 13 LYS N N 3.387 8.014 -0.434 1.00 . A A . 13 LYS N 1 1 3 1168 1 1 13 LYS NZ N 8.507 5.219 0.905 1.00 . A A . 13 LYS NZ 1 1 3 1169 1 1 13 LYS O O 3.098 9.623 -2.682 1.00 . A A . 13 LYS O 1 1 3 1170 1 1 14 CYS C C 3.389 8.026 -5.787 1.00 . A A . 14 CYS C 1 1 3 1171 1 1 14 CYS CA C 4.225 9.076 -5.051 1.00 . A A . 14 CYS CA 1 1 3 1172 1 1 14 CYS CB C 5.499 9.396 -5.855 1.00 . A A . 14 CYS CB 1 1 3 1173 1 1 14 CYS H H 5.448 7.919 -3.700 1.00 . A A . 14 CYS H 1 1 3 1174 1 1 14 CYS HA H 3.648 9.977 -4.902 1.00 . A A . 14 CYS HA 1 1 3 1175 1 1 14 CYS HB2 H 5.719 8.573 -6.518 1.00 . A A . 14 CYS HB2 1 1 3 1176 1 1 14 CYS HB3 H 5.342 10.290 -6.437 1.00 . A A . 14 CYS HB3 1 1 3 1177 1 1 14 CYS N N 4.677 8.529 -3.740 1.00 . A A . 14 CYS N 1 1 3 1178 1 1 14 CYS O O 3.151 8.131 -6.974 1.00 . A A . 14 CYS O 1 1 3 1179 1 1 14 CYS SG S 6.909 9.659 -4.756 1.00 . A A . 14 CYS SG 1 1 3 1180 1 1 15 ASN C C 1.117 5.339 -4.802 1.00 . A A . 15 ASN C 1 1 3 1181 1 1 15 ASN CA C 2.131 5.955 -5.772 1.00 . A A . 15 ASN CA 1 1 3 1182 1 1 15 ASN CB C 3.146 4.903 -6.221 1.00 . A A . 15 ASN CB 1 1 3 1183 1 1 15 ASN CG C 3.758 5.321 -7.559 1.00 . A A . 15 ASN CG 1 1 3 1184 1 1 15 ASN H H 3.147 6.934 -4.138 1.00 . A A . 15 ASN H 1 1 3 1185 1 1 15 ASN HA H 1.626 6.364 -6.632 1.00 . A A . 15 ASN HA 1 1 3 1186 1 1 15 ASN HB2 H 3.926 4.817 -5.478 1.00 . A A . 15 ASN HB2 1 1 3 1187 1 1 15 ASN HB3 H 2.652 3.951 -6.335 1.00 . A A . 15 ASN HB3 1 1 3 1188 1 1 15 ASN HD21 H 5.469 4.363 -7.232 1.00 . A A . 15 ASN HD21 1 1 3 1189 1 1 15 ASN HD22 H 5.364 5.188 -8.722 1.00 . A A . 15 ASN HD22 1 1 3 1190 1 1 15 ASN N N 2.943 7.008 -5.095 1.00 . A A . 15 ASN N 1 1 3 1191 1 1 15 ASN ND2 N 4.963 4.925 -7.863 1.00 . A A . 15 ASN ND2 1 1 3 1192 1 1 15 ASN O O -0.007 5.789 -4.697 1.00 . A A . 15 ASN O 1 1 3 1193 1 1 15 ASN OD1 O 3.133 6.015 -8.336 1.00 . A A . 15 ASN OD1 1 1 3 1194 1 1 16 THR C C 1.286 2.718 -2.209 1.00 . A A . 16 THR C 1 1 3 1195 1 1 16 THR CA C 0.546 3.654 -3.156 1.00 . A A . 16 THR CA 1 1 3 1196 1 1 16 THR CB C -0.427 2.885 -4.062 1.00 . A A . 16 THR CB 1 1 3 1197 1 1 16 THR CG2 C -1.004 1.673 -3.324 1.00 . A A . 16 THR CG2 1 1 3 1198 1 1 16 THR H H 2.406 3.947 -4.210 1.00 . A A . 16 THR H 1 1 3 1199 1 1 16 THR HA H 0.011 4.391 -2.581 1.00 . A A . 16 THR HA 1 1 3 1200 1 1 16 THR HB H 0.095 2.546 -4.943 1.00 . A A . 16 THR HB 1 1 3 1201 1 1 16 THR HG1 H -1.660 4.350 -3.718 1.00 . A A . 16 THR HG1 1 1 3 1202 1 1 16 THR HG21 H -1.605 2.010 -2.492 1.00 . A A . 16 THR HG21 1 1 3 1203 1 1 16 THR HG22 H -0.197 1.056 -2.958 1.00 . A A . 16 THR HG22 1 1 3 1204 1 1 16 THR HG23 H -1.618 1.098 -4.003 1.00 . A A . 16 THR HG23 1 1 3 1205 1 1 16 THR N N 1.499 4.304 -4.103 1.00 . A A . 16 THR N 1 1 3 1206 1 1 16 THR O O 2.471 2.480 -2.337 1.00 . A A . 16 THR O 1 1 3 1207 1 1 16 THR OG1 O -1.488 3.749 -4.447 1.00 . A A . 16 THR OG1 1 1 3 1208 1 1 17 CYS C C 0.226 0.214 0.164 1.00 . A A . 17 CYS C 1 1 3 1209 1 1 17 CYS CA C 1.219 1.305 -0.253 1.00 . A A . 17 CYS CA 1 1 3 1210 1 1 17 CYS CB C 1.535 2.227 0.921 1.00 . A A . 17 CYS CB 1 1 3 1211 1 1 17 CYS H H -0.365 2.432 -1.157 1.00 . A A . 17 CYS H 1 1 3 1212 1 1 17 CYS HA H 2.119 0.874 -0.651 1.00 . A A . 17 CYS HA 1 1 3 1213 1 1 17 CYS HB2 H 1.029 3.170 0.776 1.00 . A A . 17 CYS HB2 1 1 3 1214 1 1 17 CYS HB3 H 1.184 1.773 1.826 1.00 . A A . 17 CYS HB3 1 1 3 1215 1 1 17 CYS N N 0.585 2.207 -1.242 1.00 . A A . 17 CYS N 1 1 3 1216 1 1 17 CYS O O -0.550 0.384 1.083 1.00 . A A . 17 CYS O 1 1 3 1217 1 1 17 CYS SG S 3.320 2.525 1.037 1.00 . A A . 17 CYS SG 1 1 3 1218 1 1 18 ARG C C -0.486 -2.472 1.273 1.00 . A A . 18 ARG C 1 1 3 1219 1 1 18 ARG CA C -0.703 -2.004 -0.169 1.00 . A A . 18 ARG CA 1 1 3 1220 1 1 18 ARG CB C -0.370 -3.118 -1.165 1.00 . A A . 18 ARG CB 1 1 3 1221 1 1 18 ARG CD C -2.378 -4.495 -0.574 1.00 . A A . 18 ARG CD 1 1 3 1222 1 1 18 ARG CG C -0.849 -4.470 -0.628 1.00 . A A . 18 ARG CG 1 1 3 1223 1 1 18 ARG CZ C -3.921 -6.363 -0.597 1.00 . A A . 18 ARG CZ 1 1 3 1224 1 1 18 ARG H H 0.874 -1.012 -1.252 1.00 . A A . 18 ARG H 1 1 3 1225 1 1 18 ARG HA H -1.723 -1.682 -0.307 1.00 . A A . 18 ARG HA 1 1 3 1226 1 1 18 ARG HB2 H -0.858 -2.910 -2.105 1.00 . A A . 18 ARG HB2 1 1 3 1227 1 1 18 ARG HB3 H 0.698 -3.152 -1.317 1.00 . A A . 18 ARG HB3 1 1 3 1228 1 1 18 ARG HD2 H -2.736 -3.864 0.228 1.00 . A A . 18 ARG HD2 1 1 3 1229 1 1 18 ARG HD3 H -2.794 -4.180 -1.518 1.00 . A A . 18 ARG HD3 1 1 3 1230 1 1 18 ARG HE H -2.059 -6.525 0.074 1.00 . A A . 18 ARG HE 1 1 3 1231 1 1 18 ARG HG2 H -0.500 -5.258 -1.280 1.00 . A A . 18 ARG HG2 1 1 3 1232 1 1 18 ARG HG3 H -0.454 -4.624 0.365 1.00 . A A . 18 ARG HG3 1 1 3 1233 1 1 18 ARG HH11 H -3.695 -6.139 -2.575 1.00 . A A . 18 ARG HH11 1 1 3 1234 1 1 18 ARG HH12 H -5.225 -6.768 -2.061 1.00 . A A . 18 ARG HH12 1 1 3 1235 1 1 18 ARG HH21 H -4.422 -6.690 1.313 1.00 . A A . 18 ARG HH21 1 1 3 1236 1 1 18 ARG HH22 H -5.638 -7.080 0.143 1.00 . A A . 18 ARG HH22 1 1 3 1237 1 1 18 ARG N N 0.242 -0.900 -0.512 1.00 . A A . 18 ARG N 1 1 3 1238 1 1 18 ARG NE N -2.727 -5.919 -0.312 1.00 . A A . 18 ARG NE 1 1 3 1239 1 1 18 ARG NH1 N -4.310 -6.428 -1.841 1.00 . A A . 18 ARG NH1 1 1 3 1240 1 1 18 ARG NH2 N -4.722 -6.740 0.361 1.00 . A A . 18 ARG NH2 1 1 3 1241 1 1 18 ARG O O 0.610 -2.820 1.665 1.00 . A A . 18 ARG O 1 1 3 1242 1 1 19 CYS C C -1.350 -4.477 3.524 1.00 . A A . 19 CYS C 1 1 3 1243 1 1 19 CYS CA C -1.390 -2.947 3.474 1.00 . A A . 19 CYS CA 1 1 3 1244 1 1 19 CYS CB C -2.633 -2.412 4.186 1.00 . A A . 19 CYS CB 1 1 3 1245 1 1 19 CYS H H -2.404 -2.213 1.720 1.00 . A A . 19 CYS H 1 1 3 1246 1 1 19 CYS HA H -0.500 -2.531 3.919 1.00 . A A . 19 CYS HA 1 1 3 1247 1 1 19 CYS HB2 H -2.838 -1.407 3.844 1.00 . A A . 19 CYS HB2 1 1 3 1248 1 1 19 CYS HB3 H -3.478 -3.048 3.964 1.00 . A A . 19 CYS HB3 1 1 3 1249 1 1 19 CYS N N -1.528 -2.491 2.061 1.00 . A A . 19 CYS N 1 1 3 1250 1 1 19 CYS O O -2.304 -5.146 3.180 1.00 . A A . 19 CYS O 1 1 3 1251 1 1 19 CYS SG S -2.346 -2.390 5.973 1.00 . A A . 19 CYS SG 1 1 3 1252 1 1 20 GLY C C -1.301 -7.101 4.797 1.00 . A A . 20 GLY C 1 1 3 1253 1 1 20 GLY CA C -0.130 -6.518 4.005 1.00 . A A . 20 GLY CA 1 1 3 1254 1 1 20 GLY H H 0.512 -4.472 4.205 1.00 . A A . 20 GLY H 1 1 3 1255 1 1 20 GLY HA2 H -0.138 -6.922 3.001 1.00 . A A . 20 GLY HA2 1 1 3 1256 1 1 20 GLY HA3 H 0.796 -6.784 4.494 1.00 . A A . 20 GLY HA3 1 1 3 1257 1 1 20 GLY N N -0.246 -5.033 3.939 1.00 . A A . 20 GLY N 1 1 3 1258 1 1 20 GLY O O -2.135 -6.384 5.315 1.00 . A A . 20 GLY O 1 1 3 1259 1 1 21 SER C C -2.255 -8.878 7.158 1.00 . A A . 21 SER C 1 1 3 1260 1 1 21 SER CA C -2.480 -9.042 5.653 1.00 . A A . 21 SER CA 1 1 3 1261 1 1 21 SER CB C -2.424 -10.518 5.263 1.00 . A A . 21 SER CB 1 1 3 1262 1 1 21 SER H H -0.682 -8.958 4.470 1.00 . A A . 21 SER H 1 1 3 1263 1 1 21 SER HA H -3.429 -8.619 5.363 1.00 . A A . 21 SER HA 1 1 3 1264 1 1 21 SER HB2 H -1.959 -10.619 4.297 1.00 . A A . 21 SER HB2 1 1 3 1265 1 1 21 SER HB3 H -1.843 -11.060 5.999 1.00 . A A . 21 SER HB3 1 1 3 1266 1 1 21 SER HG H -3.942 -11.443 6.054 1.00 . A A . 21 SER HG 1 1 3 1267 1 1 21 SER N N -1.367 -8.402 4.895 1.00 . A A . 21 SER N 1 1 3 1268 1 1 21 SER O O -3.112 -9.188 7.962 1.00 . A A . 21 SER O 1 1 3 1269 1 1 21 SER OG O -3.745 -11.040 5.204 1.00 . A A . 21 SER OG 1 1 3 1270 1 1 22 ASP C C -0.980 -6.728 9.372 1.00 . A A . 22 ASP C 1 1 3 1271 1 1 22 ASP CA C -0.828 -8.204 8.995 1.00 . A A . 22 ASP CA 1 1 3 1272 1 1 22 ASP CB C 0.619 -8.662 9.182 1.00 . A A . 22 ASP CB 1 1 3 1273 1 1 22 ASP CG C 0.636 -10.120 9.649 1.00 . A A . 22 ASP CG 1 1 3 1274 1 1 22 ASP H H -0.433 -8.146 6.878 1.00 . A A . 22 ASP H 1 1 3 1275 1 1 22 ASP HA H -1.489 -8.815 9.589 1.00 . A A . 22 ASP HA 1 1 3 1276 1 1 22 ASP HB2 H 1.147 -8.578 8.242 1.00 . A A . 22 ASP HB2 1 1 3 1277 1 1 22 ASP HB3 H 1.100 -8.042 9.926 1.00 . A A . 22 ASP HB3 1 1 3 1278 1 1 22 ASP N N -1.109 -8.391 7.544 1.00 . A A . 22 ASP N 1 1 3 1279 1 1 22 ASP O O -0.706 -6.330 10.487 1.00 . A A . 22 ASP O 1 1 3 1280 1 1 22 ASP OD1 O 0.138 -10.380 10.731 1.00 . A A . 22 ASP OD1 1 1 3 1281 1 1 22 ASP OD2 O 1.147 -10.949 8.915 1.00 . A A . 22 ASP OD2 1 1 3 1282 1 1 23 GLY C C -0.222 -3.793 8.886 1.00 . A A . 23 GLY C 1 1 3 1283 1 1 23 GLY CA C -1.591 -4.464 8.755 1.00 . A A . 23 GLY CA 1 1 3 1284 1 1 23 GLY H H -1.637 -6.256 7.558 1.00 . A A . 23 GLY H 1 1 3 1285 1 1 23 GLY HA2 H -2.148 -3.994 7.955 1.00 . A A . 23 GLY HA2 1 1 3 1286 1 1 23 GLY HA3 H -2.131 -4.356 9.684 1.00 . A A . 23 GLY HA3 1 1 3 1287 1 1 23 GLY N N -1.418 -5.914 8.450 1.00 . A A . 23 GLY N 1 1 3 1288 1 1 23 GLY O O 0.108 -2.886 8.149 1.00 . A A . 23 GLY O 1 1 3 1289 1 1 24 LYS C C 2.907 -4.148 8.969 1.00 . A A . 24 LYS C 1 1 3 1290 1 1 24 LYS CA C 1.920 -3.607 10.008 1.00 . A A . 24 LYS CA 1 1 3 1291 1 1 24 LYS CB C 2.352 -4.019 11.416 1.00 . A A . 24 LYS CB 1 1 3 1292 1 1 24 LYS CD C 3.063 -3.132 13.640 1.00 . A A . 24 LYS CD 1 1 3 1293 1 1 24 LYS CE C 1.718 -2.941 14.343 1.00 . A A . 24 LYS CE 1 1 3 1294 1 1 24 LYS CG C 2.914 -2.803 12.153 1.00 . A A . 24 LYS CG 1 1 3 1295 1 1 24 LYS H H 0.287 -4.957 10.412 1.00 . A A . 24 LYS H 1 1 3 1296 1 1 24 LYS HA H 1.853 -2.532 9.942 1.00 . A A . 24 LYS HA 1 1 3 1297 1 1 24 LYS HB2 H 1.499 -4.404 11.955 1.00 . A A . 24 LYS HB2 1 1 3 1298 1 1 24 LYS HB3 H 3.113 -4.781 11.352 1.00 . A A . 24 LYS HB3 1 1 3 1299 1 1 24 LYS HD2 H 3.386 -4.157 13.750 1.00 . A A . 24 LYS HD2 1 1 3 1300 1 1 24 LYS HD3 H 3.795 -2.473 14.083 1.00 . A A . 24 LYS HD3 1 1 3 1301 1 1 24 LYS HE2 H 0.905 -3.116 13.652 1.00 . A A . 24 LYS HE2 1 1 3 1302 1 1 24 LYS HE3 H 1.640 -3.601 15.193 1.00 . A A . 24 LYS HE3 1 1 3 1303 1 1 24 LYS HG2 H 3.880 -2.548 11.741 1.00 . A A . 24 LYS HG2 1 1 3 1304 1 1 24 LYS HG3 H 2.240 -1.967 12.037 1.00 . A A . 24 LYS HG3 1 1 3 1305 1 1 24 LYS HZ1 H 1.952 -0.903 13.995 1.00 . A A . 24 LYS HZ1 1 1 3 1306 1 1 24 LYS HZ2 H 2.430 -1.401 15.547 1.00 . A A . 24 LYS HZ2 1 1 3 1307 1 1 24 LYS HZ3 H 0.781 -1.274 15.163 1.00 . A A . 24 LYS HZ3 1 1 3 1308 1 1 24 LYS N N 0.574 -4.227 9.824 1.00 . A A . 24 LYS N 1 1 3 1309 1 1 24 LYS NZ N 1.721 -1.524 14.797 1.00 . A A . 24 LYS NZ 1 1 3 1310 1 1 24 LYS O O 3.999 -4.565 9.297 1.00 . A A . 24 LYS O 1 1 3 1311 1 1 25 SER C C 2.907 -4.282 5.278 1.00 . A A . 25 SER C 1 1 3 1312 1 1 25 SER CA C 3.449 -4.653 6.660 1.00 . A A . 25 SER CA 1 1 3 1313 1 1 25 SER CB C 3.458 -6.171 6.841 1.00 . A A . 25 SER CB 1 1 3 1314 1 1 25 SER H H 1.647 -3.799 7.475 1.00 . A A . 25 SER H 1 1 3 1315 1 1 25 SER HA H 4.443 -4.256 6.795 1.00 . A A . 25 SER HA 1 1 3 1316 1 1 25 SER HB2 H 2.446 -6.531 6.929 1.00 . A A . 25 SER HB2 1 1 3 1317 1 1 25 SER HB3 H 3.932 -6.633 5.983 1.00 . A A . 25 SER HB3 1 1 3 1318 1 1 25 SER HG H 5.089 -6.240 7.903 1.00 . A A . 25 SER HG 1 1 3 1319 1 1 25 SER N N 2.532 -4.142 7.719 1.00 . A A . 25 SER N 1 1 3 1320 1 1 25 SER O O 2.014 -4.922 4.764 1.00 . A A . 25 SER O 1 1 3 1321 1 1 25 SER OG O 4.173 -6.501 8.026 1.00 . A A . 25 SER OG 1 1 3 1322 1 1 26 ALA C C 4.018 -3.072 2.272 1.00 . A A . 26 ALA C 1 1 3 1323 1 1 26 ALA CA C 2.938 -2.848 3.329 1.00 . A A . 26 ALA CA 1 1 3 1324 1 1 26 ALA CB C 2.615 -1.358 3.454 1.00 . A A . 26 ALA CB 1 1 3 1325 1 1 26 ALA H H 4.156 -2.746 5.103 1.00 . A A . 26 ALA H 1 1 3 1326 1 1 26 ALA HA H 2.044 -3.397 3.079 1.00 . A A . 26 ALA HA 1 1 3 1327 1 1 26 ALA HB1 H 3.416 -0.858 3.977 1.00 . A A . 26 ALA HB1 1 1 3 1328 1 1 26 ALA HB2 H 1.693 -1.233 4.002 1.00 . A A . 26 ALA HB2 1 1 3 1329 1 1 26 ALA HB3 H 2.508 -0.930 2.468 1.00 . A A . 26 ALA HB3 1 1 3 1330 1 1 26 ALA N N 3.435 -3.253 4.674 1.00 . A A . 26 ALA N 1 1 3 1331 1 1 26 ALA O O 5.178 -3.254 2.582 1.00 . A A . 26 ALA O 1 1 3 1332 1 1 27 ALA C C 4.949 -1.934 -0.746 1.00 . A A . 27 ALA C 1 1 3 1333 1 1 27 ALA CA C 4.648 -3.264 -0.058 1.00 . A A . 27 ALA CA 1 1 3 1334 1 1 27 ALA CB C 3.984 -4.230 -1.038 1.00 . A A . 27 ALA CB 1 1 3 1335 1 1 27 ALA H H 2.703 -2.904 0.795 1.00 . A A . 27 ALA H 1 1 3 1336 1 1 27 ALA HA H 5.547 -3.698 0.342 1.00 . A A . 27 ALA HA 1 1 3 1337 1 1 27 ALA HB1 H 4.494 -5.180 -1.009 1.00 . A A . 27 ALA HB1 1 1 3 1338 1 1 27 ALA HB2 H 4.038 -3.822 -2.036 1.00 . A A . 27 ALA HB2 1 1 3 1339 1 1 27 ALA HB3 H 2.949 -4.367 -0.760 1.00 . A A . 27 ALA HB3 1 1 3 1340 1 1 27 ALA N N 3.644 -3.056 1.023 1.00 . A A . 27 ALA N 1 1 3 1341 1 1 27 ALA O O 6.081 -1.498 -0.816 1.00 . A A . 27 ALA O 1 1 3 1342 1 1 28 CYS C C 4.924 -0.155 -3.224 1.00 . A A . 28 CYS C 1 1 3 1343 1 1 28 CYS CA C 4.128 0.020 -1.929 1.00 . A A . 28 CYS CA 1 1 3 1344 1 1 28 CYS CB C 4.906 0.886 -0.934 1.00 . A A . 28 CYS CB 1 1 3 1345 1 1 28 CYS H H 3.036 -1.671 -1.167 1.00 . A A . 28 CYS H 1 1 3 1346 1 1 28 CYS HA H 3.172 0.471 -2.138 1.00 . A A . 28 CYS HA 1 1 3 1347 1 1 28 CYS HB2 H 5.935 0.570 -0.906 1.00 . A A . 28 CYS HB2 1 1 3 1348 1 1 28 CYS HB3 H 4.859 1.919 -1.248 1.00 . A A . 28 CYS HB3 1 1 3 1349 1 1 28 CYS N N 3.935 -1.291 -1.245 1.00 . A A . 28 CYS N 1 1 3 1350 1 1 28 CYS O O 5.866 -0.921 -3.289 1.00 . A A . 28 CYS O 1 1 3 1351 1 1 28 CYS SG S 4.178 0.726 0.717 1.00 . A A . 28 CYS SG 1 1 3 1352 1 1 29 THR C C 5.977 1.767 -5.883 1.00 . A A . 29 THR C 1 1 3 1353 1 1 29 THR CA C 5.288 0.440 -5.547 1.00 . A A . 29 THR CA 1 1 3 1354 1 1 29 THR CB C 4.218 0.115 -6.588 1.00 . A A . 29 THR CB 1 1 3 1355 1 1 29 THR CG2 C 3.225 1.276 -6.682 1.00 . A A . 29 THR CG2 1 1 3 1356 1 1 29 THR H H 3.791 1.168 -4.177 1.00 . A A . 29 THR H 1 1 3 1357 1 1 29 THR HA H 6.011 -0.359 -5.499 1.00 . A A . 29 THR HA 1 1 3 1358 1 1 29 THR HB H 3.691 -0.781 -6.298 1.00 . A A . 29 THR HB 1 1 3 1359 1 1 29 THR HG1 H 4.996 0.777 -8.244 1.00 . A A . 29 THR HG1 1 1 3 1360 1 1 29 THR HG21 H 2.217 0.893 -6.627 1.00 . A A . 29 THR HG21 1 1 3 1361 1 1 29 THR HG22 H 3.363 1.793 -7.621 1.00 . A A . 29 THR HG22 1 1 3 1362 1 1 29 THR HG23 H 3.395 1.961 -5.865 1.00 . A A . 29 THR HG23 1 1 3 1363 1 1 29 THR N N 4.553 0.556 -4.254 1.00 . A A . 29 THR N 1 1 3 1364 1 1 29 THR O O 5.437 2.597 -6.587 1.00 . A A . 29 THR O 1 1 3 1365 1 1 29 THR OG1 O 4.835 -0.084 -7.852 1.00 . A A . 29 THR OG1 1 1 3 1366 1 1 30 LEU C C 9.296 2.937 -6.204 1.00 . A A . 30 LEU C 1 1 3 1367 1 1 30 LEU CA C 7.891 3.242 -5.677 1.00 . A A . 30 LEU CA 1 1 3 1368 1 1 30 LEU CB C 7.967 3.978 -4.337 1.00 . A A . 30 LEU CB 1 1 3 1369 1 1 30 LEU CD1 C 9.213 3.689 -2.188 1.00 . A A . 30 LEU CD1 1 1 3 1370 1 1 30 LEU CD2 C 7.054 2.488 -2.554 1.00 . A A . 30 LEU CD2 1 1 3 1371 1 1 30 LEU CG C 8.333 2.991 -3.227 1.00 . A A . 30 LEU CG 1 1 3 1372 1 1 30 LEU H H 7.583 1.288 -4.821 1.00 . A A . 30 LEU H 1 1 3 1373 1 1 30 LEU HA H 7.341 3.833 -6.391 1.00 . A A . 30 LEU HA 1 1 3 1374 1 1 30 LEU HB2 H 8.719 4.752 -4.395 1.00 . A A . 30 LEU HB2 1 1 3 1375 1 1 30 LEU HB3 H 7.008 4.423 -4.117 1.00 . A A . 30 LEU HB3 1 1 3 1376 1 1 30 LEU HD11 H 8.982 4.743 -2.171 1.00 . A A . 30 LEU HD11 1 1 3 1377 1 1 30 LEU HD12 H 10.252 3.552 -2.447 1.00 . A A . 30 LEU HD12 1 1 3 1378 1 1 30 LEU HD13 H 9.026 3.262 -1.213 1.00 . A A . 30 LEU HD13 1 1 3 1379 1 1 30 LEU HD21 H 7.302 1.717 -1.839 1.00 . A A . 30 LEU HD21 1 1 3 1380 1 1 30 LEU HD22 H 6.389 2.085 -3.303 1.00 . A A . 30 LEU HD22 1 1 3 1381 1 1 30 LEU HD23 H 6.570 3.308 -2.045 1.00 . A A . 30 LEU HD23 1 1 3 1382 1 1 30 LEU HG H 8.872 2.156 -3.651 1.00 . A A . 30 LEU HG 1 1 3 1383 1 1 30 LEU N N 7.165 1.971 -5.385 1.00 . A A . 30 LEU N 1 1 3 1384 1 1 30 LEU O O 9.952 2.019 -5.752 1.00 . A A . 30 LEU O 1 1 3 1385 1 1 31 LYS C C 11.973 4.715 -7.623 1.00 . A A . 31 LYS C 1 1 3 1386 1 1 31 LYS CA C 11.122 3.445 -7.711 1.00 . A A . 31 LYS CA 1 1 3 1387 1 1 31 LYS CB C 10.886 3.058 -9.172 1.00 . A A . 31 LYS CB 1 1 3 1388 1 1 31 LYS CD C 11.265 0.606 -8.866 1.00 . A A . 31 LYS CD 1 1 3 1389 1 1 31 LYS CE C 9.968 0.159 -9.547 1.00 . A A . 31 LYS CE 1 1 3 1390 1 1 31 LYS CG C 11.787 1.876 -9.541 1.00 . A A . 31 LYS CG 1 1 3 1391 1 1 31 LYS H H 9.215 4.430 -7.509 1.00 . A A . 31 LYS H 1 1 3 1392 1 1 31 LYS HA H 11.599 2.632 -7.188 1.00 . A A . 31 LYS HA 1 1 3 1393 1 1 31 LYS HB2 H 9.852 2.780 -9.309 1.00 . A A . 31 LYS HB2 1 1 3 1394 1 1 31 LYS HB3 H 11.121 3.897 -9.809 1.00 . A A . 31 LYS HB3 1 1 3 1395 1 1 31 LYS HD2 H 12.006 -0.177 -8.952 1.00 . A A . 31 LYS HD2 1 1 3 1396 1 1 31 LYS HD3 H 11.071 0.806 -7.824 1.00 . A A . 31 LYS HD3 1 1 3 1397 1 1 31 LYS HE2 H 9.441 -0.547 -8.920 1.00 . A A . 31 LYS HE2 1 1 3 1398 1 1 31 LYS HE3 H 9.344 1.011 -9.763 1.00 . A A . 31 LYS HE3 1 1 3 1399 1 1 31 LYS HG2 H 11.783 1.742 -10.613 1.00 . A A . 31 LYS HG2 1 1 3 1400 1 1 31 LYS HG3 H 12.792 2.072 -9.205 1.00 . A A . 31 LYS HG3 1 1 3 1401 1 1 31 LYS HZ1 H 10.763 -1.445 -10.611 1.00 . A A . 31 LYS HZ1 1 1 3 1402 1 1 31 LYS HZ2 H 11.154 0.077 -11.257 1.00 . A A . 31 LYS HZ2 1 1 3 1403 1 1 31 LYS HZ3 H 9.594 -0.561 -11.463 1.00 . A A . 31 LYS HZ3 1 1 3 1404 1 1 31 LYS N N 9.761 3.696 -7.157 1.00 . A A . 31 LYS N 1 1 3 1405 1 1 31 LYS NZ N 10.403 -0.491 -10.815 1.00 . A A . 31 LYS NZ 1 1 3 1406 1 1 31 LYS O O 13.110 4.682 -7.197 1.00 . A A . 31 LYS O 1 1 3 1407 1 1 32 ALA C C 11.696 7.991 -6.829 1.00 . A A . 32 ALA C 1 1 3 1408 1 1 32 ALA CA C 12.213 7.104 -7.964 1.00 . A A . 32 ALA CA 1 1 3 1409 1 1 32 ALA CB C 11.983 7.774 -9.319 1.00 . A A . 32 ALA CB 1 1 3 1410 1 1 32 ALA H H 10.515 5.839 -8.366 1.00 . A A . 32 ALA H 1 1 3 1411 1 1 32 ALA HA H 13.262 6.895 -7.830 1.00 . A A . 32 ALA HA 1 1 3 1412 1 1 32 ALA HB1 H 11.618 8.778 -9.166 1.00 . A A . 32 ALA HB1 1 1 3 1413 1 1 32 ALA HB2 H 11.256 7.207 -9.882 1.00 . A A . 32 ALA HB2 1 1 3 1414 1 1 32 ALA HB3 H 12.913 7.809 -9.866 1.00 . A A . 32 ALA HB3 1 1 3 1415 1 1 32 ALA N N 11.433 5.834 -8.024 1.00 . A A . 32 ALA N 1 1 3 1416 1 1 32 ALA O O 12.265 8.045 -5.758 1.00 . A A . 32 ALA O 1 1 3 1417 1 1 33 CYS C C 11.091 10.617 -5.561 1.00 . A A . 33 CYS C 1 1 3 1418 1 1 33 CYS CA C 10.057 9.578 -6.003 1.00 . A A . 33 CYS CA 1 1 3 1419 1 1 33 CYS CB C 9.708 8.653 -4.839 1.00 . A A . 33 CYS CB 1 1 3 1420 1 1 33 CYS H H 10.180 8.628 -7.934 1.00 . A A . 33 CYS H 1 1 3 1421 1 1 33 CYS HA H 9.163 10.065 -6.359 1.00 . A A . 33 CYS HA 1 1 3 1422 1 1 33 CYS HB2 H 10.402 7.829 -4.797 1.00 . A A . 33 CYS HB2 1 1 3 1423 1 1 33 CYS HB3 H 9.749 9.215 -3.918 1.00 . A A . 33 CYS HB3 1 1 3 1424 1 1 33 CYS N N 10.620 8.688 -7.061 1.00 . A A . 33 CYS N 1 1 3 1425 1 1 33 CYS O O 12.266 10.490 -5.845 1.00 . A A . 33 CYS O 1 1 3 1426 1 1 33 CYS SG S 8.039 8.021 -5.059 1.00 . A A . 33 CYS SG 1 1 3 1427 1 1 34 PRO C C 12.243 12.237 -3.130 1.00 . A A . 34 PRO C 1 1 3 1428 1 1 34 PRO CA C 11.480 12.702 -4.372 1.00 . A A . 34 PRO CA 1 1 3 1429 1 1 34 PRO CB C 10.498 13.805 -4.004 1.00 . A A . 34 PRO CB 1 1 3 1430 1 1 34 PRO CD C 9.204 11.820 -4.508 1.00 . A A . 34 PRO CD 1 1 3 1431 1 1 34 PRO CG C 9.212 13.099 -3.713 1.00 . A A . 34 PRO CG 1 1 3 1432 1 1 34 PRO HA H 12.155 13.042 -5.140 1.00 . A A . 34 PRO HA 1 1 3 1433 1 1 34 PRO HB2 H 10.844 14.338 -3.128 1.00 . A A . 34 PRO HB2 1 1 3 1434 1 1 34 PRO HB3 H 10.367 14.484 -4.832 1.00 . A A . 34 PRO HB3 1 1 3 1435 1 1 34 PRO HD2 H 8.845 11.000 -3.899 1.00 . A A . 34 PRO HD2 1 1 3 1436 1 1 34 PRO HD3 H 8.599 11.928 -5.396 1.00 . A A . 34 PRO HD3 1 1 3 1437 1 1 34 PRO HG2 H 9.150 12.875 -2.657 1.00 . A A . 34 PRO HG2 1 1 3 1438 1 1 34 PRO HG3 H 8.379 13.715 -4.010 1.00 . A A . 34 PRO HG3 1 1 3 1439 1 1 34 PRO N N 10.606 11.615 -4.874 1.00 . A A . 34 PRO N 1 1 3 1440 1 1 34 PRO O O 12.118 12.811 -2.067 1.00 . A A . 34 PRO O 1 1 3 1441 1 1 35 GLN C C 12.831 10.274 -0.965 1.00 . A A . 35 GLN C 1 1 3 1442 1 1 35 GLN CA C 13.791 10.692 -2.081 1.00 . A A . 35 GLN CA 1 1 3 1443 1 1 35 GLN CB C 14.664 11.865 -1.626 1.00 . A A . 35 GLN CB 1 1 3 1444 1 1 35 GLN CD C 14.876 11.822 0.866 1.00 . A A . 35 GLN CD 1 1 3 1445 1 1 35 GLN CG C 15.543 11.422 -0.454 1.00 . A A . 35 GLN CG 1 1 3 1446 1 1 35 GLN H H 13.096 10.754 -4.122 1.00 . A A . 35 GLN H 1 1 3 1447 1 1 35 GLN HA H 14.413 9.861 -2.372 1.00 . A A . 35 GLN HA 1 1 3 1448 1 1 35 GLN HB2 H 15.290 12.186 -2.447 1.00 . A A . 35 GLN HB2 1 1 3 1449 1 1 35 GLN HB3 H 14.036 12.683 -1.312 1.00 . A A . 35 GLN HB3 1 1 3 1450 1 1 35 GLN HE21 H 16.505 12.698 1.590 1.00 . A A . 35 GLN HE21 1 1 3 1451 1 1 35 GLN HE22 H 15.148 12.730 2.610 1.00 . A A . 35 GLN HE22 1 1 3 1452 1 1 35 GLN HG2 H 15.670 10.350 -0.484 1.00 . A A . 35 GLN HG2 1 1 3 1453 1 1 35 GLN HG3 H 16.508 11.902 -0.527 1.00 . A A . 35 GLN HG3 1 1 3 1454 1 1 35 GLN N N 13.022 11.202 -3.255 1.00 . A A . 35 GLN N 1 1 3 1455 1 1 35 GLN NE2 N 15.567 12.470 1.763 1.00 . A A . 35 GLN NE2 1 1 3 1456 1 1 35 GLN O O 13.259 9.550 -0.082 1.00 . A A . 35 GLN O 1 1 3 1457 1 1 35 GLN OXT O 11.684 10.686 -1.013 1.00 . A A . 35 GLN OXT 1 1 3 1458 1 1 35 GLN OE1 O 13.716 11.539 1.083 1.00 . A A . 35 GLN OE1 1 1 4 1459 1 1 1 GLU C C 4.993 1.623 9.182 1.00 . A A . 1 GLU C 1 1 4 1460 1 1 1 GLU CA C 6.372 1.499 9.834 1.00 . A A . 1 GLU CA 1 1 4 1461 1 1 1 GLU CB C 7.324 2.559 9.280 1.00 . A A . 1 GLU CB 1 1 4 1462 1 1 1 GLU CD C 9.781 2.369 9.689 1.00 . A A . 1 GLU CD 1 1 4 1463 1 1 1 GLU CG C 8.445 2.814 10.288 1.00 . A A . 1 GLU CG 1 1 4 1464 1 1 1 GLU H1 H 7.982 0.178 9.817 1.00 . A A . 1 GLU H1 1 1 4 1465 1 1 1 GLU H2 H 6.985 0.073 8.446 1.00 . A A . 1 GLU H2 1 1 4 1466 1 1 1 GLU H3 H 6.469 -0.580 9.928 1.00 . A A . 1 GLU H3 1 1 4 1467 1 1 1 GLU HA H 6.293 1.600 10.905 1.00 . A A . 1 GLU HA 1 1 4 1468 1 1 1 GLU HB2 H 7.747 2.210 8.349 1.00 . A A . 1 GLU HB2 1 1 4 1469 1 1 1 GLU HB3 H 6.781 3.476 9.110 1.00 . A A . 1 GLU HB3 1 1 4 1470 1 1 1 GLU HG2 H 8.487 3.869 10.522 1.00 . A A . 1 GLU HG2 1 1 4 1471 1 1 1 GLU HG3 H 8.253 2.253 11.190 1.00 . A A . 1 GLU HG3 1 1 4 1472 1 1 1 GLU N N 7.000 0.194 9.479 1.00 . A A . 1 GLU N 1 1 4 1473 1 1 1 GLU O O 4.692 2.602 8.529 1.00 . A A . 1 GLU O 1 1 4 1474 1 1 1 GLU OE1 O 9.868 2.301 8.473 1.00 . A A . 1 GLU OE1 1 1 4 1475 1 1 1 GLU OE2 O 10.693 2.105 10.454 1.00 . A A . 1 GLU OE2 1 1 4 1476 1 1 2 VAL C C 1.716 0.703 9.824 1.00 . A A . 2 VAL C 1 1 4 1477 1 1 2 VAL CA C 2.796 0.711 8.738 1.00 . A A . 2 VAL CA 1 1 4 1478 1 1 2 VAL CB C 2.680 -0.538 7.865 1.00 . A A . 2 VAL CB 1 1 4 1479 1 1 2 VAL CG1 C 1.395 -0.464 7.039 1.00 . A A . 2 VAL CG1 1 1 4 1480 1 1 2 VAL CG2 C 3.879 -0.624 6.919 1.00 . A A . 2 VAL CG2 1 1 4 1481 1 1 2 VAL H H 4.412 -0.142 9.881 1.00 . A A . 2 VAL H 1 1 4 1482 1 1 2 VAL HA H 2.708 1.596 8.127 1.00 . A A . 2 VAL HA 1 1 4 1483 1 1 2 VAL HB H 2.651 -1.416 8.494 1.00 . A A . 2 VAL HB 1 1 4 1484 1 1 2 VAL HG11 H 1.101 0.568 6.924 1.00 . A A . 2 VAL HG11 1 1 4 1485 1 1 2 VAL HG12 H 0.612 -1.010 7.544 1.00 . A A . 2 VAL HG12 1 1 4 1486 1 1 2 VAL HG13 H 1.569 -0.901 6.067 1.00 . A A . 2 VAL HG13 1 1 4 1487 1 1 2 VAL HG21 H 3.719 0.031 6.075 1.00 . A A . 2 VAL HG21 1 1 4 1488 1 1 2 VAL HG22 H 3.987 -1.641 6.568 1.00 . A A . 2 VAL HG22 1 1 4 1489 1 1 2 VAL HG23 H 4.774 -0.327 7.443 1.00 . A A . 2 VAL HG23 1 1 4 1490 1 1 2 VAL N N 4.152 0.640 9.352 1.00 . A A . 2 VAL N 1 1 4 1491 1 1 2 VAL O O 1.983 0.458 10.984 1.00 . A A . 2 VAL O 1 1 4 1492 1 1 3 THR C C -1.952 1.041 9.689 1.00 . A A . 3 THR C 1 1 4 1493 1 1 3 THR CA C -0.619 0.975 10.436 1.00 . A A . 3 THR CA 1 1 4 1494 1 1 3 THR CB C -0.404 2.240 11.270 1.00 . A A . 3 THR CB 1 1 4 1495 1 1 3 THR CG2 C -0.310 3.453 10.343 1.00 . A A . 3 THR CG2 1 1 4 1496 1 1 3 THR H H 0.308 1.160 8.504 1.00 . A A . 3 THR H 1 1 4 1497 1 1 3 THR HA H -0.577 0.100 11.066 1.00 . A A . 3 THR HA 1 1 4 1498 1 1 3 THR HB H 0.512 2.150 11.832 1.00 . A A . 3 THR HB 1 1 4 1499 1 1 3 THR HG1 H -1.155 2.785 12.979 1.00 . A A . 3 THR HG1 1 1 4 1500 1 1 3 THR HG21 H 0.292 3.201 9.483 1.00 . A A . 3 THR HG21 1 1 4 1501 1 1 3 THR HG22 H 0.146 4.276 10.873 1.00 . A A . 3 THR HG22 1 1 4 1502 1 1 3 THR HG23 H -1.300 3.737 10.021 1.00 . A A . 3 THR HG23 1 1 4 1503 1 1 3 THR N N 0.496 0.967 9.447 1.00 . A A . 3 THR N 1 1 4 1504 1 1 3 THR O O -2.609 2.063 9.657 1.00 . A A . 3 THR O 1 1 4 1505 1 1 3 THR OG1 O -1.495 2.406 12.165 1.00 . A A . 3 THR OG1 1 1 4 1506 1 1 4 CYS C C -4.267 -1.422 8.322 1.00 . A A . 4 CYS C 1 1 4 1507 1 1 4 CYS CA C -3.625 -0.033 8.306 1.00 . A A . 4 CYS CA 1 1 4 1508 1 1 4 CYS CB C -3.219 0.344 6.879 1.00 . A A . 4 CYS CB 1 1 4 1509 1 1 4 CYS H H -1.794 -0.847 9.096 1.00 . A A . 4 CYS H 1 1 4 1510 1 1 4 CYS HA H -4.303 0.705 8.703 1.00 . A A . 4 CYS HA 1 1 4 1511 1 1 4 CYS HB2 H -4.053 0.186 6.211 1.00 . A A . 4 CYS HB2 1 1 4 1512 1 1 4 CYS HB3 H -2.923 1.384 6.851 1.00 . A A . 4 CYS HB3 1 1 4 1513 1 1 4 CYS N N -2.346 -0.038 9.069 1.00 . A A . 4 CYS N 1 1 4 1514 1 1 4 CYS O O -3.723 -2.364 8.863 1.00 . A A . 4 CYS O 1 1 4 1515 1 1 4 CYS SG S -1.826 -0.693 6.358 1.00 . A A . 4 CYS SG 1 1 4 1516 1 1 5 GLU C C -5.620 -3.666 6.460 1.00 . A A . 5 GLU C 1 1 4 1517 1 1 5 GLU CA C -6.089 -2.885 7.689 1.00 . A A . 5 GLU CA 1 1 4 1518 1 1 5 GLU CB C -7.582 -2.574 7.590 1.00 . A A . 5 GLU CB 1 1 4 1519 1 1 5 GLU CD C -7.568 -2.086 10.040 1.00 . A A . 5 GLU CD 1 1 4 1520 1 1 5 GLU CG C -8.255 -2.882 8.929 1.00 . A A . 5 GLU CG 1 1 4 1521 1 1 5 GLU H H -5.835 -0.787 7.284 1.00 . A A . 5 GLU H 1 1 4 1522 1 1 5 GLU HA H -5.885 -3.437 8.592 1.00 . A A . 5 GLU HA 1 1 4 1523 1 1 5 GLU HB2 H -7.716 -1.529 7.351 1.00 . A A . 5 GLU HB2 1 1 4 1524 1 1 5 GLU HB3 H -8.027 -3.181 6.817 1.00 . A A . 5 GLU HB3 1 1 4 1525 1 1 5 GLU HG2 H -9.298 -2.607 8.878 1.00 . A A . 5 GLU HG2 1 1 4 1526 1 1 5 GLU HG3 H -8.170 -3.938 9.140 1.00 . A A . 5 GLU HG3 1 1 4 1527 1 1 5 GLU N N -5.417 -1.557 7.722 1.00 . A A . 5 GLU N 1 1 4 1528 1 1 5 GLU O O -5.270 -3.084 5.454 1.00 . A A . 5 GLU O 1 1 4 1529 1 1 5 GLU OE1 O -7.876 -0.914 10.180 1.00 . A A . 5 GLU OE1 1 1 4 1530 1 1 5 GLU OE2 O -6.746 -2.663 10.732 1.00 . A A . 5 GLU OE2 1 1 4 1531 1 1 6 PRO C C -6.219 -5.800 4.327 1.00 . A A . 6 PRO C 1 1 4 1532 1 1 6 PRO CA C -5.188 -5.830 5.460 1.00 . A A . 6 PRO CA 1 1 4 1533 1 1 6 PRO CB C -5.103 -7.217 6.093 1.00 . A A . 6 PRO CB 1 1 4 1534 1 1 6 PRO CD C -6.037 -5.740 7.756 1.00 . A A . 6 PRO CD 1 1 4 1535 1 1 6 PRO CG C -6.030 -7.165 7.265 1.00 . A A . 6 PRO CG 1 1 4 1536 1 1 6 PRO HA H -4.218 -5.528 5.101 1.00 . A A . 6 PRO HA 1 1 4 1537 1 1 6 PRO HB2 H -5.423 -7.971 5.388 1.00 . A A . 6 PRO HB2 1 1 4 1538 1 1 6 PRO HB3 H -4.096 -7.416 6.428 1.00 . A A . 6 PRO HB3 1 1 4 1539 1 1 6 PRO HD2 H -7.032 -5.455 8.075 1.00 . A A . 6 PRO HD2 1 1 4 1540 1 1 6 PRO HD3 H -5.325 -5.608 8.558 1.00 . A A . 6 PRO HD3 1 1 4 1541 1 1 6 PRO HG2 H -7.024 -7.457 6.959 1.00 . A A . 6 PRO HG2 1 1 4 1542 1 1 6 PRO HG3 H -5.677 -7.817 8.048 1.00 . A A . 6 PRO HG3 1 1 4 1543 1 1 6 PRO N N -5.626 -4.964 6.582 1.00 . A A . 6 PRO N 1 1 4 1544 1 1 6 PRO O O -7.258 -6.426 4.399 1.00 . A A . 6 PRO O 1 1 4 1545 1 1 7 GLY C C -7.437 -3.564 2.024 1.00 . A A . 7 GLY C 1 1 4 1546 1 1 7 GLY CA C -6.898 -4.992 2.140 1.00 . A A . 7 GLY CA 1 1 4 1547 1 1 7 GLY H H -5.094 -4.571 3.243 1.00 . A A . 7 GLY H 1 1 4 1548 1 1 7 GLY HA2 H -6.390 -5.261 1.223 1.00 . A A . 7 GLY HA2 1 1 4 1549 1 1 7 GLY HA3 H -7.718 -5.671 2.313 1.00 . A A . 7 GLY HA3 1 1 4 1550 1 1 7 GLY N N -5.938 -5.070 3.280 1.00 . A A . 7 GLY N 1 1 4 1551 1 1 7 GLY O O -8.627 -3.348 1.903 1.00 . A A . 7 GLY O 1 1 4 1552 1 1 8 THR C C -5.992 -0.310 1.241 1.00 . A A . 8 THR C 1 1 4 1553 1 1 8 THR CA C -7.037 -1.171 1.959 1.00 . A A . 8 THR CA 1 1 4 1554 1 1 8 THR CB C -7.210 -0.704 3.405 1.00 . A A . 8 THR CB 1 1 4 1555 1 1 8 THR CG2 C -7.555 0.786 3.424 1.00 . A A . 8 THR CG2 1 1 4 1556 1 1 8 THR H H -5.618 -2.784 2.163 1.00 . A A . 8 THR H 1 1 4 1557 1 1 8 THR HA H -7.980 -1.124 1.442 1.00 . A A . 8 THR HA 1 1 4 1558 1 1 8 THR HB H -6.292 -0.864 3.947 1.00 . A A . 8 THR HB 1 1 4 1559 1 1 8 THR HG1 H -7.876 -1.970 4.721 1.00 . A A . 8 THR HG1 1 1 4 1560 1 1 8 THR HG21 H -8.430 0.961 2.815 1.00 . A A . 8 THR HG21 1 1 4 1561 1 1 8 THR HG22 H -6.724 1.353 3.033 1.00 . A A . 8 THR HG22 1 1 4 1562 1 1 8 THR HG23 H -7.756 1.095 4.440 1.00 . A A . 8 THR HG23 1 1 4 1563 1 1 8 THR N N -6.571 -2.587 2.064 1.00 . A A . 8 THR N 1 1 4 1564 1 1 8 THR O O -6.330 0.610 0.524 1.00 . A A . 8 THR O 1 1 4 1565 1 1 8 THR OG1 O -8.257 -1.444 4.015 1.00 . A A . 8 THR OG1 1 1 4 1566 1 1 9 THR C C -3.960 1.690 0.827 1.00 . A A . 9 THR C 1 1 4 1567 1 1 9 THR CA C -3.649 0.190 0.776 1.00 . A A . 9 THR CA 1 1 4 1568 1 1 9 THR CB C -3.595 -0.315 -0.672 1.00 . A A . 9 THR CB 1 1 4 1569 1 1 9 THR CG2 C -4.821 0.163 -1.449 1.00 . A A . 9 THR CG2 1 1 4 1570 1 1 9 THR H H -4.495 -1.347 2.024 1.00 . A A . 9 THR H 1 1 4 1571 1 1 9 THR HA H -2.704 -0.004 1.261 1.00 . A A . 9 THR HA 1 1 4 1572 1 1 9 THR HB H -3.574 -1.395 -0.674 1.00 . A A . 9 THR HB 1 1 4 1573 1 1 9 THR HG1 H -1.783 0.389 -0.615 1.00 . A A . 9 THR HG1 1 1 4 1574 1 1 9 THR HG21 H -5.053 1.179 -1.170 1.00 . A A . 9 THR HG21 1 1 4 1575 1 1 9 THR HG22 H -5.663 -0.474 -1.221 1.00 . A A . 9 THR HG22 1 1 4 1576 1 1 9 THR HG23 H -4.615 0.120 -2.510 1.00 . A A . 9 THR HG23 1 1 4 1577 1 1 9 THR N N -4.733 -0.603 1.435 1.00 . A A . 9 THR N 1 1 4 1578 1 1 9 THR O O -4.889 2.124 1.479 1.00 . A A . 9 THR O 1 1 4 1579 1 1 9 THR OG1 O -2.420 0.178 -1.301 1.00 . A A . 9 THR OG1 1 1 4 1580 1 1 10 PHE C C -2.292 4.692 -0.564 1.00 . A A . 10 PHE C 1 1 4 1581 1 1 10 PHE CA C -3.419 3.962 0.171 1.00 . A A . 10 PHE CA 1 1 4 1582 1 1 10 PHE CB C -3.446 4.359 1.652 1.00 . A A . 10 PHE CB 1 1 4 1583 1 1 10 PHE CD1 C -1.039 4.040 2.348 1.00 . A A . 10 PHE CD1 1 1 4 1584 1 1 10 PHE CD2 C -2.711 2.501 3.191 1.00 . A A . 10 PHE CD2 1 1 4 1585 1 1 10 PHE CE1 C -0.047 3.352 3.058 1.00 . A A . 10 PHE CE1 1 1 4 1586 1 1 10 PHE CE2 C -1.721 1.813 3.900 1.00 . A A . 10 PHE CE2 1 1 4 1587 1 1 10 PHE CG C -2.371 3.615 2.414 1.00 . A A . 10 PHE CG 1 1 4 1588 1 1 10 PHE CZ C -0.388 2.238 3.834 1.00 . A A . 10 PHE CZ 1 1 4 1589 1 1 10 PHE H H -2.425 2.122 -0.356 1.00 . A A . 10 PHE H 1 1 4 1590 1 1 10 PHE HA H -4.370 4.189 -0.284 1.00 . A A . 10 PHE HA 1 1 4 1591 1 1 10 PHE HB2 H -3.274 5.422 1.741 1.00 . A A . 10 PHE HB2 1 1 4 1592 1 1 10 PHE HB3 H -4.411 4.117 2.070 1.00 . A A . 10 PHE HB3 1 1 4 1593 1 1 10 PHE HD1 H -0.775 4.900 1.748 1.00 . A A . 10 PHE HD1 1 1 4 1594 1 1 10 PHE HD2 H -3.738 2.172 3.242 1.00 . A A . 10 PHE HD2 1 1 4 1595 1 1 10 PHE HE1 H 0.981 3.680 3.008 1.00 . A A . 10 PHE HE1 1 1 4 1596 1 1 10 PHE HE2 H -1.984 0.955 4.495 1.00 . A A . 10 PHE HE2 1 1 4 1597 1 1 10 PHE HZ H 0.374 1.705 4.384 1.00 . A A . 10 PHE HZ 1 1 4 1598 1 1 10 PHE N N -3.177 2.489 0.155 1.00 . A A . 10 PHE N 1 1 4 1599 1 1 10 PHE O O -1.478 4.083 -1.229 1.00 . A A . 10 PHE O 1 1 4 1600 1 1 11 LYS C C -0.089 7.205 -0.176 1.00 . A A . 11 LYS C 1 1 4 1601 1 1 11 LYS CA C -1.169 6.754 -1.163 1.00 . A A . 11 LYS CA 1 1 4 1602 1 1 11 LYS CB C -1.876 7.964 -1.773 1.00 . A A . 11 LYS CB 1 1 4 1603 1 1 11 LYS CD C -3.147 8.379 -3.885 1.00 . A A . 11 LYS CD 1 1 4 1604 1 1 11 LYS CE C -3.340 7.802 -5.290 1.00 . A A . 11 LYS CE 1 1 4 1605 1 1 11 LYS CG C -1.829 7.868 -3.300 1.00 . A A . 11 LYS CG 1 1 4 1606 1 1 11 LYS H H -2.910 6.468 0.078 1.00 . A A . 11 LYS H 1 1 4 1607 1 1 11 LYS HA H -0.734 6.152 -1.945 1.00 . A A . 11 LYS HA 1 1 4 1608 1 1 11 LYS HB2 H -2.906 7.984 -1.445 1.00 . A A . 11 LYS HB2 1 1 4 1609 1 1 11 LYS HB3 H -1.380 8.869 -1.457 1.00 . A A . 11 LYS HB3 1 1 4 1610 1 1 11 LYS HD2 H -3.966 8.068 -3.252 1.00 . A A . 11 LYS HD2 1 1 4 1611 1 1 11 LYS HD3 H -3.123 9.456 -3.940 1.00 . A A . 11 LYS HD3 1 1 4 1612 1 1 11 LYS HE2 H -2.769 6.891 -5.403 1.00 . A A . 11 LYS HE2 1 1 4 1613 1 1 11 LYS HE3 H -4.386 7.619 -5.482 1.00 . A A . 11 LYS HE3 1 1 4 1614 1 1 11 LYS HG2 H -1.012 8.468 -3.672 1.00 . A A . 11 LYS HG2 1 1 4 1615 1 1 11 LYS HG3 H -1.682 6.838 -3.591 1.00 . A A . 11 LYS HG3 1 1 4 1616 1 1 11 LYS HZ1 H -2.961 8.551 -7.196 1.00 . A A . 11 LYS HZ1 1 1 4 1617 1 1 11 LYS HZ2 H -1.817 9.015 -6.029 1.00 . A A . 11 LYS HZ2 1 1 4 1618 1 1 11 LYS HZ3 H -3.353 9.740 -6.052 1.00 . A A . 11 LYS HZ3 1 1 4 1619 1 1 11 LYS N N -2.241 5.992 -0.459 1.00 . A A . 11 LYS N 1 1 4 1620 1 1 11 LYS NZ N -2.829 8.856 -6.211 1.00 . A A . 11 LYS NZ 1 1 4 1621 1 1 11 LYS O O -0.323 8.032 0.683 1.00 . A A . 11 LYS O 1 1 4 1622 1 1 12 ASP C C 3.377 7.608 -0.195 1.00 . A A . 12 ASP C 1 1 4 1623 1 1 12 ASP CA C 2.198 7.070 0.620 1.00 . A A . 12 ASP CA 1 1 4 1624 1 1 12 ASP CB C 2.588 5.786 1.353 1.00 . A A . 12 ASP CB 1 1 4 1625 1 1 12 ASP CG C 2.683 6.062 2.855 1.00 . A A . 12 ASP CG 1 1 4 1626 1 1 12 ASP H H 1.261 6.011 -1.004 1.00 . A A . 12 ASP H 1 1 4 1627 1 1 12 ASP HA H 1.856 7.811 1.325 1.00 . A A . 12 ASP HA 1 1 4 1628 1 1 12 ASP HB2 H 1.839 5.028 1.172 1.00 . A A . 12 ASP HB2 1 1 4 1629 1 1 12 ASP HB3 H 3.548 5.442 0.992 1.00 . A A . 12 ASP HB3 1 1 4 1630 1 1 12 ASP N N 1.095 6.671 -0.300 1.00 . A A . 12 ASP N 1 1 4 1631 1 1 12 ASP O O 3.644 7.144 -1.285 1.00 . A A . 12 ASP O 1 1 4 1632 1 1 12 ASP OD1 O 2.237 7.118 3.274 1.00 . A A . 12 ASP OD1 1 1 4 1633 1 1 12 ASP OD2 O 3.198 5.212 3.563 1.00 . A A . 12 ASP OD2 1 1 4 1634 1 1 13 LYS C C 4.925 9.235 -1.921 1.00 . A A . 13 LYS C 1 1 4 1635 1 1 13 LYS CA C 5.235 9.171 -0.421 1.00 . A A . 13 LYS CA 1 1 4 1636 1 1 13 LYS CB C 6.408 8.234 -0.137 1.00 . A A . 13 LYS CB 1 1 4 1637 1 1 13 LYS CD C 7.392 6.017 -0.717 1.00 . A A . 13 LYS CD 1 1 4 1638 1 1 13 LYS CE C 7.273 4.904 -1.760 1.00 . A A . 13 LYS CE 1 1 4 1639 1 1 13 LYS CG C 6.111 6.854 -0.710 1.00 . A A . 13 LYS CG 1 1 4 1640 1 1 13 LYS H H 3.832 8.946 1.202 1.00 . A A . 13 LYS H 1 1 4 1641 1 1 13 LYS HA H 5.458 10.153 -0.049 1.00 . A A . 13 LYS HA 1 1 4 1642 1 1 13 LYS HB2 H 7.303 8.630 -0.597 1.00 . A A . 13 LYS HB2 1 1 4 1643 1 1 13 LYS HB3 H 6.554 8.155 0.932 1.00 . A A . 13 LYS HB3 1 1 4 1644 1 1 13 LYS HD2 H 8.233 6.651 -0.958 1.00 . A A . 13 LYS HD2 1 1 4 1645 1 1 13 LYS HD3 H 7.540 5.579 0.259 1.00 . A A . 13 LYS HD3 1 1 4 1646 1 1 13 LYS HE2 H 6.240 4.607 -1.875 1.00 . A A . 13 LYS HE2 1 1 4 1647 1 1 13 LYS HE3 H 7.682 5.228 -2.705 1.00 . A A . 13 LYS HE3 1 1 4 1648 1 1 13 LYS HG2 H 5.361 6.365 -0.102 1.00 . A A . 13 LYS HG2 1 1 4 1649 1 1 13 LYS HG3 H 5.743 6.962 -1.716 1.00 . A A . 13 LYS HG3 1 1 4 1650 1 1 13 LYS HZ1 H 9.033 4.122 -0.965 1.00 . A A . 13 LYS HZ1 1 1 4 1651 1 1 13 LYS HZ2 H 8.160 3.028 -1.929 1.00 . A A . 13 LYS HZ2 1 1 4 1652 1 1 13 LYS HZ3 H 7.621 3.402 -0.362 1.00 . A A . 13 LYS HZ3 1 1 4 1653 1 1 13 LYS N N 4.075 8.588 0.323 1.00 . A A . 13 LYS N 1 1 4 1654 1 1 13 LYS NZ N 8.082 3.779 -1.213 1.00 . A A . 13 LYS NZ 1 1 4 1655 1 1 13 LYS O O 3.791 9.418 -2.317 1.00 . A A . 13 LYS O 1 1 4 1656 1 1 14 CYS C C 5.120 7.814 -4.753 1.00 . A A . 14 CYS C 1 1 4 1657 1 1 14 CYS CA C 5.647 9.159 -4.229 1.00 . A A . 14 CYS CA 1 1 4 1658 1 1 14 CYS CB C 7.000 9.492 -4.862 1.00 . A A . 14 CYS CB 1 1 4 1659 1 1 14 CYS H H 6.830 8.953 -2.435 1.00 . A A . 14 CYS H 1 1 4 1660 1 1 14 CYS HA H 4.941 9.945 -4.443 1.00 . A A . 14 CYS HA 1 1 4 1661 1 1 14 CYS HB2 H 6.844 9.833 -5.876 1.00 . A A . 14 CYS HB2 1 1 4 1662 1 1 14 CYS HB3 H 7.482 10.272 -4.288 1.00 . A A . 14 CYS HB3 1 1 4 1663 1 1 14 CYS N N 5.914 9.093 -2.762 1.00 . A A . 14 CYS N 1 1 4 1664 1 1 14 CYS O O 5.487 7.375 -5.825 1.00 . A A . 14 CYS O 1 1 4 1665 1 1 14 CYS SG S 8.053 8.016 -4.878 1.00 . A A . 14 CYS SG 1 1 4 1666 1 1 15 ASN C C 2.626 5.351 -3.561 1.00 . A A . 15 ASN C 1 1 4 1667 1 1 15 ASN CA C 3.730 5.850 -4.495 1.00 . A A . 15 ASN CA 1 1 4 1668 1 1 15 ASN CB C 4.925 4.894 -4.474 1.00 . A A . 15 ASN CB 1 1 4 1669 1 1 15 ASN CG C 5.524 4.797 -5.879 1.00 . A A . 15 ASN CG 1 1 4 1670 1 1 15 ASN H H 3.975 7.520 -3.156 1.00 . A A . 15 ASN H 1 1 4 1671 1 1 15 ASN HA H 3.355 5.945 -5.502 1.00 . A A . 15 ASN HA 1 1 4 1672 1 1 15 ASN HB2 H 5.671 5.264 -3.787 1.00 . A A . 15 ASN HB2 1 1 4 1673 1 1 15 ASN HB3 H 4.597 3.915 -4.157 1.00 . A A . 15 ASN HB3 1 1 4 1674 1 1 15 ASN HD21 H 7.375 5.187 -5.268 1.00 . A A . 15 ASN HD21 1 1 4 1675 1 1 15 ASN HD22 H 7.197 4.925 -6.944 1.00 . A A . 15 ASN HD22 1 1 4 1676 1 1 15 ASN N N 4.266 7.156 -4.016 1.00 . A A . 15 ASN N 1 1 4 1677 1 1 15 ASN ND2 N 6.804 4.985 -6.044 1.00 . A A . 15 ASN ND2 1 1 4 1678 1 1 15 ASN O O 2.091 6.094 -2.763 1.00 . A A . 15 ASN O 1 1 4 1679 1 1 15 ASN OD1 O 4.818 4.547 -6.837 1.00 . A A . 15 ASN OD1 1 1 4 1680 1 1 16 THR C C 1.771 2.393 -1.941 1.00 . A A . 16 THR C 1 1 4 1681 1 1 16 THR CA C 1.212 3.544 -2.783 1.00 . A A . 16 THR CA 1 1 4 1682 1 1 16 THR CB C 0.123 3.063 -3.760 1.00 . A A . 16 THR CB 1 1 4 1683 1 1 16 THR CG2 C -0.508 1.752 -3.275 1.00 . A A . 16 THR CG2 1 1 4 1684 1 1 16 THR H H 2.727 3.516 -4.311 1.00 . A A . 16 THR H 1 1 4 1685 1 1 16 THR HA H 0.814 4.314 -2.139 1.00 . A A . 16 THR HA 1 1 4 1686 1 1 16 THR HB H 0.564 2.904 -4.733 1.00 . A A . 16 THR HB 1 1 4 1687 1 1 16 THR HG1 H -1.718 3.620 -4.049 1.00 . A A . 16 THR HG1 1 1 4 1688 1 1 16 THR HG21 H -0.971 1.911 -2.312 1.00 . A A . 16 THR HG21 1 1 4 1689 1 1 16 THR HG22 H 0.258 0.997 -3.186 1.00 . A A . 16 THR HG22 1 1 4 1690 1 1 16 THR HG23 H -1.254 1.428 -3.985 1.00 . A A . 16 THR HG23 1 1 4 1691 1 1 16 THR N N 2.281 4.097 -3.659 1.00 . A A . 16 THR N 1 1 4 1692 1 1 16 THR O O 2.874 1.932 -2.155 1.00 . A A . 16 THR O 1 1 4 1693 1 1 16 THR OG1 O -0.885 4.059 -3.862 1.00 . A A . 16 THR OG1 1 1 4 1694 1 1 17 CYS C C 0.344 -0.137 0.205 1.00 . A A . 17 CYS C 1 1 4 1695 1 1 17 CYS CA C 1.498 0.817 -0.127 1.00 . A A . 17 CYS CA 1 1 4 1696 1 1 17 CYS CB C 2.018 1.501 1.136 1.00 . A A . 17 CYS CB 1 1 4 1697 1 1 17 CYS H H 0.129 2.321 -0.831 1.00 . A A . 17 CYS H 1 1 4 1698 1 1 17 CYS HA H 2.299 0.289 -0.614 1.00 . A A . 17 CYS HA 1 1 4 1699 1 1 17 CYS HB2 H 2.135 2.559 0.948 1.00 . A A . 17 CYS HB2 1 1 4 1700 1 1 17 CYS HB3 H 1.312 1.354 1.940 1.00 . A A . 17 CYS HB3 1 1 4 1701 1 1 17 CYS N N 1.015 1.931 -0.986 1.00 . A A . 17 CYS N 1 1 4 1702 1 1 17 CYS O O -0.539 0.187 0.973 1.00 . A A . 17 CYS O 1 1 4 1703 1 1 17 CYS SG S 3.618 0.790 1.593 1.00 . A A . 17 CYS SG 1 1 4 1704 1 1 18 ARG C C -0.640 -2.832 1.323 1.00 . A A . 18 ARG C 1 1 4 1705 1 1 18 ARG CA C -0.757 -2.279 -0.100 1.00 . A A . 18 ARG CA 1 1 4 1706 1 1 18 ARG CB C -0.568 -3.398 -1.125 1.00 . A A . 18 ARG CB 1 1 4 1707 1 1 18 ARG CD C -2.953 -4.145 -1.036 1.00 . A A . 18 ARG CD 1 1 4 1708 1 1 18 ARG CG C -1.502 -4.564 -0.792 1.00 . A A . 18 ARG CG 1 1 4 1709 1 1 18 ARG CZ C -2.859 -4.631 -3.406 1.00 . A A . 18 ARG CZ 1 1 4 1710 1 1 18 ARG H H 1.062 -1.548 -0.996 1.00 . A A . 18 ARG H 1 1 4 1711 1 1 18 ARG HA H -1.718 -1.809 -0.242 1.00 . A A . 18 ARG HA 1 1 4 1712 1 1 18 ARG HB2 H -0.796 -3.024 -2.113 1.00 . A A . 18 ARG HB2 1 1 4 1713 1 1 18 ARG HB3 H 0.456 -3.742 -1.098 1.00 . A A . 18 ARG HB3 1 1 4 1714 1 1 18 ARG HD2 H -3.567 -4.408 -0.185 1.00 . A A . 18 ARG HD2 1 1 4 1715 1 1 18 ARG HD3 H -3.010 -3.086 -1.230 1.00 . A A . 18 ARG HD3 1 1 4 1716 1 1 18 ARG HE H -4.050 -5.617 -2.162 1.00 . A A . 18 ARG HE 1 1 4 1717 1 1 18 ARG HG2 H -1.259 -5.410 -1.419 1.00 . A A . 18 ARG HG2 1 1 4 1718 1 1 18 ARG HG3 H -1.379 -4.840 0.245 1.00 . A A . 18 ARG HG3 1 1 4 1719 1 1 18 ARG HH11 H -3.267 -2.675 -3.292 1.00 . A A . 18 ARG HH11 1 1 4 1720 1 1 18 ARG HH12 H -2.465 -3.190 -4.739 1.00 . A A . 18 ARG HH12 1 1 4 1721 1 1 18 ARG HH21 H -2.331 -6.523 -3.793 1.00 . A A . 18 ARG HH21 1 1 4 1722 1 1 18 ARG HH22 H -1.934 -5.370 -5.021 1.00 . A A . 18 ARG HH22 1 1 4 1723 1 1 18 ARG N N 0.343 -1.308 -0.375 1.00 . A A . 18 ARG N 1 1 4 1724 1 1 18 ARG NE N -3.378 -4.909 -2.242 1.00 . A A . 18 ARG NE 1 1 4 1725 1 1 18 ARG NH1 N -2.864 -3.403 -3.847 1.00 . A A . 18 ARG NH1 1 1 4 1726 1 1 18 ARG NH2 N -2.334 -5.582 -4.130 1.00 . A A . 18 ARG NH2 1 1 4 1727 1 1 18 ARG O O 0.284 -3.553 1.646 1.00 . A A . 18 ARG O 1 1 4 1728 1 1 19 CYS C C -1.400 -4.547 3.563 1.00 . A A . 19 CYS C 1 1 4 1729 1 1 19 CYS CA C -1.516 -3.020 3.575 1.00 . A A . 19 CYS CA 1 1 4 1730 1 1 19 CYS CB C -2.836 -2.583 4.212 1.00 . A A . 19 CYS CB 1 1 4 1731 1 1 19 CYS H H -2.313 -1.928 1.896 1.00 . A A . 19 CYS H 1 1 4 1732 1 1 19 CYS HA H -0.686 -2.582 4.105 1.00 . A A . 19 CYS HA 1 1 4 1733 1 1 19 CYS HB2 H -3.110 -1.606 3.838 1.00 . A A . 19 CYS HB2 1 1 4 1734 1 1 19 CYS HB3 H -3.609 -3.296 3.962 1.00 . A A . 19 CYS HB3 1 1 4 1735 1 1 19 CYS N N -1.574 -2.506 2.176 1.00 . A A . 19 CYS N 1 1 4 1736 1 1 19 CYS O O -2.196 -5.236 2.957 1.00 . A A . 19 CYS O 1 1 4 1737 1 1 19 CYS SG S -2.648 -2.506 6.013 1.00 . A A . 19 CYS SG 1 1 4 1738 1 1 20 GLY C C -1.463 -7.216 4.878 1.00 . A A . 20 GLY C 1 1 4 1739 1 1 20 GLY CA C -0.236 -6.562 4.242 1.00 . A A . 20 GLY CA 1 1 4 1740 1 1 20 GLY H H 0.227 -4.507 4.700 1.00 . A A . 20 GLY H 1 1 4 1741 1 1 20 GLY HA2 H -0.119 -6.922 3.229 1.00 . A A . 20 GLY HA2 1 1 4 1742 1 1 20 GLY HA3 H 0.642 -6.813 4.820 1.00 . A A . 20 GLY HA3 1 1 4 1743 1 1 20 GLY N N -0.408 -5.080 4.222 1.00 . A A . 20 GLY N 1 1 4 1744 1 1 20 GLY O O -2.376 -6.550 5.323 1.00 . A A . 20 GLY O 1 1 4 1745 1 1 21 SER C C -2.598 -9.116 7.056 1.00 . A A . 21 SER C 1 1 4 1746 1 1 21 SER CA C -2.655 -9.224 5.533 1.00 . A A . 21 SER CA 1 1 4 1747 1 1 21 SER CB C -2.509 -10.680 5.098 1.00 . A A . 21 SER CB 1 1 4 1748 1 1 21 SER H H -0.741 -9.039 4.560 1.00 . A A . 21 SER H 1 1 4 1749 1 1 21 SER HA H -3.581 -8.818 5.158 1.00 . A A . 21 SER HA 1 1 4 1750 1 1 21 SER HB2 H -1.773 -10.753 4.314 1.00 . A A . 21 SER HB2 1 1 4 1751 1 1 21 SER HB3 H -2.191 -11.277 5.943 1.00 . A A . 21 SER HB3 1 1 4 1752 1 1 21 SER HG H -4.131 -10.479 4.041 1.00 . A A . 21 SER HG 1 1 4 1753 1 1 21 SER N N -1.489 -8.521 4.924 1.00 . A A . 21 SER N 1 1 4 1754 1 1 21 SER O O -3.512 -9.511 7.753 1.00 . A A . 21 SER O 1 1 4 1755 1 1 21 SER OG O -3.758 -11.155 4.612 1.00 . A A . 21 SER OG 1 1 4 1756 1 1 22 ASP C C -1.806 -7.039 9.491 1.00 . A A . 22 ASP C 1 1 4 1757 1 1 22 ASP CA C -1.407 -8.451 9.056 1.00 . A A . 22 ASP CA 1 1 4 1758 1 1 22 ASP CB C 0.068 -8.714 9.353 1.00 . A A . 22 ASP CB 1 1 4 1759 1 1 22 ASP CG C 0.227 -9.131 10.816 1.00 . A A . 22 ASP CG 1 1 4 1760 1 1 22 ASP H H -0.804 -8.274 6.998 1.00 . A A . 22 ASP H 1 1 4 1761 1 1 22 ASP HA H -2.020 -9.185 9.552 1.00 . A A . 22 ASP HA 1 1 4 1762 1 1 22 ASP HB2 H 0.429 -9.507 8.712 1.00 . A A . 22 ASP HB2 1 1 4 1763 1 1 22 ASP HB3 H 0.639 -7.814 9.174 1.00 . A A . 22 ASP HB3 1 1 4 1764 1 1 22 ASP N N -1.529 -8.585 7.578 1.00 . A A . 22 ASP N 1 1 4 1765 1 1 22 ASP O O -1.806 -6.715 10.663 1.00 . A A . 22 ASP O 1 1 4 1766 1 1 22 ASP OD1 O -0.773 -9.162 11.514 1.00 . A A . 22 ASP OD1 1 1 4 1767 1 1 22 ASP OD2 O 1.344 -9.416 11.213 1.00 . A A . 22 ASP OD2 1 1 4 1768 1 1 23 GLY C C -1.326 -3.917 9.040 1.00 . A A . 23 GLY C 1 1 4 1769 1 1 23 GLY CA C -2.561 -4.810 8.914 1.00 . A A . 23 GLY CA 1 1 4 1770 1 1 23 GLY H H -2.153 -6.480 7.617 1.00 . A A . 23 GLY H 1 1 4 1771 1 1 23 GLY HA2 H -3.212 -4.418 8.144 1.00 . A A . 23 GLY HA2 1 1 4 1772 1 1 23 GLY HA3 H -3.086 -4.825 9.857 1.00 . A A . 23 GLY HA3 1 1 4 1773 1 1 23 GLY N N -2.154 -6.197 8.555 1.00 . A A . 23 GLY N 1 1 4 1774 1 1 23 GLY O O -1.423 -2.707 9.033 1.00 . A A . 23 GLY O 1 1 4 1775 1 1 24 LYS C C 1.896 -3.735 8.001 1.00 . A A . 24 LYS C 1 1 4 1776 1 1 24 LYS CA C 1.067 -3.668 9.289 1.00 . A A . 24 LYS CA 1 1 4 1777 1 1 24 LYS CB C 1.835 -4.274 10.464 1.00 . A A . 24 LYS CB 1 1 4 1778 1 1 24 LYS CD C 1.993 -4.274 12.959 1.00 . A A . 24 LYS CD 1 1 4 1779 1 1 24 LYS CE C 1.042 -5.456 13.173 1.00 . A A . 24 LYS CE 1 1 4 1780 1 1 24 LYS CG C 1.541 -3.473 11.735 1.00 . A A . 24 LYS CG 1 1 4 1781 1 1 24 LYS H H -0.101 -5.475 9.165 1.00 . A A . 24 LYS H 1 1 4 1782 1 1 24 LYS HA H 0.805 -2.646 9.511 1.00 . A A . 24 LYS HA 1 1 4 1783 1 1 24 LYS HB2 H 1.526 -5.300 10.605 1.00 . A A . 24 LYS HB2 1 1 4 1784 1 1 24 LYS HB3 H 2.893 -4.241 10.260 1.00 . A A . 24 LYS HB3 1 1 4 1785 1 1 24 LYS HD2 H 2.996 -4.644 12.794 1.00 . A A . 24 LYS HD2 1 1 4 1786 1 1 24 LYS HD3 H 1.982 -3.639 13.831 1.00 . A A . 24 LYS HD3 1 1 4 1787 1 1 24 LYS HE2 H 0.523 -5.689 12.253 1.00 . A A . 24 LYS HE2 1 1 4 1788 1 1 24 LYS HE3 H 1.589 -6.318 13.524 1.00 . A A . 24 LYS HE3 1 1 4 1789 1 1 24 LYS HG2 H 2.076 -2.535 11.701 1.00 . A A . 24 LYS HG2 1 1 4 1790 1 1 24 LYS HG3 H 0.481 -3.282 11.805 1.00 . A A . 24 LYS HG3 1 1 4 1791 1 1 24 LYS HZ1 H 0.322 -4.051 14.543 1.00 . A A . 24 LYS HZ1 1 1 4 1792 1 1 24 LYS HZ2 H 0.104 -5.666 15.023 1.00 . A A . 24 LYS HZ2 1 1 4 1793 1 1 24 LYS HZ3 H -0.886 -4.995 13.818 1.00 . A A . 24 LYS HZ3 1 1 4 1794 1 1 24 LYS N N -0.164 -4.498 9.159 1.00 . A A . 24 LYS N 1 1 4 1795 1 1 24 LYS NZ N 0.074 -5.007 14.218 1.00 . A A . 24 LYS NZ 1 1 4 1796 1 1 24 LYS O O 1.672 -2.980 7.080 1.00 . A A . 24 LYS O 1 1 4 1797 1 1 25 SER C C 2.921 -4.396 5.451 1.00 . A A . 25 SER C 1 1 4 1798 1 1 25 SER CA C 3.708 -4.752 6.715 1.00 . A A . 25 SER CA 1 1 4 1799 1 1 25 SER CB C 4.140 -6.217 6.682 1.00 . A A . 25 SER CB 1 1 4 1800 1 1 25 SER H H 3.010 -5.222 8.695 1.00 . A A . 25 SER H 1 1 4 1801 1 1 25 SER HA H 4.575 -4.116 6.804 1.00 . A A . 25 SER HA 1 1 4 1802 1 1 25 SER HB2 H 3.270 -6.852 6.723 1.00 . A A . 25 SER HB2 1 1 4 1803 1 1 25 SER HB3 H 4.682 -6.410 5.764 1.00 . A A . 25 SER HB3 1 1 4 1804 1 1 25 SER HG H 5.703 -7.032 7.507 1.00 . A A . 25 SER HG 1 1 4 1805 1 1 25 SER N N 2.850 -4.630 7.936 1.00 . A A . 25 SER N 1 1 4 1806 1 1 25 SER O O 1.966 -5.057 5.093 1.00 . A A . 25 SER O 1 1 4 1807 1 1 25 SER OG O 4.970 -6.487 7.804 1.00 . A A . 25 SER OG 1 1 4 1808 1 1 26 ALA C C 3.539 -2.976 2.343 1.00 . A A . 26 ALA C 1 1 4 1809 1 1 26 ALA CA C 2.595 -2.933 3.547 1.00 . A A . 26 ALA CA 1 1 4 1810 1 1 26 ALA CB C 2.146 -1.498 3.827 1.00 . A A . 26 ALA CB 1 1 4 1811 1 1 26 ALA H H 4.085 -2.829 5.096 1.00 . A A . 26 ALA H 1 1 4 1812 1 1 26 ALA HA H 1.735 -3.562 3.379 1.00 . A A . 26 ALA HA 1 1 4 1813 1 1 26 ALA HB1 H 2.840 -1.034 4.514 1.00 . A A . 26 ALA HB1 1 1 4 1814 1 1 26 ALA HB2 H 1.160 -1.508 4.265 1.00 . A A . 26 ALA HB2 1 1 4 1815 1 1 26 ALA HB3 H 2.127 -0.940 2.904 1.00 . A A . 26 ALA HB3 1 1 4 1816 1 1 26 ALA N N 3.315 -3.348 4.782 1.00 . A A . 26 ALA N 1 1 4 1817 1 1 26 ALA O O 4.718 -2.705 2.455 1.00 . A A . 26 ALA O 1 1 4 1818 1 1 27 ALA C C 3.976 -1.995 -0.675 1.00 . A A . 27 ALA C 1 1 4 1819 1 1 27 ALA CA C 3.898 -3.370 -0.022 1.00 . A A . 27 ALA CA 1 1 4 1820 1 1 27 ALA CB C 3.205 -4.344 -0.966 1.00 . A A . 27 ALA CB 1 1 4 1821 1 1 27 ALA H H 2.075 -3.525 1.118 1.00 . A A . 27 ALA H 1 1 4 1822 1 1 27 ALA HA H 4.882 -3.732 0.230 1.00 . A A . 27 ALA HA 1 1 4 1823 1 1 27 ALA HB1 H 2.498 -3.804 -1.580 1.00 . A A . 27 ALA HB1 1 1 4 1824 1 1 27 ALA HB2 H 2.685 -5.093 -0.390 1.00 . A A . 27 ALA HB2 1 1 4 1825 1 1 27 ALA HB3 H 3.941 -4.817 -1.597 1.00 . A A . 27 ALA HB3 1 1 4 1826 1 1 27 ALA N N 3.030 -3.313 1.189 1.00 . A A . 27 ALA N 1 1 4 1827 1 1 27 ALA O O 3.024 -1.528 -1.265 1.00 . A A . 27 ALA O 1 1 4 1828 1 1 28 CYS C C 5.902 -0.094 -2.566 1.00 . A A . 28 CYS C 1 1 4 1829 1 1 28 CYS CA C 5.204 0.002 -1.206 1.00 . A A . 28 CYS CA 1 1 4 1830 1 1 28 CYS CB C 6.041 0.829 -0.228 1.00 . A A . 28 CYS CB 1 1 4 1831 1 1 28 CYS H H 5.859 -1.730 -0.105 1.00 . A A . 28 CYS H 1 1 4 1832 1 1 28 CYS HA H 4.224 0.434 -1.315 1.00 . A A . 28 CYS HA 1 1 4 1833 1 1 28 CYS HB2 H 6.529 0.172 0.475 1.00 . A A . 28 CYS HB2 1 1 4 1834 1 1 28 CYS HB3 H 6.785 1.388 -0.775 1.00 . A A . 28 CYS HB3 1 1 4 1835 1 1 28 CYS N N 5.096 -1.342 -0.581 1.00 . A A . 28 CYS N 1 1 4 1836 1 1 28 CYS O O 7.068 -0.421 -2.654 1.00 . A A . 28 CYS O 1 1 4 1837 1 1 28 CYS SG S 4.966 1.978 0.669 1.00 . A A . 28 CYS SG 1 1 4 1838 1 1 29 THR C C 6.860 1.241 -5.126 1.00 . A A . 29 THR C 1 1 4 1839 1 1 29 THR CA C 5.829 0.118 -4.975 1.00 . A A . 29 THR CA 1 1 4 1840 1 1 29 THR CB C 4.681 0.301 -5.970 1.00 . A A . 29 THR CB 1 1 4 1841 1 1 29 THR CG2 C 3.858 1.532 -5.586 1.00 . A A . 29 THR CG2 1 1 4 1842 1 1 29 THR H H 4.257 0.458 -3.539 1.00 . A A . 29 THR H 1 1 4 1843 1 1 29 THR HA H 6.295 -0.843 -5.122 1.00 . A A . 29 THR HA 1 1 4 1844 1 1 29 THR HB H 4.045 -0.571 -5.951 1.00 . A A . 29 THR HB 1 1 4 1845 1 1 29 THR HG1 H 4.939 -0.279 -7.809 1.00 . A A . 29 THR HG1 1 1 4 1846 1 1 29 THR HG21 H 3.630 2.103 -6.473 1.00 . A A . 29 THR HG21 1 1 4 1847 1 1 29 THR HG22 H 4.424 2.143 -4.899 1.00 . A A . 29 THR HG22 1 1 4 1848 1 1 29 THR HG23 H 2.940 1.217 -5.114 1.00 . A A . 29 THR HG23 1 1 4 1849 1 1 29 THR N N 5.197 0.191 -3.628 1.00 . A A . 29 THR N 1 1 4 1850 1 1 29 THR O O 6.517 2.386 -5.341 1.00 . A A . 29 THR O 1 1 4 1851 1 1 29 THR OG1 O 5.212 0.472 -7.277 1.00 . A A . 29 THR OG1 1 1 4 1852 1 1 30 LEU C C 9.611 2.116 -6.589 1.00 . A A . 30 LEU C 1 1 4 1853 1 1 30 LEU CA C 9.172 1.971 -5.130 1.00 . A A . 30 LEU CA 1 1 4 1854 1 1 30 LEU CB C 10.332 1.472 -4.270 1.00 . A A . 30 LEU CB 1 1 4 1855 1 1 30 LEU CD1 C 10.032 -0.501 -2.769 1.00 . A A . 30 LEU CD1 1 1 4 1856 1 1 30 LEU CD2 C 10.516 1.748 -1.795 1.00 . A A . 30 LEU CD2 1 1 4 1857 1 1 30 LEU CG C 9.794 1.002 -2.918 1.00 . A A . 30 LEU CG 1 1 4 1858 1 1 30 LEU H H 8.375 -0.007 -4.824 1.00 . A A . 30 LEU H 1 1 4 1859 1 1 30 LEU HA H 8.811 2.914 -4.750 1.00 . A A . 30 LEU HA 1 1 4 1860 1 1 30 LEU HB2 H 10.822 0.649 -4.769 1.00 . A A . 30 LEU HB2 1 1 4 1861 1 1 30 LEU HB3 H 11.038 2.274 -4.115 1.00 . A A . 30 LEU HB3 1 1 4 1862 1 1 30 LEU HD11 H 10.980 -0.762 -3.216 1.00 . A A . 30 LEU HD11 1 1 4 1863 1 1 30 LEU HD12 H 9.239 -1.043 -3.265 1.00 . A A . 30 LEU HD12 1 1 4 1864 1 1 30 LEU HD13 H 10.044 -0.762 -1.721 1.00 . A A . 30 LEU HD13 1 1 4 1865 1 1 30 LEU HD21 H 10.353 1.234 -0.859 1.00 . A A . 30 LEU HD21 1 1 4 1866 1 1 30 LEU HD22 H 10.130 2.754 -1.725 1.00 . A A . 30 LEU HD22 1 1 4 1867 1 1 30 LEU HD23 H 11.575 1.783 -2.008 1.00 . A A . 30 LEU HD23 1 1 4 1868 1 1 30 LEU HG H 8.734 1.205 -2.864 1.00 . A A . 30 LEU HG 1 1 4 1869 1 1 30 LEU N N 8.119 0.922 -5.004 1.00 . A A . 30 LEU N 1 1 4 1870 1 1 30 LEU O O 10.101 1.185 -7.195 1.00 . A A . 30 LEU O 1 1 4 1871 1 1 31 LYS C C 10.567 4.832 -8.719 1.00 . A A . 31 LYS C 1 1 4 1872 1 1 31 LYS CA C 9.851 3.486 -8.572 1.00 . A A . 31 LYS CA 1 1 4 1873 1 1 31 LYS CB C 8.544 3.479 -9.368 1.00 . A A . 31 LYS CB 1 1 4 1874 1 1 31 LYS CD C 9.695 1.970 -11.003 1.00 . A A . 31 LYS CD 1 1 4 1875 1 1 31 LYS CE C 9.109 0.846 -10.142 1.00 . A A . 31 LYS CE 1 1 4 1876 1 1 31 LYS CG C 8.845 3.234 -10.849 1.00 . A A . 31 LYS CG 1 1 4 1877 1 1 31 LYS H H 9.046 4.018 -6.646 1.00 . A A . 31 LYS H 1 1 4 1878 1 1 31 LYS HA H 10.488 2.682 -8.901 1.00 . A A . 31 LYS HA 1 1 4 1879 1 1 31 LYS HB2 H 7.903 2.693 -8.996 1.00 . A A . 31 LYS HB2 1 1 4 1880 1 1 31 LYS HB3 H 8.049 4.431 -9.255 1.00 . A A . 31 LYS HB3 1 1 4 1881 1 1 31 LYS HD2 H 9.699 1.664 -12.040 1.00 . A A . 31 LYS HD2 1 1 4 1882 1 1 31 LYS HD3 H 10.706 2.173 -10.685 1.00 . A A . 31 LYS HD3 1 1 4 1883 1 1 31 LYS HE2 H 9.671 -0.066 -10.284 1.00 . A A . 31 LYS HE2 1 1 4 1884 1 1 31 LYS HE3 H 9.108 1.131 -9.102 1.00 . A A . 31 LYS HE3 1 1 4 1885 1 1 31 LYS HG2 H 7.917 3.112 -11.388 1.00 . A A . 31 LYS HG2 1 1 4 1886 1 1 31 LYS HG3 H 9.385 4.078 -11.250 1.00 . A A . 31 LYS HG3 1 1 4 1887 1 1 31 LYS HZ1 H 7.723 0.396 -11.628 1.00 . A A . 31 LYS HZ1 1 1 4 1888 1 1 31 LYS HZ2 H 7.200 1.580 -10.528 1.00 . A A . 31 LYS HZ2 1 1 4 1889 1 1 31 LYS HZ3 H 7.234 -0.056 -10.068 1.00 . A A . 31 LYS HZ3 1 1 4 1890 1 1 31 LYS N N 9.441 3.279 -7.154 1.00 . A A . 31 LYS N 1 1 4 1891 1 1 31 LYS NZ N 7.711 0.679 -10.628 1.00 . A A . 31 LYS NZ 1 1 4 1892 1 1 31 LYS O O 11.608 4.926 -9.338 1.00 . A A . 31 LYS O 1 1 4 1893 1 1 32 ALA C C 9.778 8.281 -7.610 1.00 . A A . 32 ALA C 1 1 4 1894 1 1 32 ALA CA C 10.668 7.212 -8.248 1.00 . A A . 32 ALA CA 1 1 4 1895 1 1 32 ALA CB C 10.818 7.476 -9.747 1.00 . A A . 32 ALA CB 1 1 4 1896 1 1 32 ALA H H 9.181 5.771 -7.650 1.00 . A A . 32 ALA H 1 1 4 1897 1 1 32 ALA HA H 11.638 7.197 -7.777 1.00 . A A . 32 ALA HA 1 1 4 1898 1 1 32 ALA HB1 H 9.888 7.250 -10.247 1.00 . A A . 32 ALA HB1 1 1 4 1899 1 1 32 ALA HB2 H 11.604 6.853 -10.147 1.00 . A A . 32 ALA HB2 1 1 4 1900 1 1 32 ALA HB3 H 11.068 8.514 -9.905 1.00 . A A . 32 ALA HB3 1 1 4 1901 1 1 32 ALA N N 10.019 5.872 -8.148 1.00 . A A . 32 ALA N 1 1 4 1902 1 1 32 ALA O O 8.570 8.158 -7.578 1.00 . A A . 32 ALA O 1 1 4 1903 1 1 33 CYS C C 9.893 11.766 -7.108 1.00 . A A . 33 CYS C 1 1 4 1904 1 1 33 CYS CA C 9.547 10.413 -6.481 1.00 . A A . 33 CYS CA 1 1 4 1905 1 1 33 CYS CB C 9.911 10.397 -4.994 1.00 . A A . 33 CYS CB 1 1 4 1906 1 1 33 CYS H H 11.340 9.417 -7.150 1.00 . A A . 33 CYS H 1 1 4 1907 1 1 33 CYS HA H 8.497 10.202 -6.604 1.00 . A A . 33 CYS HA 1 1 4 1908 1 1 33 CYS HB2 H 10.898 10.812 -4.859 1.00 . A A . 33 CYS HB2 1 1 4 1909 1 1 33 CYS HB3 H 9.194 10.989 -4.442 1.00 . A A . 33 CYS HB3 1 1 4 1910 1 1 33 CYS N N 10.364 9.334 -7.108 1.00 . A A . 33 CYS N 1 1 4 1911 1 1 33 CYS O O 11.024 12.007 -7.483 1.00 . A A . 33 CYS O 1 1 4 1912 1 1 33 CYS SG S 9.887 8.698 -4.378 1.00 . A A . 33 CYS SG 1 1 4 1913 1 1 34 PRO C C 9.893 14.840 -6.831 1.00 . A A . 34 PRO C 1 1 4 1914 1 1 34 PRO CA C 9.092 13.953 -7.787 1.00 . A A . 34 PRO CA 1 1 4 1915 1 1 34 PRO CB C 7.667 14.475 -7.958 1.00 . A A . 34 PRO CB 1 1 4 1916 1 1 34 PRO CD C 7.516 12.381 -6.765 1.00 . A A . 34 PRO CD 1 1 4 1917 1 1 34 PRO CG C 6.856 13.723 -6.952 1.00 . A A . 34 PRO CG 1 1 4 1918 1 1 34 PRO HA H 9.580 13.885 -8.746 1.00 . A A . 34 PRO HA 1 1 4 1919 1 1 34 PRO HB2 H 7.632 15.537 -7.757 1.00 . A A . 34 PRO HB2 1 1 4 1920 1 1 34 PRO HB3 H 7.307 14.267 -8.954 1.00 . A A . 34 PRO HB3 1 1 4 1921 1 1 34 PRO HD2 H 7.485 12.087 -5.724 1.00 . A A . 34 PRO HD2 1 1 4 1922 1 1 34 PRO HD3 H 7.047 11.635 -7.388 1.00 . A A . 34 PRO HD3 1 1 4 1923 1 1 34 PRO HG2 H 6.839 14.263 -6.015 1.00 . A A . 34 PRO HG2 1 1 4 1924 1 1 34 PRO HG3 H 5.850 13.584 -7.317 1.00 . A A . 34 PRO HG3 1 1 4 1925 1 1 34 PRO N N 8.899 12.606 -7.199 1.00 . A A . 34 PRO N 1 1 4 1926 1 1 34 PRO O O 11.105 14.896 -6.892 1.00 . A A . 34 PRO O 1 1 4 1927 1 1 35 GLN C C 11.192 15.688 -4.446 1.00 . A A . 35 GLN C 1 1 4 1928 1 1 35 GLN CA C 9.957 16.411 -4.991 1.00 . A A . 35 GLN CA 1 1 4 1929 1 1 35 GLN CB C 8.957 16.685 -3.867 1.00 . A A . 35 GLN CB 1 1 4 1930 1 1 35 GLN CD C 8.153 18.590 -2.468 1.00 . A A . 35 GLN CD 1 1 4 1931 1 1 35 GLN CG C 8.571 18.164 -3.876 1.00 . A A . 35 GLN CG 1 1 4 1932 1 1 35 GLN H H 8.251 15.473 -5.915 1.00 . A A . 35 GLN H 1 1 4 1933 1 1 35 GLN HA H 10.240 17.336 -5.467 1.00 . A A . 35 GLN HA 1 1 4 1934 1 1 35 GLN HB2 H 8.075 16.079 -4.015 1.00 . A A . 35 GLN HB2 1 1 4 1935 1 1 35 GLN HB3 H 9.408 16.438 -2.917 1.00 . A A . 35 GLN HB3 1 1 4 1936 1 1 35 GLN HE21 H 9.948 19.289 -1.992 1.00 . A A . 35 GLN HE21 1 1 4 1937 1 1 35 GLN HE22 H 8.771 19.425 -0.777 1.00 . A A . 35 GLN HE22 1 1 4 1938 1 1 35 GLN HG2 H 9.417 18.755 -4.196 1.00 . A A . 35 GLN HG2 1 1 4 1939 1 1 35 GLN HG3 H 7.747 18.317 -4.556 1.00 . A A . 35 GLN HG3 1 1 4 1940 1 1 35 GLN N N 9.228 15.532 -5.949 1.00 . A A . 35 GLN N 1 1 4 1941 1 1 35 GLN NE2 N 9.030 19.147 -1.680 1.00 . A A . 35 GLN NE2 1 1 4 1942 1 1 35 GLN O O 12.199 16.346 -4.246 1.00 . A A . 35 GLN O 1 1 4 1943 1 1 35 GLN OXT O 11.107 14.488 -4.238 1.00 . A A . 35 GLN OXT 1 1 4 1944 1 1 35 GLN OE1 O 7.015 18.411 -2.081 1.00 . A A . 35 GLN OE1 1 1 5 1945 1 1 1 GLU C C 4.320 0.687 10.653 1.00 . A A . 1 GLU C 1 1 5 1946 1 1 1 GLU CA C 5.551 0.172 11.408 1.00 . A A . 1 GLU CA 1 1 5 1947 1 1 1 GLU CB C 6.745 0.008 10.450 1.00 . A A . 1 GLU CB 1 1 5 1948 1 1 1 GLU CD C 7.320 -1.363 8.436 1.00 . A A . 1 GLU CD 1 1 5 1949 1 1 1 GLU CG C 6.794 -1.413 9.871 1.00 . A A . 1 GLU CG 1 1 5 1950 1 1 1 GLU H1 H 6.176 -1.694 12.103 1.00 . A A . 1 GLU H1 1 1 5 1951 1 1 1 GLU H2 H 4.660 -1.715 11.336 1.00 . A A . 1 GLU H2 1 1 5 1952 1 1 1 GLU H3 H 4.814 -1.081 12.904 1.00 . A A . 1 GLU H3 1 1 5 1953 1 1 1 GLU HA H 5.812 0.859 12.198 1.00 . A A . 1 GLU HA 1 1 5 1954 1 1 1 GLU HB2 H 6.649 0.717 9.641 1.00 . A A . 1 GLU HB2 1 1 5 1955 1 1 1 GLU HB3 H 7.660 0.204 10.987 1.00 . A A . 1 GLU HB3 1 1 5 1956 1 1 1 GLU HG2 H 7.450 -2.023 10.474 1.00 . A A . 1 GLU HG2 1 1 5 1957 1 1 1 GLU HG3 H 5.804 -1.841 9.875 1.00 . A A . 1 GLU HG3 1 1 5 1958 1 1 1 GLU N N 5.281 -1.183 11.980 1.00 . A A . 1 GLU N 1 1 5 1959 1 1 1 GLU O O 3.795 1.741 10.956 1.00 . A A . 1 GLU O 1 1 5 1960 1 1 1 GLU OE1 O 7.368 -0.277 7.881 1.00 . A A . 1 GLU OE1 1 1 5 1961 1 1 1 GLU OE2 O 7.666 -2.410 7.916 1.00 . A A . 1 GLU OE2 1 1 5 1962 1 1 2 VAL C C 1.432 0.466 9.830 1.00 . A A . 2 VAL C 1 1 5 1963 1 1 2 VAL CA C 2.658 0.414 8.911 1.00 . A A . 2 VAL CA 1 1 5 1964 1 1 2 VAL CB C 2.464 -0.637 7.817 1.00 . A A . 2 VAL CB 1 1 5 1965 1 1 2 VAL CG1 C 1.186 -0.331 7.037 1.00 . A A . 2 VAL CG1 1 1 5 1966 1 1 2 VAL CG2 C 3.657 -0.607 6.859 1.00 . A A . 2 VAL CG2 1 1 5 1967 1 1 2 VAL H H 4.288 -0.888 9.445 1.00 . A A . 2 VAL H 1 1 5 1968 1 1 2 VAL HA H 2.839 1.381 8.468 1.00 . A A . 2 VAL HA 1 1 5 1969 1 1 2 VAL HB H 2.387 -1.615 8.269 1.00 . A A . 2 VAL HB 1 1 5 1970 1 1 2 VAL HG11 H 0.813 -1.242 6.591 1.00 . A A . 2 VAL HG11 1 1 5 1971 1 1 2 VAL HG12 H 1.401 0.387 6.260 1.00 . A A . 2 VAL HG12 1 1 5 1972 1 1 2 VAL HG13 H 0.443 0.073 7.707 1.00 . A A . 2 VAL HG13 1 1 5 1973 1 1 2 VAL HG21 H 4.143 -1.570 6.860 1.00 . A A . 2 VAL HG21 1 1 5 1974 1 1 2 VAL HG22 H 4.357 0.151 7.179 1.00 . A A . 2 VAL HG22 1 1 5 1975 1 1 2 VAL HG23 H 3.311 -0.379 5.861 1.00 . A A . 2 VAL HG23 1 1 5 1976 1 1 2 VAL N N 3.854 -0.042 9.676 1.00 . A A . 2 VAL N 1 1 5 1977 1 1 2 VAL O O 1.346 -0.255 10.805 1.00 . A A . 2 VAL O 1 1 5 1978 1 1 3 THR C C -1.993 1.451 9.521 1.00 . A A . 3 THR C 1 1 5 1979 1 1 3 THR CA C -0.733 1.406 10.389 1.00 . A A . 3 THR CA 1 1 5 1980 1 1 3 THR CB C -0.570 2.711 11.172 1.00 . A A . 3 THR CB 1 1 5 1981 1 1 3 THR CG2 C -0.719 3.902 10.221 1.00 . A A . 3 THR CG2 1 1 5 1982 1 1 3 THR H H 0.571 1.887 8.739 1.00 . A A . 3 THR H 1 1 5 1983 1 1 3 THR HA H -0.775 0.571 11.070 1.00 . A A . 3 THR HA 1 1 5 1984 1 1 3 THR HB H 0.409 2.738 11.624 1.00 . A A . 3 THR HB 1 1 5 1985 1 1 3 THR HG1 H -2.134 3.526 12.008 1.00 . A A . 3 THR HG1 1 1 5 1986 1 1 3 THR HG21 H -1.636 4.429 10.446 1.00 . A A . 3 THR HG21 1 1 5 1987 1 1 3 THR HG22 H -0.748 3.548 9.202 1.00 . A A . 3 THR HG22 1 1 5 1988 1 1 3 THR HG23 H 0.120 4.570 10.347 1.00 . A A . 3 THR HG23 1 1 5 1989 1 1 3 THR N N 0.484 1.313 9.529 1.00 . A A . 3 THR N 1 1 5 1990 1 1 3 THR O O -2.703 2.437 9.488 1.00 . A A . 3 THR O 1 1 5 1991 1 1 3 THR OG1 O -1.564 2.775 12.190 1.00 . A A . 3 THR OG1 1 1 5 1992 1 1 4 CYS C C -4.213 -0.974 8.083 1.00 . A A . 4 CYS C 1 1 5 1993 1 1 4 CYS CA C -3.492 0.370 7.953 1.00 . A A . 4 CYS CA 1 1 5 1994 1 1 4 CYS CB C -2.964 0.556 6.531 1.00 . A A . 4 CYS CB 1 1 5 1995 1 1 4 CYS H H -1.693 -0.396 8.859 1.00 . A A . 4 CYS H 1 1 5 1996 1 1 4 CYS HA H -4.153 1.182 8.211 1.00 . A A . 4 CYS HA 1 1 5 1997 1 1 4 CYS HB2 H -3.769 0.409 5.824 1.00 . A A . 4 CYS HB2 1 1 5 1998 1 1 4 CYS HB3 H -2.565 1.556 6.421 1.00 . A A . 4 CYS HB3 1 1 5 1999 1 1 4 CYS N N -2.277 0.388 8.819 1.00 . A A . 4 CYS N 1 1 5 2000 1 1 4 CYS O O -3.824 -1.826 8.857 1.00 . A A . 4 CYS O 1 1 5 2001 1 1 4 CYS SG S -1.654 -0.654 6.214 1.00 . A A . 4 CYS SG 1 1 5 2002 1 1 5 GLU C C -5.501 -3.417 6.320 1.00 . A A . 5 GLU C 1 1 5 2003 1 1 5 GLU CA C -6.001 -2.462 7.406 1.00 . A A . 5 GLU CA 1 1 5 2004 1 1 5 GLU CB C -7.465 -2.093 7.168 1.00 . A A . 5 GLU CB 1 1 5 2005 1 1 5 GLU CD C -9.810 -2.755 7.717 1.00 . A A . 5 GLU CD 1 1 5 2006 1 1 5 GLU CG C -8.362 -3.241 7.633 1.00 . A A . 5 GLU CG 1 1 5 2007 1 1 5 GLU H H -5.555 -0.472 6.708 1.00 . A A . 5 GLU H 1 1 5 2008 1 1 5 GLU HA H -5.886 -2.906 8.382 1.00 . A A . 5 GLU HA 1 1 5 2009 1 1 5 GLU HB2 H -7.705 -1.198 7.726 1.00 . A A . 5 GLU HB2 1 1 5 2010 1 1 5 GLU HB3 H -7.626 -1.916 6.115 1.00 . A A . 5 GLU HB3 1 1 5 2011 1 1 5 GLU HG2 H -8.294 -4.057 6.930 1.00 . A A . 5 GLU HG2 1 1 5 2012 1 1 5 GLU HG3 H -8.041 -3.576 8.608 1.00 . A A . 5 GLU HG3 1 1 5 2013 1 1 5 GLU N N -5.259 -1.171 7.329 1.00 . A A . 5 GLU N 1 1 5 2014 1 1 5 GLU O O -5.220 -3.005 5.212 1.00 . A A . 5 GLU O 1 1 5 2015 1 1 5 GLU OE1 O -10.012 -1.620 8.114 1.00 . A A . 5 GLU OE1 1 1 5 2016 1 1 5 GLU OE2 O -10.693 -3.527 7.379 1.00 . A A . 5 GLU OE2 1 1 5 2017 1 1 6 PRO C C -5.963 -5.915 4.615 1.00 . A A . 6 PRO C 1 1 5 2018 1 1 6 PRO CA C -4.928 -5.697 5.722 1.00 . A A . 6 PRO CA 1 1 5 2019 1 1 6 PRO CB C -4.765 -6.942 6.590 1.00 . A A . 6 PRO CB 1 1 5 2020 1 1 6 PRO CD C -5.736 -5.239 7.987 1.00 . A A . 6 PRO CD 1 1 5 2021 1 1 6 PRO CG C -5.683 -6.726 7.749 1.00 . A A . 6 PRO CG 1 1 5 2022 1 1 6 PRO HA H -3.977 -5.411 5.303 1.00 . A A . 6 PRO HA 1 1 5 2023 1 1 6 PRO HB2 H -5.052 -7.825 6.037 1.00 . A A . 6 PRO HB2 1 1 5 2024 1 1 6 PRO HB3 H -3.747 -7.029 6.937 1.00 . A A . 6 PRO HB3 1 1 5 2025 1 1 6 PRO HD2 H -6.730 -4.941 8.297 1.00 . A A . 6 PRO HD2 1 1 5 2026 1 1 6 PRO HD3 H -5.001 -4.943 8.720 1.00 . A A . 6 PRO HD3 1 1 5 2027 1 1 6 PRO HG2 H -6.667 -7.102 7.513 1.00 . A A . 6 PRO HG2 1 1 5 2028 1 1 6 PRO HG3 H -5.296 -7.222 8.626 1.00 . A A . 6 PRO HG3 1 1 5 2029 1 1 6 PRO N N -5.406 -4.668 6.677 1.00 . A A . 6 PRO N 1 1 5 2030 1 1 6 PRO O O -7.028 -6.455 4.842 1.00 . A A . 6 PRO O 1 1 5 2031 1 1 7 GLY C C -7.294 -4.314 2.011 1.00 . A A . 7 GLY C 1 1 5 2032 1 1 7 GLY CA C -6.617 -5.655 2.292 1.00 . A A . 7 GLY CA 1 1 5 2033 1 1 7 GLY H H -4.794 -5.051 3.265 1.00 . A A . 7 GLY H 1 1 5 2034 1 1 7 GLY HA2 H -6.083 -5.986 1.411 1.00 . A A . 7 GLY HA2 1 1 5 2035 1 1 7 GLY HA3 H -7.366 -6.387 2.560 1.00 . A A . 7 GLY HA3 1 1 5 2036 1 1 7 GLY N N -5.656 -5.489 3.420 1.00 . A A . 7 GLY N 1 1 5 2037 1 1 7 GLY O O -8.498 -4.231 1.866 1.00 . A A . 7 GLY O 1 1 5 2038 1 1 8 THR C C -6.142 -0.978 0.972 1.00 . A A . 8 THR C 1 1 5 2039 1 1 8 THR CA C -7.130 -1.917 1.682 1.00 . A A . 8 THR CA 1 1 5 2040 1 1 8 THR CB C -7.477 -1.373 3.069 1.00 . A A . 8 THR CB 1 1 5 2041 1 1 8 THR CG2 C -8.536 -0.277 2.944 1.00 . A A . 8 THR CG2 1 1 5 2042 1 1 8 THR H H -5.565 -3.353 2.072 1.00 . A A . 8 THR H 1 1 5 2043 1 1 8 THR HA H -8.031 -2.020 1.099 1.00 . A A . 8 THR HA 1 1 5 2044 1 1 8 THR HB H -6.590 -0.959 3.526 1.00 . A A . 8 THR HB 1 1 5 2045 1 1 8 THR HG1 H -8.925 -2.490 3.730 1.00 . A A . 8 THR HG1 1 1 5 2046 1 1 8 THR HG21 H -9.020 -0.352 1.981 1.00 . A A . 8 THR HG21 1 1 5 2047 1 1 8 THR HG22 H -8.066 0.691 3.036 1.00 . A A . 8 THR HG22 1 1 5 2048 1 1 8 THR HG23 H -9.271 -0.397 3.725 1.00 . A A . 8 THR HG23 1 1 5 2049 1 1 8 THR N N -6.529 -3.260 1.942 1.00 . A A . 8 THR N 1 1 5 2050 1 1 8 THR O O -6.548 -0.048 0.306 1.00 . A A . 8 THR O 1 1 5 2051 1 1 8 THR OG1 O -7.979 -2.428 3.877 1.00 . A A . 8 THR OG1 1 1 5 2052 1 1 9 THR C C -4.187 1.158 0.671 1.00 . A A . 9 THR C 1 1 5 2053 1 1 9 THR CA C -3.836 -0.322 0.470 1.00 . A A . 9 THR CA 1 1 5 2054 1 1 9 THR CB C -3.835 -0.701 -1.020 1.00 . A A . 9 THR CB 1 1 5 2055 1 1 9 THR CG2 C -5.065 -0.129 -1.726 1.00 . A A . 9 THR CG2 1 1 5 2056 1 1 9 THR H H -4.559 -1.951 1.674 1.00 . A A . 9 THR H 1 1 5 2057 1 1 9 THR HA H -2.863 -0.522 0.891 1.00 . A A . 9 THR HA 1 1 5 2058 1 1 9 THR HB H -3.840 -1.777 -1.114 1.00 . A A . 9 THR HB 1 1 5 2059 1 1 9 THR HG1 H -2.804 -0.173 -2.582 1.00 . A A . 9 THR HG1 1 1 5 2060 1 1 9 THR HG21 H -5.279 0.856 -1.340 1.00 . A A . 9 THR HG21 1 1 5 2061 1 1 9 THR HG22 H -5.912 -0.775 -1.553 1.00 . A A . 9 THR HG22 1 1 5 2062 1 1 9 THR HG23 H -4.872 -0.064 -2.786 1.00 . A A . 9 THR HG23 1 1 5 2063 1 1 9 THR N N -4.857 -1.204 1.122 1.00 . A A . 9 THR N 1 1 5 2064 1 1 9 THR O O -5.174 1.495 1.291 1.00 . A A . 9 THR O 1 1 5 2065 1 1 9 THR OG1 O -2.663 -0.183 -1.633 1.00 . A A . 9 THR OG1 1 1 5 2066 1 1 10 PHE C C -2.531 4.335 -0.292 1.00 . A A . 10 PHE C 1 1 5 2067 1 1 10 PHE CA C -3.653 3.501 0.334 1.00 . A A . 10 PHE CA 1 1 5 2068 1 1 10 PHE CB C -3.702 3.722 1.847 1.00 . A A . 10 PHE CB 1 1 5 2069 1 1 10 PHE CD1 C -1.303 3.885 2.605 1.00 . A A . 10 PHE CD1 1 1 5 2070 1 1 10 PHE CD2 C -2.492 1.801 2.948 1.00 . A A . 10 PHE CD2 1 1 5 2071 1 1 10 PHE CE1 C -0.160 3.330 3.191 1.00 . A A . 10 PHE CE1 1 1 5 2072 1 1 10 PHE CE2 C -1.350 1.245 3.535 1.00 . A A . 10 PHE CE2 1 1 5 2073 1 1 10 PHE CG C -2.470 3.121 2.482 1.00 . A A . 10 PHE CG 1 1 5 2074 1 1 10 PHE CZ C -0.183 2.010 3.656 1.00 . A A . 10 PHE CZ 1 1 5 2075 1 1 10 PHE H H -2.575 1.753 -0.325 1.00 . A A . 10 PHE H 1 1 5 2076 1 1 10 PHE HA H -4.604 3.757 -0.106 1.00 . A A . 10 PHE HA 1 1 5 2077 1 1 10 PHE HB2 H -3.732 4.782 2.054 1.00 . A A . 10 PHE HB2 1 1 5 2078 1 1 10 PHE HB3 H -4.583 3.252 2.255 1.00 . A A . 10 PHE HB3 1 1 5 2079 1 1 10 PHE HD1 H -1.286 4.904 2.246 1.00 . A A . 10 PHE HD1 1 1 5 2080 1 1 10 PHE HD2 H -3.392 1.211 2.858 1.00 . A A . 10 PHE HD2 1 1 5 2081 1 1 10 PHE HE1 H 0.740 3.919 3.285 1.00 . A A . 10 PHE HE1 1 1 5 2082 1 1 10 PHE HE2 H -1.366 0.227 3.891 1.00 . A A . 10 PHE HE2 1 1 5 2083 1 1 10 PHE HZ H 0.698 1.581 4.108 1.00 . A A . 10 PHE HZ 1 1 5 2084 1 1 10 PHE N N -3.373 2.044 0.162 1.00 . A A . 10 PHE N 1 1 5 2085 1 1 10 PHE O O -1.718 3.835 -1.045 1.00 . A A . 10 PHE O 1 1 5 2086 1 1 11 LYS C C -0.422 6.897 0.533 1.00 . A A . 11 LYS C 1 1 5 2087 1 1 11 LYS CA C -1.406 6.468 -0.560 1.00 . A A . 11 LYS CA 1 1 5 2088 1 1 11 LYS CB C -2.142 7.686 -1.120 1.00 . A A . 11 LYS CB 1 1 5 2089 1 1 11 LYS CD C -3.216 8.342 -3.277 1.00 . A A . 11 LYS CD 1 1 5 2090 1 1 11 LYS CE C -3.142 9.868 -3.199 1.00 . A A . 11 LYS CE 1 1 5 2091 1 1 11 LYS CG C -1.965 7.737 -2.639 1.00 . A A . 11 LYS CG 1 1 5 2092 1 1 11 LYS H H -3.141 5.987 0.627 1.00 . A A . 11 LYS H 1 1 5 2093 1 1 11 LYS HA H -0.890 5.952 -1.354 1.00 . A A . 11 LYS HA 1 1 5 2094 1 1 11 LYS HB2 H -3.194 7.613 -0.882 1.00 . A A . 11 LYS HB2 1 1 5 2095 1 1 11 LYS HB3 H -1.735 8.585 -0.682 1.00 . A A . 11 LYS HB3 1 1 5 2096 1 1 11 LYS HD2 H -3.278 8.035 -4.311 1.00 . A A . 11 LYS HD2 1 1 5 2097 1 1 11 LYS HD3 H -4.092 7.999 -2.747 1.00 . A A . 11 LYS HD3 1 1 5 2098 1 1 11 LYS HE2 H -4.081 10.305 -3.508 1.00 . A A . 11 LYS HE2 1 1 5 2099 1 1 11 LYS HE3 H -2.890 10.182 -2.198 1.00 . A A . 11 LYS HE3 1 1 5 2100 1 1 11 LYS HG2 H -1.105 8.346 -2.881 1.00 . A A . 11 LYS HG2 1 1 5 2101 1 1 11 LYS HG3 H -1.817 6.737 -3.019 1.00 . A A . 11 LYS HG3 1 1 5 2102 1 1 11 LYS HZ1 H -1.935 9.502 -4.855 1.00 . A A . 11 LYS HZ1 1 1 5 2103 1 1 11 LYS HZ2 H -1.166 10.371 -3.615 1.00 . A A . 11 LYS HZ2 1 1 5 2104 1 1 11 LYS HZ3 H -2.302 11.141 -4.617 1.00 . A A . 11 LYS HZ3 1 1 5 2105 1 1 11 LYS N N -2.477 5.603 0.017 1.00 . A A . 11 LYS N 1 1 5 2106 1 1 11 LYS NZ N -2.055 10.250 -4.143 1.00 . A A . 11 LYS NZ 1 1 5 2107 1 1 11 LYS O O -0.738 6.883 1.706 1.00 . A A . 11 LYS O 1 1 5 2108 1 1 12 ASP C C 2.729 8.743 0.575 1.00 . A A . 12 ASP C 1 1 5 2109 1 1 12 ASP CA C 1.768 7.715 1.176 1.00 . A A . 12 ASP CA 1 1 5 2110 1 1 12 ASP CB C 2.518 6.441 1.565 1.00 . A A . 12 ASP CB 1 1 5 2111 1 1 12 ASP CG C 3.023 6.565 3.003 1.00 . A A . 12 ASP CG 1 1 5 2112 1 1 12 ASP H H 1.003 7.289 -0.795 1.00 . A A . 12 ASP H 1 1 5 2113 1 1 12 ASP HA H 1.272 8.126 2.037 1.00 . A A . 12 ASP HA 1 1 5 2114 1 1 12 ASP HB2 H 1.850 5.594 1.489 1.00 . A A . 12 ASP HB2 1 1 5 2115 1 1 12 ASP HB3 H 3.359 6.301 0.901 1.00 . A A . 12 ASP HB3 1 1 5 2116 1 1 12 ASP N N 0.768 7.282 0.157 1.00 . A A . 12 ASP N 1 1 5 2117 1 1 12 ASP O O 3.040 9.749 1.180 1.00 . A A . 12 ASP O 1 1 5 2118 1 1 12 ASP OD1 O 3.031 7.673 3.514 1.00 . A A . 12 ASP OD1 1 1 5 2119 1 1 12 ASP OD2 O 3.395 5.550 3.570 1.00 . A A . 12 ASP OD2 1 1 5 2120 1 1 13 LYS C C 3.832 9.550 -2.762 1.00 . A A . 13 LYS C 1 1 5 2121 1 1 13 LYS CA C 4.139 9.453 -1.265 1.00 . A A . 13 LYS CA 1 1 5 2122 1 1 13 LYS CB C 5.529 8.858 -1.036 1.00 . A A . 13 LYS CB 1 1 5 2123 1 1 13 LYS CD C 7.148 8.590 0.847 1.00 . A A . 13 LYS CD 1 1 5 2124 1 1 13 LYS CE C 7.267 8.443 2.366 1.00 . A A . 13 LYS CE 1 1 5 2125 1 1 13 LYS CG C 5.679 8.471 0.436 1.00 . A A . 13 LYS CG 1 1 5 2126 1 1 13 LYS H H 2.930 7.677 -1.082 1.00 . A A . 13 LYS H 1 1 5 2127 1 1 13 LYS HA H 4.071 10.423 -0.800 1.00 . A A . 13 LYS HA 1 1 5 2128 1 1 13 LYS HB2 H 5.653 7.981 -1.655 1.00 . A A . 13 LYS HB2 1 1 5 2129 1 1 13 LYS HB3 H 6.281 9.591 -1.291 1.00 . A A . 13 LYS HB3 1 1 5 2130 1 1 13 LYS HD2 H 7.720 7.813 0.363 1.00 . A A . 13 LYS HD2 1 1 5 2131 1 1 13 LYS HD3 H 7.528 9.556 0.550 1.00 . A A . 13 LYS HD3 1 1 5 2132 1 1 13 LYS HE2 H 6.626 9.159 2.863 1.00 . A A . 13 LYS HE2 1 1 5 2133 1 1 13 LYS HE3 H 7.017 7.439 2.667 1.00 . A A . 13 LYS HE3 1 1 5 2134 1 1 13 LYS HG2 H 5.078 9.131 1.044 1.00 . A A . 13 LYS HG2 1 1 5 2135 1 1 13 LYS HG3 H 5.350 7.453 0.574 1.00 . A A . 13 LYS HG3 1 1 5 2136 1 1 13 LYS HZ1 H 9.021 8.099 3.434 1.00 . A A . 13 LYS HZ1 1 1 5 2137 1 1 13 LYS HZ2 H 8.801 9.717 2.964 1.00 . A A . 13 LYS HZ2 1 1 5 2138 1 1 13 LYS HZ3 H 9.274 8.555 1.819 1.00 . A A . 13 LYS HZ3 1 1 5 2139 1 1 13 LYS N N 3.198 8.494 -0.614 1.00 . A A . 13 LYS N 1 1 5 2140 1 1 13 LYS NZ N 8.699 8.725 2.668 1.00 . A A . 13 LYS NZ 1 1 5 2141 1 1 13 LYS O O 2.686 9.594 -3.164 1.00 . A A . 13 LYS O 1 1 5 2142 1 1 14 CYS C C 4.031 8.333 -5.569 1.00 . A A . 14 CYS C 1 1 5 2143 1 1 14 CYS CA C 4.584 9.670 -5.057 1.00 . A A . 14 CYS CA 1 1 5 2144 1 1 14 CYS CB C 5.955 10.018 -5.680 1.00 . A A . 14 CYS CB 1 1 5 2145 1 1 14 CYS H H 5.757 9.543 -3.254 1.00 . A A . 14 CYS H 1 1 5 2146 1 1 14 CYS HA H 3.881 10.463 -5.261 1.00 . A A . 14 CYS HA 1 1 5 2147 1 1 14 CYS HB2 H 5.812 10.747 -6.464 1.00 . A A . 14 CYS HB2 1 1 5 2148 1 1 14 CYS HB3 H 6.590 10.444 -4.914 1.00 . A A . 14 CYS HB3 1 1 5 2149 1 1 14 CYS N N 4.839 9.581 -3.592 1.00 . A A . 14 CYS N 1 1 5 2150 1 1 14 CYS O O 3.601 8.217 -6.699 1.00 . A A . 14 CYS O 1 1 5 2151 1 1 14 CYS SG S 6.769 8.550 -6.382 1.00 . A A . 14 CYS SG 1 1 5 2152 1 1 15 ASN C C 2.461 5.489 -4.196 1.00 . A A . 15 ASN C 1 1 5 2153 1 1 15 ASN CA C 3.529 5.992 -5.171 1.00 . A A . 15 ASN CA 1 1 5 2154 1 1 15 ASN CB C 4.748 5.074 -5.144 1.00 . A A . 15 ASN CB 1 1 5 2155 1 1 15 ASN CG C 5.496 5.183 -6.474 1.00 . A A . 15 ASN CG 1 1 5 2156 1 1 15 ASN H H 4.399 7.440 -3.834 1.00 . A A . 15 ASN H 1 1 5 2157 1 1 15 ASN HA H 3.131 6.043 -6.172 1.00 . A A . 15 ASN HA 1 1 5 2158 1 1 15 ASN HB2 H 5.403 5.368 -4.336 1.00 . A A . 15 ASN HB2 1 1 5 2159 1 1 15 ASN HB3 H 4.427 4.055 -4.995 1.00 . A A . 15 ASN HB3 1 1 5 2160 1 1 15 ASN HD21 H 3.852 4.981 -7.571 1.00 . A A . 15 ASN HD21 1 1 5 2161 1 1 15 ASN HD22 H 5.299 5.176 -8.452 1.00 . A A . 15 ASN HD22 1 1 5 2162 1 1 15 ASN N N 4.044 7.324 -4.740 1.00 . A A . 15 ASN N 1 1 5 2163 1 1 15 ASN ND2 N 4.827 5.107 -7.591 1.00 . A A . 15 ASN ND2 1 1 5 2164 1 1 15 ASN O O 1.969 6.221 -3.361 1.00 . A A . 15 ASN O 1 1 5 2165 1 1 15 ASN OD1 O 6.702 5.338 -6.497 1.00 . A A . 15 ASN OD1 1 1 5 2166 1 1 16 THR C C 1.681 2.571 -2.525 1.00 . A A . 16 THR C 1 1 5 2167 1 1 16 THR CA C 1.069 3.673 -3.391 1.00 . A A . 16 THR CA 1 1 5 2168 1 1 16 THR CB C -0.007 3.108 -4.327 1.00 . A A . 16 THR CB 1 1 5 2169 1 1 16 THR CG2 C -0.807 2.019 -3.610 1.00 . A A . 16 THR CG2 1 1 5 2170 1 1 16 THR H H 2.514 3.672 -4.985 1.00 . A A . 16 THR H 1 1 5 2171 1 1 16 THR HA H 0.649 4.445 -2.766 1.00 . A A . 16 THR HA 1 1 5 2172 1 1 16 THR HB H 0.465 2.685 -5.201 1.00 . A A . 16 THR HB 1 1 5 2173 1 1 16 THR HG1 H -0.519 4.562 -5.513 1.00 . A A . 16 THR HG1 1 1 5 2174 1 1 16 THR HG21 H -0.139 1.234 -3.288 1.00 . A A . 16 THR HG21 1 1 5 2175 1 1 16 THR HG22 H -1.543 1.610 -4.286 1.00 . A A . 16 THR HG22 1 1 5 2176 1 1 16 THR HG23 H -1.305 2.445 -2.751 1.00 . A A . 16 THR HG23 1 1 5 2177 1 1 16 THR N N 2.102 4.240 -4.303 1.00 . A A . 16 THR N 1 1 5 2178 1 1 16 THR O O 2.805 2.155 -2.729 1.00 . A A . 16 THR O 1 1 5 2179 1 1 16 THR OG1 O -0.881 4.155 -4.723 1.00 . A A . 16 THR OG1 1 1 5 2180 1 1 17 CYS C C 0.334 0.133 -0.191 1.00 . A A . 17 CYS C 1 1 5 2181 1 1 17 CYS CA C 1.476 1.032 -0.670 1.00 . A A . 17 CYS CA 1 1 5 2182 1 1 17 CYS CB C 2.108 1.780 0.501 1.00 . A A . 17 CYS CB 1 1 5 2183 1 1 17 CYS H H 0.045 2.456 -1.412 1.00 . A A . 17 CYS H 1 1 5 2184 1 1 17 CYS HA H 2.223 0.452 -1.183 1.00 . A A . 17 CYS HA 1 1 5 2185 1 1 17 CYS HB2 H 2.154 2.835 0.271 1.00 . A A . 17 CYS HB2 1 1 5 2186 1 1 17 CYS HB3 H 1.510 1.630 1.386 1.00 . A A . 17 CYS HB3 1 1 5 2187 1 1 17 CYS N N 0.947 2.102 -1.558 1.00 . A A . 17 CYS N 1 1 5 2188 1 1 17 CYS O O -0.510 0.541 0.581 1.00 . A A . 17 CYS O 1 1 5 2189 1 1 17 CYS SG S 3.782 1.151 0.782 1.00 . A A . 17 CYS SG 1 1 5 2190 1 1 18 ARG C C -0.597 -2.410 1.238 1.00 . A A . 18 ARG C 1 1 5 2191 1 1 18 ARG CA C -0.776 -2.019 -0.227 1.00 . A A . 18 ARG CA 1 1 5 2192 1 1 18 ARG CB C -0.608 -3.238 -1.129 1.00 . A A . 18 ARG CB 1 1 5 2193 1 1 18 ARG CD C -2.831 -4.215 -1.685 1.00 . A A . 18 ARG CD 1 1 5 2194 1 1 18 ARG CG C -1.733 -3.267 -2.161 1.00 . A A . 18 ARG CG 1 1 5 2195 1 1 18 ARG CZ C -3.446 -6.462 -2.349 1.00 . A A . 18 ARG CZ 1 1 5 2196 1 1 18 ARG H H 0.995 -1.394 -1.268 1.00 . A A . 18 ARG H 1 1 5 2197 1 1 18 ARG HA H -1.744 -1.573 -0.385 1.00 . A A . 18 ARG HA 1 1 5 2198 1 1 18 ARG HB2 H 0.346 -3.182 -1.636 1.00 . A A . 18 ARG HB2 1 1 5 2199 1 1 18 ARG HB3 H -0.646 -4.137 -0.532 1.00 . A A . 18 ARG HB3 1 1 5 2200 1 1 18 ARG HD2 H -2.755 -4.369 -0.617 1.00 . A A . 18 ARG HD2 1 1 5 2201 1 1 18 ARG HD3 H -3.803 -3.823 -1.943 1.00 . A A . 18 ARG HD3 1 1 5 2202 1 1 18 ARG HE H -1.766 -5.593 -2.950 1.00 . A A . 18 ARG HE 1 1 5 2203 1 1 18 ARG HG2 H -2.140 -2.272 -2.277 1.00 . A A . 18 ARG HG2 1 1 5 2204 1 1 18 ARG HG3 H -1.347 -3.611 -3.107 1.00 . A A . 18 ARG HG3 1 1 5 2205 1 1 18 ARG HH11 H -5.003 -5.321 -2.879 1.00 . A A . 18 ARG HH11 1 1 5 2206 1 1 18 ARG HH12 H -5.366 -6.985 -2.569 1.00 . A A . 18 ARG HH12 1 1 5 2207 1 1 18 ARG HH21 H -2.091 -7.831 -1.801 1.00 . A A . 18 ARG HH21 1 1 5 2208 1 1 18 ARG HH22 H -3.716 -8.407 -1.958 1.00 . A A . 18 ARG HH22 1 1 5 2209 1 1 18 ARG N N 0.304 -1.088 -0.647 1.00 . A A . 18 ARG N 1 1 5 2210 1 1 18 ARG NE N -2.581 -5.487 -2.417 1.00 . A A . 18 ARG NE 1 1 5 2211 1 1 18 ARG NH1 N -4.703 -6.238 -2.620 1.00 . A A . 18 ARG NH1 1 1 5 2212 1 1 18 ARG NH2 N -3.054 -7.660 -2.009 1.00 . A A . 18 ARG NH2 1 1 5 2213 1 1 18 ARG O O 0.503 -2.636 1.696 1.00 . A A . 18 ARG O 1 1 5 2214 1 1 19 CYS C C -1.392 -4.396 3.530 1.00 . A A . 19 CYS C 1 1 5 2215 1 1 19 CYS CA C -1.548 -2.878 3.409 1.00 . A A . 19 CYS CA 1 1 5 2216 1 1 19 CYS CB C -2.850 -2.413 4.060 1.00 . A A . 19 CYS CB 1 1 5 2217 1 1 19 CYS H H -2.550 -2.311 1.583 1.00 . A A . 19 CYS H 1 1 5 2218 1 1 19 CYS HA H -0.708 -2.377 3.864 1.00 . A A . 19 CYS HA 1 1 5 2219 1 1 19 CYS HB2 H -3.094 -1.420 3.708 1.00 . A A . 19 CYS HB2 1 1 5 2220 1 1 19 CYS HB3 H -3.648 -3.095 3.802 1.00 . A A . 19 CYS HB3 1 1 5 2221 1 1 19 CYS N N -1.669 -2.495 1.975 1.00 . A A . 19 CYS N 1 1 5 2222 1 1 19 CYS O O -2.298 -5.151 3.234 1.00 . A A . 19 CYS O 1 1 5 2223 1 1 19 CYS SG S -2.642 -2.379 5.859 1.00 . A A . 19 CYS SG 1 1 5 2224 1 1 20 GLY C C -1.160 -6.934 4.907 1.00 . A A . 20 GLY C 1 1 5 2225 1 1 20 GLY CA C -0.023 -6.315 4.093 1.00 . A A . 20 GLY CA 1 1 5 2226 1 1 20 GLY H H 0.472 -4.221 4.186 1.00 . A A . 20 GLY H 1 1 5 2227 1 1 20 GLY HA2 H 0.005 -6.766 3.110 1.00 . A A . 20 GLY HA2 1 1 5 2228 1 1 20 GLY HA3 H 0.915 -6.491 4.599 1.00 . A A . 20 GLY HA3 1 1 5 2229 1 1 20 GLY N N -0.245 -4.848 3.957 1.00 . A A . 20 GLY N 1 1 5 2230 1 1 20 GLY O O -1.888 -6.249 5.598 1.00 . A A . 20 GLY O 1 1 5 2231 1 1 21 SER C C -2.054 -8.922 7.091 1.00 . A A . 21 SER C 1 1 5 2232 1 1 21 SER CA C -2.401 -8.898 5.600 1.00 . A A . 21 SER CA 1 1 5 2233 1 1 21 SER CB C -2.452 -10.317 5.042 1.00 . A A . 21 SER CB 1 1 5 2234 1 1 21 SER H H -0.713 -8.758 4.268 1.00 . A A . 21 SER H 1 1 5 2235 1 1 21 SER HA H -3.343 -8.401 5.437 1.00 . A A . 21 SER HA 1 1 5 2236 1 1 21 SER HB2 H -1.592 -10.490 4.417 1.00 . A A . 21 SER HB2 1 1 5 2237 1 1 21 SER HB3 H -2.448 -11.023 5.861 1.00 . A A . 21 SER HB3 1 1 5 2238 1 1 21 SER HG H -3.611 -9.828 3.557 1.00 . A A . 21 SER HG 1 1 5 2239 1 1 21 SER N N -1.314 -8.227 4.831 1.00 . A A . 21 SER N 1 1 5 2240 1 1 21 SER O O -2.838 -9.351 7.916 1.00 . A A . 21 SER O 1 1 5 2241 1 1 21 SER OG O -3.633 -10.475 4.267 1.00 . A A . 21 SER OG 1 1 5 2242 1 1 22 ASP C C -0.885 -7.129 9.517 1.00 . A A . 22 ASP C 1 1 5 2243 1 1 22 ASP CA C -0.483 -8.456 8.873 1.00 . A A . 22 ASP CA 1 1 5 2244 1 1 22 ASP CB C 1.038 -8.606 8.855 1.00 . A A . 22 ASP CB 1 1 5 2245 1 1 22 ASP CG C 1.472 -9.576 9.957 1.00 . A A . 22 ASP CG 1 1 5 2246 1 1 22 ASP H H -0.273 -8.121 6.761 1.00 . A A . 22 ASP H 1 1 5 2247 1 1 22 ASP HA H -0.932 -9.284 9.399 1.00 . A A . 22 ASP HA 1 1 5 2248 1 1 22 ASP HB2 H 1.350 -8.990 7.894 1.00 . A A . 22 ASP HB2 1 1 5 2249 1 1 22 ASP HB3 H 1.497 -7.643 9.026 1.00 . A A . 22 ASP HB3 1 1 5 2250 1 1 22 ASP N N -0.886 -8.464 7.441 1.00 . A A . 22 ASP N 1 1 5 2251 1 1 22 ASP O O -0.646 -6.896 10.686 1.00 . A A . 22 ASP O 1 1 5 2252 1 1 22 ASP OD1 O 0.774 -10.553 10.168 1.00 . A A . 22 ASP OD1 1 1 5 2253 1 1 22 ASP OD2 O 2.496 -9.323 10.570 1.00 . A A . 22 ASP OD2 1 1 5 2254 1 1 23 GLY C C -0.706 -4.020 9.456 1.00 . A A . 23 GLY C 1 1 5 2255 1 1 23 GLY CA C -1.917 -4.950 9.336 1.00 . A A . 23 GLY CA 1 1 5 2256 1 1 23 GLY H H -1.686 -6.463 7.824 1.00 . A A . 23 GLY H 1 1 5 2257 1 1 23 GLY HA2 H -2.659 -4.497 8.693 1.00 . A A . 23 GLY HA2 1 1 5 2258 1 1 23 GLY HA3 H -2.337 -5.114 10.314 1.00 . A A . 23 GLY HA3 1 1 5 2259 1 1 23 GLY N N -1.498 -6.257 8.764 1.00 . A A . 23 GLY N 1 1 5 2260 1 1 23 GLY O O -0.681 -2.944 8.893 1.00 . A A . 23 GLY O 1 1 5 2261 1 1 24 LYS C C 2.523 -3.852 9.248 1.00 . A A . 24 LYS C 1 1 5 2262 1 1 24 LYS CA C 1.500 -3.556 10.350 1.00 . A A . 24 LYS CA 1 1 5 2263 1 1 24 LYS CB C 2.077 -3.917 11.721 1.00 . A A . 24 LYS CB 1 1 5 2264 1 1 24 LYS CD C 0.036 -2.805 12.642 1.00 . A A . 24 LYS CD 1 1 5 2265 1 1 24 LYS CE C -0.187 -2.219 14.038 1.00 . A A . 24 LYS CE 1 1 5 2266 1 1 24 LYS CG C 0.942 -4.033 12.742 1.00 . A A . 24 LYS CG 1 1 5 2267 1 1 24 LYS H H 0.256 -5.294 10.641 1.00 . A A . 24 LYS H 1 1 5 2268 1 1 24 LYS HA H 1.219 -2.515 10.332 1.00 . A A . 24 LYS HA 1 1 5 2269 1 1 24 LYS HB2 H 2.599 -4.859 11.654 1.00 . A A . 24 LYS HB2 1 1 5 2270 1 1 24 LYS HB3 H 2.762 -3.145 12.036 1.00 . A A . 24 LYS HB3 1 1 5 2271 1 1 24 LYS HD2 H 0.502 -2.063 12.010 1.00 . A A . 24 LYS HD2 1 1 5 2272 1 1 24 LYS HD3 H -0.915 -3.092 12.218 1.00 . A A . 24 LYS HD3 1 1 5 2273 1 1 24 LYS HE2 H -0.329 -3.013 14.759 1.00 . A A . 24 LYS HE2 1 1 5 2274 1 1 24 LYS HE3 H 0.645 -1.595 14.322 1.00 . A A . 24 LYS HE3 1 1 5 2275 1 1 24 LYS HG2 H 0.365 -4.924 12.537 1.00 . A A . 24 LYS HG2 1 1 5 2276 1 1 24 LYS HG3 H 1.356 -4.092 13.736 1.00 . A A . 24 LYS HG3 1 1 5 2277 1 1 24 LYS HZ1 H -2.249 -2.024 13.833 1.00 . A A . 24 LYS HZ1 1 1 5 2278 1 1 24 LYS HZ2 H -1.356 -0.796 13.070 1.00 . A A . 24 LYS HZ2 1 1 5 2279 1 1 24 LYS HZ3 H -1.527 -0.800 14.760 1.00 . A A . 24 LYS HZ3 1 1 5 2280 1 1 24 LYS N N 0.296 -4.424 10.191 1.00 . A A . 24 LYS N 1 1 5 2281 1 1 24 LYS NZ N -1.423 -1.398 13.916 1.00 . A A . 24 LYS NZ 1 1 5 2282 1 1 24 LYS O O 3.674 -4.128 9.517 1.00 . A A . 24 LYS O 1 1 5 2283 1 1 25 SER C C 2.454 -3.604 5.569 1.00 . A A . 25 SER C 1 1 5 2284 1 1 25 SER CA C 3.058 -4.071 6.896 1.00 . A A . 25 SER CA 1 1 5 2285 1 1 25 SER CB C 3.236 -5.587 6.894 1.00 . A A . 25 SER CB 1 1 5 2286 1 1 25 SER H H 1.177 -3.567 7.818 1.00 . A A . 25 SER H 1 1 5 2287 1 1 25 SER HA H 4.005 -3.586 7.074 1.00 . A A . 25 SER HA 1 1 5 2288 1 1 25 SER HB2 H 2.284 -6.064 6.723 1.00 . A A . 25 SER HB2 1 1 5 2289 1 1 25 SER HB3 H 3.926 -5.867 6.107 1.00 . A A . 25 SER HB3 1 1 5 2290 1 1 25 SER HG H 4.665 -5.732 8.207 1.00 . A A . 25 SER HG 1 1 5 2291 1 1 25 SER N N 2.110 -3.795 8.013 1.00 . A A . 25 SER N 1 1 5 2292 1 1 25 SER O O 1.252 -3.598 5.396 1.00 . A A . 25 SER O 1 1 5 2293 1 1 25 SER OG O 3.746 -6.002 8.155 1.00 . A A . 25 SER OG 1 1 5 2294 1 1 26 ALA C C 3.814 -2.740 2.251 1.00 . A A . 26 ALA C 1 1 5 2295 1 1 26 ALA CA C 2.723 -2.757 3.323 1.00 . A A . 26 ALA CA 1 1 5 2296 1 1 26 ALA CB C 2.212 -1.338 3.576 1.00 . A A . 26 ALA CB 1 1 5 2297 1 1 26 ALA H H 4.240 -3.225 4.782 1.00 . A A . 26 ALA H 1 1 5 2298 1 1 26 ALA HA H 1.907 -3.391 3.019 1.00 . A A . 26 ALA HA 1 1 5 2299 1 1 26 ALA HB1 H 2.069 -1.190 4.635 1.00 . A A . 26 ALA HB1 1 1 5 2300 1 1 26 ALA HB2 H 1.272 -1.196 3.062 1.00 . A A . 26 ALA HB2 1 1 5 2301 1 1 26 ALA HB3 H 2.934 -0.624 3.207 1.00 . A A . 26 ALA HB3 1 1 5 2302 1 1 26 ALA N N 3.272 -3.214 4.630 1.00 . A A . 26 ALA N 1 1 5 2303 1 1 26 ALA O O 4.978 -2.542 2.534 1.00 . A A . 26 ALA O 1 1 5 2304 1 1 27 ALA C C 4.235 -1.672 -0.935 1.00 . A A . 27 ALA C 1 1 5 2305 1 1 27 ALA CA C 4.436 -2.921 -0.086 1.00 . A A . 27 ALA CA 1 1 5 2306 1 1 27 ALA CB C 4.136 -4.159 -0.919 1.00 . A A . 27 ALA CB 1 1 5 2307 1 1 27 ALA H H 2.488 -3.084 0.816 1.00 . A A . 27 ALA H 1 1 5 2308 1 1 27 ALA HA H 5.440 -2.964 0.304 1.00 . A A . 27 ALA HA 1 1 5 2309 1 1 27 ALA HB1 H 4.282 -3.929 -1.965 1.00 . A A . 27 ALA HB1 1 1 5 2310 1 1 27 ALA HB2 H 3.112 -4.460 -0.757 1.00 . A A . 27 ALA HB2 1 1 5 2311 1 1 27 ALA HB3 H 4.800 -4.957 -0.630 1.00 . A A . 27 ALA HB3 1 1 5 2312 1 1 27 ALA N N 3.436 -2.937 1.018 1.00 . A A . 27 ALA N 1 1 5 2313 1 1 27 ALA O O 3.146 -1.402 -1.401 1.00 . A A . 27 ALA O 1 1 5 2314 1 1 28 CYS C C 5.551 0.065 -3.405 1.00 . A A . 28 CYS C 1 1 5 2315 1 1 28 CYS CA C 5.093 0.319 -1.967 1.00 . A A . 28 CYS CA 1 1 5 2316 1 1 28 CYS CB C 5.977 1.373 -1.299 1.00 . A A . 28 CYS CB 1 1 5 2317 1 1 28 CYS H H 6.136 -1.132 -0.764 1.00 . A A . 28 CYS H 1 1 5 2318 1 1 28 CYS HA H 4.064 0.631 -1.950 1.00 . A A . 28 CYS HA 1 1 5 2319 1 1 28 CYS HB2 H 6.734 0.885 -0.703 1.00 . A A . 28 CYS HB2 1 1 5 2320 1 1 28 CYS HB3 H 6.453 1.976 -2.060 1.00 . A A . 28 CYS HB3 1 1 5 2321 1 1 28 CYS N N 5.262 -0.906 -1.145 1.00 . A A . 28 CYS N 1 1 5 2322 1 1 28 CYS O O 6.612 -0.480 -3.638 1.00 . A A . 28 CYS O 1 1 5 2323 1 1 28 CYS SG S 4.963 2.435 -0.238 1.00 . A A . 28 CYS SG 1 1 5 2324 1 1 29 THR C C 6.647 0.583 -5.964 1.00 . A A . 29 THR C 1 1 5 2325 1 1 29 THR CA C 5.165 0.243 -5.795 1.00 . A A . 29 THR CA 1 1 5 2326 1 1 29 THR CB C 4.300 1.201 -6.620 1.00 . A A . 29 THR CB 1 1 5 2327 1 1 29 THR CG2 C 2.832 1.063 -6.210 1.00 . A A . 29 THR CG2 1 1 5 2328 1 1 29 THR H H 3.911 0.901 -4.163 1.00 . A A . 29 THR H 1 1 5 2329 1 1 29 THR HA H 4.975 -0.777 -6.090 1.00 . A A . 29 THR HA 1 1 5 2330 1 1 29 THR HB H 4.399 0.961 -7.667 1.00 . A A . 29 THR HB 1 1 5 2331 1 1 29 THR HG1 H 4.051 3.125 -6.731 1.00 . A A . 29 THR HG1 1 1 5 2332 1 1 29 THR HG21 H 2.528 1.943 -5.662 1.00 . A A . 29 THR HG21 1 1 5 2333 1 1 29 THR HG22 H 2.712 0.191 -5.586 1.00 . A A . 29 THR HG22 1 1 5 2334 1 1 29 THR HG23 H 2.221 0.961 -7.094 1.00 . A A . 29 THR HG23 1 1 5 2335 1 1 29 THR N N 4.762 0.459 -4.372 1.00 . A A . 29 THR N 1 1 5 2336 1 1 29 THR O O 7.323 0.060 -6.828 1.00 . A A . 29 THR O 1 1 5 2337 1 1 29 THR OG1 O 4.731 2.535 -6.397 1.00 . A A . 29 THR OG1 1 1 5 2338 1 1 30 LEU C C 8.967 2.126 -6.691 1.00 . A A . 30 LEU C 1 1 5 2339 1 1 30 LEU CA C 8.592 1.837 -5.237 1.00 . A A . 30 LEU CA 1 1 5 2340 1 1 30 LEU CB C 9.359 0.622 -4.713 1.00 . A A . 30 LEU CB 1 1 5 2341 1 1 30 LEU CD1 C 9.667 -0.620 -2.566 1.00 . A A . 30 LEU CD1 1 1 5 2342 1 1 30 LEU CD2 C 10.873 1.532 -2.946 1.00 . A A . 30 LEU CD2 1 1 5 2343 1 1 30 LEU CG C 9.573 0.767 -3.204 1.00 . A A . 30 LEU CG 1 1 5 2344 1 1 30 LEU H H 6.590 1.865 -4.449 1.00 . A A . 30 LEU H 1 1 5 2345 1 1 30 LEU HA H 8.796 2.696 -4.617 1.00 . A A . 30 LEU HA 1 1 5 2346 1 1 30 LEU HB2 H 8.791 -0.275 -4.911 1.00 . A A . 30 LEU HB2 1 1 5 2347 1 1 30 LEU HB3 H 10.318 0.560 -5.206 1.00 . A A . 30 LEU HB3 1 1 5 2348 1 1 30 LEU HD11 H 9.589 -1.376 -3.332 1.00 . A A . 30 LEU HD11 1 1 5 2349 1 1 30 LEU HD12 H 8.862 -0.744 -1.856 1.00 . A A . 30 LEU HD12 1 1 5 2350 1 1 30 LEU HD13 H 10.614 -0.719 -2.056 1.00 . A A . 30 LEU HD13 1 1 5 2351 1 1 30 LEU HD21 H 11.074 2.191 -3.777 1.00 . A A . 30 LEU HD21 1 1 5 2352 1 1 30 LEU HD22 H 11.687 0.831 -2.838 1.00 . A A . 30 LEU HD22 1 1 5 2353 1 1 30 LEU HD23 H 10.775 2.114 -2.041 1.00 . A A . 30 LEU HD23 1 1 5 2354 1 1 30 LEU HG H 8.743 1.307 -2.773 1.00 . A A . 30 LEU HG 1 1 5 2355 1 1 30 LEU N N 7.155 1.457 -5.138 1.00 . A A . 30 LEU N 1 1 5 2356 1 1 30 LEU O O 9.650 1.351 -7.331 1.00 . A A . 30 LEU O 1 1 5 2357 1 1 31 LYS C C 10.005 4.592 -8.675 1.00 . A A . 31 LYS C 1 1 5 2358 1 1 31 LYS CA C 8.865 3.572 -8.630 1.00 . A A . 31 LYS CA 1 1 5 2359 1 1 31 LYS CB C 7.585 4.172 -9.213 1.00 . A A . 31 LYS CB 1 1 5 2360 1 1 31 LYS CD C 6.438 2.542 -10.720 1.00 . A A . 31 LYS CD 1 1 5 2361 1 1 31 LYS CE C 6.892 1.444 -9.753 1.00 . A A . 31 LYS CE 1 1 5 2362 1 1 31 LYS CG C 7.421 3.712 -10.662 1.00 . A A . 31 LYS CG 1 1 5 2363 1 1 31 LYS H H 7.980 3.848 -6.683 1.00 . A A . 31 LYS H 1 1 5 2364 1 1 31 LYS HA H 9.134 2.680 -9.174 1.00 . A A . 31 LYS HA 1 1 5 2365 1 1 31 LYS HB2 H 6.736 3.846 -8.630 1.00 . A A . 31 LYS HB2 1 1 5 2366 1 1 31 LYS HB3 H 7.649 5.250 -9.185 1.00 . A A . 31 LYS HB3 1 1 5 2367 1 1 31 LYS HD2 H 5.454 2.885 -10.438 1.00 . A A . 31 LYS HD2 1 1 5 2368 1 1 31 LYS HD3 H 6.409 2.144 -11.723 1.00 . A A . 31 LYS HD3 1 1 5 2369 1 1 31 LYS HE2 H 7.888 1.108 -10.008 1.00 . A A . 31 LYS HE2 1 1 5 2370 1 1 31 LYS HE3 H 6.862 1.803 -8.736 1.00 . A A . 31 LYS HE3 1 1 5 2371 1 1 31 LYS HG2 H 7.043 4.530 -11.259 1.00 . A A . 31 LYS HG2 1 1 5 2372 1 1 31 LYS HG3 H 8.378 3.395 -11.050 1.00 . A A . 31 LYS HG3 1 1 5 2373 1 1 31 LYS HZ1 H 6.182 -0.469 -9.347 1.00 . A A . 31 LYS HZ1 1 1 5 2374 1 1 31 LYS HZ2 H 5.887 0.057 -10.934 1.00 . A A . 31 LYS HZ2 1 1 5 2375 1 1 31 LYS HZ3 H 4.962 0.670 -9.648 1.00 . A A . 31 LYS HZ3 1 1 5 2376 1 1 31 LYS N N 8.528 3.236 -7.217 1.00 . A A . 31 LYS N 1 1 5 2377 1 1 31 LYS NZ N 5.906 0.342 -9.934 1.00 . A A . 31 LYS NZ 1 1 5 2378 1 1 31 LYS O O 10.909 4.490 -9.481 1.00 . A A . 31 LYS O 1 1 5 2379 1 1 32 ALA C C 10.816 7.642 -6.726 1.00 . A A . 32 ALA C 1 1 5 2380 1 1 32 ALA CA C 11.055 6.599 -7.821 1.00 . A A . 32 ALA CA 1 1 5 2381 1 1 32 ALA CB C 10.981 7.249 -9.203 1.00 . A A . 32 ALA CB 1 1 5 2382 1 1 32 ALA H H 9.233 5.644 -7.176 1.00 . A A . 32 ALA H 1 1 5 2383 1 1 32 ALA HA H 12.014 6.131 -7.688 1.00 . A A . 32 ALA HA 1 1 5 2384 1 1 32 ALA HB1 H 11.825 6.931 -9.796 1.00 . A A . 32 ALA HB1 1 1 5 2385 1 1 32 ALA HB2 H 11.000 8.323 -9.098 1.00 . A A . 32 ALA HB2 1 1 5 2386 1 1 32 ALA HB3 H 10.065 6.951 -9.692 1.00 . A A . 32 ALA HB3 1 1 5 2387 1 1 32 ALA N N 9.971 5.576 -7.818 1.00 . A A . 32 ALA N 1 1 5 2388 1 1 32 ALA O O 11.524 7.696 -5.741 1.00 . A A . 32 ALA O 1 1 5 2389 1 1 33 CYS C C 10.766 10.418 -5.679 1.00 . A A . 33 CYS C 1 1 5 2390 1 1 33 CYS CA C 9.538 9.525 -5.877 1.00 . A A . 33 CYS CA 1 1 5 2391 1 1 33 CYS CB C 9.215 8.765 -4.585 1.00 . A A . 33 CYS CB 1 1 5 2392 1 1 33 CYS H H 9.274 8.410 -7.705 1.00 . A A . 33 CYS H 1 1 5 2393 1 1 33 CYS HA H 8.690 10.118 -6.177 1.00 . A A . 33 CYS HA 1 1 5 2394 1 1 33 CYS HB2 H 10.057 8.144 -4.314 1.00 . A A . 33 CYS HB2 1 1 5 2395 1 1 33 CYS HB3 H 9.021 9.476 -3.793 1.00 . A A . 33 CYS HB3 1 1 5 2396 1 1 33 CYS N N 9.826 8.473 -6.899 1.00 . A A . 33 CYS N 1 1 5 2397 1 1 33 CYS O O 11.888 9.984 -5.846 1.00 . A A . 33 CYS O 1 1 5 2398 1 1 33 CYS SG S 7.752 7.720 -4.824 1.00 . A A . 33 CYS SG 1 1 5 2399 1 1 34 PRO C C 12.302 12.342 -3.767 1.00 . A A . 34 PRO C 1 1 5 2400 1 1 34 PRO CA C 11.599 12.624 -5.098 1.00 . A A . 34 PRO CA 1 1 5 2401 1 1 34 PRO CB C 10.874 13.965 -5.054 1.00 . A A . 34 PRO CB 1 1 5 2402 1 1 34 PRO CD C 9.181 12.237 -5.111 1.00 . A A . 34 PRO CD 1 1 5 2403 1 1 34 PRO CG C 9.473 13.640 -4.642 1.00 . A A . 34 PRO CG 1 1 5 2404 1 1 34 PRO HA H 12.303 12.610 -5.915 1.00 . A A . 34 PRO HA 1 1 5 2405 1 1 34 PRO HB2 H 11.341 14.619 -4.329 1.00 . A A . 34 PRO HB2 1 1 5 2406 1 1 34 PRO HB3 H 10.874 14.425 -6.030 1.00 . A A . 34 PRO HB3 1 1 5 2407 1 1 34 PRO HD2 H 8.639 11.690 -4.351 1.00 . A A . 34 PRO HD2 1 1 5 2408 1 1 34 PRO HD3 H 8.627 12.255 -6.037 1.00 . A A . 34 PRO HD3 1 1 5 2409 1 1 34 PRO HG2 H 9.386 13.695 -3.565 1.00 . A A . 34 PRO HG2 1 1 5 2410 1 1 34 PRO HG3 H 8.784 14.327 -5.104 1.00 . A A . 34 PRO HG3 1 1 5 2411 1 1 34 PRO N N 10.506 11.648 -5.326 1.00 . A A . 34 PRO N 1 1 5 2412 1 1 34 PRO O O 12.449 13.216 -2.936 1.00 . A A . 34 PRO O 1 1 5 2413 1 1 35 GLN C C 12.631 11.345 -1.091 1.00 . A A . 35 GLN C 1 1 5 2414 1 1 35 GLN CA C 13.427 10.797 -2.278 1.00 . A A . 35 GLN CA 1 1 5 2415 1 1 35 GLN CB C 14.791 11.481 -2.376 1.00 . A A . 35 GLN CB 1 1 5 2416 1 1 35 GLN CD C 16.434 12.166 -4.132 1.00 . A A . 35 GLN CD 1 1 5 2417 1 1 35 GLN CG C 15.482 11.060 -3.676 1.00 . A A . 35 GLN CG 1 1 5 2418 1 1 35 GLN H H 12.606 10.439 -4.238 1.00 . A A . 35 GLN H 1 1 5 2419 1 1 35 GLN HA H 13.556 9.729 -2.186 1.00 . A A . 35 GLN HA 1 1 5 2420 1 1 35 GLN HB2 H 14.657 12.553 -2.369 1.00 . A A . 35 GLN HB2 1 1 5 2421 1 1 35 GLN HB3 H 15.403 11.190 -1.535 1.00 . A A . 35 GLN HB3 1 1 5 2422 1 1 35 GLN HE21 H 17.991 10.945 -4.309 1.00 . A A . 35 GLN HE21 1 1 5 2423 1 1 35 GLN HE22 H 18.295 12.570 -4.695 1.00 . A A . 35 GLN HE22 1 1 5 2424 1 1 35 GLN HG2 H 16.039 10.150 -3.507 1.00 . A A . 35 GLN HG2 1 1 5 2425 1 1 35 GLN HG3 H 14.738 10.890 -4.439 1.00 . A A . 35 GLN HG3 1 1 5 2426 1 1 35 GLN N N 12.736 11.130 -3.557 1.00 . A A . 35 GLN N 1 1 5 2427 1 1 35 GLN NE2 N 17.677 11.869 -4.401 1.00 . A A . 35 GLN NE2 1 1 5 2428 1 1 35 GLN O O 11.828 10.605 -0.550 1.00 . A A . 35 GLN O 1 1 5 2429 1 1 35 GLN OXT O 12.841 12.496 -0.745 1.00 . A A . 35 GLN OXT 1 1 5 2430 1 1 35 GLN OE1 O 16.045 13.311 -4.246 1.00 . A A . 35 GLN OE1 1 1 6 2431 1 1 1 GLU C C 2.742 0.710 10.304 1.00 . A A . 1 GLU C 1 1 6 2432 1 1 1 GLU CA C 3.833 1.192 11.264 1.00 . A A . 1 GLU CA 1 1 6 2433 1 1 1 GLU CB C 5.195 1.197 10.565 1.00 . A A . 1 GLU CB 1 1 6 2434 1 1 1 GLU CD C 7.640 1.376 11.054 1.00 . A A . 1 GLU CD 1 1 6 2435 1 1 1 GLU CG C 6.243 1.823 11.488 1.00 . A A . 1 GLU CG 1 1 6 2436 1 1 1 GLU H1 H 3.655 0.690 13.279 1.00 . A A . 1 GLU H1 1 1 6 2437 1 1 1 GLU H2 H 4.974 -0.046 12.500 1.00 . A A . 1 GLU H2 1 1 6 2438 1 1 1 GLU H3 H 3.394 -0.607 12.219 1.00 . A A . 1 GLU H3 1 1 6 2439 1 1 1 GLU HA H 3.604 2.180 11.630 1.00 . A A . 1 GLU HA 1 1 6 2440 1 1 1 GLU HB2 H 5.481 0.181 10.329 1.00 . A A . 1 GLU HB2 1 1 6 2441 1 1 1 GLU HB3 H 5.131 1.773 9.653 1.00 . A A . 1 GLU HB3 1 1 6 2442 1 1 1 GLU HG2 H 6.174 2.900 11.431 1.00 . A A . 1 GLU HG2 1 1 6 2443 1 1 1 GLU HG3 H 6.064 1.504 12.503 1.00 . A A . 1 GLU HG3 1 1 6 2444 1 1 1 GLU N N 3.976 0.235 12.401 1.00 . A A . 1 GLU N 1 1 6 2445 1 1 1 GLU O O 2.003 -0.207 10.601 1.00 . A A . 1 GLU O 1 1 6 2446 1 1 1 GLU OE1 O 7.799 0.205 10.752 1.00 . A A . 1 GLU OE1 1 1 6 2447 1 1 1 GLU OE2 O 8.527 2.213 11.031 1.00 . A A . 1 GLU OE2 1 1 6 2448 1 1 2 VAL C C 0.226 0.842 8.850 1.00 . A A . 2 VAL C 1 1 6 2449 1 1 2 VAL CA C 1.596 0.893 8.178 1.00 . A A . 2 VAL CA 1 1 6 2450 1 1 2 VAL CB C 2.022 -0.500 7.731 1.00 . A A . 2 VAL CB 1 1 6 2451 1 1 2 VAL CG1 C 1.040 -1.018 6.680 1.00 . A A . 2 VAL CG1 1 1 6 2452 1 1 2 VAL CG2 C 3.421 -0.418 7.129 1.00 . A A . 2 VAL CG2 1 1 6 2453 1 1 2 VAL H H 3.245 2.055 8.934 1.00 . A A . 2 VAL H 1 1 6 2454 1 1 2 VAL HA H 1.575 1.561 7.333 1.00 . A A . 2 VAL HA 1 1 6 2455 1 1 2 VAL HB H 2.029 -1.167 8.580 1.00 . A A . 2 VAL HB 1 1 6 2456 1 1 2 VAL HG11 H 0.253 -1.576 7.167 1.00 . A A . 2 VAL HG11 1 1 6 2457 1 1 2 VAL HG12 H 1.562 -1.659 5.987 1.00 . A A . 2 VAL HG12 1 1 6 2458 1 1 2 VAL HG13 H 0.611 -0.182 6.146 1.00 . A A . 2 VAL HG13 1 1 6 2459 1 1 2 VAL HG21 H 3.830 -1.412 7.035 1.00 . A A . 2 VAL HG21 1 1 6 2460 1 1 2 VAL HG22 H 4.053 0.173 7.775 1.00 . A A . 2 VAL HG22 1 1 6 2461 1 1 2 VAL HG23 H 3.365 0.046 6.156 1.00 . A A . 2 VAL HG23 1 1 6 2462 1 1 2 VAL N N 2.637 1.319 9.156 1.00 . A A . 2 VAL N 1 1 6 2463 1 1 2 VAL O O -0.616 0.038 8.506 1.00 . A A . 2 VAL O 1 1 6 2464 1 1 3 THR C C -2.449 1.722 9.464 1.00 . A A . 3 THR C 1 1 6 2465 1 1 3 THR CA C -1.319 1.712 10.498 1.00 . A A . 3 THR CA 1 1 6 2466 1 1 3 THR CB C -1.324 3.006 11.316 1.00 . A A . 3 THR CB 1 1 6 2467 1 1 3 THR CG2 C -2.643 3.123 12.081 1.00 . A A . 3 THR CG2 1 1 6 2468 1 1 3 THR H H 0.700 2.336 10.054 1.00 . A A . 3 THR H 1 1 6 2469 1 1 3 THR HA H -1.410 0.860 11.152 1.00 . A A . 3 THR HA 1 1 6 2470 1 1 3 THR HB H -1.222 3.851 10.654 1.00 . A A . 3 THR HB 1 1 6 2471 1 1 3 THR HG1 H 0.256 3.803 12.122 1.00 . A A . 3 THR HG1 1 1 6 2472 1 1 3 THR HG21 H -2.775 4.139 12.418 1.00 . A A . 3 THR HG21 1 1 6 2473 1 1 3 THR HG22 H -2.624 2.460 12.934 1.00 . A A . 3 THR HG22 1 1 6 2474 1 1 3 THR HG23 H -3.461 2.848 11.431 1.00 . A A . 3 THR HG23 1 1 6 2475 1 1 3 THR N N 0.001 1.699 9.801 1.00 . A A . 3 THR N 1 1 6 2476 1 1 3 THR O O -2.896 2.764 9.029 1.00 . A A . 3 THR O 1 1 6 2477 1 1 3 THR OG1 O -0.241 2.989 12.235 1.00 . A A . 3 THR OG1 1 1 6 2478 1 1 4 CYS C C -4.608 -0.899 8.010 1.00 . A A . 4 CYS C 1 1 6 2479 1 1 4 CYS CA C -3.992 0.509 8.038 1.00 . A A . 4 CYS CA 1 1 6 2480 1 1 4 CYS CB C -3.278 0.861 6.716 1.00 . A A . 4 CYS CB 1 1 6 2481 1 1 4 CYS H H -2.523 -0.262 9.414 1.00 . A A . 4 CYS H 1 1 6 2482 1 1 4 CYS HA H -4.748 1.246 8.255 1.00 . A A . 4 CYS HA 1 1 6 2483 1 1 4 CYS HB2 H -3.396 1.918 6.523 1.00 . A A . 4 CYS HB2 1 1 6 2484 1 1 4 CYS HB3 H -2.225 0.634 6.814 1.00 . A A . 4 CYS HB3 1 1 6 2485 1 1 4 CYS N N -2.904 0.566 9.058 1.00 . A A . 4 CYS N 1 1 6 2486 1 1 4 CYS O O -4.096 -1.824 8.609 1.00 . A A . 4 CYS O 1 1 6 2487 1 1 4 CYS SG S -3.966 -0.073 5.318 1.00 . A A . 4 CYS SG 1 1 6 2488 1 1 5 GLU C C -5.749 -3.213 6.088 1.00 . A A . 5 GLU C 1 1 6 2489 1 1 5 GLU CA C -6.352 -2.401 7.238 1.00 . A A . 5 GLU CA 1 1 6 2490 1 1 5 GLU CB C -7.829 -2.108 6.972 1.00 . A A . 5 GLU CB 1 1 6 2491 1 1 5 GLU CD C -9.831 -0.843 7.775 1.00 . A A . 5 GLU CD 1 1 6 2492 1 1 5 GLU CG C -8.343 -1.109 8.011 1.00 . A A . 5 GLU CG 1 1 6 2493 1 1 5 GLU H H -6.094 -0.301 6.837 1.00 . A A . 5 GLU H 1 1 6 2494 1 1 5 GLU HA H -6.242 -2.929 8.171 1.00 . A A . 5 GLU HA 1 1 6 2495 1 1 5 GLU HB2 H -7.941 -1.689 5.982 1.00 . A A . 5 GLU HB2 1 1 6 2496 1 1 5 GLU HB3 H -8.398 -3.023 7.043 1.00 . A A . 5 GLU HB3 1 1 6 2497 1 1 5 GLU HG2 H -8.203 -1.517 9.001 1.00 . A A . 5 GLU HG2 1 1 6 2498 1 1 5 GLU HG3 H -7.796 -0.183 7.922 1.00 . A A . 5 GLU HG3 1 1 6 2499 1 1 5 GLU N N -5.701 -1.062 7.314 1.00 . A A . 5 GLU N 1 1 6 2500 1 1 5 GLU O O -5.550 -2.700 5.005 1.00 . A A . 5 GLU O 1 1 6 2501 1 1 5 GLU OE1 O -10.430 -1.579 7.007 1.00 . A A . 5 GLU OE1 1 1 6 2502 1 1 5 GLU OE2 O -10.347 0.091 8.366 1.00 . A A . 5 GLU OE2 1 1 6 2503 1 1 6 PRO C C -5.869 -5.629 4.210 1.00 . A A . 6 PRO C 1 1 6 2504 1 1 6 PRO CA C -4.876 -5.356 5.343 1.00 . A A . 6 PRO CA 1 1 6 2505 1 1 6 PRO CB C -4.562 -6.629 6.125 1.00 . A A . 6 PRO CB 1 1 6 2506 1 1 6 PRO CD C -5.697 -5.151 7.640 1.00 . A A . 6 PRO CD 1 1 6 2507 1 1 6 PRO CG C -5.498 -6.601 7.289 1.00 . A A . 6 PRO CG 1 1 6 2508 1 1 6 PRO HA H -3.965 -4.930 4.953 1.00 . A A . 6 PRO HA 1 1 6 2509 1 1 6 PRO HB2 H -4.744 -7.501 5.512 1.00 . A A . 6 PRO HB2 1 1 6 2510 1 1 6 PRO HB3 H -3.541 -6.617 6.473 1.00 . A A . 6 PRO HB3 1 1 6 2511 1 1 6 PRO HD2 H -6.704 -4.982 7.999 1.00 . A A . 6 PRO HD2 1 1 6 2512 1 1 6 PRO HD3 H -4.970 -4.831 8.370 1.00 . A A . 6 PRO HD3 1 1 6 2513 1 1 6 PRO HG2 H -6.442 -7.053 7.015 1.00 . A A . 6 PRO HG2 1 1 6 2514 1 1 6 PRO HG3 H -5.063 -7.123 8.127 1.00 . A A . 6 PRO HG3 1 1 6 2515 1 1 6 PRO N N -5.474 -4.459 6.366 1.00 . A A . 6 PRO N 1 1 6 2516 1 1 6 PRO O O -6.983 -6.061 4.434 1.00 . A A . 6 PRO O 1 1 6 2517 1 1 7 GLY C C -7.064 -4.311 1.438 1.00 . A A . 7 GLY C 1 1 6 2518 1 1 7 GLY CA C -6.381 -5.621 1.840 1.00 . A A . 7 GLY CA 1 1 6 2519 1 1 7 GLY H H -4.566 -5.031 2.837 1.00 . A A . 7 GLY H 1 1 6 2520 1 1 7 GLY HA2 H -5.808 -6.001 1.003 1.00 . A A . 7 GLY HA2 1 1 6 2521 1 1 7 GLY HA3 H -7.133 -6.343 2.121 1.00 . A A . 7 GLY HA3 1 1 6 2522 1 1 7 GLY N N -5.469 -5.378 2.992 1.00 . A A . 7 GLY N 1 1 6 2523 1 1 7 GLY O O -8.197 -4.302 0.998 1.00 . A A . 7 GLY O 1 1 6 2524 1 1 8 THR C C -5.980 -0.861 0.750 1.00 . A A . 8 THR C 1 1 6 2525 1 1 8 THR CA C -7.021 -1.896 1.220 1.00 . A A . 8 THR CA 1 1 6 2526 1 1 8 THR CB C -7.703 -1.413 2.502 1.00 . A A . 8 THR CB 1 1 6 2527 1 1 8 THR CG2 C -8.481 -0.129 2.214 1.00 . A A . 8 THR CG2 1 1 6 2528 1 1 8 THR H H -5.483 -3.227 1.957 1.00 . A A . 8 THR H 1 1 6 2529 1 1 8 THR HA H -7.764 -2.048 0.454 1.00 . A A . 8 THR HA 1 1 6 2530 1 1 8 THR HB H -6.956 -1.217 3.256 1.00 . A A . 8 THR HB 1 1 6 2531 1 1 8 THR HG1 H -8.341 -2.646 3.863 1.00 . A A . 8 THR HG1 1 1 6 2532 1 1 8 THR HG21 H -8.186 0.636 2.917 1.00 . A A . 8 THR HG21 1 1 6 2533 1 1 8 THR HG22 H -9.538 -0.319 2.311 1.00 . A A . 8 THR HG22 1 1 6 2534 1 1 8 THR HG23 H -8.265 0.204 1.209 1.00 . A A . 8 THR HG23 1 1 6 2535 1 1 8 THR N N -6.390 -3.201 1.592 1.00 . A A . 8 THR N 1 1 6 2536 1 1 8 THR O O -6.339 0.219 0.329 1.00 . A A . 8 THR O 1 1 6 2537 1 1 8 THR OG1 O -8.596 -2.415 2.966 1.00 . A A . 8 THR OG1 1 1 6 2538 1 1 9 THR C C -3.977 1.222 0.814 1.00 . A A . 9 THR C 1 1 6 2539 1 1 9 THR CA C -3.647 -0.213 0.376 1.00 . A A . 9 THR CA 1 1 6 2540 1 1 9 THR CB C -3.604 -0.324 -1.153 1.00 . A A . 9 THR CB 1 1 6 2541 1 1 9 THR CG2 C -4.918 0.174 -1.756 1.00 . A A . 9 THR CG2 1 1 6 2542 1 1 9 THR H H -4.442 -2.053 1.158 1.00 . A A . 9 THR H 1 1 6 2543 1 1 9 THR HA H -2.693 -0.507 0.784 1.00 . A A . 9 THR HA 1 1 6 2544 1 1 9 THR HB H -3.453 -1.355 -1.433 1.00 . A A . 9 THR HB 1 1 6 2545 1 1 9 THR HG1 H -2.579 0.459 -2.609 1.00 . A A . 9 THR HG1 1 1 6 2546 1 1 9 THR HG21 H -5.190 1.114 -1.300 1.00 . A A . 9 THR HG21 1 1 6 2547 1 1 9 THR HG22 H -5.695 -0.553 -1.574 1.00 . A A . 9 THR HG22 1 1 6 2548 1 1 9 THR HG23 H -4.796 0.310 -2.820 1.00 . A A . 9 THR HG23 1 1 6 2549 1 1 9 THR N N -4.707 -1.179 0.818 1.00 . A A . 9 THR N 1 1 6 2550 1 1 9 THR O O -4.899 1.459 1.565 1.00 . A A . 9 THR O 1 1 6 2551 1 1 9 THR OG1 O -2.530 0.462 -1.649 1.00 . A A . 9 THR OG1 1 1 6 2552 1 1 10 PHE C C -2.325 4.490 0.212 1.00 . A A . 10 PHE C 1 1 6 2553 1 1 10 PHE CA C -3.464 3.602 0.728 1.00 . A A . 10 PHE CA 1 1 6 2554 1 1 10 PHE CB C -3.508 3.625 2.260 1.00 . A A . 10 PHE CB 1 1 6 2555 1 1 10 PHE CD1 C -1.093 3.471 2.967 1.00 . A A . 10 PHE CD1 1 1 6 2556 1 1 10 PHE CD2 C -2.502 1.511 3.200 1.00 . A A . 10 PHE CD2 1 1 6 2557 1 1 10 PHE CE1 C -0.010 2.755 3.491 1.00 . A A . 10 PHE CE1 1 1 6 2558 1 1 10 PHE CE2 C -1.418 0.795 3.724 1.00 . A A . 10 PHE CE2 1 1 6 2559 1 1 10 PHE CG C -2.339 2.850 2.821 1.00 . A A . 10 PHE CG 1 1 6 2560 1 1 10 PHE CZ C -0.173 1.417 3.870 1.00 . A A . 10 PHE CZ 1 1 6 2561 1 1 10 PHE H H -2.471 1.958 -0.250 1.00 . A A . 10 PHE H 1 1 6 2562 1 1 10 PHE HA H -4.409 3.936 0.328 1.00 . A A . 10 PHE HA 1 1 6 2563 1 1 10 PHE HB2 H -3.453 4.648 2.603 1.00 . A A . 10 PHE HB2 1 1 6 2564 1 1 10 PHE HB3 H -4.430 3.183 2.602 1.00 . A A . 10 PHE HB3 1 1 6 2565 1 1 10 PHE HD1 H -0.966 4.503 2.675 1.00 . A A . 10 PHE HD1 1 1 6 2566 1 1 10 PHE HD2 H -3.462 1.032 3.088 1.00 . A A . 10 PHE HD2 1 1 6 2567 1 1 10 PHE HE1 H 0.951 3.234 3.604 1.00 . A A . 10 PHE HE1 1 1 6 2568 1 1 10 PHE HE2 H -1.544 -0.237 4.016 1.00 . A A . 10 PHE HE2 1 1 6 2569 1 1 10 PHE HZ H 0.662 0.865 4.273 1.00 . A A . 10 PHE HZ 1 1 6 2570 1 1 10 PHE N N -3.214 2.177 0.349 1.00 . A A . 10 PHE N 1 1 6 2571 1 1 10 PHE O O -1.379 4.017 -0.385 1.00 . A A . 10 PHE O 1 1 6 2572 1 1 11 LYS C C -0.201 6.757 0.990 1.00 . A A . 11 LYS C 1 1 6 2573 1 1 11 LYS CA C -1.333 6.689 -0.039 1.00 . A A . 11 LYS CA 1 1 6 2574 1 1 11 LYS CB C -2.013 8.052 -0.177 1.00 . A A . 11 LYS CB 1 1 6 2575 1 1 11 LYS CD C -2.578 7.698 -2.583 1.00 . A A . 11 LYS CD 1 1 6 2576 1 1 11 LYS CE C -2.595 8.997 -3.392 1.00 . A A . 11 LYS CE 1 1 6 2577 1 1 11 LYS CG C -3.154 7.954 -1.190 1.00 . A A . 11 LYS CG 1 1 6 2578 1 1 11 LYS H H -3.180 6.139 0.920 1.00 . A A . 11 LYS H 1 1 6 2579 1 1 11 LYS HA H -0.957 6.367 -0.996 1.00 . A A . 11 LYS HA 1 1 6 2580 1 1 11 LYS HB2 H -2.406 8.356 0.782 1.00 . A A . 11 LYS HB2 1 1 6 2581 1 1 11 LYS HB3 H -1.294 8.779 -0.518 1.00 . A A . 11 LYS HB3 1 1 6 2582 1 1 11 LYS HD2 H -1.562 7.342 -2.493 1.00 . A A . 11 LYS HD2 1 1 6 2583 1 1 11 LYS HD3 H -3.177 6.955 -3.089 1.00 . A A . 11 LYS HD3 1 1 6 2584 1 1 11 LYS HE2 H -2.402 9.842 -2.746 1.00 . A A . 11 LYS HE2 1 1 6 2585 1 1 11 LYS HE3 H -1.865 8.953 -4.186 1.00 . A A . 11 LYS HE3 1 1 6 2586 1 1 11 LYS HG2 H -3.811 7.142 -0.916 1.00 . A A . 11 LYS HG2 1 1 6 2587 1 1 11 LYS HG3 H -3.710 8.880 -1.198 1.00 . A A . 11 LYS HG3 1 1 6 2588 1 1 11 LYS HZ1 H -4.608 8.460 -3.429 1.00 . A A . 11 LYS HZ1 1 1 6 2589 1 1 11 LYS HZ2 H -3.946 8.777 -4.961 1.00 . A A . 11 LYS HZ2 1 1 6 2590 1 1 11 LYS HZ3 H -4.309 10.059 -3.908 1.00 . A A . 11 LYS HZ3 1 1 6 2591 1 1 11 LYS N N -2.409 5.775 0.437 1.00 . A A . 11 LYS N 1 1 6 2592 1 1 11 LYS NZ N -3.968 9.079 -3.965 1.00 . A A . 11 LYS NZ 1 1 6 2593 1 1 11 LYS O O -0.434 6.762 2.182 1.00 . A A . 11 LYS O 1 1 6 2594 1 1 12 ASP C C 3.243 7.840 0.980 1.00 . A A . 12 ASP C 1 1 6 2595 1 1 12 ASP CA C 2.168 6.880 1.496 1.00 . A A . 12 ASP CA 1 1 6 2596 1 1 12 ASP CB C 2.711 5.454 1.570 1.00 . A A . 12 ASP CB 1 1 6 2597 1 1 12 ASP CG C 3.800 5.380 2.641 1.00 . A A . 12 ASP CG 1 1 6 2598 1 1 12 ASP H H 1.193 6.809 -0.426 1.00 . A A . 12 ASP H 1 1 6 2599 1 1 12 ASP HA H 1.824 7.192 2.465 1.00 . A A . 12 ASP HA 1 1 6 2600 1 1 12 ASP HB2 H 1.908 4.775 1.823 1.00 . A A . 12 ASP HB2 1 1 6 2601 1 1 12 ASP HB3 H 3.131 5.178 0.613 1.00 . A A . 12 ASP HB3 1 1 6 2602 1 1 12 ASP N N 1.024 6.812 0.539 1.00 . A A . 12 ASP N 1 1 6 2603 1 1 12 ASP O O 3.700 8.714 1.691 1.00 . A A . 12 ASP O 1 1 6 2604 1 1 12 ASP OD1 O 3.510 5.717 3.778 1.00 . A A . 12 ASP OD1 1 1 6 2605 1 1 12 ASP OD2 O 4.906 4.988 2.308 1.00 . A A . 12 ASP OD2 1 1 6 2606 1 1 13 LYS C C 4.323 9.044 -2.218 1.00 . A A . 13 LYS C 1 1 6 2607 1 1 13 LYS CA C 4.698 8.592 -0.804 1.00 . A A . 13 LYS CA 1 1 6 2608 1 1 13 LYS CB C 5.979 7.756 -0.828 1.00 . A A . 13 LYS CB 1 1 6 2609 1 1 13 LYS CD C 7.639 6.816 0.790 1.00 . A A . 13 LYS CD 1 1 6 2610 1 1 13 LYS CE C 8.050 5.450 0.237 1.00 . A A . 13 LYS CE 1 1 6 2611 1 1 13 LYS CG C 6.150 7.047 0.518 1.00 . A A . 13 LYS CG 1 1 6 2612 1 1 13 LYS H H 3.269 6.975 -0.800 1.00 . A A . 13 LYS H 1 1 6 2613 1 1 13 LYS HA H 4.833 9.448 -0.160 1.00 . A A . 13 LYS HA 1 1 6 2614 1 1 13 LYS HB2 H 5.913 7.020 -1.619 1.00 . A A . 13 LYS HB2 1 1 6 2615 1 1 13 LYS HB3 H 6.828 8.401 -1.003 1.00 . A A . 13 LYS HB3 1 1 6 2616 1 1 13 LYS HD2 H 8.218 7.592 0.309 1.00 . A A . 13 LYS HD2 1 1 6 2617 1 1 13 LYS HD3 H 7.817 6.840 1.854 1.00 . A A . 13 LYS HD3 1 1 6 2618 1 1 13 LYS HE2 H 7.567 4.659 0.795 1.00 . A A . 13 LYS HE2 1 1 6 2619 1 1 13 LYS HE3 H 7.802 5.378 -0.810 1.00 . A A . 13 LYS HE3 1 1 6 2620 1 1 13 LYS HG2 H 5.731 7.661 1.302 1.00 . A A . 13 LYS HG2 1 1 6 2621 1 1 13 LYS HG3 H 5.639 6.097 0.491 1.00 . A A . 13 LYS HG3 1 1 6 2622 1 1 13 LYS HZ1 H 9.920 4.651 -0.201 1.00 . A A . 13 LYS HZ1 1 1 6 2623 1 1 13 LYS HZ2 H 9.745 5.162 1.410 1.00 . A A . 13 LYS HZ2 1 1 6 2624 1 1 13 LYS HZ3 H 9.947 6.305 0.170 1.00 . A A . 13 LYS HZ3 1 1 6 2625 1 1 13 LYS N N 3.650 7.685 -0.247 1.00 . A A . 13 LYS N 1 1 6 2626 1 1 13 LYS NZ N 9.527 5.388 0.418 1.00 . A A . 13 LYS NZ 1 1 6 2627 1 1 13 LYS O O 3.172 9.292 -2.517 1.00 . A A . 13 LYS O 1 1 6 2628 1 1 14 CYS C C 4.193 8.554 -5.240 1.00 . A A . 14 CYS C 1 1 6 2629 1 1 14 CYS CA C 5.000 9.614 -4.478 1.00 . A A . 14 CYS CA 1 1 6 2630 1 1 14 CYS CB C 6.378 9.825 -5.119 1.00 . A A . 14 CYS CB 1 1 6 2631 1 1 14 CYS H H 6.213 8.969 -2.820 1.00 . A A . 14 CYS H 1 1 6 2632 1 1 14 CYS HA H 4.460 10.549 -4.462 1.00 . A A . 14 CYS HA 1 1 6 2633 1 1 14 CYS HB2 H 6.275 10.458 -5.989 1.00 . A A . 14 CYS HB2 1 1 6 2634 1 1 14 CYS HB3 H 7.034 10.301 -4.403 1.00 . A A . 14 CYS HB3 1 1 6 2635 1 1 14 CYS N N 5.291 9.165 -3.086 1.00 . A A . 14 CYS N 1 1 6 2636 1 1 14 CYS O O 3.758 8.776 -6.353 1.00 . A A . 14 CYS O 1 1 6 2637 1 1 14 CYS SG S 7.088 8.231 -5.617 1.00 . A A . 14 CYS SG 1 1 6 2638 1 1 15 ASN C C 2.093 5.811 -4.482 1.00 . A A . 15 ASN C 1 1 6 2639 1 1 15 ASN CA C 3.221 6.343 -5.369 1.00 . A A . 15 ASN CA 1 1 6 2640 1 1 15 ASN CB C 4.239 5.239 -5.663 1.00 . A A . 15 ASN CB 1 1 6 2641 1 1 15 ASN CG C 4.683 5.330 -7.125 1.00 . A A . 15 ASN CG 1 1 6 2642 1 1 15 ASN H H 4.354 7.233 -3.763 1.00 . A A . 15 ASN H 1 1 6 2643 1 1 15 ASN HA H 2.821 6.727 -6.293 1.00 . A A . 15 ASN HA 1 1 6 2644 1 1 15 ASN HB2 H 5.095 5.357 -5.016 1.00 . A A . 15 ASN HB2 1 1 6 2645 1 1 15 ASN HB3 H 3.784 4.276 -5.488 1.00 . A A . 15 ASN HB3 1 1 6 2646 1 1 15 ASN HD21 H 4.904 7.305 -7.081 1.00 . A A . 15 ASN HD21 1 1 6 2647 1 1 15 ASN HD22 H 5.257 6.562 -8.575 1.00 . A A . 15 ASN HD22 1 1 6 2648 1 1 15 ASN N N 3.994 7.403 -4.658 1.00 . A A . 15 ASN N 1 1 6 2649 1 1 15 ASN ND2 N 4.973 6.495 -7.636 1.00 . A A . 15 ASN ND2 1 1 6 2650 1 1 15 ASN O O 0.985 6.305 -4.509 1.00 . A A . 15 ASN O 1 1 6 2651 1 1 15 ASN OD1 O 4.766 4.329 -7.809 1.00 . A A . 15 ASN OD1 1 1 6 2652 1 1 16 THR C C 1.888 3.077 -1.989 1.00 . A A . 16 THR C 1 1 6 2653 1 1 16 THR CA C 1.308 4.225 -2.824 1.00 . A A . 16 THR CA 1 1 6 2654 1 1 16 THR CB C 0.233 3.724 -3.802 1.00 . A A . 16 THR CB 1 1 6 2655 1 1 16 THR CG2 C -0.505 2.515 -3.222 1.00 . A A . 16 THR CG2 1 1 6 2656 1 1 16 THR H H 3.267 4.410 -3.703 1.00 . A A . 16 THR H 1 1 6 2657 1 1 16 THR HA H 0.897 4.986 -2.180 1.00 . A A . 16 THR HA 1 1 6 2658 1 1 16 THR HB H 0.702 3.440 -4.732 1.00 . A A . 16 THR HB 1 1 6 2659 1 1 16 THR HG1 H -0.362 5.302 -4.769 1.00 . A A . 16 THR HG1 1 1 6 2660 1 1 16 THR HG21 H -1.180 2.116 -3.965 1.00 . A A . 16 THR HG21 1 1 6 2661 1 1 16 THR HG22 H -1.067 2.819 -2.352 1.00 . A A . 16 THR HG22 1 1 6 2662 1 1 16 THR HG23 H 0.210 1.756 -2.942 1.00 . A A . 16 THR HG23 1 1 6 2663 1 1 16 THR N N 2.366 4.798 -3.704 1.00 . A A . 16 THR N 1 1 6 2664 1 1 16 THR O O 3.029 2.692 -2.152 1.00 . A A . 16 THR O 1 1 6 2665 1 1 16 THR OG1 O -0.699 4.768 -4.047 1.00 . A A . 16 THR OG1 1 1 6 2666 1 1 17 CYS C C 0.491 0.427 0.065 1.00 . A A . 17 CYS C 1 1 6 2667 1 1 17 CYS CA C 1.617 1.413 -0.252 1.00 . A A . 17 CYS CA 1 1 6 2668 1 1 17 CYS CB C 2.122 2.083 1.024 1.00 . A A . 17 CYS CB 1 1 6 2669 1 1 17 CYS H H 0.194 2.857 -0.977 1.00 . A A . 17 CYS H 1 1 6 2670 1 1 17 CYS HA H 2.428 0.907 -0.746 1.00 . A A . 17 CYS HA 1 1 6 2671 1 1 17 CYS HB2 H 2.262 3.141 0.844 1.00 . A A . 17 CYS HB2 1 1 6 2672 1 1 17 CYS HB3 H 1.399 1.944 1.813 1.00 . A A . 17 CYS HB3 1 1 6 2673 1 1 17 CYS N N 1.109 2.530 -1.095 1.00 . A A . 17 CYS N 1 1 6 2674 1 1 17 CYS O O -0.394 0.708 0.851 1.00 . A A . 17 CYS O 1 1 6 2675 1 1 17 CYS SG S 3.700 1.340 1.511 1.00 . A A . 17 CYS SG 1 1 6 2676 1 1 18 ARG C C -0.494 -2.170 1.193 1.00 . A A . 18 ARG C 1 1 6 2677 1 1 18 ARG CA C -0.540 -1.744 -0.270 1.00 . A A . 18 ARG CA 1 1 6 2678 1 1 18 ARG CB C -0.201 -2.920 -1.185 1.00 . A A . 18 ARG CB 1 1 6 2679 1 1 18 ARG CD C -2.497 -3.904 -1.164 1.00 . A A . 18 ARG CD 1 1 6 2680 1 1 18 ARG CG C -1.034 -4.137 -0.780 1.00 . A A . 18 ARG CG 1 1 6 2681 1 1 18 ARG CZ C -2.728 -6.132 -2.085 1.00 . A A . 18 ARG CZ 1 1 6 2682 1 1 18 ARG H H 1.247 -0.937 -1.161 1.00 . A A . 18 ARG H 1 1 6 2683 1 1 18 ARG HA H -1.515 -1.353 -0.514 1.00 . A A . 18 ARG HA 1 1 6 2684 1 1 18 ARG HB2 H -0.424 -2.656 -2.209 1.00 . A A . 18 ARG HB2 1 1 6 2685 1 1 18 ARG HB3 H 0.848 -3.159 -1.094 1.00 . A A . 18 ARG HB3 1 1 6 2686 1 1 18 ARG HD2 H -2.984 -3.281 -0.427 1.00 . A A . 18 ARG HD2 1 1 6 2687 1 1 18 ARG HD3 H -2.561 -3.451 -2.142 1.00 . A A . 18 ARG HD3 1 1 6 2688 1 1 18 ARG HE H -3.800 -5.499 -0.537 1.00 . A A . 18 ARG HE 1 1 6 2689 1 1 18 ARG HG2 H -0.662 -5.015 -1.288 1.00 . A A . 18 ARG HG2 1 1 6 2690 1 1 18 ARG HG3 H -0.964 -4.282 0.289 1.00 . A A . 18 ARG HG3 1 1 6 2691 1 1 18 ARG HH11 H -1.265 -6.890 -0.948 1.00 . A A . 18 ARG HH11 1 1 6 2692 1 1 18 ARG HH12 H -1.445 -7.605 -2.516 1.00 . A A . 18 ARG HH12 1 1 6 2693 1 1 18 ARG HH21 H -4.101 -5.576 -3.433 1.00 . A A . 18 ARG HH21 1 1 6 2694 1 1 18 ARG HH22 H -3.048 -6.862 -3.921 1.00 . A A . 18 ARG HH22 1 1 6 2695 1 1 18 ARG N N 0.522 -0.730 -0.536 1.00 . A A . 18 ARG N 1 1 6 2696 1 1 18 ARG NE N -3.109 -5.261 -1.190 1.00 . A A . 18 ARG NE 1 1 6 2697 1 1 18 ARG NH1 N -1.735 -6.938 -1.831 1.00 . A A . 18 ARG NH1 1 1 6 2698 1 1 18 ARG NH2 N -3.340 -6.195 -3.236 1.00 . A A . 18 ARG NH2 1 1 6 2699 1 1 18 ARG O O 0.561 -2.291 1.785 1.00 . A A . 18 ARG O 1 1 6 2700 1 1 19 CYS C C -1.402 -4.311 3.324 1.00 . A A . 19 CYS C 1 1 6 2701 1 1 19 CYS CA C -1.658 -2.806 3.207 1.00 . A A . 19 CYS CA 1 1 6 2702 1 1 19 CYS CB C -3.064 -2.448 3.680 1.00 . A A . 19 CYS CB 1 1 6 2703 1 1 19 CYS H H -2.469 -2.288 1.284 1.00 . A A . 19 CYS H 1 1 6 2704 1 1 19 CYS HA H -0.927 -2.254 3.773 1.00 . A A . 19 CYS HA 1 1 6 2705 1 1 19 CYS HB2 H -3.470 -1.674 3.042 1.00 . A A . 19 CYS HB2 1 1 6 2706 1 1 19 CYS HB3 H -3.695 -3.323 3.632 1.00 . A A . 19 CYS HB3 1 1 6 2707 1 1 19 CYS N N -1.631 -2.394 1.782 1.00 . A A . 19 CYS N 1 1 6 2708 1 1 19 CYS O O -2.209 -5.124 2.918 1.00 . A A . 19 CYS O 1 1 6 2709 1 1 19 CYS SG S -2.991 -1.842 5.383 1.00 . A A . 19 CYS SG 1 1 6 2710 1 1 20 GLY C C -1.191 -6.890 4.503 1.00 . A A . 20 GLY C 1 1 6 2711 1 1 20 GLY CA C 0.043 -6.135 4.009 1.00 . A A . 20 GLY CA 1 1 6 2712 1 1 20 GLY H H 0.362 -4.012 4.185 1.00 . A A . 20 GLY H 1 1 6 2713 1 1 20 GLY HA2 H 0.346 -6.529 3.049 1.00 . A A . 20 GLY HA2 1 1 6 2714 1 1 20 GLY HA3 H 0.846 -6.258 4.722 1.00 . A A . 20 GLY HA3 1 1 6 2715 1 1 20 GLY N N -0.277 -4.686 3.870 1.00 . A A . 20 GLY N 1 1 6 2716 1 1 20 GLY O O -2.162 -6.299 4.931 1.00 . A A . 20 GLY O 1 1 6 2717 1 1 21 SER C C -2.244 -9.240 6.423 1.00 . A A . 21 SER C 1 1 6 2718 1 1 21 SER CA C -2.334 -8.990 4.914 1.00 . A A . 21 SER CA 1 1 6 2719 1 1 21 SER CB C -2.245 -10.310 4.148 1.00 . A A . 21 SER CB 1 1 6 2720 1 1 21 SER H H -0.366 -8.651 4.101 1.00 . A A . 21 SER H 1 1 6 2721 1 1 21 SER HA H -3.253 -8.483 4.670 1.00 . A A . 21 SER HA 1 1 6 2722 1 1 21 SER HB2 H -1.350 -10.324 3.549 1.00 . A A . 21 SER HB2 1 1 6 2723 1 1 21 SER HB3 H -2.218 -11.131 4.852 1.00 . A A . 21 SER HB3 1 1 6 2724 1 1 21 SER HG H -4.084 -10.847 3.802 1.00 . A A . 21 SER HG 1 1 6 2725 1 1 21 SER N N -1.161 -8.194 4.449 1.00 . A A . 21 SER N 1 1 6 2726 1 1 21 SER O O -3.191 -9.678 7.044 1.00 . A A . 21 SER O 1 1 6 2727 1 1 21 SER OG O -3.378 -10.435 3.298 1.00 . A A . 21 SER OG 1 1 6 2728 1 1 22 ASP C C -1.070 -7.867 9.243 1.00 . A A . 22 ASP C 1 1 6 2729 1 1 22 ASP CA C -0.972 -9.193 8.486 1.00 . A A . 22 ASP CA 1 1 6 2730 1 1 22 ASP CB C 0.417 -9.807 8.663 1.00 . A A . 22 ASP CB 1 1 6 2731 1 1 22 ASP CG C 0.677 -10.058 10.150 1.00 . A A . 22 ASP CG 1 1 6 2732 1 1 22 ASP H H -0.360 -8.612 6.502 1.00 . A A . 22 ASP H 1 1 6 2733 1 1 22 ASP HA H -1.726 -9.883 8.834 1.00 . A A . 22 ASP HA 1 1 6 2734 1 1 22 ASP HB2 H 0.467 -10.745 8.125 1.00 . A A . 22 ASP HB2 1 1 6 2735 1 1 22 ASP HB3 H 1.164 -9.127 8.279 1.00 . A A . 22 ASP HB3 1 1 6 2736 1 1 22 ASP N N -1.114 -8.965 7.018 1.00 . A A . 22 ASP N 1 1 6 2737 1 1 22 ASP O O -0.899 -7.816 10.446 1.00 . A A . 22 ASP O 1 1 6 2738 1 1 22 ASP OD1 O 0.038 -10.938 10.702 1.00 . A A . 22 ASP OD1 1 1 6 2739 1 1 22 ASP OD2 O 1.510 -9.365 10.711 1.00 . A A . 22 ASP OD2 1 1 6 2740 1 1 23 GLY C C -0.069 -5.055 9.744 1.00 . A A . 23 GLY C 1 1 6 2741 1 1 23 GLY CA C -1.448 -5.479 9.238 1.00 . A A . 23 GLY CA 1 1 6 2742 1 1 23 GLY H H -1.478 -6.858 7.584 1.00 . A A . 23 GLY H 1 1 6 2743 1 1 23 GLY HA2 H -1.822 -4.740 8.541 1.00 . A A . 23 GLY HA2 1 1 6 2744 1 1 23 GLY HA3 H -2.125 -5.563 10.076 1.00 . A A . 23 GLY HA3 1 1 6 2745 1 1 23 GLY N N -1.343 -6.797 8.553 1.00 . A A . 23 GLY N 1 1 6 2746 1 1 23 GLY O O 0.820 -5.867 9.907 1.00 . A A . 23 GLY O 1 1 6 2747 1 1 24 LYS C C 2.530 -3.581 9.447 1.00 . A A . 24 LYS C 1 1 6 2748 1 1 24 LYS CA C 1.440 -3.306 10.488 1.00 . A A . 24 LYS CA 1 1 6 2749 1 1 24 LYS CB C 1.704 -4.104 11.768 1.00 . A A . 24 LYS CB 1 1 6 2750 1 1 24 LYS CD C -0.192 -2.790 12.744 1.00 . A A . 24 LYS CD 1 1 6 2751 1 1 24 LYS CE C 0.638 -1.966 13.730 1.00 . A A . 24 LYS CE 1 1 6 2752 1 1 24 LYS CG C 0.421 -4.185 12.602 1.00 . A A . 24 LYS CG 1 1 6 2753 1 1 24 LYS H H -0.614 -3.149 9.853 1.00 . A A . 24 LYS H 1 1 6 2754 1 1 24 LYS HA H 1.396 -2.252 10.714 1.00 . A A . 24 LYS HA 1 1 6 2755 1 1 24 LYS HB2 H 2.029 -5.101 11.510 1.00 . A A . 24 LYS HB2 1 1 6 2756 1 1 24 LYS HB3 H 2.474 -3.613 12.345 1.00 . A A . 24 LYS HB3 1 1 6 2757 1 1 24 LYS HD2 H -0.204 -2.300 11.782 1.00 . A A . 24 LYS HD2 1 1 6 2758 1 1 24 LYS HD3 H -1.203 -2.877 13.114 1.00 . A A . 24 LYS HD3 1 1 6 2759 1 1 24 LYS HE2 H 1.660 -1.887 13.384 1.00 . A A . 24 LYS HE2 1 1 6 2760 1 1 24 LYS HE3 H 0.206 -0.986 13.860 1.00 . A A . 24 LYS HE3 1 1 6 2761 1 1 24 LYS HG2 H -0.285 -4.841 12.112 1.00 . A A . 24 LYS HG2 1 1 6 2762 1 1 24 LYS HG3 H 0.653 -4.574 13.582 1.00 . A A . 24 LYS HG3 1 1 6 2763 1 1 24 LYS HZ1 H 1.411 -3.342 15.089 1.00 . A A . 24 LYS HZ1 1 1 6 2764 1 1 24 LYS HZ2 H -0.287 -3.305 15.030 1.00 . A A . 24 LYS HZ2 1 1 6 2765 1 1 24 LYS HZ3 H 0.567 -2.059 15.808 1.00 . A A . 24 LYS HZ3 1 1 6 2766 1 1 24 LYS N N 0.117 -3.787 9.992 1.00 . A A . 24 LYS N 1 1 6 2767 1 1 24 LYS NZ N 0.578 -2.725 15.010 1.00 . A A . 24 LYS NZ 1 1 6 2768 1 1 24 LYS O O 3.706 -3.574 9.749 1.00 . A A . 24 LYS O 1 1 6 2769 1 1 25 SER C C 2.586 -3.761 5.785 1.00 . A A . 25 SER C 1 1 6 2770 1 1 25 SER CA C 3.161 -4.095 7.164 1.00 . A A . 25 SER CA 1 1 6 2771 1 1 25 SER CB C 3.455 -5.590 7.274 1.00 . A A . 25 SER CB 1 1 6 2772 1 1 25 SER H H 1.192 -3.822 7.999 1.00 . A A . 25 SER H 1 1 6 2773 1 1 25 SER HA H 4.060 -3.527 7.346 1.00 . A A . 25 SER HA 1 1 6 2774 1 1 25 SER HB2 H 2.535 -6.147 7.195 1.00 . A A . 25 SER HB2 1 1 6 2775 1 1 25 SER HB3 H 4.124 -5.883 6.473 1.00 . A A . 25 SER HB3 1 1 6 2776 1 1 25 SER HG H 4.189 -6.805 8.605 1.00 . A A . 25 SER HG 1 1 6 2777 1 1 25 SER N N 2.147 -3.822 8.223 1.00 . A A . 25 SER N 1 1 6 2778 1 1 25 SER O O 1.502 -4.182 5.437 1.00 . A A . 25 SER O 1 1 6 2779 1 1 25 SER OG O 4.058 -5.857 8.533 1.00 . A A . 25 SER OG 1 1 6 2780 1 1 26 ALA C C 3.753 -3.143 2.562 1.00 . A A . 26 ALA C 1 1 6 2781 1 1 26 ALA CA C 2.793 -2.642 3.644 1.00 . A A . 26 ALA CA 1 1 6 2782 1 1 26 ALA CB C 2.731 -1.114 3.638 1.00 . A A . 26 ALA CB 1 1 6 2783 1 1 26 ALA H H 4.174 -2.671 5.299 1.00 . A A . 26 ALA H 1 1 6 2784 1 1 26 ALA HA H 1.806 -3.050 3.491 1.00 . A A . 26 ALA HA 1 1 6 2785 1 1 26 ALA HB1 H 3.671 -0.715 3.988 1.00 . A A . 26 ALA HB1 1 1 6 2786 1 1 26 ALA HB2 H 1.934 -0.783 4.290 1.00 . A A . 26 ALA HB2 1 1 6 2787 1 1 26 ALA HB3 H 2.543 -0.765 2.633 1.00 . A A . 26 ALA HB3 1 1 6 2788 1 1 26 ALA N N 3.303 -3.003 4.999 1.00 . A A . 26 ALA N 1 1 6 2789 1 1 26 ALA O O 4.707 -3.841 2.839 1.00 . A A . 26 ALA O 1 1 6 2790 1 1 27 ALA C C 5.026 -2.043 -0.474 1.00 . A A . 27 ALA C 1 1 6 2791 1 1 27 ALA CA C 4.398 -3.246 0.226 1.00 . A A . 27 ALA CA 1 1 6 2792 1 1 27 ALA CB C 3.479 -3.992 -0.740 1.00 . A A . 27 ALA CB 1 1 6 2793 1 1 27 ALA H H 2.727 -2.229 1.130 1.00 . A A . 27 ALA H 1 1 6 2794 1 1 27 ALA HA H 5.158 -3.908 0.599 1.00 . A A . 27 ALA HA 1 1 6 2795 1 1 27 ALA HB1 H 4.076 -4.527 -1.461 1.00 . A A . 27 ALA HB1 1 1 6 2796 1 1 27 ALA HB2 H 2.845 -3.283 -1.251 1.00 . A A . 27 ALA HB2 1 1 6 2797 1 1 27 ALA HB3 H 2.867 -4.689 -0.188 1.00 . A A . 27 ALA HB3 1 1 6 2798 1 1 27 ALA N N 3.504 -2.792 1.330 1.00 . A A . 27 ALA N 1 1 6 2799 1 1 27 ALA O O 6.226 -1.966 -0.651 1.00 . A A . 27 ALA O 1 1 6 2800 1 1 28 CYS C C 5.405 -0.298 -2.893 1.00 . A A . 28 CYS C 1 1 6 2801 1 1 28 CYS CA C 4.742 0.099 -1.573 1.00 . A A . 28 CYS CA 1 1 6 2802 1 1 28 CYS CB C 5.767 0.707 -0.612 1.00 . A A . 28 CYS CB 1 1 6 2803 1 1 28 CYS H H 3.254 -1.202 -0.721 1.00 . A A . 28 CYS H 1 1 6 2804 1 1 28 CYS HA H 3.948 0.799 -1.752 1.00 . A A . 28 CYS HA 1 1 6 2805 1 1 28 CYS HB2 H 6.056 -0.030 0.123 1.00 . A A . 28 CYS HB2 1 1 6 2806 1 1 28 CYS HB3 H 6.639 1.022 -1.168 1.00 . A A . 28 CYS HB3 1 1 6 2807 1 1 28 CYS N N 4.216 -1.108 -0.875 1.00 . A A . 28 CYS N 1 1 6 2808 1 1 28 CYS O O 6.429 -0.951 -2.916 1.00 . A A . 28 CYS O 1 1 6 2809 1 1 28 CYS SG S 5.038 2.139 0.225 1.00 . A A . 28 CYS SG 1 1 6 2810 1 1 29 THR C C 6.826 0.345 -5.441 1.00 . A A . 29 THR C 1 1 6 2811 1 1 29 THR CA C 5.422 -0.259 -5.317 1.00 . A A . 29 THR CA 1 1 6 2812 1 1 29 THR CB C 4.472 0.350 -6.354 1.00 . A A . 29 THR CB 1 1 6 2813 1 1 29 THR CG2 C 4.726 1.854 -6.472 1.00 . A A . 29 THR CG2 1 1 6 2814 1 1 29 THR H H 3.999 0.622 -3.957 1.00 . A A . 29 THR H 1 1 6 2815 1 1 29 THR HA H 5.461 -1.331 -5.437 1.00 . A A . 29 THR HA 1 1 6 2816 1 1 29 THR HB H 3.451 0.186 -6.044 1.00 . A A . 29 THR HB 1 1 6 2817 1 1 29 THR HG1 H 3.892 -0.158 -8.140 1.00 . A A . 29 THR HG1 1 1 6 2818 1 1 29 THR HG21 H 5.633 2.023 -7.033 1.00 . A A . 29 THR HG21 1 1 6 2819 1 1 29 THR HG22 H 4.827 2.281 -5.485 1.00 . A A . 29 THR HG22 1 1 6 2820 1 1 29 THR HG23 H 3.896 2.320 -6.982 1.00 . A A . 29 THR HG23 1 1 6 2821 1 1 29 THR N N 4.826 0.095 -3.997 1.00 . A A . 29 THR N 1 1 6 2822 1 1 29 THR O O 7.645 -0.114 -6.212 1.00 . A A . 29 THR O 1 1 6 2823 1 1 29 THR OG1 O 4.688 -0.270 -7.613 1.00 . A A . 29 THR OG1 1 1 6 2824 1 1 30 LEU C C 8.889 2.180 -6.210 1.00 . A A . 30 LEU C 1 1 6 2825 1 1 30 LEU CA C 8.452 2.009 -4.753 1.00 . A A . 30 LEU CA 1 1 6 2826 1 1 30 LEU CB C 9.384 1.041 -4.026 1.00 . A A . 30 LEU CB 1 1 6 2827 1 1 30 LEU CD1 C 10.162 0.252 -1.787 1.00 . A A . 30 LEU CD1 1 1 6 2828 1 1 30 LEU CD2 C 9.398 2.611 -2.084 1.00 . A A . 30 LEU CD2 1 1 6 2829 1 1 30 LEU CG C 9.171 1.160 -2.516 1.00 . A A . 30 LEU CG 1 1 6 2830 1 1 30 LEU H H 6.428 1.724 -4.071 1.00 . A A . 30 LEU H 1 1 6 2831 1 1 30 LEU HA H 8.443 2.961 -4.248 1.00 . A A . 30 LEU HA 1 1 6 2832 1 1 30 LEU HB2 H 9.172 0.030 -4.342 1.00 . A A . 30 LEU HB2 1 1 6 2833 1 1 30 LEU HB3 H 10.410 1.284 -4.262 1.00 . A A . 30 LEU HB3 1 1 6 2834 1 1 30 LEU HD11 H 10.217 0.537 -0.748 1.00 . A A . 30 LEU HD11 1 1 6 2835 1 1 30 LEU HD12 H 11.138 0.348 -2.240 1.00 . A A . 30 LEU HD12 1 1 6 2836 1 1 30 LEU HD13 H 9.832 -0.774 -1.862 1.00 . A A . 30 LEU HD13 1 1 6 2837 1 1 30 LEU HD21 H 8.460 3.043 -1.768 1.00 . A A . 30 LEU HD21 1 1 6 2838 1 1 30 LEU HD22 H 9.794 3.176 -2.913 1.00 . A A . 30 LEU HD22 1 1 6 2839 1 1 30 LEU HD23 H 10.101 2.635 -1.263 1.00 . A A . 30 LEU HD23 1 1 6 2840 1 1 30 LEU HG H 8.161 0.863 -2.271 1.00 . A A . 30 LEU HG 1 1 6 2841 1 1 30 LEU N N 7.104 1.372 -4.685 1.00 . A A . 30 LEU N 1 1 6 2842 1 1 30 LEU O O 9.756 1.480 -6.694 1.00 . A A . 30 LEU O 1 1 6 2843 1 1 31 LYS C C 9.372 4.683 -8.495 1.00 . A A . 31 LYS C 1 1 6 2844 1 1 31 LYS CA C 8.689 3.323 -8.337 1.00 . A A . 31 LYS CA 1 1 6 2845 1 1 31 LYS CB C 7.377 3.274 -9.122 1.00 . A A . 31 LYS CB 1 1 6 2846 1 1 31 LYS CD C 7.814 0.926 -9.880 1.00 . A A . 31 LYS CD 1 1 6 2847 1 1 31 LYS CE C 6.542 0.324 -9.284 1.00 . A A . 31 LYS CE 1 1 6 2848 1 1 31 LYS CG C 7.540 2.362 -10.340 1.00 . A A . 31 LYS CG 1 1 6 2849 1 1 31 LYS H H 7.603 3.666 -6.507 1.00 . A A . 31 LYS H 1 1 6 2850 1 1 31 LYS HA H 9.347 2.536 -8.668 1.00 . A A . 31 LYS HA 1 1 6 2851 1 1 31 LYS HB2 H 6.592 2.892 -8.486 1.00 . A A . 31 LYS HB2 1 1 6 2852 1 1 31 LYS HB3 H 7.119 4.269 -9.453 1.00 . A A . 31 LYS HB3 1 1 6 2853 1 1 31 LYS HD2 H 8.131 0.333 -10.724 1.00 . A A . 31 LYS HD2 1 1 6 2854 1 1 31 LYS HD3 H 8.592 0.928 -9.131 1.00 . A A . 31 LYS HD3 1 1 6 2855 1 1 31 LYS HE2 H 6.644 0.217 -8.212 1.00 . A A . 31 LYS HE2 1 1 6 2856 1 1 31 LYS HE3 H 5.686 0.936 -9.522 1.00 . A A . 31 LYS HE3 1 1 6 2857 1 1 31 LYS HG2 H 6.633 2.383 -10.927 1.00 . A A . 31 LYS HG2 1 1 6 2858 1 1 31 LYS HG3 H 8.366 2.708 -10.942 1.00 . A A . 31 LYS HG3 1 1 6 2859 1 1 31 LYS HZ1 H 6.175 -0.889 -10.936 1.00 . A A . 31 LYS HZ1 1 1 6 2860 1 1 31 LYS HZ2 H 5.657 -1.553 -9.460 1.00 . A A . 31 LYS HZ2 1 1 6 2861 1 1 31 LYS HZ3 H 7.310 -1.525 -9.850 1.00 . A A . 31 LYS HZ3 1 1 6 2862 1 1 31 LYS N N 8.299 3.108 -6.914 1.00 . A A . 31 LYS N 1 1 6 2863 1 1 31 LYS NZ N 6.411 -1.011 -9.931 1.00 . A A . 31 LYS NZ 1 1 6 2864 1 1 31 LYS O O 9.011 5.479 -9.340 1.00 . A A . 31 LYS O 1 1 6 2865 1 1 32 ALA C C 10.155 7.410 -7.416 1.00 . A A . 32 ALA C 1 1 6 2866 1 1 32 ALA CA C 11.083 6.251 -7.785 1.00 . A A . 32 ALA CA 1 1 6 2867 1 1 32 ALA CB C 11.514 6.357 -9.248 1.00 . A A . 32 ALA CB 1 1 6 2868 1 1 32 ALA H H 10.638 4.289 -7.019 1.00 . A A . 32 ALA H 1 1 6 2869 1 1 32 ALA HA H 11.952 6.248 -7.147 1.00 . A A . 32 ALA HA 1 1 6 2870 1 1 32 ALA HB1 H 12.593 6.367 -9.306 1.00 . A A . 32 ALA HB1 1 1 6 2871 1 1 32 ALA HB2 H 11.122 7.269 -9.673 1.00 . A A . 32 ALA HB2 1 1 6 2872 1 1 32 ALA HB3 H 11.132 5.509 -9.798 1.00 . A A . 32 ALA HB3 1 1 6 2873 1 1 32 ALA N N 10.363 4.949 -7.688 1.00 . A A . 32 ALA N 1 1 6 2874 1 1 32 ALA O O 8.954 7.339 -7.586 1.00 . A A . 32 ALA O 1 1 6 2875 1 1 33 CYS C C 10.586 10.950 -6.940 1.00 . A A . 33 CYS C 1 1 6 2876 1 1 33 CYS CA C 9.873 9.655 -6.537 1.00 . A A . 33 CYS CA 1 1 6 2877 1 1 33 CYS CB C 9.735 9.576 -5.016 1.00 . A A . 33 CYS CB 1 1 6 2878 1 1 33 CYS H H 11.681 8.512 -6.795 1.00 . A A . 33 CYS H 1 1 6 2879 1 1 33 CYS HA H 8.901 9.595 -7.002 1.00 . A A . 33 CYS HA 1 1 6 2880 1 1 33 CYS HB2 H 10.717 9.535 -4.567 1.00 . A A . 33 CYS HB2 1 1 6 2881 1 1 33 CYS HB3 H 9.209 10.450 -4.656 1.00 . A A . 33 CYS HB3 1 1 6 2882 1 1 33 CYS N N 10.709 8.480 -6.916 1.00 . A A . 33 CYS N 1 1 6 2883 1 1 33 CYS O O 11.773 10.949 -7.200 1.00 . A A . 33 CYS O 1 1 6 2884 1 1 33 CYS SG S 8.806 8.089 -4.565 1.00 . A A . 33 CYS SG 1 1 6 2885 1 1 34 PRO C C 11.288 13.865 -6.213 1.00 . A A . 34 PRO C 1 1 6 2886 1 1 34 PRO CA C 10.402 13.335 -7.345 1.00 . A A . 34 PRO CA 1 1 6 2887 1 1 34 PRO CB C 9.172 14.215 -7.537 1.00 . A A . 34 PRO CB 1 1 6 2888 1 1 34 PRO CD C 8.401 12.095 -6.678 1.00 . A A . 34 PRO CD 1 1 6 2889 1 1 34 PRO CG C 8.104 13.572 -6.709 1.00 . A A . 34 PRO CG 1 1 6 2890 1 1 34 PRO HA H 10.958 13.268 -8.267 1.00 . A A . 34 PRO HA 1 1 6 2891 1 1 34 PRO HB2 H 9.370 15.220 -7.186 1.00 . A A . 34 PRO HB2 1 1 6 2892 1 1 34 PRO HB3 H 8.876 14.228 -8.574 1.00 . A A . 34 PRO HB3 1 1 6 2893 1 1 34 PRO HD2 H 8.190 11.688 -5.697 1.00 . A A . 34 PRO HD2 1 1 6 2894 1 1 34 PRO HD3 H 7.835 11.577 -7.436 1.00 . A A . 34 PRO HD3 1 1 6 2895 1 1 34 PRO HG2 H 8.123 13.976 -5.707 1.00 . A A . 34 PRO HG2 1 1 6 2896 1 1 34 PRO HG3 H 7.138 13.738 -7.158 1.00 . A A . 34 PRO HG3 1 1 6 2897 1 1 34 PRO N N 9.834 12.016 -6.976 1.00 . A A . 34 PRO N 1 1 6 2898 1 1 34 PRO O O 12.469 13.584 -6.153 1.00 . A A . 34 PRO O 1 1 6 2899 1 1 35 GLN C C 12.642 16.083 -4.710 1.00 . A A . 35 GLN C 1 1 6 2900 1 1 35 GLN CA C 11.539 15.162 -4.181 1.00 . A A . 35 GLN CA 1 1 6 2901 1 1 35 GLN CB C 12.146 13.930 -3.507 1.00 . A A . 35 GLN CB 1 1 6 2902 1 1 35 GLN CD C 12.086 12.778 -1.291 1.00 . A A . 35 GLN CD 1 1 6 2903 1 1 35 GLN CG C 12.166 14.136 -1.993 1.00 . A A . 35 GLN CG 1 1 6 2904 1 1 35 GLN H H 9.772 14.836 -5.371 1.00 . A A . 35 GLN H 1 1 6 2905 1 1 35 GLN HA H 10.909 15.691 -3.482 1.00 . A A . 35 GLN HA 1 1 6 2906 1 1 35 GLN HB2 H 11.551 13.061 -3.746 1.00 . A A . 35 GLN HB2 1 1 6 2907 1 1 35 GLN HB3 H 13.155 13.787 -3.863 1.00 . A A . 35 GLN HB3 1 1 6 2908 1 1 35 GLN HE21 H 11.269 13.520 0.358 1.00 . A A . 35 GLN HE21 1 1 6 2909 1 1 35 GLN HE22 H 11.533 11.844 0.370 1.00 . A A . 35 GLN HE22 1 1 6 2910 1 1 35 GLN HG2 H 13.081 14.635 -1.710 1.00 . A A . 35 GLN HG2 1 1 6 2911 1 1 35 GLN HG3 H 11.321 14.739 -1.699 1.00 . A A . 35 GLN HG3 1 1 6 2912 1 1 35 GLN N N 10.726 14.623 -5.310 1.00 . A A . 35 GLN N 1 1 6 2913 1 1 35 GLN NE2 N 11.589 12.708 -0.088 1.00 . A A . 35 GLN NE2 1 1 6 2914 1 1 35 GLN O O 12.931 16.008 -5.893 1.00 . A A . 35 GLN O 1 1 6 2915 1 1 35 GLN OXT O 13.176 16.847 -3.924 1.00 . A A . 35 GLN OXT 1 1 6 2916 1 1 35 GLN OE1 O 12.481 11.771 -1.844 1.00 . A A . 35 GLN OE1 1 1 7 2917 1 1 1 GLU C C 5.224 1.971 8.005 1.00 . A A . 1 GLU C 1 1 7 2918 1 1 1 GLU CA C 6.706 1.698 8.285 1.00 . A A . 1 GLU CA 1 1 7 2919 1 1 1 GLU CB C 7.346 2.889 9.001 1.00 . A A . 1 GLU CB 1 1 7 2920 1 1 1 GLU CD C 9.276 3.300 10.534 1.00 . A A . 1 GLU CD 1 1 7 2921 1 1 1 GLU CG C 8.826 2.599 9.251 1.00 . A A . 1 GLU CG 1 1 7 2922 1 1 1 GLU H1 H 6.896 1.022 6.323 1.00 . A A . 1 GLU H1 1 1 7 2923 1 1 1 GLU H2 H 8.363 1.085 7.179 1.00 . A A . 1 GLU H2 1 1 7 2924 1 1 1 GLU H3 H 7.642 2.516 6.613 1.00 . A A . 1 GLU H3 1 1 7 2925 1 1 1 GLU HA H 6.819 0.806 8.880 1.00 . A A . 1 GLU HA 1 1 7 2926 1 1 1 GLU HB2 H 7.249 3.772 8.385 1.00 . A A . 1 GLU HB2 1 1 7 2927 1 1 1 GLU HB3 H 6.848 3.051 9.945 1.00 . A A . 1 GLU HB3 1 1 7 2928 1 1 1 GLU HG2 H 8.973 1.533 9.351 1.00 . A A . 1 GLU HG2 1 1 7 2929 1 1 1 GLU HG3 H 9.411 2.966 8.420 1.00 . A A . 1 GLU HG3 1 1 7 2930 1 1 1 GLU N N 7.459 1.570 7.004 1.00 . A A . 1 GLU N 1 1 7 2931 1 1 1 GLU O O 4.873 2.942 7.367 1.00 . A A . 1 GLU O 1 1 7 2932 1 1 1 GLU OE1 O 8.490 4.058 11.078 1.00 . A A . 1 GLU OE1 1 1 7 2933 1 1 1 GLU OE2 O 10.398 3.068 10.952 1.00 . A A . 1 GLU OE2 1 1 7 2934 1 1 2 VAL C C 2.067 0.597 9.291 1.00 . A A . 2 VAL C 1 1 7 2935 1 1 2 VAL CA C 2.897 1.335 8.237 1.00 . A A . 2 VAL CA 1 1 7 2936 1 1 2 VAL CB C 2.635 0.758 6.844 1.00 . A A . 2 VAL CB 1 1 7 2937 1 1 2 VAL CG1 C 3.336 -0.595 6.703 1.00 . A A . 2 VAL CG1 1 1 7 2938 1 1 2 VAL CG2 C 1.129 0.571 6.644 1.00 . A A . 2 VAL CG2 1 1 7 2939 1 1 2 VAL H H 4.655 0.343 8.992 1.00 . A A . 2 VAL H 1 1 7 2940 1 1 2 VAL HA H 2.667 2.389 8.246 1.00 . A A . 2 VAL HA 1 1 7 2941 1 1 2 VAL HB H 3.017 1.438 6.096 1.00 . A A . 2 VAL HB 1 1 7 2942 1 1 2 VAL HG11 H 4.369 -0.498 6.999 1.00 . A A . 2 VAL HG11 1 1 7 2943 1 1 2 VAL HG12 H 3.287 -0.920 5.675 1.00 . A A . 2 VAL HG12 1 1 7 2944 1 1 2 VAL HG13 H 2.846 -1.321 7.334 1.00 . A A . 2 VAL HG13 1 1 7 2945 1 1 2 VAL HG21 H 0.804 -0.318 7.163 1.00 . A A . 2 VAL HG21 1 1 7 2946 1 1 2 VAL HG22 H 0.915 0.471 5.589 1.00 . A A . 2 VAL HG22 1 1 7 2947 1 1 2 VAL HG23 H 0.604 1.430 7.038 1.00 . A A . 2 VAL HG23 1 1 7 2948 1 1 2 VAL N N 4.354 1.121 8.478 1.00 . A A . 2 VAL N 1 1 7 2949 1 1 2 VAL O O 2.526 -0.337 9.918 1.00 . A A . 2 VAL O 1 1 7 2950 1 1 3 THR C C -1.493 0.467 10.096 1.00 . A A . 3 THR C 1 1 7 2951 1 1 3 THR CA C -0.022 0.336 10.500 1.00 . A A . 3 THR CA 1 1 7 2952 1 1 3 THR CB C 0.242 1.077 11.813 1.00 . A A . 3 THR CB 1 1 7 2953 1 1 3 THR CG2 C -0.600 0.456 12.929 1.00 . A A . 3 THR CG2 1 1 7 2954 1 1 3 THR H H 0.494 1.765 8.972 1.00 . A A . 3 THR H 1 1 7 2955 1 1 3 THR HA H 0.252 -0.702 10.599 1.00 . A A . 3 THR HA 1 1 7 2956 1 1 3 THR HB H -0.026 2.115 11.700 1.00 . A A . 3 THR HB 1 1 7 2957 1 1 3 THR HG1 H 1.920 0.096 11.895 1.00 . A A . 3 THR HG1 1 1 7 2958 1 1 3 THR HG21 H 0.020 0.292 13.798 1.00 . A A . 3 THR HG21 1 1 7 2959 1 1 3 THR HG22 H -1.005 -0.487 12.593 1.00 . A A . 3 THR HG22 1 1 7 2960 1 1 3 THR HG23 H -1.408 1.125 13.186 1.00 . A A . 3 THR HG23 1 1 7 2961 1 1 3 THR N N 0.844 1.011 9.490 1.00 . A A . 3 THR N 1 1 7 2962 1 1 3 THR O O -2.348 0.760 10.907 1.00 . A A . 3 THR O 1 1 7 2963 1 1 3 THR OG1 O 1.620 0.974 12.142 1.00 . A A . 3 THR OG1 1 1 7 2964 1 1 4 CYS C C -3.884 -1.001 8.410 1.00 . A A . 4 CYS C 1 1 7 2965 1 1 4 CYS CA C -3.200 0.376 8.376 1.00 . A A . 4 CYS CA 1 1 7 2966 1 1 4 CYS CB C -3.076 0.961 6.949 1.00 . A A . 4 CYS CB 1 1 7 2967 1 1 4 CYS H H -1.082 0.026 8.205 1.00 . A A . 4 CYS H 1 1 7 2968 1 1 4 CYS HA H -3.738 1.067 9.006 1.00 . A A . 4 CYS HA 1 1 7 2969 1 1 4 CYS HB2 H -3.580 1.915 6.917 1.00 . A A . 4 CYS HB2 1 1 7 2970 1 1 4 CYS HB3 H -2.027 1.111 6.725 1.00 . A A . 4 CYS HB3 1 1 7 2971 1 1 4 CYS N N -1.790 0.257 8.843 1.00 . A A . 4 CYS N 1 1 7 2972 1 1 4 CYS O O -3.301 -1.986 8.819 1.00 . A A . 4 CYS O 1 1 7 2973 1 1 4 CYS SG S -3.805 -0.128 5.688 1.00 . A A . 4 CYS SG 1 1 7 2974 1 1 5 GLU C C -5.389 -3.228 6.795 1.00 . A A . 5 GLU C 1 1 7 2975 1 1 5 GLU CA C -5.839 -2.376 7.983 1.00 . A A . 5 GLU CA 1 1 7 2976 1 1 5 GLU CB C -7.317 -2.008 7.844 1.00 . A A . 5 GLU CB 1 1 7 2977 1 1 5 GLU CD C -8.953 -0.407 8.841 1.00 . A A . 5 GLU CD 1 1 7 2978 1 1 5 GLU CG C -7.818 -1.387 9.148 1.00 . A A . 5 GLU CG 1 1 7 2979 1 1 5 GLU H H -5.565 -0.267 7.651 1.00 . A A . 5 GLU H 1 1 7 2980 1 1 5 GLU HA H -5.674 -2.900 8.912 1.00 . A A . 5 GLU HA 1 1 7 2981 1 1 5 GLU HB2 H -7.434 -1.297 7.039 1.00 . A A . 5 GLU HB2 1 1 7 2982 1 1 5 GLU HB3 H -7.890 -2.897 7.626 1.00 . A A . 5 GLU HB3 1 1 7 2983 1 1 5 GLU HG2 H -8.182 -2.168 9.801 1.00 . A A . 5 GLU HG2 1 1 7 2984 1 1 5 GLU HG3 H -7.010 -0.860 9.632 1.00 . A A . 5 GLU HG3 1 1 7 2985 1 1 5 GLU N N -5.116 -1.072 7.980 1.00 . A A . 5 GLU N 1 1 7 2986 1 1 5 GLU O O -5.117 -2.711 5.729 1.00 . A A . 5 GLU O 1 1 7 2987 1 1 5 GLU OE1 O -10.024 -0.865 8.481 1.00 . A A . 5 GLU OE1 1 1 7 2988 1 1 5 GLU OE2 O -8.730 0.785 8.971 1.00 . A A . 5 GLU OE2 1 1 7 2989 1 1 6 PRO C C -6.010 -5.601 4.906 1.00 . A A . 6 PRO C 1 1 7 2990 1 1 6 PRO CA C -4.902 -5.448 5.952 1.00 . A A . 6 PRO CA 1 1 7 2991 1 1 6 PRO CB C -4.668 -6.759 6.697 1.00 . A A . 6 PRO CB 1 1 7 2992 1 1 6 PRO CD C -5.635 -5.204 8.274 1.00 . A A . 6 PRO CD 1 1 7 2993 1 1 6 PRO CG C -5.519 -6.666 7.924 1.00 . A A . 6 PRO CG 1 1 7 2994 1 1 6 PRO HA H -3.987 -5.115 5.492 1.00 . A A . 6 PRO HA 1 1 7 2995 1 1 6 PRO HB2 H -4.975 -7.597 6.085 1.00 . A A . 6 PRO HB2 1 1 7 2996 1 1 6 PRO HB3 H -3.630 -6.855 6.974 1.00 . A A . 6 PRO HB3 1 1 7 2997 1 1 6 PRO HD2 H -6.642 -4.973 8.599 1.00 . A A . 6 PRO HD2 1 1 7 2998 1 1 6 PRO HD3 H -4.918 -4.938 9.035 1.00 . A A . 6 PRO HD3 1 1 7 2999 1 1 6 PRO HG2 H -6.498 -7.080 7.725 1.00 . A A . 6 PRO HG2 1 1 7 3000 1 1 6 PRO HG3 H -5.052 -7.199 8.738 1.00 . A A . 6 PRO HG3 1 1 7 3001 1 1 6 PRO N N -5.325 -4.512 7.019 1.00 . A A . 6 PRO N 1 1 7 3002 1 1 6 PRO O O -7.058 -6.155 5.172 1.00 . A A . 6 PRO O 1 1 7 3003 1 1 7 GLY C C -7.435 -3.853 2.387 1.00 . A A . 7 GLY C 1 1 7 3004 1 1 7 GLY CA C -6.823 -5.229 2.654 1.00 . A A . 7 GLY CA 1 1 7 3005 1 1 7 GLY H H -4.932 -4.671 3.522 1.00 . A A . 7 GLY H 1 1 7 3006 1 1 7 GLY HA2 H -6.369 -5.605 1.747 1.00 . A A . 7 GLY HA2 1 1 7 3007 1 1 7 GLY HA3 H -7.598 -5.907 2.981 1.00 . A A . 7 GLY HA3 1 1 7 3008 1 1 7 GLY N N -5.784 -5.114 3.717 1.00 . A A . 7 GLY N 1 1 7 3009 1 1 7 GLY O O -8.616 -3.727 2.129 1.00 . A A . 7 GLY O 1 1 7 3010 1 1 8 THR C C -6.253 -0.662 1.271 1.00 . A A . 8 THR C 1 1 7 3011 1 1 8 THR CA C -7.181 -1.448 2.205 1.00 . A A . 8 THR CA 1 1 7 3012 1 1 8 THR CB C -7.237 -0.792 3.588 1.00 . A A . 8 THR CB 1 1 7 3013 1 1 8 THR CG2 C -7.377 0.724 3.433 1.00 . A A . 8 THR CG2 1 1 7 3014 1 1 8 THR H H -5.693 -2.942 2.665 1.00 . A A . 8 THR H 1 1 7 3015 1 1 8 THR HA H -8.172 -1.506 1.788 1.00 . A A . 8 THR HA 1 1 7 3016 1 1 8 THR HB H -6.329 -1.012 4.129 1.00 . A A . 8 THR HB 1 1 7 3017 1 1 8 THR HG1 H -8.614 -0.643 4.953 1.00 . A A . 8 THR HG1 1 1 7 3018 1 1 8 THR HG21 H -6.421 1.148 3.165 1.00 . A A . 8 THR HG21 1 1 7 3019 1 1 8 THR HG22 H -7.713 1.151 4.366 1.00 . A A . 8 THR HG22 1 1 7 3020 1 1 8 THR HG23 H -8.097 0.941 2.658 1.00 . A A . 8 THR HG23 1 1 7 3021 1 1 8 THR N N -6.642 -2.818 2.452 1.00 . A A . 8 THR N 1 1 7 3022 1 1 8 THR O O -6.702 0.156 0.495 1.00 . A A . 8 THR O 1 1 7 3023 1 1 8 THR OG1 O -8.352 -1.302 4.307 1.00 . A A . 8 THR OG1 1 1 7 3024 1 1 9 THR C C -4.288 1.322 0.451 1.00 . A A . 9 THR C 1 1 7 3025 1 1 9 THR CA C -3.986 -0.180 0.487 1.00 . A A . 9 THR CA 1 1 7 3026 1 1 9 THR CB C -4.110 -0.812 -0.908 1.00 . A A . 9 THR CB 1 1 7 3027 1 1 9 THR CG2 C -5.378 -0.323 -1.613 1.00 . A A . 9 THR CG2 1 1 7 3028 1 1 9 THR H H -4.647 -1.569 1.996 1.00 . A A . 9 THR H 1 1 7 3029 1 1 9 THR HA H -2.987 -0.337 0.862 1.00 . A A . 9 THR HA 1 1 7 3030 1 1 9 THR HB H -4.151 -1.886 -0.811 1.00 . A A . 9 THR HB 1 1 7 3031 1 1 9 THR HG1 H -3.221 -0.506 -2.611 1.00 . A A . 9 THR HG1 1 1 7 3032 1 1 9 THR HG21 H -5.275 -0.473 -2.677 1.00 . A A . 9 THR HG21 1 1 7 3033 1 1 9 THR HG22 H -5.526 0.726 -1.411 1.00 . A A . 9 THR HG22 1 1 7 3034 1 1 9 THR HG23 H -6.227 -0.884 -1.253 1.00 . A A . 9 THR HG23 1 1 7 3035 1 1 9 THR N N -4.970 -0.906 1.354 1.00 . A A . 9 THR N 1 1 7 3036 1 1 9 THR O O -5.229 1.796 1.054 1.00 . A A . 9 THR O 1 1 7 3037 1 1 9 THR OG1 O -2.977 -0.452 -1.685 1.00 . A A . 9 THR OG1 1 1 7 3038 1 1 10 PHE C C -2.543 4.225 -1.042 1.00 . A A . 10 PHE C 1 1 7 3039 1 1 10 PHE CA C -3.707 3.550 -0.313 1.00 . A A . 10 PHE CA 1 1 7 3040 1 1 10 PHE CB C -3.769 4.021 1.143 1.00 . A A . 10 PHE CB 1 1 7 3041 1 1 10 PHE CD1 C -1.362 3.892 1.890 1.00 . A A . 10 PHE CD1 1 1 7 3042 1 1 10 PHE CD2 C -2.932 2.244 2.726 1.00 . A A . 10 PHE CD2 1 1 7 3043 1 1 10 PHE CE1 C -0.337 3.289 2.629 1.00 . A A . 10 PHE CE1 1 1 7 3044 1 1 10 PHE CE2 C -1.907 1.642 3.463 1.00 . A A . 10 PHE CE2 1 1 7 3045 1 1 10 PHE CG C -2.661 3.370 1.938 1.00 . A A . 10 PHE CG 1 1 7 3046 1 1 10 PHE CZ C -0.609 2.163 3.415 1.00 . A A . 10 PHE CZ 1 1 7 3047 1 1 10 PHE H H -2.720 1.675 -0.713 1.00 . A A . 10 PHE H 1 1 7 3048 1 1 10 PHE HA H -4.639 3.764 -0.810 1.00 . A A . 10 PHE HA 1 1 7 3049 1 1 10 PHE HB2 H -3.652 5.093 1.177 1.00 . A A . 10 PHE HB2 1 1 7 3050 1 1 10 PHE HB3 H -4.722 3.750 1.570 1.00 . A A . 10 PHE HB3 1 1 7 3051 1 1 10 PHE HD1 H -1.151 4.760 1.283 1.00 . A A . 10 PHE HD1 1 1 7 3052 1 1 10 PHE HD2 H -3.934 1.841 2.764 1.00 . A A . 10 PHE HD2 1 1 7 3053 1 1 10 PHE HE1 H 0.665 3.691 2.591 1.00 . A A . 10 PHE HE1 1 1 7 3054 1 1 10 PHE HE2 H -2.117 0.774 4.070 1.00 . A A . 10 PHE HE2 1 1 7 3055 1 1 10 PHE HZ H 0.182 1.698 3.985 1.00 . A A . 10 PHE HZ 1 1 7 3056 1 1 10 PHE N N -3.481 2.076 -0.243 1.00 . A A . 10 PHE N 1 1 7 3057 1 1 10 PHE O O -1.777 3.585 -1.733 1.00 . A A . 10 PHE O 1 1 7 3058 1 1 11 LYS C C -0.327 6.819 -0.537 1.00 . A A . 11 LYS C 1 1 7 3059 1 1 11 LYS CA C -1.286 6.227 -1.574 1.00 . A A . 11 LYS CA 1 1 7 3060 1 1 11 LYS CB C -1.958 7.339 -2.379 1.00 . A A . 11 LYS CB 1 1 7 3061 1 1 11 LYS CD C -2.460 7.344 -4.828 1.00 . A A . 11 LYS CD 1 1 7 3062 1 1 11 LYS CE C -2.418 8.611 -5.685 1.00 . A A . 11 LYS CE 1 1 7 3063 1 1 11 LYS CG C -1.346 7.398 -3.780 1.00 . A A . 11 LYS CG 1 1 7 3064 1 1 11 LYS H H -3.032 6.013 -0.327 1.00 . A A . 11 LYS H 1 1 7 3065 1 1 11 LYS HA H -0.761 5.557 -2.235 1.00 . A A . 11 LYS HA 1 1 7 3066 1 1 11 LYS HB2 H -3.017 7.138 -2.457 1.00 . A A . 11 LYS HB2 1 1 7 3067 1 1 11 LYS HB3 H -1.806 8.286 -1.883 1.00 . A A . 11 LYS HB3 1 1 7 3068 1 1 11 LYS HD2 H -2.319 6.477 -5.458 1.00 . A A . 11 LYS HD2 1 1 7 3069 1 1 11 LYS HD3 H -3.418 7.278 -4.333 1.00 . A A . 11 LYS HD3 1 1 7 3070 1 1 11 LYS HE2 H -1.396 8.853 -5.946 1.00 . A A . 11 LYS HE2 1 1 7 3071 1 1 11 LYS HE3 H -3.014 8.484 -6.575 1.00 . A A . 11 LYS HE3 1 1 7 3072 1 1 11 LYS HG2 H -0.790 8.317 -3.892 1.00 . A A . 11 LYS HG2 1 1 7 3073 1 1 11 LYS HG3 H -0.684 6.557 -3.919 1.00 . A A . 11 LYS HG3 1 1 7 3074 1 1 11 LYS HZ1 H -2.559 10.589 -5.053 1.00 . A A . 11 LYS HZ1 1 1 7 3075 1 1 11 LYS HZ2 H -2.832 9.448 -3.824 1.00 . A A . 11 LYS HZ2 1 1 7 3076 1 1 11 LYS HZ3 H -4.026 9.739 -4.997 1.00 . A A . 11 LYS HZ3 1 1 7 3077 1 1 11 LYS N N -2.404 5.514 -0.890 1.00 . A A . 11 LYS N 1 1 7 3078 1 1 11 LYS NZ N -3.003 9.677 -4.826 1.00 . A A . 11 LYS NZ 1 1 7 3079 1 1 11 LYS O O -0.735 7.508 0.377 1.00 . A A . 11 LYS O 1 1 7 3080 1 1 12 ASP C C 3.188 7.532 -0.456 1.00 . A A . 12 ASP C 1 1 7 3081 1 1 12 ASP CA C 1.927 7.105 0.292 1.00 . A A . 12 ASP CA 1 1 7 3082 1 1 12 ASP CB C 2.233 5.947 1.243 1.00 . A A . 12 ASP CB 1 1 7 3083 1 1 12 ASP CG C 2.991 6.475 2.463 1.00 . A A . 12 ASP CG 1 1 7 3084 1 1 12 ASP H H 1.256 6.006 -1.417 1.00 . A A . 12 ASP H 1 1 7 3085 1 1 12 ASP HA H 1.507 7.934 0.838 1.00 . A A . 12 ASP HA 1 1 7 3086 1 1 12 ASP HB2 H 1.307 5.491 1.564 1.00 . A A . 12 ASP HB2 1 1 7 3087 1 1 12 ASP HB3 H 2.842 5.214 0.733 1.00 . A A . 12 ASP HB3 1 1 7 3088 1 1 12 ASP N N 0.944 6.558 -0.674 1.00 . A A . 12 ASP N 1 1 7 3089 1 1 12 ASP O O 3.736 6.786 -1.242 1.00 . A A . 12 ASP O 1 1 7 3090 1 1 12 ASP OD1 O 2.591 7.502 2.985 1.00 . A A . 12 ASP OD1 1 1 7 3091 1 1 12 ASP OD2 O 3.957 5.841 2.855 1.00 . A A . 12 ASP OD2 1 1 7 3092 1 1 13 LYS C C 4.600 9.337 -2.421 1.00 . A A . 13 LYS C 1 1 7 3093 1 1 13 LYS CA C 4.885 9.192 -0.926 1.00 . A A . 13 LYS CA 1 1 7 3094 1 1 13 LYS CB C 5.945 8.109 -0.696 1.00 . A A . 13 LYS CB 1 1 7 3095 1 1 13 LYS CD C 7.066 7.162 1.330 1.00 . A A . 13 LYS CD 1 1 7 3096 1 1 13 LYS CE C 7.628 5.833 0.822 1.00 . A A . 13 LYS CE 1 1 7 3097 1 1 13 LYS CG C 5.721 7.439 0.656 1.00 . A A . 13 LYS CG 1 1 7 3098 1 1 13 LYS H H 3.201 9.312 0.417 1.00 . A A . 13 LYS H 1 1 7 3099 1 1 13 LYS HA H 5.221 10.118 -0.507 1.00 . A A . 13 LYS HA 1 1 7 3100 1 1 13 LYS HB2 H 5.876 7.367 -1.480 1.00 . A A . 13 LYS HB2 1 1 7 3101 1 1 13 LYS HB3 H 6.928 8.561 -0.713 1.00 . A A . 13 LYS HB3 1 1 7 3102 1 1 13 LYS HD2 H 7.756 7.961 1.097 1.00 . A A . 13 LYS HD2 1 1 7 3103 1 1 13 LYS HD3 H 6.928 7.108 2.400 1.00 . A A . 13 LYS HD3 1 1 7 3104 1 1 13 LYS HE2 H 7.169 5.006 1.346 1.00 . A A . 13 LYS HE2 1 1 7 3105 1 1 13 LYS HE3 H 7.471 5.739 -0.242 1.00 . A A . 13 LYS HE3 1 1 7 3106 1 1 13 LYS HG2 H 5.121 8.084 1.280 1.00 . A A . 13 LYS HG2 1 1 7 3107 1 1 13 LYS HG3 H 5.200 6.518 0.501 1.00 . A A . 13 LYS HG3 1 1 7 3108 1 1 13 LYS HZ1 H 9.467 6.808 0.804 1.00 . A A . 13 LYS HZ1 1 1 7 3109 1 1 13 LYS HZ2 H 9.574 5.124 0.613 1.00 . A A . 13 LYS HZ2 1 1 7 3110 1 1 13 LYS HZ3 H 9.239 5.788 2.140 1.00 . A A . 13 LYS HZ3 1 1 7 3111 1 1 13 LYS N N 3.656 8.724 -0.221 1.00 . A A . 13 LYS N 1 1 7 3112 1 1 13 LYS NZ N 9.087 5.892 1.117 1.00 . A A . 13 LYS NZ 1 1 7 3113 1 1 13 LYS O O 3.523 9.731 -2.822 1.00 . A A . 13 LYS O 1 1 7 3114 1 1 14 CYS C C 4.830 7.748 -5.243 1.00 . A A . 14 CYS C 1 1 7 3115 1 1 14 CYS CA C 5.321 9.098 -4.720 1.00 . A A . 14 CYS CA 1 1 7 3116 1 1 14 CYS CB C 6.686 9.443 -5.316 1.00 . A A . 14 CYS CB 1 1 7 3117 1 1 14 CYS H H 6.405 8.672 -2.910 1.00 . A A . 14 CYS H 1 1 7 3118 1 1 14 CYS HA H 4.608 9.876 -4.945 1.00 . A A . 14 CYS HA 1 1 7 3119 1 1 14 CYS HB2 H 7.424 8.739 -4.955 1.00 . A A . 14 CYS HB2 1 1 7 3120 1 1 14 CYS HB3 H 6.633 9.387 -6.395 1.00 . A A . 14 CYS HB3 1 1 7 3121 1 1 14 CYS N N 5.549 9.001 -3.251 1.00 . A A . 14 CYS N 1 1 7 3122 1 1 14 CYS O O 4.992 7.418 -6.402 1.00 . A A . 14 CYS O 1 1 7 3123 1 1 14 CYS SG S 7.156 11.119 -4.822 1.00 . A A . 14 CYS SG 1 1 7 3124 1 1 15 ASN C C 2.584 5.165 -3.937 1.00 . A A . 15 ASN C 1 1 7 3125 1 1 15 ASN CA C 3.745 5.621 -4.821 1.00 . A A . 15 ASN CA 1 1 7 3126 1 1 15 ASN CB C 4.939 4.688 -4.639 1.00 . A A . 15 ASN CB 1 1 7 3127 1 1 15 ASN CG C 5.897 4.851 -5.820 1.00 . A A . 15 ASN CG 1 1 7 3128 1 1 15 ASN H H 4.128 7.243 -3.456 1.00 . A A . 15 ASN H 1 1 7 3129 1 1 15 ASN HA H 3.447 5.639 -5.856 1.00 . A A . 15 ASN HA 1 1 7 3130 1 1 15 ASN HB2 H 5.450 4.935 -3.722 1.00 . A A . 15 ASN HB2 1 1 7 3131 1 1 15 ASN HB3 H 4.595 3.667 -4.593 1.00 . A A . 15 ASN HB3 1 1 7 3132 1 1 15 ASN HD21 H 4.482 4.554 -7.185 1.00 . A A . 15 ASN HD21 1 1 7 3133 1 1 15 ASN HD22 H 6.046 4.843 -7.803 1.00 . A A . 15 ASN HD22 1 1 7 3134 1 1 15 ASN N N 4.239 6.958 -4.387 1.00 . A A . 15 ASN N 1 1 7 3135 1 1 15 ASN ND2 N 5.437 4.741 -7.037 1.00 . A A . 15 ASN ND2 1 1 7 3136 1 1 15 ASN O O 2.155 5.862 -3.040 1.00 . A A . 15 ASN O 1 1 7 3137 1 1 15 ASN OD1 O 7.075 5.079 -5.634 1.00 . A A . 15 ASN OD1 1 1 7 3138 1 1 16 THR C C 1.478 2.375 -2.428 1.00 . A A . 16 THR C 1 1 7 3139 1 1 16 THR CA C 0.954 3.459 -3.371 1.00 . A A . 16 THR CA 1 1 7 3140 1 1 16 THR CB C -0.035 2.887 -4.400 1.00 . A A . 16 THR CB 1 1 7 3141 1 1 16 THR CG2 C -0.750 1.657 -3.833 1.00 . A A . 16 THR CG2 1 1 7 3142 1 1 16 THR H H 2.456 3.449 -4.913 1.00 . A A . 16 THR H 1 1 7 3143 1 1 16 THR HA H 0.487 4.251 -2.806 1.00 . A A . 16 THR HA 1 1 7 3144 1 1 16 THR HB H 0.502 2.604 -5.293 1.00 . A A . 16 THR HB 1 1 7 3145 1 1 16 THR HG1 H -1.071 4.477 -3.975 1.00 . A A . 16 THR HG1 1 1 7 3146 1 1 16 THR HG21 H -1.478 1.302 -4.546 1.00 . A A . 16 THR HG21 1 1 7 3147 1 1 16 THR HG22 H -1.247 1.921 -2.912 1.00 . A A . 16 THR HG22 1 1 7 3148 1 1 16 THR HG23 H -0.025 0.879 -3.639 1.00 . A A . 16 THR HG23 1 1 7 3149 1 1 16 THR N N 2.083 3.990 -4.187 1.00 . A A . 16 THR N 1 1 7 3150 1 1 16 THR O O 2.598 1.926 -2.549 1.00 . A A . 16 THR O 1 1 7 3151 1 1 16 THR OG1 O -0.997 3.881 -4.724 1.00 . A A . 16 THR OG1 1 1 7 3152 1 1 17 CYS C C -0.004 -0.044 -0.190 1.00 . A A . 17 CYS C 1 1 7 3153 1 1 17 CYS CA C 1.142 0.910 -0.539 1.00 . A A . 17 CYS CA 1 1 7 3154 1 1 17 CYS CB C 1.595 1.685 0.695 1.00 . A A . 17 CYS CB 1 1 7 3155 1 1 17 CYS H H -0.221 2.336 -1.403 1.00 . A A . 17 CYS H 1 1 7 3156 1 1 17 CYS HA H 1.973 0.366 -0.956 1.00 . A A . 17 CYS HA 1 1 7 3157 1 1 17 CYS HB2 H 1.678 2.736 0.450 1.00 . A A . 17 CYS HB2 1 1 7 3158 1 1 17 CYS HB3 H 0.871 1.556 1.484 1.00 . A A . 17 CYS HB3 1 1 7 3159 1 1 17 CYS N N 0.678 1.958 -1.488 1.00 . A A . 17 CYS N 1 1 7 3160 1 1 17 CYS O O -0.951 0.323 0.476 1.00 . A A . 17 CYS O 1 1 7 3161 1 1 17 CYS SG S 3.206 1.066 1.240 1.00 . A A . 17 CYS SG 1 1 7 3162 1 1 18 ARG C C -0.827 -2.804 1.086 1.00 . A A . 18 ARG C 1 1 7 3163 1 1 18 ARG CA C -1.001 -2.252 -0.327 1.00 . A A . 18 ARG CA 1 1 7 3164 1 1 18 ARG CB C -0.836 -3.361 -1.366 1.00 . A A . 18 ARG CB 1 1 7 3165 1 1 18 ARG CD C -3.135 -4.244 -0.931 1.00 . A A . 18 ARG CD 1 1 7 3166 1 1 18 ARG CG C -1.644 -4.589 -0.941 1.00 . A A . 18 ARG CG 1 1 7 3167 1 1 18 ARG CZ C -5.090 -5.659 -0.738 1.00 . A A . 18 ARG CZ 1 1 7 3168 1 1 18 ARG H H 0.853 -1.545 -1.168 1.00 . A A . 18 ARG H 1 1 7 3169 1 1 18 ARG HA H -1.972 -1.793 -0.427 1.00 . A A . 18 ARG HA 1 1 7 3170 1 1 18 ARG HB2 H -1.191 -3.011 -2.326 1.00 . A A . 18 ARG HB2 1 1 7 3171 1 1 18 ARG HB3 H 0.207 -3.628 -1.445 1.00 . A A . 18 ARG HB3 1 1 7 3172 1 1 18 ARG HD2 H -3.404 -3.774 0.004 1.00 . A A . 18 ARG HD2 1 1 7 3173 1 1 18 ARG HD3 H -3.377 -3.600 -1.762 1.00 . A A . 18 ARG HD3 1 1 7 3174 1 1 18 ARG HE H -3.352 -6.328 -1.429 1.00 . A A . 18 ARG HE 1 1 7 3175 1 1 18 ARG HG2 H -1.464 -5.395 -1.637 1.00 . A A . 18 ARG HG2 1 1 7 3176 1 1 18 ARG HG3 H -1.341 -4.893 0.050 1.00 . A A . 18 ARG HG3 1 1 7 3177 1 1 18 ARG HH11 H -5.512 -3.736 -1.098 1.00 . A A . 18 ARG HH11 1 1 7 3178 1 1 18 ARG HH12 H -6.836 -4.702 -0.535 1.00 . A A . 18 ARG HH12 1 1 7 3179 1 1 18 ARG HH21 H -4.961 -7.608 -0.295 1.00 . A A . 18 ARG HH21 1 1 7 3180 1 1 18 ARG HH22 H -6.523 -6.892 -0.081 1.00 . A A . 18 ARG HH22 1 1 7 3181 1 1 18 ARG N N 0.079 -1.269 -0.634 1.00 . A A . 18 ARG N 1 1 7 3182 1 1 18 ARG NE N -3.834 -5.550 -1.077 1.00 . A A . 18 ARG NE 1 1 7 3183 1 1 18 ARG NH1 N -5.874 -4.619 -0.794 1.00 . A A . 18 ARG NH1 1 1 7 3184 1 1 18 ARG NH2 N -5.562 -6.810 -0.340 1.00 . A A . 18 ARG NH2 1 1 7 3185 1 1 18 ARG O O 0.110 -3.519 1.378 1.00 . A A . 18 ARG O 1 1 7 3186 1 1 19 CYS C C -1.565 -4.497 3.372 1.00 . A A . 19 CYS C 1 1 7 3187 1 1 19 CYS CA C -1.640 -2.967 3.361 1.00 . A A . 19 CYS CA 1 1 7 3188 1 1 19 CYS CB C -2.932 -2.479 4.016 1.00 . A A . 19 CYS CB 1 1 7 3189 1 1 19 CYS H H -2.477 -1.895 1.698 1.00 . A A . 19 CYS H 1 1 7 3190 1 1 19 CYS HA H -0.786 -2.539 3.862 1.00 . A A . 19 CYS HA 1 1 7 3191 1 1 19 CYS HB2 H -3.402 -1.745 3.374 1.00 . A A . 19 CYS HB2 1 1 7 3192 1 1 19 CYS HB3 H -3.600 -3.313 4.156 1.00 . A A . 19 CYS HB3 1 1 7 3193 1 1 19 CYS N N -1.730 -2.472 1.963 1.00 . A A . 19 CYS N 1 1 7 3194 1 1 19 CYS O O -2.479 -5.175 2.948 1.00 . A A . 19 CYS O 1 1 7 3195 1 1 19 CYS SG S -2.562 -1.719 5.615 1.00 . A A . 19 CYS SG 1 1 7 3196 1 1 20 GLY C C -1.603 -7.152 4.478 1.00 . A A . 20 GLY C 1 1 7 3197 1 1 20 GLY CA C -0.341 -6.529 3.879 1.00 . A A . 20 GLY CA 1 1 7 3198 1 1 20 GLY H H 0.250 -4.478 4.180 1.00 . A A . 20 GLY H 1 1 7 3199 1 1 20 GLY HA2 H -0.200 -6.897 2.871 1.00 . A A . 20 GLY HA2 1 1 7 3200 1 1 20 GLY HA3 H 0.512 -6.798 4.485 1.00 . A A . 20 GLY HA3 1 1 7 3201 1 1 20 GLY N N -0.479 -5.044 3.847 1.00 . A A . 20 GLY N 1 1 7 3202 1 1 20 GLY O O -2.514 -6.462 4.888 1.00 . A A . 20 GLY O 1 1 7 3203 1 1 21 SER C C -2.705 -9.306 6.617 1.00 . A A . 21 SER C 1 1 7 3204 1 1 21 SER CA C -2.866 -9.125 5.106 1.00 . A A . 21 SER CA 1 1 7 3205 1 1 21 SER CB C -2.929 -10.482 4.409 1.00 . A A . 21 SER CB 1 1 7 3206 1 1 21 SER H H -0.917 -8.994 4.196 1.00 . A A . 21 SER H 1 1 7 3207 1 1 21 SER HA H -3.756 -8.556 4.885 1.00 . A A . 21 SER HA 1 1 7 3208 1 1 21 SER HB2 H -2.701 -10.363 3.363 1.00 . A A . 21 SER HB2 1 1 7 3209 1 1 21 SER HB3 H -2.207 -11.149 4.859 1.00 . A A . 21 SER HB3 1 1 7 3210 1 1 21 SER HG H -4.230 -11.642 5.273 1.00 . A A . 21 SER HG 1 1 7 3211 1 1 21 SER N N -1.663 -8.455 4.532 1.00 . A A . 21 SER N 1 1 7 3212 1 1 21 SER O O -3.650 -9.608 7.320 1.00 . A A . 21 SER O 1 1 7 3213 1 1 21 SER OG O -4.239 -11.019 4.543 1.00 . A A . 21 SER OG 1 1 7 3214 1 1 22 ASP C C -1.337 -7.922 9.282 1.00 . A A . 22 ASP C 1 1 7 3215 1 1 22 ASP CA C -1.299 -9.287 8.590 1.00 . A A . 22 ASP CA 1 1 7 3216 1 1 22 ASP CB C 0.088 -9.918 8.717 1.00 . A A . 22 ASP CB 1 1 7 3217 1 1 22 ASP CG C -0.056 -11.402 9.062 1.00 . A A . 22 ASP CG 1 1 7 3218 1 1 22 ASP H H -0.768 -8.880 6.541 1.00 . A A . 22 ASP H 1 1 7 3219 1 1 22 ASP HA H -2.042 -9.944 9.010 1.00 . A A . 22 ASP HA 1 1 7 3220 1 1 22 ASP HB2 H 0.617 -9.816 7.778 1.00 . A A . 22 ASP HB2 1 1 7 3221 1 1 22 ASP HB3 H 0.641 -9.421 9.501 1.00 . A A . 22 ASP HB3 1 1 7 3222 1 1 22 ASP N N -1.516 -9.124 7.124 1.00 . A A . 22 ASP N 1 1 7 3223 1 1 22 ASP O O -1.277 -7.826 10.492 1.00 . A A . 22 ASP O 1 1 7 3224 1 1 22 ASP OD1 O -0.594 -11.694 10.118 1.00 . A A . 22 ASP OD1 1 1 7 3225 1 1 22 ASP OD2 O 0.372 -12.220 8.266 1.00 . A A . 22 ASP OD2 1 1 7 3226 1 1 23 GLY C C -0.078 -5.071 9.536 1.00 . A A . 23 GLY C 1 1 7 3227 1 1 23 GLY CA C -1.490 -5.508 9.138 1.00 . A A . 23 GLY CA 1 1 7 3228 1 1 23 GLY H H -1.494 -6.964 7.551 1.00 . A A . 23 GLY H 1 1 7 3229 1 1 23 GLY HA2 H -1.896 -4.804 8.423 1.00 . A A . 23 GLY HA2 1 1 7 3230 1 1 23 GLY HA3 H -2.115 -5.533 10.018 1.00 . A A . 23 GLY HA3 1 1 7 3231 1 1 23 GLY N N -1.442 -6.865 8.524 1.00 . A A . 23 GLY N 1 1 7 3232 1 1 23 GLY O O 0.869 -5.825 9.431 1.00 . A A . 23 GLY O 1 1 7 3233 1 1 24 LYS C C 2.427 -3.602 9.276 1.00 . A A . 24 LYS C 1 1 7 3234 1 1 24 LYS CA C 1.417 -3.370 10.403 1.00 . A A . 24 LYS CA 1 1 7 3235 1 1 24 LYS CB C 1.784 -4.201 11.633 1.00 . A A . 24 LYS CB 1 1 7 3236 1 1 24 LYS CD C 0.554 -3.975 13.798 1.00 . A A . 24 LYS CD 1 1 7 3237 1 1 24 LYS CE C -0.091 -2.885 14.656 1.00 . A A . 24 LYS CE 1 1 7 3238 1 1 24 LYS CG C 1.618 -3.349 12.894 1.00 . A A . 24 LYS CG 1 1 7 3239 1 1 24 LYS H H -0.710 -3.267 10.074 1.00 . A A . 24 LYS H 1 1 7 3240 1 1 24 LYS HA H 1.377 -2.325 10.665 1.00 . A A . 24 LYS HA 1 1 7 3241 1 1 24 LYS HB2 H 1.134 -5.062 11.691 1.00 . A A . 24 LYS HB2 1 1 7 3242 1 1 24 LYS HB3 H 2.810 -4.528 11.555 1.00 . A A . 24 LYS HB3 1 1 7 3243 1 1 24 LYS HD2 H -0.202 -4.450 13.188 1.00 . A A . 24 LYS HD2 1 1 7 3244 1 1 24 LYS HD3 H 1.015 -4.710 14.440 1.00 . A A . 24 LYS HD3 1 1 7 3245 1 1 24 LYS HE2 H 0.223 -1.905 14.318 1.00 . A A . 24 LYS HE2 1 1 7 3246 1 1 24 LYS HE3 H -1.167 -2.968 14.625 1.00 . A A . 24 LYS HE3 1 1 7 3247 1 1 24 LYS HG2 H 2.560 -3.302 13.422 1.00 . A A . 24 LYS HG2 1 1 7 3248 1 1 24 LYS HG3 H 1.311 -2.352 12.616 1.00 . A A . 24 LYS HG3 1 1 7 3249 1 1 24 LYS HZ1 H 0.475 -2.243 16.554 1.00 . A A . 24 LYS HZ1 1 1 7 3250 1 1 24 LYS HZ2 H 1.337 -3.596 15.994 1.00 . A A . 24 LYS HZ2 1 1 7 3251 1 1 24 LYS HZ3 H -0.265 -3.768 16.533 1.00 . A A . 24 LYS HZ3 1 1 7 3252 1 1 24 LYS N N 0.068 -3.858 9.996 1.00 . A A . 24 LYS N 1 1 7 3253 1 1 24 LYS NZ N 0.401 -3.143 16.039 1.00 . A A . 24 LYS NZ 1 1 7 3254 1 1 24 LYS O O 3.623 -3.621 9.496 1.00 . A A . 24 LYS O 1 1 7 3255 1 1 25 SER C C 2.201 -3.641 5.616 1.00 . A A . 25 SER C 1 1 7 3256 1 1 25 SER CA C 2.889 -4.005 6.932 1.00 . A A . 25 SER CA 1 1 7 3257 1 1 25 SER CB C 3.213 -5.497 6.975 1.00 . A A . 25 SER CB 1 1 7 3258 1 1 25 SER H H 0.989 -3.756 7.919 1.00 . A A . 25 SER H 1 1 7 3259 1 1 25 SER HA H 3.790 -3.426 7.060 1.00 . A A . 25 SER HA 1 1 7 3260 1 1 25 SER HB2 H 2.333 -6.051 7.261 1.00 . A A . 25 SER HB2 1 1 7 3261 1 1 25 SER HB3 H 3.541 -5.821 5.995 1.00 . A A . 25 SER HB3 1 1 7 3262 1 1 25 SER HG H 4.084 -5.147 8.680 1.00 . A A . 25 SER HG 1 1 7 3263 1 1 25 SER N N 1.957 -3.777 8.074 1.00 . A A . 25 SER N 1 1 7 3264 1 1 25 SER O O 1.040 -3.935 5.409 1.00 . A A . 25 SER O 1 1 7 3265 1 1 25 SER OG O 4.240 -5.727 7.932 1.00 . A A . 25 SER OG 1 1 7 3266 1 1 26 ALA C C 3.335 -2.631 2.312 1.00 . A A . 26 ALA C 1 1 7 3267 1 1 26 ALA CA C 2.285 -2.620 3.425 1.00 . A A . 26 ALA CA 1 1 7 3268 1 1 26 ALA CB C 1.752 -1.204 3.646 1.00 . A A . 26 ALA CB 1 1 7 3269 1 1 26 ALA H H 3.839 -2.772 4.909 1.00 . A A . 26 ALA H 1 1 7 3270 1 1 26 ALA HA H 1.473 -3.287 3.184 1.00 . A A . 26 ALA HA 1 1 7 3271 1 1 26 ALA HB1 H 1.696 -1.002 4.705 1.00 . A A . 26 ALA HB1 1 1 7 3272 1 1 26 ALA HB2 H 0.767 -1.118 3.211 1.00 . A A . 26 ALA HB2 1 1 7 3273 1 1 26 ALA HB3 H 2.417 -0.492 3.178 1.00 . A A . 26 ALA HB3 1 1 7 3274 1 1 26 ALA N N 2.906 -3.002 4.724 1.00 . A A . 26 ALA N 1 1 7 3275 1 1 26 ALA O O 4.479 -2.276 2.517 1.00 . A A . 26 ALA O 1 1 7 3276 1 1 27 ALA C C 3.876 -1.737 -0.754 1.00 . A A . 27 ALA C 1 1 7 3277 1 1 27 ALA CA C 3.923 -3.058 0.000 1.00 . A A . 27 ALA CA 1 1 7 3278 1 1 27 ALA CB C 3.450 -4.184 -0.909 1.00 . A A . 27 ALA CB 1 1 7 3279 1 1 27 ALA H H 2.023 -3.307 0.985 1.00 . A A . 27 ALA H 1 1 7 3280 1 1 27 ALA HA H 4.921 -3.262 0.357 1.00 . A A . 27 ALA HA 1 1 7 3281 1 1 27 ALA HB1 H 4.280 -4.544 -1.495 1.00 . A A . 27 ALA HB1 1 1 7 3282 1 1 27 ALA HB2 H 2.680 -3.807 -1.569 1.00 . A A . 27 ALA HB2 1 1 7 3283 1 1 27 ALA HB3 H 3.051 -4.986 -0.311 1.00 . A A . 27 ALA HB3 1 1 7 3284 1 1 27 ALA N N 2.952 -3.030 1.131 1.00 . A A . 27 ALA N 1 1 7 3285 1 1 27 ALA O O 2.911 -1.436 -1.426 1.00 . A A . 27 ALA O 1 1 7 3286 1 1 28 CYS C C 5.529 0.209 -2.754 1.00 . A A . 28 CYS C 1 1 7 3287 1 1 28 CYS CA C 4.877 0.352 -1.377 1.00 . A A . 28 CYS CA 1 1 7 3288 1 1 28 CYS CB C 5.671 1.317 -0.497 1.00 . A A . 28 CYS CB 1 1 7 3289 1 1 28 CYS H H 5.674 -1.196 -0.110 1.00 . A A . 28 CYS H 1 1 7 3290 1 1 28 CYS HA H 3.862 0.689 -1.476 1.00 . A A . 28 CYS HA 1 1 7 3291 1 1 28 CYS HB2 H 6.285 0.753 0.190 1.00 . A A . 28 CYS HB2 1 1 7 3292 1 1 28 CYS HB3 H 6.301 1.936 -1.118 1.00 . A A . 28 CYS HB3 1 1 7 3293 1 1 28 CYS N N 4.899 -0.944 -0.656 1.00 . A A . 28 CYS N 1 1 7 3294 1 1 28 CYS O O 6.544 -0.442 -2.906 1.00 . A A . 28 CYS O 1 1 7 3295 1 1 28 CYS SG S 4.529 2.364 0.438 1.00 . A A . 28 CYS SG 1 1 7 3296 1 1 29 THR C C 6.762 1.635 -5.240 1.00 . A A . 29 THR C 1 1 7 3297 1 1 29 THR CA C 5.555 0.700 -5.127 1.00 . A A . 29 THR CA 1 1 7 3298 1 1 29 THR CB C 4.456 1.123 -6.120 1.00 . A A . 29 THR CB 1 1 7 3299 1 1 29 THR CG2 C 3.073 0.738 -5.587 1.00 . A A . 29 THR CG2 1 1 7 3300 1 1 29 THR H H 4.135 1.333 -3.622 1.00 . A A . 29 THR H 1 1 7 3301 1 1 29 THR HA H 5.853 -0.318 -5.321 1.00 . A A . 29 THR HA 1 1 7 3302 1 1 29 THR HB H 4.621 0.623 -7.063 1.00 . A A . 29 THR HB 1 1 7 3303 1 1 29 THR HG1 H 3.981 2.737 -7.093 1.00 . A A . 29 THR HG1 1 1 7 3304 1 1 29 THR HG21 H 2.597 1.611 -5.165 1.00 . A A . 29 THR HG21 1 1 7 3305 1 1 29 THR HG22 H 3.179 -0.017 -4.825 1.00 . A A . 29 THR HG22 1 1 7 3306 1 1 29 THR HG23 H 2.469 0.354 -6.395 1.00 . A A . 29 THR HG23 1 1 7 3307 1 1 29 THR N N 4.956 0.811 -3.762 1.00 . A A . 29 THR N 1 1 7 3308 1 1 29 THR O O 6.825 2.480 -6.109 1.00 . A A . 29 THR O 1 1 7 3309 1 1 29 THR OG1 O 4.511 2.527 -6.321 1.00 . A A . 29 THR OG1 1 1 7 3310 1 1 30 LEU C C 9.401 2.525 -5.866 1.00 . A A . 30 LEU C 1 1 7 3311 1 1 30 LEU CA C 8.924 2.371 -4.420 1.00 . A A . 30 LEU CA 1 1 7 3312 1 1 30 LEU CB C 9.983 1.651 -3.583 1.00 . A A . 30 LEU CB 1 1 7 3313 1 1 30 LEU CD1 C 9.970 0.348 -1.452 1.00 . A A . 30 LEU CD1 1 1 7 3314 1 1 30 LEU CD2 C 10.290 2.824 -1.400 1.00 . A A . 30 LEU CD2 1 1 7 3315 1 1 30 LEU CG C 9.575 1.673 -2.109 1.00 . A A . 30 LEU CG 1 1 7 3316 1 1 30 LEU H H 7.650 0.801 -3.671 1.00 . A A . 30 LEU H 1 1 7 3317 1 1 30 LEU HA H 8.706 3.335 -3.989 1.00 . A A . 30 LEU HA 1 1 7 3318 1 1 30 LEU HB2 H 10.072 0.628 -3.919 1.00 . A A . 30 LEU HB2 1 1 7 3319 1 1 30 LEU HB3 H 10.933 2.151 -3.699 1.00 . A A . 30 LEU HB3 1 1 7 3320 1 1 30 LEU HD11 H 10.351 0.539 -0.460 1.00 . A A . 30 LEU HD11 1 1 7 3321 1 1 30 LEU HD12 H 10.733 -0.134 -2.044 1.00 . A A . 30 LEU HD12 1 1 7 3322 1 1 30 LEU HD13 H 9.103 -0.294 -1.387 1.00 . A A . 30 LEU HD13 1 1 7 3323 1 1 30 LEU HD21 H 10.534 3.593 -2.119 1.00 . A A . 30 LEU HD21 1 1 7 3324 1 1 30 LEU HD22 H 11.197 2.457 -0.944 1.00 . A A . 30 LEU HD22 1 1 7 3325 1 1 30 LEU HD23 H 9.644 3.234 -0.639 1.00 . A A . 30 LEU HD23 1 1 7 3326 1 1 30 LEU HG H 8.505 1.808 -2.034 1.00 . A A . 30 LEU HG 1 1 7 3327 1 1 30 LEU N N 7.721 1.489 -4.365 1.00 . A A . 30 LEU N 1 1 7 3328 1 1 30 LEU O O 10.162 1.721 -6.368 1.00 . A A . 30 LEU O 1 1 7 3329 1 1 31 LYS C C 9.810 5.200 -8.185 1.00 . A A . 31 LYS C 1 1 7 3330 1 1 31 LYS CA C 9.382 3.747 -7.957 1.00 . A A . 31 LYS CA 1 1 7 3331 1 1 31 LYS CB C 8.144 3.415 -8.790 1.00 . A A . 31 LYS CB 1 1 7 3332 1 1 31 LYS CD C 8.442 0.979 -8.306 1.00 . A A . 31 LYS CD 1 1 7 3333 1 1 31 LYS CE C 7.647 -0.275 -8.681 1.00 . A A . 31 LYS CE 1 1 7 3334 1 1 31 LYS CG C 8.301 2.025 -9.413 1.00 . A A . 31 LYS CG 1 1 7 3335 1 1 31 LYS H H 8.341 4.184 -6.122 1.00 . A A . 31 LYS H 1 1 7 3336 1 1 31 LYS HA H 10.186 3.074 -8.208 1.00 . A A . 31 LYS HA 1 1 7 3337 1 1 31 LYS HB2 H 7.270 3.428 -8.156 1.00 . A A . 31 LYS HB2 1 1 7 3338 1 1 31 LYS HB3 H 8.030 4.147 -9.575 1.00 . A A . 31 LYS HB3 1 1 7 3339 1 1 31 LYS HD2 H 9.484 0.722 -8.184 1.00 . A A . 31 LYS HD2 1 1 7 3340 1 1 31 LYS HD3 H 8.058 1.379 -7.381 1.00 . A A . 31 LYS HD3 1 1 7 3341 1 1 31 LYS HE2 H 7.432 -0.860 -7.796 1.00 . A A . 31 LYS HE2 1 1 7 3342 1 1 31 LYS HE3 H 6.734 -0.004 -9.186 1.00 . A A . 31 LYS HE3 1 1 7 3343 1 1 31 LYS HG2 H 7.430 1.800 -10.013 1.00 . A A . 31 LYS HG2 1 1 7 3344 1 1 31 LYS HG3 H 9.181 2.007 -10.037 1.00 . A A . 31 LYS HG3 1 1 7 3345 1 1 31 LYS HZ1 H 9.075 -0.368 -10.193 1.00 . A A . 31 LYS HZ1 1 1 7 3346 1 1 31 LYS HZ2 H 7.958 -1.647 -10.213 1.00 . A A . 31 LYS HZ2 1 1 7 3347 1 1 31 LYS HZ3 H 9.196 -1.615 -9.050 1.00 . A A . 31 LYS HZ3 1 1 7 3348 1 1 31 LYS N N 8.958 3.549 -6.543 1.00 . A A . 31 LYS N 1 1 7 3349 1 1 31 LYS NZ N 8.536 -1.033 -9.604 1.00 . A A . 31 LYS NZ 1 1 7 3350 1 1 31 LYS O O 9.143 5.953 -8.866 1.00 . A A . 31 LYS O 1 1 7 3351 1 1 32 ALA C C 10.411 7.986 -7.166 1.00 . A A . 32 ALA C 1 1 7 3352 1 1 32 ALA CA C 11.391 7.002 -7.812 1.00 . A A . 32 ALA CA 1 1 7 3353 1 1 32 ALA CB C 11.438 7.204 -9.327 1.00 . A A . 32 ALA CB 1 1 7 3354 1 1 32 ALA H H 11.444 4.976 -7.079 1.00 . A A . 32 ALA H 1 1 7 3355 1 1 32 ALA HA H 12.378 7.126 -7.395 1.00 . A A . 32 ALA HA 1 1 7 3356 1 1 32 ALA HB1 H 12.462 7.342 -9.640 1.00 . A A . 32 ALA HB1 1 1 7 3357 1 1 32 ALA HB2 H 10.860 8.076 -9.593 1.00 . A A . 32 ALA HB2 1 1 7 3358 1 1 32 ALA HB3 H 11.026 6.337 -9.820 1.00 . A A . 32 ALA HB3 1 1 7 3359 1 1 32 ALA N N 10.919 5.599 -7.624 1.00 . A A . 32 ALA N 1 1 7 3360 1 1 32 ALA O O 9.237 7.708 -7.026 1.00 . A A . 32 ALA O 1 1 7 3361 1 1 33 CYS C C 10.650 11.522 -6.159 1.00 . A A . 33 CYS C 1 1 7 3362 1 1 33 CYS CA C 9.987 10.142 -6.136 1.00 . A A . 33 CYS CA 1 1 7 3363 1 1 33 CYS CB C 9.806 9.650 -4.698 1.00 . A A . 33 CYS CB 1 1 7 3364 1 1 33 CYS H H 11.837 9.340 -6.897 1.00 . A A . 33 CYS H 1 1 7 3365 1 1 33 CYS HA H 9.034 10.170 -6.640 1.00 . A A . 33 CYS HA 1 1 7 3366 1 1 33 CYS HB2 H 9.278 8.707 -4.705 1.00 . A A . 33 CYS HB2 1 1 7 3367 1 1 33 CYS HB3 H 10.776 9.519 -4.239 1.00 . A A . 33 CYS HB3 1 1 7 3368 1 1 33 CYS N N 10.886 9.136 -6.773 1.00 . A A . 33 CYS N 1 1 7 3369 1 1 33 CYS O O 11.474 11.833 -5.321 1.00 . A A . 33 CYS O 1 1 7 3370 1 1 33 CYS SG S 8.854 10.868 -3.754 1.00 . A A . 33 CYS SG 1 1 7 3371 1 1 34 PRO C C 10.289 14.614 -6.219 1.00 . A A . 34 PRO C 1 1 7 3372 1 1 34 PRO CA C 10.839 13.665 -7.290 1.00 . A A . 34 PRO CA 1 1 7 3373 1 1 34 PRO CB C 10.372 14.090 -8.679 1.00 . A A . 34 PRO CB 1 1 7 3374 1 1 34 PRO CD C 9.283 11.993 -8.173 1.00 . A A . 34 PRO CD 1 1 7 3375 1 1 34 PRO CG C 9.139 13.282 -8.939 1.00 . A A . 34 PRO CG 1 1 7 3376 1 1 34 PRO HA H 11.915 13.635 -7.256 1.00 . A A . 34 PRO HA 1 1 7 3377 1 1 34 PRO HB2 H 10.143 15.147 -8.691 1.00 . A A . 34 PRO HB2 1 1 7 3378 1 1 34 PRO HB3 H 11.126 13.858 -9.416 1.00 . A A . 34 PRO HB3 1 1 7 3379 1 1 34 PRO HD2 H 8.337 11.711 -7.729 1.00 . A A . 34 PRO HD2 1 1 7 3380 1 1 34 PRO HD3 H 9.654 11.208 -8.815 1.00 . A A . 34 PRO HD3 1 1 7 3381 1 1 34 PRO HG2 H 8.269 13.824 -8.594 1.00 . A A . 34 PRO HG2 1 1 7 3382 1 1 34 PRO HG3 H 9.051 13.072 -9.992 1.00 . A A . 34 PRO HG3 1 1 7 3383 1 1 34 PRO N N 10.271 12.304 -7.134 1.00 . A A . 34 PRO N 1 1 7 3384 1 1 34 PRO O O 10.844 15.665 -5.967 1.00 . A A . 34 PRO O 1 1 7 3385 1 1 35 GLN C C 8.943 14.601 -3.146 1.00 . A A . 35 GLN C 1 1 7 3386 1 1 35 GLN CA C 8.629 15.147 -4.541 1.00 . A A . 35 GLN CA 1 1 7 3387 1 1 35 GLN CB C 7.121 15.135 -4.797 1.00 . A A . 35 GLN CB 1 1 7 3388 1 1 35 GLN CD C 5.720 16.616 -6.243 1.00 . A A . 35 GLN CD 1 1 7 3389 1 1 35 GLN CG C 6.631 16.569 -5.017 1.00 . A A . 35 GLN CG 1 1 7 3390 1 1 35 GLN H H 8.767 13.407 -5.806 1.00 . A A . 35 GLN H 1 1 7 3391 1 1 35 GLN HA H 9.012 16.151 -4.648 1.00 . A A . 35 GLN HA 1 1 7 3392 1 1 35 GLN HB2 H 6.911 14.543 -5.675 1.00 . A A . 35 GLN HB2 1 1 7 3393 1 1 35 GLN HB3 H 6.614 14.710 -3.945 1.00 . A A . 35 GLN HB3 1 1 7 3394 1 1 35 GLN HE21 H 6.779 18.031 -7.149 1.00 . A A . 35 GLN HE21 1 1 7 3395 1 1 35 GLN HE22 H 5.418 17.485 -8.003 1.00 . A A . 35 GLN HE22 1 1 7 3396 1 1 35 GLN HG2 H 6.081 16.898 -4.146 1.00 . A A . 35 GLN HG2 1 1 7 3397 1 1 35 GLN HG3 H 7.478 17.219 -5.175 1.00 . A A . 35 GLN HG3 1 1 7 3398 1 1 35 GLN N N 9.204 14.257 -5.589 1.00 . A A . 35 GLN N 1 1 7 3399 1 1 35 GLN NE2 N 5.995 17.447 -7.212 1.00 . A A . 35 GLN NE2 1 1 7 3400 1 1 35 GLN O O 8.737 15.326 -2.186 1.00 . A A . 35 GLN O 1 1 7 3401 1 1 35 GLN OXT O 9.387 13.467 -3.061 1.00 . A A . 35 GLN OXT 1 1 7 3402 1 1 35 GLN OE1 O 4.747 15.892 -6.322 1.00 . A A . 35 GLN OE1 1 1 8 3403 1 1 1 GLU C C 4.161 2.564 9.148 1.00 . A A . 1 GLU C 1 1 8 3404 1 1 1 GLU CA C 5.380 2.436 10.065 1.00 . A A . 1 GLU CA 1 1 8 3405 1 1 1 GLU CB C 5.477 1.017 10.633 1.00 . A A . 1 GLU CB 1 1 8 3406 1 1 1 GLU CD C 5.818 -0.998 9.196 1.00 . A A . 1 GLU CD 1 1 8 3407 1 1 1 GLU CG C 6.502 0.216 9.828 1.00 . A A . 1 GLU CG 1 1 8 3408 1 1 1 GLU H1 H 4.320 3.839 11.186 1.00 . A A . 1 GLU H1 1 1 8 3409 1 1 1 GLU H2 H 6.006 4.022 11.265 1.00 . A A . 1 GLU H2 1 1 8 3410 1 1 1 GLU H3 H 5.244 2.771 12.124 1.00 . A A . 1 GLU H3 1 1 8 3411 1 1 1 GLU HA H 6.283 2.679 9.525 1.00 . A A . 1 GLU HA 1 1 8 3412 1 1 1 GLU HB2 H 5.788 1.062 11.667 1.00 . A A . 1 GLU HB2 1 1 8 3413 1 1 1 GLU HB3 H 4.514 0.536 10.567 1.00 . A A . 1 GLU HB3 1 1 8 3414 1 1 1 GLU HG2 H 6.917 0.842 9.051 1.00 . A A . 1 GLU HG2 1 1 8 3415 1 1 1 GLU HG3 H 7.292 -0.118 10.482 1.00 . A A . 1 GLU HG3 1 1 8 3416 1 1 1 GLU N N 5.226 3.333 11.251 1.00 . A A . 1 GLU N 1 1 8 3417 1 1 1 GLU O O 3.569 3.617 9.031 1.00 . A A . 1 GLU O 1 1 8 3418 1 1 1 GLU OE1 O 4.600 -0.998 9.126 1.00 . A A . 1 GLU OE1 1 1 8 3419 1 1 1 GLU OE2 O 6.524 -1.907 8.793 1.00 . A A . 1 GLU OE2 1 1 8 3420 1 1 2 VAL C C 1.354 1.979 8.373 1.00 . A A . 2 VAL C 1 1 8 3421 1 1 2 VAL CA C 2.600 1.564 7.590 1.00 . A A . 2 VAL CA 1 1 8 3422 1 1 2 VAL CB C 2.436 0.147 7.039 1.00 . A A . 2 VAL CB 1 1 8 3423 1 1 2 VAL CG1 C 1.226 0.101 6.104 1.00 . A A . 2 VAL CG1 1 1 8 3424 1 1 2 VAL CG2 C 3.694 -0.251 6.264 1.00 . A A . 2 VAL CG2 1 1 8 3425 1 1 2 VAL H H 4.271 0.656 8.604 1.00 . A A . 2 VAL H 1 1 8 3426 1 1 2 VAL HA H 2.783 2.254 6.784 1.00 . A A . 2 VAL HA 1 1 8 3427 1 1 2 VAL HB H 2.283 -0.541 7.858 1.00 . A A . 2 VAL HB 1 1 8 3428 1 1 2 VAL HG11 H 0.781 -0.882 6.138 1.00 . A A . 2 VAL HG11 1 1 8 3429 1 1 2 VAL HG12 H 1.543 0.318 5.093 1.00 . A A . 2 VAL HG12 1 1 8 3430 1 1 2 VAL HG13 H 0.500 0.835 6.419 1.00 . A A . 2 VAL HG13 1 1 8 3431 1 1 2 VAL HG21 H 3.641 0.147 5.261 1.00 . A A . 2 VAL HG21 1 1 8 3432 1 1 2 VAL HG22 H 3.764 -1.328 6.220 1.00 . A A . 2 VAL HG22 1 1 8 3433 1 1 2 VAL HG23 H 4.566 0.147 6.763 1.00 . A A . 2 VAL HG23 1 1 8 3434 1 1 2 VAL N N 3.781 1.498 8.497 1.00 . A A . 2 VAL N 1 1 8 3435 1 1 2 VAL O O 0.528 2.731 7.894 1.00 . A A . 2 VAL O 1 1 8 3436 1 1 3 THR C C -1.235 1.851 9.522 1.00 . A A . 3 THR C 1 1 8 3437 1 1 3 THR CA C 0.021 1.853 10.397 1.00 . A A . 3 THR CA 1 1 8 3438 1 1 3 THR CB C 0.314 3.258 10.923 1.00 . A A . 3 THR CB 1 1 8 3439 1 1 3 THR CG2 C -0.682 3.610 12.028 1.00 . A A . 3 THR CG2 1 1 8 3440 1 1 3 THR H H 1.894 0.889 9.939 1.00 . A A . 3 THR H 1 1 8 3441 1 1 3 THR HA H -0.092 1.167 11.222 1.00 . A A . 3 THR HA 1 1 8 3442 1 1 3 THR HB H 0.219 3.970 10.118 1.00 . A A . 3 THR HB 1 1 8 3443 1 1 3 THR HG1 H 2.082 4.057 11.055 1.00 . A A . 3 THR HG1 1 1 8 3444 1 1 3 THR HG21 H -0.468 4.601 12.401 1.00 . A A . 3 THR HG21 1 1 8 3445 1 1 3 THR HG22 H -0.593 2.894 12.833 1.00 . A A . 3 THR HG22 1 1 8 3446 1 1 3 THR HG23 H -1.686 3.583 11.631 1.00 . A A . 3 THR HG23 1 1 8 3447 1 1 3 THR N N 1.214 1.492 9.577 1.00 . A A . 3 THR N 1 1 8 3448 1 1 3 THR O O -1.770 2.890 9.182 1.00 . A A . 3 THR O 1 1 8 3449 1 1 3 THR OG1 O 1.636 3.300 11.440 1.00 . A A . 3 THR OG1 1 1 8 3450 1 1 4 CYS C C -3.606 -0.737 8.445 1.00 . A A . 4 CYS C 1 1 8 3451 1 1 4 CYS CA C -2.915 0.625 8.275 1.00 . A A . 4 CYS CA 1 1 8 3452 1 1 4 CYS CB C -2.364 0.826 6.850 1.00 . A A . 4 CYS CB 1 1 8 3453 1 1 4 CYS H H -1.251 -0.130 9.418 1.00 . A A . 4 CYS H 1 1 8 3454 1 1 4 CYS HA H -3.596 1.424 8.521 1.00 . A A . 4 CYS HA 1 1 8 3455 1 1 4 CYS HB2 H -2.417 1.876 6.596 1.00 . A A . 4 CYS HB2 1 1 8 3456 1 1 4 CYS HB3 H -1.332 0.505 6.822 1.00 . A A . 4 CYS HB3 1 1 8 3457 1 1 4 CYS N N -1.703 0.694 9.142 1.00 . A A . 4 CYS N 1 1 8 3458 1 1 4 CYS O O -3.065 -1.651 9.035 1.00 . A A . 4 CYS O 1 1 8 3459 1 1 4 CYS SG S -3.320 -0.121 5.633 1.00 . A A . 4 CYS SG 1 1 8 3460 1 1 5 GLU C C -5.169 -3.097 6.890 1.00 . A A . 5 GLU C 1 1 8 3461 1 1 5 GLU CA C -5.532 -2.168 8.053 1.00 . A A . 5 GLU CA 1 1 8 3462 1 1 5 GLU CB C -7.013 -1.790 7.990 1.00 . A A . 5 GLU CB 1 1 8 3463 1 1 5 GLU CD C -8.972 -1.194 9.421 1.00 . A A . 5 GLU CD 1 1 8 3464 1 1 5 GLU CG C -7.446 -1.172 9.322 1.00 . A A . 5 GLU CG 1 1 8 3465 1 1 5 GLU H H -5.215 -0.123 7.457 1.00 . A A . 5 GLU H 1 1 8 3466 1 1 5 GLU HA H -5.311 -2.638 8.999 1.00 . A A . 5 GLU HA 1 1 8 3467 1 1 5 GLU HB2 H -7.167 -1.075 7.194 1.00 . A A . 5 GLU HB2 1 1 8 3468 1 1 5 GLU HB3 H -7.602 -2.674 7.799 1.00 . A A . 5 GLU HB3 1 1 8 3469 1 1 5 GLU HG2 H -7.022 -1.740 10.138 1.00 . A A . 5 GLU HG2 1 1 8 3470 1 1 5 GLU HG3 H -7.098 -0.151 9.375 1.00 . A A . 5 GLU HG3 1 1 8 3471 1 1 5 GLU N N -4.799 -0.874 7.929 1.00 . A A . 5 GLU N 1 1 8 3472 1 1 5 GLU O O -4.857 -2.644 5.808 1.00 . A A . 5 GLU O 1 1 8 3473 1 1 5 GLU OE1 O -9.616 -0.903 8.426 1.00 . A A . 5 GLU OE1 1 1 8 3474 1 1 5 GLU OE2 O -9.472 -1.502 10.491 1.00 . A A . 5 GLU OE2 1 1 8 3475 1 1 6 PRO C C -5.980 -5.435 5.043 1.00 . A A . 6 PRO C 1 1 8 3476 1 1 6 PRO CA C -4.896 -5.387 6.124 1.00 . A A . 6 PRO CA 1 1 8 3477 1 1 6 PRO CB C -4.850 -6.696 6.910 1.00 . A A . 6 PRO CB 1 1 8 3478 1 1 6 PRO CD C -5.599 -4.986 8.435 1.00 . A A . 6 PRO CD 1 1 8 3479 1 1 6 PRO CG C -5.711 -6.453 8.110 1.00 . A A . 6 PRO CG 1 1 8 3480 1 1 6 PRO HA H -3.931 -5.187 5.687 1.00 . A A . 6 PRO HA 1 1 8 3481 1 1 6 PRO HB2 H -5.249 -7.505 6.314 1.00 . A A . 6 PRO HB2 1 1 8 3482 1 1 6 PRO HB3 H -3.840 -6.915 7.219 1.00 . A A . 6 PRO HB3 1 1 8 3483 1 1 6 PRO HD2 H -6.551 -4.603 8.780 1.00 . A A . 6 PRO HD2 1 1 8 3484 1 1 6 PRO HD3 H -4.827 -4.816 9.170 1.00 . A A . 6 PRO HD3 1 1 8 3485 1 1 6 PRO HG2 H -6.737 -6.708 7.883 1.00 . A A . 6 PRO HG2 1 1 8 3486 1 1 6 PRO HG3 H -5.357 -7.039 8.944 1.00 . A A . 6 PRO HG3 1 1 8 3487 1 1 6 PRO N N -5.225 -4.372 7.158 1.00 . A A . 6 PRO N 1 1 8 3488 1 1 6 PRO O O -7.159 -5.346 5.327 1.00 . A A . 6 PRO O 1 1 8 3489 1 1 7 GLY C C -7.258 -4.263 2.555 1.00 . A A . 7 GLY C 1 1 8 3490 1 1 7 GLY CA C -6.588 -5.629 2.702 1.00 . A A . 7 GLY CA 1 1 8 3491 1 1 7 GLY H H -4.631 -5.645 3.601 1.00 . A A . 7 GLY H 1 1 8 3492 1 1 7 GLY HA2 H -6.091 -5.890 1.777 1.00 . A A . 7 GLY HA2 1 1 8 3493 1 1 7 GLY HA3 H -7.339 -6.371 2.932 1.00 . A A . 7 GLY HA3 1 1 8 3494 1 1 7 GLY N N -5.587 -5.575 3.805 1.00 . A A . 7 GLY N 1 1 8 3495 1 1 7 GLY O O -8.429 -4.102 2.834 1.00 . A A . 7 GLY O 1 1 8 3496 1 1 8 THR C C -6.223 -1.018 1.107 1.00 . A A . 8 THR C 1 1 8 3497 1 1 8 THR CA C -7.124 -1.916 1.961 1.00 . A A . 8 THR CA 1 1 8 3498 1 1 8 THR CB C -7.233 -1.355 3.381 1.00 . A A . 8 THR CB 1 1 8 3499 1 1 8 THR CG2 C -8.367 -0.331 3.440 1.00 . A A . 8 THR CG2 1 1 8 3500 1 1 8 THR H H -5.582 -3.425 1.903 1.00 . A A . 8 THR H 1 1 8 3501 1 1 8 THR HA H -8.105 -1.989 1.521 1.00 . A A . 8 THR HA 1 1 8 3502 1 1 8 THR HB H -6.306 -0.873 3.649 1.00 . A A . 8 THR HB 1 1 8 3503 1 1 8 THR HG1 H -7.333 -2.084 5.180 1.00 . A A . 8 THR HG1 1 1 8 3504 1 1 8 THR HG21 H -7.952 0.663 3.515 1.00 . A A . 8 THR HG21 1 1 8 3505 1 1 8 THR HG22 H -8.986 -0.529 4.303 1.00 . A A . 8 THR HG22 1 1 8 3506 1 1 8 THR HG23 H -8.965 -0.406 2.544 1.00 . A A . 8 THR HG23 1 1 8 3507 1 1 8 THR N N -6.524 -3.274 2.121 1.00 . A A . 8 THR N 1 1 8 3508 1 1 8 THR O O -6.697 -0.151 0.401 1.00 . A A . 8 THR O 1 1 8 3509 1 1 8 THR OG1 O -7.498 -2.411 4.293 1.00 . A A . 8 THR OG1 1 1 8 3510 1 1 9 THR C C -4.318 1.110 0.516 1.00 . A A . 9 THR C 1 1 8 3511 1 1 9 THR CA C -3.975 -0.379 0.391 1.00 . A A . 9 THR CA 1 1 8 3512 1 1 9 THR CB C -4.091 -0.868 -1.061 1.00 . A A . 9 THR CB 1 1 8 3513 1 1 9 THR CG2 C -5.348 -0.304 -1.734 1.00 . A A . 9 THR CG2 1 1 8 3514 1 1 9 THR H H -4.584 -1.915 1.769 1.00 . A A . 9 THR H 1 1 8 3515 1 1 9 THR HA H -2.970 -0.548 0.746 1.00 . A A . 9 THR HA 1 1 8 3516 1 1 9 THR HB H -4.142 -1.946 -1.068 1.00 . A A . 9 THR HB 1 1 8 3517 1 1 9 THR HG1 H -3.221 -0.184 -2.665 1.00 . A A . 9 THR HG1 1 1 8 3518 1 1 9 THR HG21 H -5.216 -0.315 -2.805 1.00 . A A . 9 THR HG21 1 1 8 3519 1 1 9 THR HG22 H -5.517 0.710 -1.405 1.00 . A A . 9 THR HG22 1 1 8 3520 1 1 9 THR HG23 H -6.200 -0.914 -1.473 1.00 . A A . 9 THR HG23 1 1 8 3521 1 1 9 THR N N -4.932 -1.215 1.181 1.00 . A A . 9 THR N 1 1 8 3522 1 1 9 THR O O -5.279 1.488 1.153 1.00 . A A . 9 THR O 1 1 8 3523 1 1 9 THR OG1 O -2.941 -0.449 -1.784 1.00 . A A . 9 THR OG1 1 1 8 3524 1 1 10 PHE C C -2.663 4.205 -0.677 1.00 . A A . 10 PHE C 1 1 8 3525 1 1 10 PHE CA C -3.789 3.425 0.003 1.00 . A A . 10 PHE CA 1 1 8 3526 1 1 10 PHE CB C -3.815 3.741 1.500 1.00 . A A . 10 PHE CB 1 1 8 3527 1 1 10 PHE CD1 C -1.393 3.862 2.184 1.00 . A A . 10 PHE CD1 1 1 8 3528 1 1 10 PHE CD2 C -2.667 1.879 2.753 1.00 . A A . 10 PHE CD2 1 1 8 3529 1 1 10 PHE CE1 C -0.261 3.311 2.797 1.00 . A A . 10 PHE CE1 1 1 8 3530 1 1 10 PHE CE2 C -1.534 1.328 3.365 1.00 . A A . 10 PHE CE2 1 1 8 3531 1 1 10 PHE CG C -2.596 3.146 2.161 1.00 . A A . 10 PHE CG 1 1 8 3532 1 1 10 PHE CZ C -0.332 2.044 3.388 1.00 . A A . 10 PHE CZ 1 1 8 3533 1 1 10 PHE H H -2.748 1.631 -0.584 1.00 . A A . 10 PHE H 1 1 8 3534 1 1 10 PHE HA H -4.742 3.666 -0.441 1.00 . A A . 10 PHE HA 1 1 8 3535 1 1 10 PHE HB2 H -3.813 4.812 1.640 1.00 . A A . 10 PHE HB2 1 1 8 3536 1 1 10 PHE HB3 H -4.706 3.323 1.944 1.00 . A A . 10 PHE HB3 1 1 8 3537 1 1 10 PHE HD1 H -1.337 4.839 1.727 1.00 . A A . 10 PHE HD1 1 1 8 3538 1 1 10 PHE HD2 H -3.595 1.327 2.734 1.00 . A A . 10 PHE HD2 1 1 8 3539 1 1 10 PHE HE1 H 0.666 3.864 2.814 1.00 . A A . 10 PHE HE1 1 1 8 3540 1 1 10 PHE HE2 H -1.590 0.350 3.821 1.00 . A A . 10 PHE HE2 1 1 8 3541 1 1 10 PHE HZ H 0.541 1.619 3.861 1.00 . A A . 10 PHE HZ 1 1 8 3542 1 1 10 PHE N N -3.524 1.959 -0.083 1.00 . A A . 10 PHE N 1 1 8 3543 1 1 10 PHE O O -1.817 3.641 -1.343 1.00 . A A . 10 PHE O 1 1 8 3544 1 1 11 LYS C C -0.741 7.011 -0.050 1.00 . A A . 11 LYS C 1 1 8 3545 1 1 11 LYS CA C -1.571 6.319 -1.137 1.00 . A A . 11 LYS CA 1 1 8 3546 1 1 11 LYS CB C -2.316 7.350 -1.982 1.00 . A A . 11 LYS CB 1 1 8 3547 1 1 11 LYS CD C -3.995 7.310 -3.833 1.00 . A A . 11 LYS CD 1 1 8 3548 1 1 11 LYS CE C -4.292 6.782 -5.240 1.00 . A A . 11 LYS CE 1 1 8 3549 1 1 11 LYS CG C -2.662 6.741 -3.342 1.00 . A A . 11 LYS CG 1 1 8 3550 1 1 11 LYS H H -3.332 5.933 0.035 1.00 . A A . 11 LYS H 1 1 8 3551 1 1 11 LYS HA H -0.943 5.707 -1.765 1.00 . A A . 11 LYS HA 1 1 8 3552 1 1 11 LYS HB2 H -3.225 7.640 -1.475 1.00 . A A . 11 LYS HB2 1 1 8 3553 1 1 11 LYS HB3 H -1.693 8.217 -2.125 1.00 . A A . 11 LYS HB3 1 1 8 3554 1 1 11 LYS HD2 H -4.784 7.004 -3.161 1.00 . A A . 11 LYS HD2 1 1 8 3555 1 1 11 LYS HD3 H -3.941 8.388 -3.859 1.00 . A A . 11 LYS HD3 1 1 8 3556 1 1 11 LYS HE2 H -3.608 7.219 -5.955 1.00 . A A . 11 LYS HE2 1 1 8 3557 1 1 11 LYS HE3 H -4.223 5.706 -5.260 1.00 . A A . 11 LYS HE3 1 1 8 3558 1 1 11 LYS HG2 H -1.884 6.982 -4.052 1.00 . A A . 11 LYS HG2 1 1 8 3559 1 1 11 LYS HG3 H -2.743 5.669 -3.247 1.00 . A A . 11 LYS HG3 1 1 8 3560 1 1 11 LYS HZ1 H -6.183 7.413 -4.634 1.00 . A A . 11 LYS HZ1 1 1 8 3561 1 1 11 LYS HZ2 H -6.188 6.450 -6.033 1.00 . A A . 11 LYS HZ2 1 1 8 3562 1 1 11 LYS HZ3 H -5.677 8.067 -6.114 1.00 . A A . 11 LYS HZ3 1 1 8 3563 1 1 11 LYS N N -2.642 5.499 -0.509 1.00 . A A . 11 LYS N 1 1 8 3564 1 1 11 LYS NZ N -5.690 7.210 -5.526 1.00 . A A . 11 LYS NZ 1 1 8 3565 1 1 11 LYS O O -1.251 7.372 0.992 1.00 . A A . 11 LYS O 1 1 8 3566 1 1 12 ASP C C 2.409 8.776 0.092 1.00 . A A . 12 ASP C 1 1 8 3567 1 1 12 ASP CA C 1.378 7.862 0.753 1.00 . A A . 12 ASP CA 1 1 8 3568 1 1 12 ASP CB C 2.070 6.718 1.493 1.00 . A A . 12 ASP CB 1 1 8 3569 1 1 12 ASP CG C 2.254 7.098 2.964 1.00 . A A . 12 ASP CG 1 1 8 3570 1 1 12 ASP H H 0.931 6.898 -1.121 1.00 . A A . 12 ASP H 1 1 8 3571 1 1 12 ASP HA H 0.765 8.422 1.437 1.00 . A A . 12 ASP HA 1 1 8 3572 1 1 12 ASP HB2 H 1.463 5.825 1.424 1.00 . A A . 12 ASP HB2 1 1 8 3573 1 1 12 ASP HB3 H 3.038 6.535 1.047 1.00 . A A . 12 ASP HB3 1 1 8 3574 1 1 12 ASP N N 0.531 7.196 -0.278 1.00 . A A . 12 ASP N 1 1 8 3575 1 1 12 ASP O O 2.469 9.960 0.361 1.00 . A A . 12 ASP O 1 1 8 3576 1 1 12 ASP OD1 O 1.560 7.994 3.416 1.00 . A A . 12 ASP OD1 1 1 8 3577 1 1 12 ASP OD2 O 3.086 6.485 3.614 1.00 . A A . 12 ASP OD2 1 1 8 3578 1 1 13 LYS C C 4.022 9.094 -2.958 1.00 . A A . 13 LYS C 1 1 8 3579 1 1 13 LYS CA C 4.256 9.074 -1.443 1.00 . A A . 13 LYS CA 1 1 8 3580 1 1 13 LYS CB C 5.588 8.404 -1.103 1.00 . A A . 13 LYS CB 1 1 8 3581 1 1 13 LYS CD C 7.162 8.743 0.805 1.00 . A A . 13 LYS CD 1 1 8 3582 1 1 13 LYS CE C 7.247 10.269 0.903 1.00 . A A . 13 LYS CE 1 1 8 3583 1 1 13 LYS CG C 5.741 8.333 0.415 1.00 . A A . 13 LYS CG 1 1 8 3584 1 1 13 LYS H H 3.159 7.280 -0.965 1.00 . A A . 13 LYS H 1 1 8 3585 1 1 13 LYS HA H 4.242 10.075 -1.047 1.00 . A A . 13 LYS HA 1 1 8 3586 1 1 13 LYS HB2 H 5.605 7.404 -1.517 1.00 . A A . 13 LYS HB2 1 1 8 3587 1 1 13 LYS HB3 H 6.399 8.984 -1.519 1.00 . A A . 13 LYS HB3 1 1 8 3588 1 1 13 LYS HD2 H 7.414 8.306 1.761 1.00 . A A . 13 LYS HD2 1 1 8 3589 1 1 13 LYS HD3 H 7.857 8.394 0.056 1.00 . A A . 13 LYS HD3 1 1 8 3590 1 1 13 LYS HE2 H 8.279 10.590 0.864 1.00 . A A . 13 LYS HE2 1 1 8 3591 1 1 13 LYS HE3 H 6.680 10.728 0.109 1.00 . A A . 13 LYS HE3 1 1 8 3592 1 1 13 LYS HG2 H 5.031 9.002 0.879 1.00 . A A . 13 LYS HG2 1 1 8 3593 1 1 13 LYS HG3 H 5.555 7.324 0.747 1.00 . A A . 13 LYS HG3 1 1 8 3594 1 1 13 LYS HZ1 H 6.650 9.769 2.836 1.00 . A A . 13 LYS HZ1 1 1 8 3595 1 1 13 LYS HZ2 H 5.665 10.931 2.082 1.00 . A A . 13 LYS HZ2 1 1 8 3596 1 1 13 LYS HZ3 H 7.198 11.365 2.671 1.00 . A A . 13 LYS HZ3 1 1 8 3597 1 1 13 LYS N N 3.224 8.236 -0.767 1.00 . A A . 13 LYS N 1 1 8 3598 1 1 13 LYS NZ N 6.645 10.609 2.223 1.00 . A A . 13 LYS NZ 1 1 8 3599 1 1 13 LYS O O 2.914 9.286 -3.420 1.00 . A A . 13 LYS O 1 1 8 3600 1 1 14 CYS C C 4.099 7.703 -5.701 1.00 . A A . 14 CYS C 1 1 8 3601 1 1 14 CYS CA C 4.886 8.928 -5.220 1.00 . A A . 14 CYS CA 1 1 8 3602 1 1 14 CYS CB C 6.311 8.901 -5.774 1.00 . A A . 14 CYS CB 1 1 8 3603 1 1 14 CYS H H 5.944 8.762 -3.353 1.00 . A A . 14 CYS H 1 1 8 3604 1 1 14 CYS HA H 4.391 9.836 -5.527 1.00 . A A . 14 CYS HA 1 1 8 3605 1 1 14 CYS HB2 H 6.944 8.328 -5.111 1.00 . A A . 14 CYS HB2 1 1 8 3606 1 1 14 CYS HB3 H 6.306 8.446 -6.755 1.00 . A A . 14 CYS HB3 1 1 8 3607 1 1 14 CYS N N 5.055 8.907 -3.738 1.00 . A A . 14 CYS N 1 1 8 3608 1 1 14 CYS O O 3.831 7.556 -6.876 1.00 . A A . 14 CYS O 1 1 8 3609 1 1 14 CYS SG S 6.942 10.593 -5.899 1.00 . A A . 14 CYS SG 1 1 8 3610 1 1 15 ASN C C 2.011 5.141 -4.149 1.00 . A A . 15 ASN C 1 1 8 3611 1 1 15 ASN CA C 2.964 5.613 -5.250 1.00 . A A . 15 ASN CA 1 1 8 3612 1 1 15 ASN CB C 4.024 4.548 -5.522 1.00 . A A . 15 ASN CB 1 1 8 3613 1 1 15 ASN CG C 4.498 4.658 -6.971 1.00 . A A . 15 ASN CG 1 1 8 3614 1 1 15 ASN H H 3.952 6.946 -3.866 1.00 . A A . 15 ASN H 1 1 8 3615 1 1 15 ASN HA H 2.417 5.823 -6.155 1.00 . A A . 15 ASN HA 1 1 8 3616 1 1 15 ASN HB2 H 4.861 4.695 -4.855 1.00 . A A . 15 ASN HB2 1 1 8 3617 1 1 15 ASN HB3 H 3.600 3.568 -5.357 1.00 . A A . 15 ASN HB3 1 1 8 3618 1 1 15 ASN HD21 H 3.741 2.897 -7.496 1.00 . A A . 15 ASN HD21 1 1 8 3619 1 1 15 ASN HD22 H 4.539 3.750 -8.739 1.00 . A A . 15 ASN HD22 1 1 8 3620 1 1 15 ASN N N 3.728 6.819 -4.812 1.00 . A A . 15 ASN N 1 1 8 3621 1 1 15 ASN ND2 N 4.237 3.688 -7.805 1.00 . A A . 15 ASN ND2 1 1 8 3622 1 1 15 ASN O O 1.839 5.789 -3.135 1.00 . A A . 15 ASN O 1 1 8 3623 1 1 15 ASN OD1 O 5.110 5.636 -7.350 1.00 . A A . 15 ASN OD1 1 1 8 3624 1 1 16 THR C C 1.153 2.380 -2.508 1.00 . A A . 16 THR C 1 1 8 3625 1 1 16 THR CA C 0.452 3.470 -3.325 1.00 . A A . 16 THR CA 1 1 8 3626 1 1 16 THR CB C -0.726 2.908 -4.144 1.00 . A A . 16 THR CB 1 1 8 3627 1 1 16 THR CG2 C -1.221 1.581 -3.555 1.00 . A A . 16 THR CG2 1 1 8 3628 1 1 16 THR H H 1.557 3.506 -5.173 1.00 . A A . 16 THR H 1 1 8 3629 1 1 16 THR HA H 0.108 4.262 -2.677 1.00 . A A . 16 THR HA 1 1 8 3630 1 1 16 THR HB H -0.406 2.745 -5.163 1.00 . A A . 16 THR HB 1 1 8 3631 1 1 16 THR HG1 H -2.432 3.579 -4.795 1.00 . A A . 16 THR HG1 1 1 8 3632 1 1 16 THR HG21 H -2.038 1.204 -4.152 1.00 . A A . 16 THR HG21 1 1 8 3633 1 1 16 THR HG22 H -1.558 1.740 -2.541 1.00 . A A . 16 THR HG22 1 1 8 3634 1 1 16 THR HG23 H -0.413 0.864 -3.556 1.00 . A A . 16 THR HG23 1 1 8 3635 1 1 16 THR N N 1.395 4.008 -4.348 1.00 . A A . 16 THR N 1 1 8 3636 1 1 16 THR O O 2.180 1.866 -2.898 1.00 . A A . 16 THR O 1 1 8 3637 1 1 16 THR OG1 O -1.791 3.849 -4.135 1.00 . A A . 16 THR OG1 1 1 8 3638 1 1 17 CYS C C 0.214 -0.094 -0.151 1.00 . A A . 17 CYS C 1 1 8 3639 1 1 17 CYS CA C 1.241 0.970 -0.544 1.00 . A A . 17 CYS CA 1 1 8 3640 1 1 17 CYS CB C 1.755 1.704 0.692 1.00 . A A . 17 CYS CB 1 1 8 3641 1 1 17 CYS H H -0.226 2.452 -1.082 1.00 . A A . 17 CYS H 1 1 8 3642 1 1 17 CYS HA H 2.065 0.518 -1.073 1.00 . A A . 17 CYS HA 1 1 8 3643 1 1 17 CYS HB2 H 1.897 2.750 0.456 1.00 . A A . 17 CYS HB2 1 1 8 3644 1 1 17 CYS HB3 H 1.035 1.609 1.492 1.00 . A A . 17 CYS HB3 1 1 8 3645 1 1 17 CYS N N 0.604 2.025 -1.380 1.00 . A A . 17 CYS N 1 1 8 3646 1 1 17 CYS O O -0.501 0.051 0.821 1.00 . A A . 17 CYS O 1 1 8 3647 1 1 17 CYS SG S 3.334 0.983 1.205 1.00 . A A . 17 CYS SG 1 1 8 3648 1 1 18 ARG C C -0.626 -2.700 0.881 1.00 . A A . 18 ARG C 1 1 8 3649 1 1 18 ARG CA C -0.838 -2.236 -0.559 1.00 . A A . 18 ARG CA 1 1 8 3650 1 1 18 ARG CB C -0.539 -3.369 -1.543 1.00 . A A . 18 ARG CB 1 1 8 3651 1 1 18 ARG CD C -2.683 -4.566 -1.076 1.00 . A A . 18 ARG CD 1 1 8 3652 1 1 18 ARG CG C -1.849 -3.873 -2.154 1.00 . A A . 18 ARG CG 1 1 8 3653 1 1 18 ARG CZ C -3.231 -6.923 -1.174 1.00 . A A . 18 ARG CZ 1 1 8 3654 1 1 18 ARG H H 0.729 -1.261 -1.671 1.00 . A A . 18 ARG H 1 1 8 3655 1 1 18 ARG HA H -1.849 -1.885 -0.692 1.00 . A A . 18 ARG HA 1 1 8 3656 1 1 18 ARG HB2 H 0.106 -3.002 -2.327 1.00 . A A . 18 ARG HB2 1 1 8 3657 1 1 18 ARG HB3 H -0.052 -4.179 -1.022 1.00 . A A . 18 ARG HB3 1 1 8 3658 1 1 18 ARG HD2 H -2.440 -4.167 -0.099 1.00 . A A . 18 ARG HD2 1 1 8 3659 1 1 18 ARG HD3 H -3.736 -4.449 -1.280 1.00 . A A . 18 ARG HD3 1 1 8 3660 1 1 18 ARG HE H -1.359 -6.260 -1.207 1.00 . A A . 18 ARG HE 1 1 8 3661 1 1 18 ARG HG2 H -2.404 -3.039 -2.557 1.00 . A A . 18 ARG HG2 1 1 8 3662 1 1 18 ARG HG3 H -1.631 -4.576 -2.944 1.00 . A A . 18 ARG HG3 1 1 8 3663 1 1 18 ARG HH11 H -4.563 -5.807 -0.181 1.00 . A A . 18 ARG HH11 1 1 8 3664 1 1 18 ARG HH12 H -5.099 -7.392 -0.626 1.00 . A A . 18 ARG HH12 1 1 8 3665 1 1 18 ARG HH21 H -2.115 -8.255 -2.172 1.00 . A A . 18 ARG HH21 1 1 8 3666 1 1 18 ARG HH22 H -3.712 -8.779 -1.754 1.00 . A A . 18 ARG HH22 1 1 8 3667 1 1 18 ARG N N 0.139 -1.162 -0.895 1.00 . A A . 18 ARG N 1 1 8 3668 1 1 18 ARG NE N -2.304 -6.005 -1.161 1.00 . A A . 18 ARG NE 1 1 8 3669 1 1 18 ARG NH1 N -4.387 -6.689 -0.617 1.00 . A A . 18 ARG NH1 1 1 8 3670 1 1 18 ARG NH2 N -3.002 -8.075 -1.744 1.00 . A A . 18 ARG NH2 1 1 8 3671 1 1 18 ARG O O 0.447 -3.128 1.258 1.00 . A A . 18 ARG O 1 1 8 3672 1 1 19 CYS C C -1.496 -4.562 3.206 1.00 . A A . 19 CYS C 1 1 8 3673 1 1 19 CYS CA C -1.508 -3.034 3.108 1.00 . A A . 19 CYS CA 1 1 8 3674 1 1 19 CYS CB C -2.739 -2.453 3.800 1.00 . A A . 19 CYS CB 1 1 8 3675 1 1 19 CYS H H -2.495 -2.254 1.364 1.00 . A A . 19 CYS H 1 1 8 3676 1 1 19 CYS HA H -0.611 -2.621 3.544 1.00 . A A . 19 CYS HA 1 1 8 3677 1 1 19 CYS HB2 H -3.131 -1.636 3.210 1.00 . A A . 19 CYS HB2 1 1 8 3678 1 1 19 CYS HB3 H -3.492 -3.221 3.900 1.00 . A A . 19 CYS HB3 1 1 8 3679 1 1 19 CYS N N -1.642 -2.608 1.689 1.00 . A A . 19 CYS N 1 1 8 3680 1 1 19 CYS O O -2.407 -5.229 2.756 1.00 . A A . 19 CYS O 1 1 8 3681 1 1 19 CYS SG S -2.277 -1.842 5.438 1.00 . A A . 19 CYS SG 1 1 8 3682 1 1 20 GLY C C -1.580 -7.107 4.745 1.00 . A A . 20 GLY C 1 1 8 3683 1 1 20 GLY CA C -0.398 -6.603 3.914 1.00 . A A . 20 GLY CA 1 1 8 3684 1 1 20 GLY H H 0.254 -4.563 4.144 1.00 . A A . 20 GLY H 1 1 8 3685 1 1 20 GLY HA2 H -0.431 -7.050 2.929 1.00 . A A . 20 GLY HA2 1 1 8 3686 1 1 20 GLY HA3 H 0.526 -6.879 4.405 1.00 . A A . 20 GLY HA3 1 1 8 3687 1 1 20 GLY N N -0.471 -5.120 3.789 1.00 . A A . 20 GLY N 1 1 8 3688 1 1 20 GLY O O -2.157 -6.379 5.528 1.00 . A A . 20 GLY O 1 1 8 3689 1 1 21 SER C C -2.736 -8.948 6.850 1.00 . A A . 21 SER C 1 1 8 3690 1 1 21 SER CA C -3.089 -8.902 5.362 1.00 . A A . 21 SER CA 1 1 8 3691 1 1 21 SER CB C -3.291 -10.316 4.819 1.00 . A A . 21 SER CB 1 1 8 3692 1 1 21 SER H H -1.466 -8.921 3.945 1.00 . A A . 21 SER H 1 1 8 3693 1 1 21 SER HA H -3.979 -8.313 5.202 1.00 . A A . 21 SER HA 1 1 8 3694 1 1 21 SER HB2 H -3.101 -10.325 3.759 1.00 . A A . 21 SER HB2 1 1 8 3695 1 1 21 SER HB3 H -2.604 -10.990 5.312 1.00 . A A . 21 SER HB3 1 1 8 3696 1 1 21 SER HG H -4.723 -10.909 5.995 1.00 . A A . 21 SER HG 1 1 8 3697 1 1 21 SER N N -1.945 -8.350 4.581 1.00 . A A . 21 SER N 1 1 8 3698 1 1 21 SER O O -3.576 -9.190 7.693 1.00 . A A . 21 SER O 1 1 8 3699 1 1 21 SER OG O -4.632 -10.725 5.057 1.00 . A A . 21 SER OG 1 1 8 3700 1 1 22 ASP C C -0.945 -7.312 9.134 1.00 . A A . 22 ASP C 1 1 8 3701 1 1 22 ASP CA C -1.079 -8.741 8.604 1.00 . A A . 22 ASP CA 1 1 8 3702 1 1 22 ASP CB C 0.279 -9.445 8.605 1.00 . A A . 22 ASP CB 1 1 8 3703 1 1 22 ASP CG C 0.140 -10.816 7.941 1.00 . A A . 22 ASP CG 1 1 8 3704 1 1 22 ASP H H -0.836 -8.520 6.477 1.00 . A A . 22 ASP H 1 1 8 3705 1 1 22 ASP HA H -1.786 -9.300 9.195 1.00 . A A . 22 ASP HA 1 1 8 3706 1 1 22 ASP HB2 H 0.994 -8.848 8.055 1.00 . A A . 22 ASP HB2 1 1 8 3707 1 1 22 ASP HB3 H 0.619 -9.572 9.623 1.00 . A A . 22 ASP HB3 1 1 8 3708 1 1 22 ASP N N -1.496 -8.715 7.175 1.00 . A A . 22 ASP N 1 1 8 3709 1 1 22 ASP O O -0.464 -7.085 10.225 1.00 . A A . 22 ASP O 1 1 8 3710 1 1 22 ASP OD1 O -0.711 -11.576 8.373 1.00 . A A . 22 ASP OD1 1 1 8 3711 1 1 22 ASP OD2 O 0.883 -11.080 7.011 1.00 . A A . 22 ASP OD2 1 1 8 3712 1 1 23 GLY C C 0.176 -4.622 9.208 1.00 . A A . 23 GLY C 1 1 8 3713 1 1 23 GLY CA C -1.269 -4.934 8.821 1.00 . A A . 23 GLY CA 1 1 8 3714 1 1 23 GLY H H -1.754 -6.552 7.487 1.00 . A A . 23 GLY H 1 1 8 3715 1 1 23 GLY HA2 H -1.579 -4.275 8.021 1.00 . A A . 23 GLY HA2 1 1 8 3716 1 1 23 GLY HA3 H -1.908 -4.788 9.679 1.00 . A A . 23 GLY HA3 1 1 8 3717 1 1 23 GLY N N -1.369 -6.347 8.364 1.00 . A A . 23 GLY N 1 1 8 3718 1 1 23 GLY O O 1.064 -5.436 9.040 1.00 . A A . 23 GLY O 1 1 8 3719 1 1 24 LYS C C 2.800 -3.526 9.041 1.00 . A A . 24 LYS C 1 1 8 3720 1 1 24 LYS CA C 1.812 -3.088 10.125 1.00 . A A . 24 LYS CA 1 1 8 3721 1 1 24 LYS CB C 2.064 -3.856 11.423 1.00 . A A . 24 LYS CB 1 1 8 3722 1 1 24 LYS CD C 0.864 -1.980 12.554 1.00 . A A . 24 LYS CD 1 1 8 3723 1 1 24 LYS CE C 0.066 -2.144 13.851 1.00 . A A . 24 LYS CE 1 1 8 3724 1 1 24 LYS CG C 2.102 -2.878 12.599 1.00 . A A . 24 LYS CG 1 1 8 3725 1 1 24 LYS H H -0.308 -2.808 9.855 1.00 . A A . 24 LYS H 1 1 8 3726 1 1 24 LYS HA H 1.889 -2.027 10.302 1.00 . A A . 24 LYS HA 1 1 8 3727 1 1 24 LYS HB2 H 1.271 -4.574 11.575 1.00 . A A . 24 LYS HB2 1 1 8 3728 1 1 24 LYS HB3 H 3.010 -4.373 11.357 1.00 . A A . 24 LYS HB3 1 1 8 3729 1 1 24 LYS HD2 H 1.171 -0.949 12.447 1.00 . A A . 24 LYS HD2 1 1 8 3730 1 1 24 LYS HD3 H 0.245 -2.260 11.715 1.00 . A A . 24 LYS HD3 1 1 8 3731 1 1 24 LYS HE2 H -0.724 -1.408 13.899 1.00 . A A . 24 LYS HE2 1 1 8 3732 1 1 24 LYS HE3 H -0.341 -3.140 13.918 1.00 . A A . 24 LYS HE3 1 1 8 3733 1 1 24 LYS HG2 H 2.113 -3.431 13.527 1.00 . A A . 24 LYS HG2 1 1 8 3734 1 1 24 LYS HG3 H 2.990 -2.268 12.532 1.00 . A A . 24 LYS HG3 1 1 8 3735 1 1 24 LYS HZ1 H 1.366 -2.839 15.322 1.00 . A A . 24 LYS HZ1 1 1 8 3736 1 1 24 LYS HZ2 H 0.607 -1.368 15.706 1.00 . A A . 24 LYS HZ2 1 1 8 3737 1 1 24 LYS HZ3 H 1.874 -1.404 14.576 1.00 . A A . 24 LYS HZ3 1 1 8 3738 1 1 24 LYS N N 0.422 -3.450 9.727 1.00 . A A . 24 LYS N 1 1 8 3739 1 1 24 LYS NZ N 1.054 -1.922 14.946 1.00 . A A . 24 LYS NZ 1 1 8 3740 1 1 24 LYS O O 3.954 -3.794 9.310 1.00 . A A . 24 LYS O 1 1 8 3741 1 1 25 SER C C 2.606 -3.743 5.358 1.00 . A A . 25 SER C 1 1 8 3742 1 1 25 SER CA C 3.263 -4.017 6.714 1.00 . A A . 25 SER CA 1 1 8 3743 1 1 25 SER CB C 3.469 -5.518 6.915 1.00 . A A . 25 SER CB 1 1 8 3744 1 1 25 SER H H 1.418 -3.378 7.624 1.00 . A A . 25 SER H 1 1 8 3745 1 1 25 SER HA H 4.208 -3.502 6.787 1.00 . A A . 25 SER HA 1 1 8 3746 1 1 25 SER HB2 H 2.547 -5.969 7.245 1.00 . A A . 25 SER HB2 1 1 8 3747 1 1 25 SER HB3 H 3.774 -5.967 5.977 1.00 . A A . 25 SER HB3 1 1 8 3748 1 1 25 SER HG H 5.315 -5.468 7.526 1.00 . A A . 25 SER HG 1 1 8 3749 1 1 25 SER N N 2.353 -3.599 7.817 1.00 . A A . 25 SER N 1 1 8 3750 1 1 25 SER O O 1.413 -3.901 5.193 1.00 . A A . 25 SER O 1 1 8 3751 1 1 25 SER OG O 4.471 -5.725 7.902 1.00 . A A . 25 SER OG 1 1 8 3752 1 1 26 ALA C C 3.782 -3.425 1.943 1.00 . A A . 26 ALA C 1 1 8 3753 1 1 26 ALA CA C 2.790 -3.050 3.046 1.00 . A A . 26 ALA CA 1 1 8 3754 1 1 26 ALA CB C 2.527 -1.544 3.037 1.00 . A A . 26 ALA CB 1 1 8 3755 1 1 26 ALA H H 4.335 -3.212 4.539 1.00 . A A . 26 ALA H 1 1 8 3756 1 1 26 ALA HA H 1.863 -3.586 2.917 1.00 . A A . 26 ALA HA 1 1 8 3757 1 1 26 ALA HB1 H 1.957 -1.283 2.157 1.00 . A A . 26 ALA HB1 1 1 8 3758 1 1 26 ALA HB2 H 3.469 -1.014 3.025 1.00 . A A . 26 ALA HB2 1 1 8 3759 1 1 26 ALA HB3 H 1.971 -1.270 3.920 1.00 . A A . 26 ALA HB3 1 1 8 3760 1 1 26 ALA N N 3.375 -3.334 4.387 1.00 . A A . 26 ALA N 1 1 8 3761 1 1 26 ALA O O 4.830 -3.986 2.198 1.00 . A A . 26 ALA O 1 1 8 3762 1 1 27 ALA C C 4.931 -2.158 -1.013 1.00 . A A . 27 ALA C 1 1 8 3763 1 1 27 ALA CA C 4.380 -3.443 -0.406 1.00 . A A . 27 ALA CA 1 1 8 3764 1 1 27 ALA CB C 3.508 -4.170 -1.427 1.00 . A A . 27 ALA CB 1 1 8 3765 1 1 27 ALA H H 2.611 -2.659 0.539 1.00 . A A . 27 ALA H 1 1 8 3766 1 1 27 ALA HA H 5.179 -4.083 -0.074 1.00 . A A . 27 ALA HA 1 1 8 3767 1 1 27 ALA HB1 H 2.530 -4.343 -1.004 1.00 . A A . 27 ALA HB1 1 1 8 3768 1 1 27 ALA HB2 H 3.964 -5.113 -1.685 1.00 . A A . 27 ALA HB2 1 1 8 3769 1 1 27 ALA HB3 H 3.414 -3.560 -2.314 1.00 . A A . 27 ALA HB3 1 1 8 3770 1 1 27 ALA N N 3.460 -3.114 0.719 1.00 . A A . 27 ALA N 1 1 8 3771 1 1 27 ALA O O 6.115 -2.017 -1.248 1.00 . A A . 27 ALA O 1 1 8 3772 1 1 28 CYS C C 5.182 -0.184 -3.225 1.00 . A A . 28 CYS C 1 1 8 3773 1 1 28 CYS CA C 4.509 0.062 -1.874 1.00 . A A . 28 CYS CA 1 1 8 3774 1 1 28 CYS CB C 5.509 0.660 -0.880 1.00 . A A . 28 CYS CB 1 1 8 3775 1 1 28 CYS H H 3.120 -1.370 -1.077 1.00 . A A . 28 CYS H 1 1 8 3776 1 1 28 CYS HA H 3.668 0.721 -1.990 1.00 . A A . 28 CYS HA 1 1 8 3777 1 1 28 CYS HB2 H 5.870 -0.110 -0.218 1.00 . A A . 28 CYS HB2 1 1 8 3778 1 1 28 CYS HB3 H 6.340 1.083 -1.420 1.00 . A A . 28 CYS HB3 1 1 8 3779 1 1 28 CYS N N 4.067 -1.224 -1.274 1.00 . A A . 28 CYS N 1 1 8 3780 1 1 28 CYS O O 6.365 -0.449 -3.299 1.00 . A A . 28 CYS O 1 1 8 3781 1 1 28 CYS SG S 4.703 1.960 0.088 1.00 . A A . 28 CYS SG 1 1 8 3782 1 1 29 THR C C 5.716 1.016 -6.104 1.00 . A A . 29 THR C 1 1 8 3783 1 1 29 THR CA C 5.055 -0.288 -5.645 1.00 . A A . 29 THR CA 1 1 8 3784 1 1 29 THR CB C 3.887 -0.657 -6.563 1.00 . A A . 29 THR CB 1 1 8 3785 1 1 29 THR CG2 C 3.058 0.592 -6.871 1.00 . A A . 29 THR CG2 1 1 8 3786 1 1 29 THR H H 3.494 0.148 -4.221 1.00 . A A . 29 THR H 1 1 8 3787 1 1 29 THR HA H 5.776 -1.090 -5.616 1.00 . A A . 29 THR HA 1 1 8 3788 1 1 29 THR HB H 3.261 -1.386 -6.072 1.00 . A A . 29 THR HB 1 1 8 3789 1 1 29 THR HG1 H 5.263 -0.829 -7.927 1.00 . A A . 29 THR HG1 1 1 8 3790 1 1 29 THR HG21 H 3.211 0.881 -7.901 1.00 . A A . 29 THR HG21 1 1 8 3791 1 1 29 THR HG22 H 3.366 1.398 -6.223 1.00 . A A . 29 THR HG22 1 1 8 3792 1 1 29 THR HG23 H 2.012 0.380 -6.710 1.00 . A A . 29 THR HG23 1 1 8 3793 1 1 29 THR N N 4.444 -0.081 -4.298 1.00 . A A . 29 THR N 1 1 8 3794 1 1 29 THR O O 5.562 1.446 -7.230 1.00 . A A . 29 THR O 1 1 8 3795 1 1 29 THR OG1 O 4.392 -1.204 -7.773 1.00 . A A . 29 THR OG1 1 1 8 3796 1 1 30 LEU C C 8.448 2.742 -6.215 1.00 . A A . 30 LEU C 1 1 8 3797 1 1 30 LEU CA C 7.078 2.948 -5.553 1.00 . A A . 30 LEU CA 1 1 8 3798 1 1 30 LEU CB C 7.213 3.655 -4.198 1.00 . A A . 30 LEU CB 1 1 8 3799 1 1 30 LEU CD1 C 8.500 3.819 -2.063 1.00 . A A . 30 LEU CD1 1 1 8 3800 1 1 30 LEU CD2 C 8.486 1.668 -3.301 1.00 . A A . 30 LEU CD2 1 1 8 3801 1 1 30 LEU CG C 8.476 3.191 -3.457 1.00 . A A . 30 LEU CG 1 1 8 3802 1 1 30 LEU H H 6.510 1.300 -4.318 1.00 . A A . 30 LEU H 1 1 8 3803 1 1 30 LEU HA H 6.440 3.530 -6.199 1.00 . A A . 30 LEU HA 1 1 8 3804 1 1 30 LEU HB2 H 7.266 4.722 -4.357 1.00 . A A . 30 LEU HB2 1 1 8 3805 1 1 30 LEU HB3 H 6.346 3.430 -3.594 1.00 . A A . 30 LEU HB3 1 1 8 3806 1 1 30 LEU HD11 H 8.463 3.038 -1.317 1.00 . A A . 30 LEU HD11 1 1 8 3807 1 1 30 LEU HD12 H 7.644 4.467 -1.945 1.00 . A A . 30 LEU HD12 1 1 8 3808 1 1 30 LEU HD13 H 9.407 4.391 -1.941 1.00 . A A . 30 LEU HD13 1 1 8 3809 1 1 30 LEU HD21 H 8.358 1.203 -4.264 1.00 . A A . 30 LEU HD21 1 1 8 3810 1 1 30 LEU HD22 H 7.681 1.369 -2.650 1.00 . A A . 30 LEU HD22 1 1 8 3811 1 1 30 LEU HD23 H 9.428 1.357 -2.874 1.00 . A A . 30 LEU HD23 1 1 8 3812 1 1 30 LEU HG H 9.347 3.502 -4.009 1.00 . A A . 30 LEU HG 1 1 8 3813 1 1 30 LEU N N 6.426 1.657 -5.218 1.00 . A A . 30 LEU N 1 1 8 3814 1 1 30 LEU O O 9.066 1.702 -6.106 1.00 . A A . 30 LEU O 1 1 8 3815 1 1 31 LYS C C 10.974 4.981 -7.397 1.00 . A A . 31 LYS C 1 1 8 3816 1 1 31 LYS CA C 10.242 3.652 -7.574 1.00 . A A . 31 LYS CA 1 1 8 3817 1 1 31 LYS CB C 9.916 3.412 -9.046 1.00 . A A . 31 LYS CB 1 1 8 3818 1 1 31 LYS CD C 8.671 1.513 -10.080 1.00 . A A . 31 LYS CD 1 1 8 3819 1 1 31 LYS CE C 7.453 1.913 -9.245 1.00 . A A . 31 LYS CE 1 1 8 3820 1 1 31 LYS CG C 9.950 1.912 -9.341 1.00 . A A . 31 LYS CG 1 1 8 3821 1 1 31 LYS H H 8.401 4.571 -6.970 1.00 . A A . 31 LYS H 1 1 8 3822 1 1 31 LYS HA H 10.823 2.835 -7.176 1.00 . A A . 31 LYS HA 1 1 8 3823 1 1 31 LYS HB2 H 8.932 3.801 -9.263 1.00 . A A . 31 LYS HB2 1 1 8 3824 1 1 31 LYS HB3 H 10.644 3.916 -9.659 1.00 . A A . 31 LYS HB3 1 1 8 3825 1 1 31 LYS HD2 H 8.635 2.017 -11.035 1.00 . A A . 31 LYS HD2 1 1 8 3826 1 1 31 LYS HD3 H 8.664 0.445 -10.236 1.00 . A A . 31 LYS HD3 1 1 8 3827 1 1 31 LYS HE2 H 7.627 1.697 -8.199 1.00 . A A . 31 LYS HE2 1 1 8 3828 1 1 31 LYS HE3 H 7.229 2.959 -9.382 1.00 . A A . 31 LYS HE3 1 1 8 3829 1 1 31 LYS HG2 H 10.809 1.686 -9.958 1.00 . A A . 31 LYS HG2 1 1 8 3830 1 1 31 LYS HG3 H 10.016 1.363 -8.415 1.00 . A A . 31 LYS HG3 1 1 8 3831 1 1 31 LYS HZ1 H 6.691 0.128 -9.993 1.00 . A A . 31 LYS HZ1 1 1 8 3832 1 1 31 LYS HZ2 H 5.954 1.518 -10.632 1.00 . A A . 31 LYS HZ2 1 1 8 3833 1 1 31 LYS HZ3 H 5.588 1.009 -9.053 1.00 . A A . 31 LYS HZ3 1 1 8 3834 1 1 31 LYS N N 8.920 3.744 -6.900 1.00 . A A . 31 LYS N 1 1 8 3835 1 1 31 LYS NZ N 6.338 1.079 -9.770 1.00 . A A . 31 LYS NZ 1 1 8 3836 1 1 31 LYS O O 11.106 5.759 -8.321 1.00 . A A . 31 LYS O 1 1 8 3837 1 1 32 ALA C C 11.082 7.688 -6.038 1.00 . A A . 32 ALA C 1 1 8 3838 1 1 32 ALA CA C 12.110 6.560 -5.953 1.00 . A A . 32 ALA CA 1 1 8 3839 1 1 32 ALA CB C 13.154 6.694 -7.061 1.00 . A A . 32 ALA CB 1 1 8 3840 1 1 32 ALA H H 11.282 4.633 -5.467 1.00 . A A . 32 ALA H 1 1 8 3841 1 1 32 ALA HA H 12.588 6.553 -4.986 1.00 . A A . 32 ALA HA 1 1 8 3842 1 1 32 ALA HB1 H 13.945 7.350 -6.729 1.00 . A A . 32 ALA HB1 1 1 8 3843 1 1 32 ALA HB2 H 12.690 7.107 -7.944 1.00 . A A . 32 ALA HB2 1 1 8 3844 1 1 32 ALA HB3 H 13.564 5.722 -7.289 1.00 . A A . 32 ALA HB3 1 1 8 3845 1 1 32 ALA N N 11.421 5.263 -6.204 1.00 . A A . 32 ALA N 1 1 8 3846 1 1 32 ALA O O 10.088 7.579 -6.729 1.00 . A A . 32 ALA O 1 1 8 3847 1 1 33 CYS C C 10.987 11.217 -5.088 1.00 . A A . 33 CYS C 1 1 8 3848 1 1 33 CYS CA C 10.306 9.878 -5.386 1.00 . A A . 33 CYS CA 1 1 8 3849 1 1 33 CYS CB C 9.286 9.539 -4.299 1.00 . A A . 33 CYS CB 1 1 8 3850 1 1 33 CYS H H 12.096 8.835 -4.779 1.00 . A A . 33 CYS H 1 1 8 3851 1 1 33 CYS HA H 9.818 9.905 -6.346 1.00 . A A . 33 CYS HA 1 1 8 3852 1 1 33 CYS HB2 H 8.810 8.598 -4.534 1.00 . A A . 33 CYS HB2 1 1 8 3853 1 1 33 CYS HB3 H 9.789 9.463 -3.344 1.00 . A A . 33 CYS HB3 1 1 8 3854 1 1 33 CYS N N 11.296 8.763 -5.338 1.00 . A A . 33 CYS N 1 1 8 3855 1 1 33 CYS O O 11.478 11.435 -3.999 1.00 . A A . 33 CYS O 1 1 8 3856 1 1 33 CYS SG S 8.034 10.845 -4.217 1.00 . A A . 33 CYS SG 1 1 8 3857 1 1 34 PRO C C 10.715 14.309 -5.067 1.00 . A A . 34 PRO C 1 1 8 3858 1 1 34 PRO CA C 11.610 13.409 -5.920 1.00 . A A . 34 PRO CA 1 1 8 3859 1 1 34 PRO CB C 11.701 13.930 -7.351 1.00 . A A . 34 PRO CB 1 1 8 3860 1 1 34 PRO CD C 10.417 11.879 -7.412 1.00 . A A . 34 PRO CD 1 1 8 3861 1 1 34 PRO CG C 10.629 13.203 -8.101 1.00 . A A . 34 PRO CG 1 1 8 3862 1 1 34 PRO HA H 12.596 13.326 -5.491 1.00 . A A . 34 PRO HA 1 1 8 3863 1 1 34 PRO HB2 H 11.522 14.996 -7.372 1.00 . A A . 34 PRO HB2 1 1 8 3864 1 1 34 PRO HB3 H 12.666 13.700 -7.774 1.00 . A A . 34 PRO HB3 1 1 8 3865 1 1 34 PRO HD2 H 9.359 11.654 -7.346 1.00 . A A . 34 PRO HD2 1 1 8 3866 1 1 34 PRO HD3 H 10.943 11.091 -7.932 1.00 . A A . 34 PRO HD3 1 1 8 3867 1 1 34 PRO HG2 H 9.715 13.780 -8.086 1.00 . A A . 34 PRO HG2 1 1 8 3868 1 1 34 PRO HG3 H 10.943 13.035 -9.120 1.00 . A A . 34 PRO HG3 1 1 8 3869 1 1 34 PRO N N 10.989 12.072 -6.075 1.00 . A A . 34 PRO N 1 1 8 3870 1 1 34 PRO O O 11.097 15.395 -4.678 1.00 . A A . 34 PRO O 1 1 8 3871 1 1 35 GLN C C 7.289 13.931 -3.702 1.00 . A A . 35 GLN C 1 1 8 3872 1 1 35 GLN CA C 8.598 14.688 -3.943 1.00 . A A . 35 GLN CA 1 1 8 3873 1 1 35 GLN CB C 8.344 15.950 -4.770 1.00 . A A . 35 GLN CB 1 1 8 3874 1 1 35 GLN CD C 8.506 17.683 -2.974 1.00 . A A . 35 GLN CD 1 1 8 3875 1 1 35 GLN CG C 7.556 16.960 -3.932 1.00 . A A . 35 GLN CG 1 1 8 3876 1 1 35 GLN H H 9.237 12.984 -5.095 1.00 . A A . 35 GLN H 1 1 8 3877 1 1 35 GLN HA H 9.062 14.949 -3.006 1.00 . A A . 35 GLN HA 1 1 8 3878 1 1 35 GLN HB2 H 9.287 16.383 -5.065 1.00 . A A . 35 GLN HB2 1 1 8 3879 1 1 35 GLN HB3 H 7.773 15.695 -5.650 1.00 . A A . 35 GLN HB3 1 1 8 3880 1 1 35 GLN HE21 H 7.041 18.536 -1.940 1.00 . A A . 35 GLN HE21 1 1 8 3881 1 1 35 GLN HE22 H 8.612 18.906 -1.414 1.00 . A A . 35 GLN HE22 1 1 8 3882 1 1 35 GLN HG2 H 7.088 17.681 -4.586 1.00 . A A . 35 GLN HG2 1 1 8 3883 1 1 35 GLN HG3 H 6.799 16.443 -3.363 1.00 . A A . 35 GLN HG3 1 1 8 3884 1 1 35 GLN N N 9.523 13.863 -4.772 1.00 . A A . 35 GLN N 1 1 8 3885 1 1 35 GLN NE2 N 8.012 18.437 -2.030 1.00 . A A . 35 GLN NE2 1 1 8 3886 1 1 35 GLN O O 6.725 13.439 -4.666 1.00 . A A . 35 GLN O 1 1 8 3887 1 1 35 GLN OXT O 6.873 13.858 -2.558 1.00 . A A . 35 GLN OXT 1 1 8 3888 1 1 35 GLN OE1 O 9.709 17.559 -3.084 1.00 . A A . 35 GLN OE1 1 1 9 3889 1 1 1 GLU C C 3.178 1.450 10.442 1.00 . A A . 1 GLU C 1 1 9 3890 1 1 1 GLU CA C 4.307 1.918 11.363 1.00 . A A . 1 GLU CA 1 1 9 3891 1 1 1 GLU CB C 5.616 2.056 10.582 1.00 . A A . 1 GLU CB 1 1 9 3892 1 1 1 GLU CD C 7.366 0.791 9.320 1.00 . A A . 1 GLU CD 1 1 9 3893 1 1 1 GLU CG C 6.174 0.665 10.272 1.00 . A A . 1 GLU CG 1 1 9 3894 1 1 1 GLU H1 H 5.587 0.924 12.673 1.00 . A A . 1 GLU H1 1 1 9 3895 1 1 1 GLU H2 H 4.366 -0.058 12.018 1.00 . A A . 1 GLU H2 1 1 9 3896 1 1 1 GLU H3 H 3.993 1.066 13.237 1.00 . A A . 1 GLU H3 1 1 9 3897 1 1 1 GLU HA H 4.053 2.859 11.825 1.00 . A A . 1 GLU HA 1 1 9 3898 1 1 1 GLU HB2 H 5.431 2.586 9.658 1.00 . A A . 1 GLU HB2 1 1 9 3899 1 1 1 GLU HB3 H 6.332 2.605 11.175 1.00 . A A . 1 GLU HB3 1 1 9 3900 1 1 1 GLU HG2 H 6.492 0.194 11.190 1.00 . A A . 1 GLU HG2 1 1 9 3901 1 1 1 GLU HG3 H 5.407 0.066 9.806 1.00 . A A . 1 GLU HG3 1 1 9 3902 1 1 1 GLU N N 4.584 0.884 12.401 1.00 . A A . 1 GLU N 1 1 9 3903 1 1 1 GLU O O 2.622 0.385 10.617 1.00 . A A . 1 GLU O 1 1 9 3904 1 1 1 GLU OE1 O 8.108 1.749 9.455 1.00 . A A . 1 GLU OE1 1 1 9 3905 1 1 1 GLU OE2 O 7.517 -0.075 8.474 1.00 . A A . 1 GLU OE2 1 1 9 3906 1 1 2 VAL C C 0.438 1.622 9.299 1.00 . A A . 2 VAL C 1 1 9 3907 1 1 2 VAL CA C 1.743 1.853 8.526 1.00 . A A . 2 VAL CA 1 1 9 3908 1 1 2 VAL CB C 2.231 0.562 7.864 1.00 . A A . 2 VAL CB 1 1 9 3909 1 1 2 VAL CG1 C 1.210 0.093 6.826 1.00 . A A . 2 VAL CG1 1 1 9 3910 1 1 2 VAL CG2 C 3.569 0.825 7.169 1.00 . A A . 2 VAL CG2 1 1 9 3911 1 1 2 VAL H H 3.299 3.093 9.343 1.00 . A A . 2 VAL H 1 1 9 3912 1 1 2 VAL HA H 1.601 2.616 7.780 1.00 . A A . 2 VAL HA 1 1 9 3913 1 1 2 VAL HB H 2.359 -0.203 8.615 1.00 . A A . 2 VAL HB 1 1 9 3914 1 1 2 VAL HG11 H 1.143 -0.984 6.849 1.00 . A A . 2 VAL HG11 1 1 9 3915 1 1 2 VAL HG12 H 1.523 0.413 5.843 1.00 . A A . 2 VAL HG12 1 1 9 3916 1 1 2 VAL HG13 H 0.244 0.519 7.053 1.00 . A A . 2 VAL HG13 1 1 9 3917 1 1 2 VAL HG21 H 4.174 1.476 7.785 1.00 . A A . 2 VAL HG21 1 1 9 3918 1 1 2 VAL HG22 H 3.392 1.298 6.213 1.00 . A A . 2 VAL HG22 1 1 9 3919 1 1 2 VAL HG23 H 4.086 -0.110 7.018 1.00 . A A . 2 VAL HG23 1 1 9 3920 1 1 2 VAL N N 2.836 2.242 9.463 1.00 . A A . 2 VAL N 1 1 9 3921 1 1 2 VAL O O -0.435 2.465 9.325 1.00 . A A . 2 VAL O 1 1 9 3922 1 1 3 THR C C -2.176 0.491 9.847 1.00 . A A . 3 THR C 1 1 9 3923 1 1 3 THR CA C -0.941 0.208 10.706 1.00 . A A . 3 THR CA 1 1 9 3924 1 1 3 THR CB C -0.892 1.161 11.901 1.00 . A A . 3 THR CB 1 1 9 3925 1 1 3 THR CG2 C -2.192 1.048 12.699 1.00 . A A . 3 THR CG2 1 1 9 3926 1 1 3 THR H H 1.020 -0.173 9.899 1.00 . A A . 3 THR H 1 1 9 3927 1 1 3 THR HA H -0.949 -0.814 11.050 1.00 . A A . 3 THR HA 1 1 9 3928 1 1 3 THR HB H -0.777 2.175 11.551 1.00 . A A . 3 THR HB 1 1 9 3929 1 1 3 THR HG1 H 0.965 1.341 12.451 1.00 . A A . 3 THR HG1 1 1 9 3930 1 1 3 THR HG21 H -2.672 2.015 12.744 1.00 . A A . 3 THR HG21 1 1 9 3931 1 1 3 THR HG22 H -1.972 0.708 13.700 1.00 . A A . 3 THR HG22 1 1 9 3932 1 1 3 THR HG23 H -2.851 0.342 12.216 1.00 . A A . 3 THR HG23 1 1 9 3933 1 1 3 THR N N 0.304 0.491 9.932 1.00 . A A . 3 THR N 1 1 9 3934 1 1 3 THR O O -2.696 1.589 9.830 1.00 . A A . 3 THR O 1 1 9 3935 1 1 3 THR OG1 O 0.208 0.820 12.732 1.00 . A A . 3 THR OG1 1 1 9 3936 1 1 4 CYS C C -4.610 -1.602 8.105 1.00 . A A . 4 CYS C 1 1 9 3937 1 1 4 CYS CA C -3.846 -0.284 8.273 1.00 . A A . 4 CYS CA 1 1 9 3938 1 1 4 CYS CB C -3.285 0.193 6.933 1.00 . A A . 4 CYS CB 1 1 9 3939 1 1 4 CYS H H -2.212 -1.370 9.161 1.00 . A A . 4 CYS H 1 1 9 3940 1 1 4 CYS HA H -4.487 0.473 8.697 1.00 . A A . 4 CYS HA 1 1 9 3941 1 1 4 CYS HB2 H -4.073 0.201 6.193 1.00 . A A . 4 CYS HB2 1 1 9 3942 1 1 4 CYS HB3 H -2.886 1.192 7.047 1.00 . A A . 4 CYS HB3 1 1 9 3943 1 1 4 CYS N N -2.647 -0.493 9.132 1.00 . A A . 4 CYS N 1 1 9 3944 1 1 4 CYS O O -4.394 -2.551 8.832 1.00 . A A . 4 CYS O 1 1 9 3945 1 1 4 CYS SG S -1.964 -0.923 6.399 1.00 . A A . 4 CYS SG 1 1 9 3946 1 1 5 GLU C C -5.685 -3.720 5.768 1.00 . A A . 5 GLU C 1 1 9 3947 1 1 5 GLU CA C -6.271 -2.929 6.940 1.00 . A A . 5 GLU CA 1 1 9 3948 1 1 5 GLU CB C -7.694 -2.475 6.615 1.00 . A A . 5 GLU CB 1 1 9 3949 1 1 5 GLU CD C -8.533 -1.404 8.708 1.00 . A A . 5 GLU CD 1 1 9 3950 1 1 5 GLU CG C -8.582 -2.664 7.844 1.00 . A A . 5 GLU CG 1 1 9 3951 1 1 5 GLU H H -5.659 -0.894 6.574 1.00 . A A . 5 GLU H 1 1 9 3952 1 1 5 GLU HA H -6.271 -3.526 7.838 1.00 . A A . 5 GLU HA 1 1 9 3953 1 1 5 GLU HB2 H -7.683 -1.431 6.334 1.00 . A A . 5 GLU HB2 1 1 9 3954 1 1 5 GLU HB3 H -8.083 -3.064 5.799 1.00 . A A . 5 GLU HB3 1 1 9 3955 1 1 5 GLU HG2 H -9.599 -2.849 7.529 1.00 . A A . 5 GLU HG2 1 1 9 3956 1 1 5 GLU HG3 H -8.225 -3.505 8.420 1.00 . A A . 5 GLU HG3 1 1 9 3957 1 1 5 GLU N N -5.500 -1.669 7.152 1.00 . A A . 5 GLU N 1 1 9 3958 1 1 5 GLU O O -5.365 -3.158 4.740 1.00 . A A . 5 GLU O 1 1 9 3959 1 1 5 GLU OE1 O -7.857 -0.466 8.317 1.00 . A A . 5 GLU OE1 1 1 9 3960 1 1 5 GLU OE2 O -9.174 -1.395 9.746 1.00 . A A . 5 GLU OE2 1 1 9 3961 1 1 6 PRO C C -6.005 -6.017 3.746 1.00 . A A . 6 PRO C 1 1 9 3962 1 1 6 PRO CA C -5.017 -5.892 4.908 1.00 . A A . 6 PRO CA 1 1 9 3963 1 1 6 PRO CB C -4.833 -7.229 5.622 1.00 . A A . 6 PRO CB 1 1 9 3964 1 1 6 PRO CD C -5.937 -5.751 7.171 1.00 . A A . 6 PRO CD 1 1 9 3965 1 1 6 PRO CG C -5.803 -7.193 6.759 1.00 . A A . 6 PRO CG 1 1 9 3966 1 1 6 PRO HA H -4.064 -5.524 4.560 1.00 . A A . 6 PRO HA 1 1 9 3967 1 1 6 PRO HB2 H -5.064 -8.046 4.952 1.00 . A A . 6 PRO HB2 1 1 9 3968 1 1 6 PRO HB3 H -3.826 -7.322 5.998 1.00 . A A . 6 PRO HB3 1 1 9 3969 1 1 6 PRO HD2 H -6.958 -5.533 7.459 1.00 . A A . 6 PRO HD2 1 1 9 3970 1 1 6 PRO HD3 H -5.254 -5.519 7.974 1.00 . A A . 6 PRO HD3 1 1 9 3971 1 1 6 PRO HG2 H -6.759 -7.579 6.439 1.00 . A A . 6 PRO HG2 1 1 9 3972 1 1 6 PRO HG3 H -5.425 -7.774 7.586 1.00 . A A . 6 PRO HG3 1 1 9 3973 1 1 6 PRO N N -5.568 -5.007 5.963 1.00 . A A . 6 PRO N 1 1 9 3974 1 1 6 PRO O O -7.001 -6.708 3.833 1.00 . A A . 6 PRO O 1 1 9 3975 1 1 7 GLY C C -7.251 -4.026 1.240 1.00 . A A . 7 GLY C 1 1 9 3976 1 1 7 GLY CA C -6.657 -5.412 1.490 1.00 . A A . 7 GLY CA 1 1 9 3977 1 1 7 GLY H H -4.930 -4.793 2.616 1.00 . A A . 7 GLY H 1 1 9 3978 1 1 7 GLY HA2 H -6.107 -5.735 0.616 1.00 . A A . 7 GLY HA2 1 1 9 3979 1 1 7 GLY HA3 H -7.455 -6.111 1.697 1.00 . A A . 7 GLY HA3 1 1 9 3980 1 1 7 GLY N N -5.736 -5.345 2.660 1.00 . A A . 7 GLY N 1 1 9 3981 1 1 7 GLY O O -8.350 -3.891 0.739 1.00 . A A . 7 GLY O 1 1 9 3982 1 1 8 THR C C -5.980 -0.708 0.768 1.00 . A A . 8 THR C 1 1 9 3983 1 1 8 THR CA C -7.057 -1.611 1.385 1.00 . A A . 8 THR CA 1 1 9 3984 1 1 8 THR CB C -7.428 -1.124 2.787 1.00 . A A . 8 THR CB 1 1 9 3985 1 1 8 THR CG2 C -7.944 0.314 2.713 1.00 . A A . 8 THR CG2 1 1 9 3986 1 1 8 THR H H -5.654 -3.129 2.002 1.00 . A A . 8 THR H 1 1 9 3987 1 1 8 THR HA H -7.933 -1.632 0.760 1.00 . A A . 8 THR HA 1 1 9 3988 1 1 8 THR HB H -6.556 -1.157 3.421 1.00 . A A . 8 THR HB 1 1 9 3989 1 1 8 THR HG1 H -8.807 -1.530 4.096 1.00 . A A . 8 THR HG1 1 1 9 3990 1 1 8 THR HG21 H -8.392 0.487 1.746 1.00 . A A . 8 THR HG21 1 1 9 3991 1 1 8 THR HG22 H -7.121 0.998 2.856 1.00 . A A . 8 THR HG22 1 1 9 3992 1 1 8 THR HG23 H -8.683 0.471 3.486 1.00 . A A . 8 THR HG23 1 1 9 3993 1 1 8 THR N N -6.534 -2.994 1.592 1.00 . A A . 8 THR N 1 1 9 3994 1 1 8 THR O O -6.282 0.220 0.048 1.00 . A A . 8 THR O 1 1 9 3995 1 1 8 THR OG1 O -8.438 -1.965 3.325 1.00 . A A . 8 THR OG1 1 1 9 3996 1 1 9 THR C C -3.958 1.347 0.568 1.00 . A A . 9 THR C 1 1 9 3997 1 1 9 THR CA C -3.617 -0.146 0.501 1.00 . A A . 9 THR CA 1 1 9 3998 1 1 9 THR CB C -3.438 -0.607 -0.951 1.00 . A A . 9 THR CB 1 1 9 3999 1 1 9 THR CG2 C -4.581 -0.079 -1.821 1.00 . A A . 9 THR CG2 1 1 9 4000 1 1 9 THR H H -4.524 -1.730 1.644 1.00 . A A . 9 THR H 1 1 9 4001 1 1 9 THR HA H -2.710 -0.338 1.053 1.00 . A A . 9 THR HA 1 1 9 4002 1 1 9 THR HB H -3.435 -1.686 -0.986 1.00 . A A . 9 THR HB 1 1 9 4003 1 1 9 THR HG1 H -1.984 -0.609 -2.244 1.00 . A A . 9 THR HG1 1 1 9 4004 1 1 9 THR HG21 H -5.464 -0.678 -1.656 1.00 . A A . 9 THR HG21 1 1 9 4005 1 1 9 THR HG22 H -4.297 -0.139 -2.862 1.00 . A A . 9 THR HG22 1 1 9 4006 1 1 9 THR HG23 H -4.788 0.948 -1.564 1.00 . A A . 9 THR HG23 1 1 9 4007 1 1 9 THR N N -4.732 -0.978 1.055 1.00 . A A . 9 THR N 1 1 9 4008 1 1 9 THR O O -4.954 1.746 1.137 1.00 . A A . 9 THR O 1 1 9 4009 1 1 9 THR OG1 O -2.202 -0.116 -1.449 1.00 . A A . 9 THR OG1 1 1 9 4010 1 1 10 PHE C C -2.196 4.400 -0.579 1.00 . A A . 10 PHE C 1 1 9 4011 1 1 10 PHE CA C -3.385 3.644 0.025 1.00 . A A . 10 PHE CA 1 1 9 4012 1 1 10 PHE CB C -3.545 3.996 1.507 1.00 . A A . 10 PHE CB 1 1 9 4013 1 1 10 PHE CD1 C -1.190 3.916 2.410 1.00 . A A . 10 PHE CD1 1 1 9 4014 1 1 10 PHE CD2 C -2.712 2.110 2.962 1.00 . A A . 10 PHE CD2 1 1 9 4015 1 1 10 PHE CE1 C -0.182 3.293 3.157 1.00 . A A . 10 PHE CE1 1 1 9 4016 1 1 10 PHE CE2 C -1.703 1.488 3.709 1.00 . A A . 10 PHE CE2 1 1 9 4017 1 1 10 PHE CG C -2.455 3.323 2.311 1.00 . A A . 10 PHE CG 1 1 9 4018 1 1 10 PHE CZ C -0.439 2.080 3.807 1.00 . A A . 10 PHE CZ 1 1 9 4019 1 1 10 PHE H H -2.324 1.831 -0.450 1.00 . A A . 10 PHE H 1 1 9 4020 1 1 10 PHE HA H -4.292 3.877 -0.509 1.00 . A A . 10 PHE HA 1 1 9 4021 1 1 10 PHE HB2 H -3.473 5.067 1.630 1.00 . A A . 10 PHE HB2 1 1 9 4022 1 1 10 PHE HB3 H -4.509 3.659 1.855 1.00 . A A . 10 PHE HB3 1 1 9 4023 1 1 10 PHE HD1 H -0.992 4.851 1.910 1.00 . A A . 10 PHE HD1 1 1 9 4024 1 1 10 PHE HD2 H -3.687 1.651 2.886 1.00 . A A . 10 PHE HD2 1 1 9 4025 1 1 10 PHE HE1 H 0.794 3.750 3.233 1.00 . A A . 10 PHE HE1 1 1 9 4026 1 1 10 PHE HE2 H -1.901 0.552 4.210 1.00 . A A . 10 PHE HE2 1 1 9 4027 1 1 10 PHE HZ H 0.339 1.601 4.383 1.00 . A A . 10 PHE HZ 1 1 9 4028 1 1 10 PHE N N -3.125 2.176 -0.005 1.00 . A A . 10 PHE N 1 1 9 4029 1 1 10 PHE O O -1.349 3.822 -1.232 1.00 . A A . 10 PHE O 1 1 9 4030 1 1 11 LYS C C -0.276 7.232 0.200 1.00 . A A . 11 LYS C 1 1 9 4031 1 1 11 LYS CA C -0.987 6.473 -0.922 1.00 . A A . 11 LYS CA 1 1 9 4032 1 1 11 LYS CB C -1.622 7.452 -1.911 1.00 . A A . 11 LYS CB 1 1 9 4033 1 1 11 LYS CD C -1.571 7.401 -4.406 1.00 . A A . 11 LYS CD 1 1 9 4034 1 1 11 LYS CE C -0.733 7.762 -5.635 1.00 . A A . 11 LYS CE 1 1 9 4035 1 1 11 LYS CG C -0.727 7.581 -3.144 1.00 . A A . 11 LYS CG 1 1 9 4036 1 1 11 LYS H H -2.816 6.133 0.167 1.00 . A A . 11 LYS H 1 1 9 4037 1 1 11 LYS HA H -0.296 5.825 -1.438 1.00 . A A . 11 LYS HA 1 1 9 4038 1 1 11 LYS HB2 H -2.594 7.084 -2.207 1.00 . A A . 11 LYS HB2 1 1 9 4039 1 1 11 LYS HB3 H -1.729 8.419 -1.443 1.00 . A A . 11 LYS HB3 1 1 9 4040 1 1 11 LYS HD2 H -1.894 6.373 -4.480 1.00 . A A . 11 LYS HD2 1 1 9 4041 1 1 11 LYS HD3 H -2.433 8.048 -4.358 1.00 . A A . 11 LYS HD3 1 1 9 4042 1 1 11 LYS HE2 H -1.001 8.746 -5.994 1.00 . A A . 11 LYS HE2 1 1 9 4043 1 1 11 LYS HE3 H 0.319 7.718 -5.400 1.00 . A A . 11 LYS HE3 1 1 9 4044 1 1 11 LYS HG2 H -0.266 8.558 -3.153 1.00 . A A . 11 LYS HG2 1 1 9 4045 1 1 11 LYS HG3 H 0.040 6.820 -3.114 1.00 . A A . 11 LYS HG3 1 1 9 4046 1 1 11 LYS HZ1 H -1.035 7.144 -7.599 1.00 . A A . 11 LYS HZ1 1 1 9 4047 1 1 11 LYS HZ2 H -2.034 6.366 -6.465 1.00 . A A . 11 LYS HZ2 1 1 9 4048 1 1 11 LYS HZ3 H -0.394 5.943 -6.587 1.00 . A A . 11 LYS HZ3 1 1 9 4049 1 1 11 LYS N N -2.125 5.685 -0.364 1.00 . A A . 11 LYS N 1 1 9 4050 1 1 11 LYS NZ N -1.075 6.726 -6.648 1.00 . A A . 11 LYS NZ 1 1 9 4051 1 1 11 LYS O O -0.854 8.073 0.858 1.00 . A A . 11 LYS O 1 1 9 4052 1 1 12 ASP C C 2.680 8.674 0.896 1.00 . A A . 12 ASP C 1 1 9 4053 1 1 12 ASP CA C 1.726 7.644 1.502 1.00 . A A . 12 ASP CA 1 1 9 4054 1 1 12 ASP CB C 2.512 6.544 2.215 1.00 . A A . 12 ASP CB 1 1 9 4055 1 1 12 ASP CG C 3.088 7.094 3.520 1.00 . A A . 12 ASP CG 1 1 9 4056 1 1 12 ASP H H 1.425 6.260 -0.121 1.00 . A A . 12 ASP H 1 1 9 4057 1 1 12 ASP HA H 1.046 8.117 2.189 1.00 . A A . 12 ASP HA 1 1 9 4058 1 1 12 ASP HB2 H 1.853 5.714 2.432 1.00 . A A . 12 ASP HB2 1 1 9 4059 1 1 12 ASP HB3 H 3.319 6.209 1.579 1.00 . A A . 12 ASP HB3 1 1 9 4060 1 1 12 ASP N N 0.977 6.941 0.422 1.00 . A A . 12 ASP N 1 1 9 4061 1 1 12 ASP O O 2.888 9.741 1.439 1.00 . A A . 12 ASP O 1 1 9 4062 1 1 12 ASP OD1 O 2.863 8.261 3.798 1.00 . A A . 12 ASP OD1 1 1 9 4063 1 1 12 ASP OD2 O 3.746 6.341 4.220 1.00 . A A . 12 ASP OD2 1 1 9 4064 1 1 13 LYS C C 3.938 9.346 -2.390 1.00 . A A . 13 LYS C 1 1 9 4065 1 1 13 LYS CA C 4.202 9.310 -0.878 1.00 . A A . 13 LYS CA 1 1 9 4066 1 1 13 LYS CB C 5.598 8.758 -0.573 1.00 . A A . 13 LYS CB 1 1 9 4067 1 1 13 LYS CD C 7.128 8.104 1.297 1.00 . A A . 13 LYS CD 1 1 9 4068 1 1 13 LYS CE C 7.316 8.516 2.760 1.00 . A A . 13 LYS CE 1 1 9 4069 1 1 13 LYS CG C 5.668 8.318 0.892 1.00 . A A . 13 LYS CG 1 1 9 4070 1 1 13 LYS H H 3.074 7.491 -0.642 1.00 . A A . 13 LYS H 1 1 9 4071 1 1 13 LYS HA H 4.094 10.296 -0.453 1.00 . A A . 13 LYS HA 1 1 9 4072 1 1 13 LYS HB2 H 5.798 7.910 -1.214 1.00 . A A . 13 LYS HB2 1 1 9 4073 1 1 13 LYS HB3 H 6.336 9.527 -0.751 1.00 . A A . 13 LYS HB3 1 1 9 4074 1 1 13 LYS HD2 H 7.384 7.060 1.179 1.00 . A A . 13 LYS HD2 1 1 9 4075 1 1 13 LYS HD3 H 7.768 8.705 0.670 1.00 . A A . 13 LYS HD3 1 1 9 4076 1 1 13 LYS HE2 H 6.482 9.121 3.087 1.00 . A A . 13 LYS HE2 1 1 9 4077 1 1 13 LYS HE3 H 7.418 7.644 3.386 1.00 . A A . 13 LYS HE3 1 1 9 4078 1 1 13 LYS HG2 H 5.227 9.081 1.517 1.00 . A A . 13 LYS HG2 1 1 9 4079 1 1 13 LYS HG3 H 5.123 7.394 1.014 1.00 . A A . 13 LYS HG3 1 1 9 4080 1 1 13 LYS HZ1 H 9.204 8.985 2.016 1.00 . A A . 13 LYS HZ1 1 1 9 4081 1 1 13 LYS HZ2 H 9.051 9.181 3.697 1.00 . A A . 13 LYS HZ2 1 1 9 4082 1 1 13 LYS HZ3 H 8.357 10.316 2.640 1.00 . A A . 13 LYS HZ3 1 1 9 4083 1 1 13 LYS N N 3.260 8.358 -0.226 1.00 . A A . 13 LYS N 1 1 9 4084 1 1 13 LYS NZ N 8.576 9.309 2.780 1.00 . A A . 13 LYS NZ 1 1 9 4085 1 1 13 LYS O O 2.821 9.549 -2.823 1.00 . A A . 13 LYS O 1 1 9 4086 1 1 14 CYS C C 4.304 7.781 -5.161 1.00 . A A . 14 CYS C 1 1 9 4087 1 1 14 CYS CA C 4.725 9.170 -4.672 1.00 . A A . 14 CYS CA 1 1 9 4088 1 1 14 CYS CB C 6.077 9.562 -5.274 1.00 . A A . 14 CYS CB 1 1 9 4089 1 1 14 CYS H H 5.841 8.981 -2.841 1.00 . A A . 14 CYS H 1 1 9 4090 1 1 14 CYS HA H 3.979 9.904 -4.931 1.00 . A A . 14 CYS HA 1 1 9 4091 1 1 14 CYS HB2 H 6.760 8.727 -5.200 1.00 . A A . 14 CYS HB2 1 1 9 4092 1 1 14 CYS HB3 H 5.943 9.830 -6.313 1.00 . A A . 14 CYS HB3 1 1 9 4093 1 1 14 CYS N N 4.946 9.147 -3.198 1.00 . A A . 14 CYS N 1 1 9 4094 1 1 14 CYS O O 4.260 7.517 -6.346 1.00 . A A . 14 CYS O 1 1 9 4095 1 1 14 CYS SG S 6.758 10.977 -4.372 1.00 . A A . 14 CYS SG 1 1 9 4096 1 1 15 ASN C C 2.456 5.005 -3.767 1.00 . A A . 15 ASN C 1 1 9 4097 1 1 15 ASN CA C 3.575 5.520 -4.674 1.00 . A A . 15 ASN CA 1 1 9 4098 1 1 15 ASN CB C 4.826 4.657 -4.517 1.00 . A A . 15 ASN CB 1 1 9 4099 1 1 15 ASN CG C 5.906 5.140 -5.487 1.00 . A A . 15 ASN CG 1 1 9 4100 1 1 15 ASN H H 4.034 7.122 -3.305 1.00 . A A . 15 ASN H 1 1 9 4101 1 1 15 ASN HA H 3.254 5.518 -5.705 1.00 . A A . 15 ASN HA 1 1 9 4102 1 1 15 ASN HB2 H 5.190 4.735 -3.503 1.00 . A A . 15 ASN HB2 1 1 9 4103 1 1 15 ASN HB3 H 4.584 3.630 -4.734 1.00 . A A . 15 ASN HB3 1 1 9 4104 1 1 15 ASN HD21 H 7.226 5.506 -4.047 1.00 . A A . 15 ASN HD21 1 1 9 4105 1 1 15 ASN HD22 H 7.761 5.838 -5.632 1.00 . A A . 15 ASN HD22 1 1 9 4106 1 1 15 ASN N N 3.992 6.890 -4.257 1.00 . A A . 15 ASN N 1 1 9 4107 1 1 15 ASN ND2 N 7.060 5.527 -5.016 1.00 . A A . 15 ASN ND2 1 1 9 4108 1 1 15 ASN O O 2.075 5.645 -2.807 1.00 . A A . 15 ASN O 1 1 9 4109 1 1 15 ASN OD1 O 5.698 5.163 -6.684 1.00 . A A . 15 ASN OD1 1 1 9 4110 1 1 16 THR C C 1.374 2.147 -2.359 1.00 . A A . 16 THR C 1 1 9 4111 1 1 16 THR CA C 0.836 3.285 -3.222 1.00 . A A . 16 THR CA 1 1 9 4112 1 1 16 THR CB C -0.212 2.778 -4.220 1.00 . A A . 16 THR CB 1 1 9 4113 1 1 16 THR CG2 C -1.083 1.701 -3.568 1.00 . A A . 16 THR CG2 1 1 9 4114 1 1 16 THR H H 2.255 3.350 -4.842 1.00 . A A . 16 THR H 1 1 9 4115 1 1 16 THR HA H 0.409 4.049 -2.591 1.00 . A A . 16 THR HA 1 1 9 4116 1 1 16 THR HB H 0.286 2.359 -5.080 1.00 . A A . 16 THR HB 1 1 9 4117 1 1 16 THR HG1 H -0.456 4.580 -4.911 1.00 . A A . 16 THR HG1 1 1 9 4118 1 1 16 THR HG21 H -1.558 2.108 -2.687 1.00 . A A . 16 THR HG21 1 1 9 4119 1 1 16 THR HG22 H -0.465 0.861 -3.287 1.00 . A A . 16 THR HG22 1 1 9 4120 1 1 16 THR HG23 H -1.836 1.375 -4.268 1.00 . A A . 16 THR HG23 1 1 9 4121 1 1 16 THR N N 1.930 3.849 -4.064 1.00 . A A . 16 THR N 1 1 9 4122 1 1 16 THR O O 2.024 1.238 -2.835 1.00 . A A . 16 THR O 1 1 9 4123 1 1 16 THR OG1 O -1.030 3.863 -4.631 1.00 . A A . 16 THR OG1 1 1 9 4124 1 1 17 CYS C C 0.467 0.169 0.169 1.00 . A A . 17 CYS C 1 1 9 4125 1 1 17 CYS CA C 1.595 1.144 -0.171 1.00 . A A . 17 CYS CA 1 1 9 4126 1 1 17 CYS CB C 2.062 1.909 1.062 1.00 . A A . 17 CYS CB 1 1 9 4127 1 1 17 CYS H H 0.581 2.951 -0.734 1.00 . A A . 17 CYS H 1 1 9 4128 1 1 17 CYS HA H 2.421 0.615 -0.607 1.00 . A A . 17 CYS HA 1 1 9 4129 1 1 17 CYS HB2 H 2.046 2.970 0.852 1.00 . A A . 17 CYS HB2 1 1 9 4130 1 1 17 CYS HB3 H 1.403 1.697 1.886 1.00 . A A . 17 CYS HB3 1 1 9 4131 1 1 17 CYS N N 1.105 2.202 -1.089 1.00 . A A . 17 CYS N 1 1 9 4132 1 1 17 CYS O O -0.493 0.512 0.832 1.00 . A A . 17 CYS O 1 1 9 4133 1 1 17 CYS SG S 3.751 1.405 1.479 1.00 . A A . 17 CYS SG 1 1 9 4134 1 1 18 ARG C C -0.405 -2.514 1.445 1.00 . A A . 18 ARG C 1 1 9 4135 1 1 18 ARG CA C -0.477 -2.061 -0.015 1.00 . A A . 18 ARG CA 1 1 9 4136 1 1 18 ARG CB C -0.158 -3.223 -0.961 1.00 . A A . 18 ARG CB 1 1 9 4137 1 1 18 ARG CD C -2.345 -4.338 -0.464 1.00 . A A . 18 ARG CD 1 1 9 4138 1 1 18 ARG CG C -0.823 -4.507 -0.456 1.00 . A A . 18 ARG CG 1 1 9 4139 1 1 18 ARG CZ C -4.045 -5.866 -1.270 1.00 . A A . 18 ARG CZ 1 1 9 4140 1 1 18 ARG H H 1.362 -1.294 -0.827 1.00 . A A . 18 ARG H 1 1 9 4141 1 1 18 ARG HA H -1.453 -1.662 -0.239 1.00 . A A . 18 ARG HA 1 1 9 4142 1 1 18 ARG HB2 H -0.528 -2.992 -1.949 1.00 . A A . 18 ARG HB2 1 1 9 4143 1 1 18 ARG HB3 H 0.911 -3.368 -1.003 1.00 . A A . 18 ARG HB3 1 1 9 4144 1 1 18 ARG HD2 H -2.683 -3.958 0.490 1.00 . A A . 18 ARG HD2 1 1 9 4145 1 1 18 ARG HD3 H -2.647 -3.680 -1.263 1.00 . A A . 18 ARG HD3 1 1 9 4146 1 1 18 ARG HE H -2.361 -6.492 -0.428 1.00 . A A . 18 ARG HE 1 1 9 4147 1 1 18 ARG HG2 H -0.548 -5.330 -1.099 1.00 . A A . 18 ARG HG2 1 1 9 4148 1 1 18 ARG HG3 H -0.491 -4.711 0.551 1.00 . A A . 18 ARG HG3 1 1 9 4149 1 1 18 ARG HH11 H -4.723 -4.057 -0.745 1.00 . A A . 18 ARG HH11 1 1 9 4150 1 1 18 ARG HH12 H -5.823 -5.032 -1.659 1.00 . A A . 18 ARG HH12 1 1 9 4151 1 1 18 ARG HH21 H -3.642 -7.714 -1.925 1.00 . A A . 18 ARG HH21 1 1 9 4152 1 1 18 ARG HH22 H -5.213 -7.104 -2.324 1.00 . A A . 18 ARG HH22 1 1 9 4153 1 1 18 ARG N N 0.579 -1.048 -0.292 1.00 . A A . 18 ARG N 1 1 9 4154 1 1 18 ARG NE N -2.881 -5.709 -0.700 1.00 . A A . 18 ARG NE 1 1 9 4155 1 1 18 ARG NH1 N -4.933 -4.910 -1.220 1.00 . A A . 18 ARG NH1 1 1 9 4156 1 1 18 ARG NH2 N -4.322 -6.982 -1.888 1.00 . A A . 18 ARG NH2 1 1 9 4157 1 1 18 ARG O O 0.630 -2.928 1.929 1.00 . A A . 18 ARG O 1 1 9 4158 1 1 19 CYS C C -1.153 -4.354 3.687 1.00 . A A . 19 CYS C 1 1 9 4159 1 1 19 CYS CA C -1.492 -2.866 3.578 1.00 . A A . 19 CYS CA 1 1 9 4160 1 1 19 CYS CB C -2.912 -2.606 4.072 1.00 . A A . 19 CYS CB 1 1 9 4161 1 1 19 CYS H H -2.324 -2.103 1.742 1.00 . A A . 19 CYS H 1 1 9 4162 1 1 19 CYS HA H -0.791 -2.275 4.146 1.00 . A A . 19 CYS HA 1 1 9 4163 1 1 19 CYS HB2 H -3.249 -1.643 3.717 1.00 . A A . 19 CYS HB2 1 1 9 4164 1 1 19 CYS HB3 H -3.569 -3.379 3.698 1.00 . A A . 19 CYS HB3 1 1 9 4165 1 1 19 CYS N N -1.499 -2.439 2.150 1.00 . A A . 19 CYS N 1 1 9 4166 1 1 19 CYS O O -1.848 -5.198 3.157 1.00 . A A . 19 CYS O 1 1 9 4167 1 1 19 CYS SG S -2.927 -2.622 5.881 1.00 . A A . 19 CYS SG 1 1 9 4168 1 1 20 GLY C C -0.946 -6.929 4.917 1.00 . A A . 20 GLY C 1 1 9 4169 1 1 20 GLY CA C 0.286 -6.115 4.516 1.00 . A A . 20 GLY CA 1 1 9 4170 1 1 20 GLY H H 0.453 -3.985 4.794 1.00 . A A . 20 GLY H 1 1 9 4171 1 1 20 GLY HA2 H 0.673 -6.482 3.575 1.00 . A A . 20 GLY HA2 1 1 9 4172 1 1 20 GLY HA3 H 1.042 -6.212 5.282 1.00 . A A . 20 GLY HA3 1 1 9 4173 1 1 20 GLY N N -0.093 -4.681 4.373 1.00 . A A . 20 GLY N 1 1 9 4174 1 1 20 GLY O O -2.003 -6.388 5.175 1.00 . A A . 20 GLY O 1 1 9 4175 1 1 21 SER C C -2.255 -8.947 6.858 1.00 . A A . 21 SER C 1 1 9 4176 1 1 21 SER CA C -1.980 -9.075 5.358 1.00 . A A . 21 SER CA 1 1 9 4177 1 1 21 SER CB C -1.555 -10.500 5.010 1.00 . A A . 21 SER CB 1 1 9 4178 1 1 21 SER H H 0.045 -8.641 4.761 1.00 . A A . 21 SER H 1 1 9 4179 1 1 21 SER HA H -2.854 -8.800 4.788 1.00 . A A . 21 SER HA 1 1 9 4180 1 1 21 SER HB2 H -0.734 -10.471 4.312 1.00 . A A . 21 SER HB2 1 1 9 4181 1 1 21 SER HB3 H -1.240 -11.010 5.910 1.00 . A A . 21 SER HB3 1 1 9 4182 1 1 21 SER HG H -2.301 -11.772 3.741 1.00 . A A . 21 SER HG 1 1 9 4183 1 1 21 SER N N -0.817 -8.225 4.973 1.00 . A A . 21 SER N 1 1 9 4184 1 1 21 SER O O -3.250 -9.431 7.361 1.00 . A A . 21 SER O 1 1 9 4185 1 1 21 SER OG O -2.650 -11.185 4.416 1.00 . A A . 21 SER OG 1 1 9 4186 1 1 22 ASP C C -1.286 -6.704 9.477 1.00 . A A . 22 ASP C 1 1 9 4187 1 1 22 ASP CA C -1.590 -8.141 9.047 1.00 . A A . 22 ASP CA 1 1 9 4188 1 1 22 ASP CB C -0.607 -9.116 9.696 1.00 . A A . 22 ASP CB 1 1 9 4189 1 1 22 ASP CG C 0.807 -8.838 9.179 1.00 . A A . 22 ASP CG 1 1 9 4190 1 1 22 ASP H H -0.583 -7.917 7.154 1.00 . A A . 22 ASP H 1 1 9 4191 1 1 22 ASP HA H -2.601 -8.408 9.312 1.00 . A A . 22 ASP HA 1 1 9 4192 1 1 22 ASP HB2 H -0.630 -8.988 10.769 1.00 . A A . 22 ASP HB2 1 1 9 4193 1 1 22 ASP HB3 H -0.887 -10.130 9.446 1.00 . A A . 22 ASP HB3 1 1 9 4194 1 1 22 ASP N N -1.380 -8.300 7.578 1.00 . A A . 22 ASP N 1 1 9 4195 1 1 22 ASP O O -0.648 -6.469 10.484 1.00 . A A . 22 ASP O 1 1 9 4196 1 1 22 ASP OD1 O 0.946 -7.982 8.321 1.00 . A A . 22 ASP OD1 1 1 9 4197 1 1 22 ASP OD2 O 1.727 -9.487 9.651 1.00 . A A . 22 ASP OD2 1 1 9 4198 1 1 23 GLY C C 0.000 -4.137 9.449 1.00 . A A . 23 GLY C 1 1 9 4199 1 1 23 GLY CA C -1.478 -4.317 9.093 1.00 . A A . 23 GLY CA 1 1 9 4200 1 1 23 GLY H H -2.255 -5.948 7.917 1.00 . A A . 23 GLY H 1 1 9 4201 1 1 23 GLY HA2 H -1.729 -3.678 8.257 1.00 . A A . 23 GLY HA2 1 1 9 4202 1 1 23 GLY HA3 H -2.084 -4.051 9.946 1.00 . A A . 23 GLY HA3 1 1 9 4203 1 1 23 GLY N N -1.740 -5.738 8.724 1.00 . A A . 23 GLY N 1 1 9 4204 1 1 23 GLY O O 0.803 -5.034 9.287 1.00 . A A . 23 GLY O 1 1 9 4205 1 1 24 LYS C C 2.713 -3.309 9.218 1.00 . A A . 24 LYS C 1 1 9 4206 1 1 24 LYS CA C 1.792 -2.737 10.297 1.00 . A A . 24 LYS CA 1 1 9 4207 1 1 24 LYS CB C 1.994 -3.477 11.619 1.00 . A A . 24 LYS CB 1 1 9 4208 1 1 24 LYS CD C 1.697 -3.264 14.088 1.00 . A A . 24 LYS CD 1 1 9 4209 1 1 24 LYS CE C 0.388 -2.834 14.753 1.00 . A A . 24 LYS CE 1 1 9 4210 1 1 24 LYS CG C 1.889 -2.491 12.782 1.00 . A A . 24 LYS CG 1 1 9 4211 1 1 24 LYS H H -0.298 -2.266 10.053 1.00 . A A . 24 LYS H 1 1 9 4212 1 1 24 LYS HA H 1.976 -1.680 10.432 1.00 . A A . 24 LYS HA 1 1 9 4213 1 1 24 LYS HB2 H 1.235 -4.240 11.724 1.00 . A A . 24 LYS HB2 1 1 9 4214 1 1 24 LYS HB3 H 2.971 -3.939 11.628 1.00 . A A . 24 LYS HB3 1 1 9 4215 1 1 24 LYS HD2 H 1.664 -4.323 13.877 1.00 . A A . 24 LYS HD2 1 1 9 4216 1 1 24 LYS HD3 H 2.522 -3.055 14.754 1.00 . A A . 24 LYS HD3 1 1 9 4217 1 1 24 LYS HE2 H 0.030 -1.913 14.315 1.00 . A A . 24 LYS HE2 1 1 9 4218 1 1 24 LYS HE3 H -0.355 -3.611 14.657 1.00 . A A . 24 LYS HE3 1 1 9 4219 1 1 24 LYS HG2 H 2.795 -1.904 12.839 1.00 . A A . 24 LYS HG2 1 1 9 4220 1 1 24 LYS HG3 H 1.044 -1.837 12.626 1.00 . A A . 24 LYS HG3 1 1 9 4221 1 1 24 LYS HZ1 H 0.071 -1.950 16.611 1.00 . A A . 24 LYS HZ1 1 1 9 4222 1 1 24 LYS HZ2 H 1.703 -2.267 16.263 1.00 . A A . 24 LYS HZ2 1 1 9 4223 1 1 24 LYS HZ3 H 0.661 -3.539 16.693 1.00 . A A . 24 LYS HZ3 1 1 9 4224 1 1 24 LYS N N 0.365 -2.978 9.932 1.00 . A A . 24 LYS N 1 1 9 4225 1 1 24 LYS NZ N 0.731 -2.632 16.188 1.00 . A A . 24 LYS NZ 1 1 9 4226 1 1 24 LYS O O 3.737 -3.897 9.507 1.00 . A A . 24 LYS O 1 1 9 4227 1 1 25 SER C C 2.748 -3.086 5.537 1.00 . A A . 25 SER C 1 1 9 4228 1 1 25 SER CA C 3.204 -3.675 6.873 1.00 . A A . 25 SER CA 1 1 9 4229 1 1 25 SER CB C 2.982 -5.186 6.900 1.00 . A A . 25 SER CB 1 1 9 4230 1 1 25 SER H H 1.525 -2.665 7.766 1.00 . A A . 25 SER H 1 1 9 4231 1 1 25 SER HA H 4.244 -3.450 7.053 1.00 . A A . 25 SER HA 1 1 9 4232 1 1 25 SER HB2 H 1.930 -5.396 7.013 1.00 . A A . 25 SER HB2 1 1 9 4233 1 1 25 SER HB3 H 3.339 -5.619 5.973 1.00 . A A . 25 SER HB3 1 1 9 4234 1 1 25 SER HG H 3.173 -5.591 8.794 1.00 . A A . 25 SER HG 1 1 9 4235 1 1 25 SER N N 2.355 -3.142 7.976 1.00 . A A . 25 SER N 1 1 9 4236 1 1 25 SER O O 1.570 -3.017 5.250 1.00 . A A . 25 SER O 1 1 9 4237 1 1 25 SER OG O 3.690 -5.745 8.000 1.00 . A A . 25 SER OG 1 1 9 4238 1 1 26 ALA C C 4.346 -2.327 2.349 1.00 . A A . 26 ALA C 1 1 9 4239 1 1 26 ALA CA C 3.270 -2.062 3.409 1.00 . A A . 26 ALA CA 1 1 9 4240 1 1 26 ALA CB C 3.130 -0.564 3.686 1.00 . A A . 26 ALA CB 1 1 9 4241 1 1 26 ALA H H 4.614 -2.710 4.966 1.00 . A A . 26 ALA H 1 1 9 4242 1 1 26 ALA HA H 2.322 -2.465 3.090 1.00 . A A . 26 ALA HA 1 1 9 4243 1 1 26 ALA HB1 H 2.445 -0.129 2.974 1.00 . A A . 26 ALA HB1 1 1 9 4244 1 1 26 ALA HB2 H 4.095 -0.089 3.595 1.00 . A A . 26 ALA HB2 1 1 9 4245 1 1 26 ALA HB3 H 2.750 -0.418 4.687 1.00 . A A . 26 ALA HB3 1 1 9 4246 1 1 26 ALA N N 3.668 -2.652 4.719 1.00 . A A . 26 ALA N 1 1 9 4247 1 1 26 ALA O O 5.525 -2.157 2.588 1.00 . A A . 26 ALA O 1 1 9 4248 1 1 27 ALA C C 5.324 -1.755 -0.629 1.00 . A A . 27 ALA C 1 1 9 4249 1 1 27 ALA CA C 4.925 -3.038 0.096 1.00 . A A . 27 ALA CA 1 1 9 4250 1 1 27 ALA CB C 4.181 -3.958 -0.867 1.00 . A A . 27 ALA CB 1 1 9 4251 1 1 27 ALA H H 2.983 -2.883 1.017 1.00 . A A . 27 ALA H 1 1 9 4252 1 1 27 ALA HA H 5.792 -3.537 0.489 1.00 . A A . 27 ALA HA 1 1 9 4253 1 1 27 ALA HB1 H 4.833 -4.758 -1.177 1.00 . A A . 27 ALA HB1 1 1 9 4254 1 1 27 ALA HB2 H 3.866 -3.392 -1.733 1.00 . A A . 27 ALA HB2 1 1 9 4255 1 1 27 ALA HB3 H 3.313 -4.369 -0.372 1.00 . A A . 27 ALA HB3 1 1 9 4256 1 1 27 ALA N N 3.940 -2.749 1.181 1.00 . A A . 27 ALA N 1 1 9 4257 1 1 27 ALA O O 6.481 -1.525 -0.920 1.00 . A A . 27 ALA O 1 1 9 4258 1 1 28 CYS C C 5.184 0.035 -3.063 1.00 . A A . 28 CYS C 1 1 9 4259 1 1 28 CYS CA C 4.657 0.334 -1.658 1.00 . A A . 28 CYS CA 1 1 9 4260 1 1 28 CYS CB C 5.708 1.059 -0.812 1.00 . A A . 28 CYS CB 1 1 9 4261 1 1 28 CYS H H 3.441 -1.159 -0.699 1.00 . A A . 28 CYS H 1 1 9 4262 1 1 28 CYS HA H 3.770 0.929 -1.723 1.00 . A A . 28 CYS HA 1 1 9 4263 1 1 28 CYS HB2 H 6.171 0.362 -0.131 1.00 . A A . 28 CYS HB2 1 1 9 4264 1 1 28 CYS HB3 H 6.460 1.485 -1.459 1.00 . A A . 28 CYS HB3 1 1 9 4265 1 1 28 CYS N N 4.365 -0.934 -0.936 1.00 . A A . 28 CYS N 1 1 9 4266 1 1 28 CYS O O 6.171 -0.650 -3.239 1.00 . A A . 28 CYS O 1 1 9 4267 1 1 28 CYS SG S 4.906 2.379 0.134 1.00 . A A . 28 CYS SG 1 1 9 4268 1 1 29 THR C C 6.342 0.913 -5.712 1.00 . A A . 29 THR C 1 1 9 4269 1 1 29 THR CA C 4.966 0.291 -5.470 1.00 . A A . 29 THR CA 1 1 9 4270 1 1 29 THR CB C 3.917 0.970 -6.356 1.00 . A A . 29 THR CB 1 1 9 4271 1 1 29 THR CG2 C 2.514 0.672 -5.825 1.00 . A A . 29 THR CG2 1 1 9 4272 1 1 29 THR H H 3.720 1.089 -3.896 1.00 . A A . 29 THR H 1 1 9 4273 1 1 29 THR HA H 4.988 -0.767 -5.673 1.00 . A A . 29 THR HA 1 1 9 4274 1 1 29 THR HB H 4.002 0.594 -7.364 1.00 . A A . 29 THR HB 1 1 9 4275 1 1 29 THR HG1 H 4.621 2.597 -7.153 1.00 . A A . 29 THR HG1 1 1 9 4276 1 1 29 THR HG21 H 1.874 0.378 -6.642 1.00 . A A . 29 THR HG21 1 1 9 4277 1 1 29 THR HG22 H 2.112 1.557 -5.354 1.00 . A A . 29 THR HG22 1 1 9 4278 1 1 29 THR HG23 H 2.565 -0.128 -5.101 1.00 . A A . 29 THR HG23 1 1 9 4279 1 1 29 THR N N 4.519 0.544 -4.067 1.00 . A A . 29 THR N 1 1 9 4280 1 1 29 THR O O 7.126 0.419 -6.497 1.00 . A A . 29 THR O 1 1 9 4281 1 1 29 THR OG1 O 4.138 2.374 -6.355 1.00 . A A . 29 THR OG1 1 1 9 4282 1 1 30 LEU C C 8.121 3.052 -6.724 1.00 . A A . 30 LEU C 1 1 9 4283 1 1 30 LEU CA C 7.959 2.657 -5.255 1.00 . A A . 30 LEU CA 1 1 9 4284 1 1 30 LEU CB C 8.997 1.603 -4.865 1.00 . A A . 30 LEU CB 1 1 9 4285 1 1 30 LEU CD1 C 9.422 -0.264 -3.259 1.00 . A A . 30 LEU CD1 1 1 9 4286 1 1 30 LEU CD2 C 9.090 2.063 -2.412 1.00 . A A . 30 LEU CD2 1 1 9 4287 1 1 30 LEU CG C 8.668 1.049 -3.478 1.00 . A A . 30 LEU CG 1 1 9 4288 1 1 30 LEU H H 5.988 2.386 -4.430 1.00 . A A . 30 LEU H 1 1 9 4289 1 1 30 LEU HA H 8.053 3.522 -4.617 1.00 . A A . 30 LEU HA 1 1 9 4290 1 1 30 LEU HB2 H 8.983 0.799 -5.587 1.00 . A A . 30 LEU HB2 1 1 9 4291 1 1 30 LEU HB3 H 9.978 2.052 -4.847 1.00 . A A . 30 LEU HB3 1 1 9 4292 1 1 30 LEU HD11 H 8.935 -0.834 -2.482 1.00 . A A . 30 LEU HD11 1 1 9 4293 1 1 30 LEU HD12 H 10.440 -0.050 -2.964 1.00 . A A . 30 LEU HD12 1 1 9 4294 1 1 30 LEU HD13 H 9.425 -0.835 -4.175 1.00 . A A . 30 LEU HD13 1 1 9 4295 1 1 30 LEU HD21 H 8.897 1.655 -1.431 1.00 . A A . 30 LEU HD21 1 1 9 4296 1 1 30 LEU HD22 H 8.526 2.976 -2.540 1.00 . A A . 30 LEU HD22 1 1 9 4297 1 1 30 LEU HD23 H 10.144 2.274 -2.513 1.00 . A A . 30 LEU HD23 1 1 9 4298 1 1 30 LEU HG H 7.605 0.869 -3.406 1.00 . A A . 30 LEU HG 1 1 9 4299 1 1 30 LEU N N 6.637 1.999 -5.052 1.00 . A A . 30 LEU N 1 1 9 4300 1 1 30 LEU O O 7.183 3.483 -7.365 1.00 . A A . 30 LEU O 1 1 9 4301 1 1 31 LYS C C 9.133 4.748 -8.923 1.00 . A A . 31 LYS C 1 1 9 4302 1 1 31 LYS CA C 9.512 3.274 -8.695 1.00 . A A . 31 LYS CA 1 1 9 4303 1 1 31 LYS CB C 8.599 2.299 -9.471 1.00 . A A . 31 LYS CB 1 1 9 4304 1 1 31 LYS CD C 6.557 2.101 -10.908 1.00 . A A . 31 LYS CD 1 1 9 4305 1 1 31 LYS CE C 5.394 2.154 -9.915 1.00 . A A . 31 LYS CE 1 1 9 4306 1 1 31 LYS CG C 7.668 3.044 -10.441 1.00 . A A . 31 LYS CG 1 1 9 4307 1 1 31 LYS H H 10.044 2.557 -6.734 1.00 . A A . 31 LYS H 1 1 9 4308 1 1 31 LYS HA H 10.542 3.108 -8.972 1.00 . A A . 31 LYS HA 1 1 9 4309 1 1 31 LYS HB2 H 9.216 1.613 -10.031 1.00 . A A . 31 LYS HB2 1 1 9 4310 1 1 31 LYS HB3 H 8.001 1.739 -8.766 1.00 . A A . 31 LYS HB3 1 1 9 4311 1 1 31 LYS HD2 H 6.213 2.407 -11.885 1.00 . A A . 31 LYS HD2 1 1 9 4312 1 1 31 LYS HD3 H 6.939 1.092 -10.959 1.00 . A A . 31 LYS HD3 1 1 9 4313 1 1 31 LYS HE2 H 4.983 1.165 -9.767 1.00 . A A . 31 LYS HE2 1 1 9 4314 1 1 31 LYS HE3 H 5.719 2.572 -8.976 1.00 . A A . 31 LYS HE3 1 1 9 4315 1 1 31 LYS HG2 H 7.229 3.894 -9.940 1.00 . A A . 31 LYS HG2 1 1 9 4316 1 1 31 LYS HG3 H 8.235 3.381 -11.296 1.00 . A A . 31 LYS HG3 1 1 9 4317 1 1 31 LYS HZ1 H 4.848 3.926 -10.861 1.00 . A A . 31 LYS HZ1 1 1 9 4318 1 1 31 LYS HZ2 H 3.640 3.274 -9.861 1.00 . A A . 31 LYS HZ2 1 1 9 4319 1 1 31 LYS HZ3 H 3.966 2.571 -11.372 1.00 . A A . 31 LYS HZ3 1 1 9 4320 1 1 31 LYS N N 9.300 2.909 -7.265 1.00 . A A . 31 LYS N 1 1 9 4321 1 1 31 LYS NZ N 4.386 3.049 -10.550 1.00 . A A . 31 LYS NZ 1 1 9 4322 1 1 31 LYS O O 8.983 5.195 -10.044 1.00 . A A . 31 LYS O 1 1 9 4323 1 1 32 ALA C C 9.242 7.782 -6.918 1.00 . A A . 32 ALA C 1 1 9 4324 1 1 32 ALA CA C 8.616 6.942 -8.034 1.00 . A A . 32 ALA CA 1 1 9 4325 1 1 32 ALA CB C 7.091 6.974 -7.933 1.00 . A A . 32 ALA CB 1 1 9 4326 1 1 32 ALA H H 9.112 5.134 -6.973 1.00 . A A . 32 ALA H 1 1 9 4327 1 1 32 ALA HA H 8.928 7.303 -9.000 1.00 . A A . 32 ALA HA 1 1 9 4328 1 1 32 ALA HB1 H 6.798 6.942 -6.894 1.00 . A A . 32 ALA HB1 1 1 9 4329 1 1 32 ALA HB2 H 6.678 6.121 -8.450 1.00 . A A . 32 ALA HB2 1 1 9 4330 1 1 32 ALA HB3 H 6.719 7.883 -8.383 1.00 . A A . 32 ALA HB3 1 1 9 4331 1 1 32 ALA N N 8.983 5.506 -7.870 1.00 . A A . 32 ALA N 1 1 9 4332 1 1 32 ALA O O 10.088 7.320 -6.178 1.00 . A A . 32 ALA O 1 1 9 4333 1 1 33 CYS C C 10.898 10.089 -5.953 1.00 . A A . 33 CYS C 1 1 9 4334 1 1 33 CYS CA C 9.397 9.885 -5.725 1.00 . A A . 33 CYS CA 1 1 9 4335 1 1 33 CYS CB C 9.152 9.125 -4.421 1.00 . A A . 33 CYS CB 1 1 9 4336 1 1 33 CYS H H 8.145 9.363 -7.399 1.00 . A A . 33 CYS H 1 1 9 4337 1 1 33 CYS HA H 8.884 10.832 -5.702 1.00 . A A . 33 CYS HA 1 1 9 4338 1 1 33 CYS HB2 H 8.569 8.238 -4.626 1.00 . A A . 33 CYS HB2 1 1 9 4339 1 1 33 CYS HB3 H 10.100 8.842 -3.987 1.00 . A A . 33 CYS HB3 1 1 9 4340 1 1 33 CYS N N 8.829 9.012 -6.792 1.00 . A A . 33 CYS N 1 1 9 4341 1 1 33 CYS O O 11.628 9.141 -6.167 1.00 . A A . 33 CYS O 1 1 9 4342 1 1 33 CYS SG S 8.251 10.186 -3.264 1.00 . A A . 33 CYS SG 1 1 9 4343 1 1 34 PRO C C 13.573 11.224 -4.898 1.00 . A A . 34 PRO C 1 1 9 4344 1 1 34 PRO CA C 12.738 11.666 -6.103 1.00 . A A . 34 PRO CA 1 1 9 4345 1 1 34 PRO CB C 12.729 13.187 -6.229 1.00 . A A . 34 PRO CB 1 1 9 4346 1 1 34 PRO CD C 10.487 12.517 -5.646 1.00 . A A . 34 PRO CD 1 1 9 4347 1 1 34 PRO CG C 11.496 13.627 -5.508 1.00 . A A . 34 PRO CG 1 1 9 4348 1 1 34 PRO HA H 13.111 11.221 -7.008 1.00 . A A . 34 PRO HA 1 1 9 4349 1 1 34 PRO HB2 H 13.611 13.605 -5.763 1.00 . A A . 34 PRO HB2 1 1 9 4350 1 1 34 PRO HB3 H 12.676 13.478 -7.266 1.00 . A A . 34 PRO HB3 1 1 9 4351 1 1 34 PRO HD2 H 9.921 12.405 -4.731 1.00 . A A . 34 PRO HD2 1 1 9 4352 1 1 34 PRO HD3 H 9.832 12.701 -6.484 1.00 . A A . 34 PRO HD3 1 1 9 4353 1 1 34 PRO HG2 H 11.720 13.798 -4.464 1.00 . A A . 34 PRO HG2 1 1 9 4354 1 1 34 PRO HG3 H 11.107 14.529 -5.956 1.00 . A A . 34 PRO HG3 1 1 9 4355 1 1 34 PRO N N 11.307 11.327 -5.899 1.00 . A A . 34 PRO N 1 1 9 4356 1 1 34 PRO O O 14.716 10.835 -5.031 1.00 . A A . 34 PRO O 1 1 9 4357 1 1 35 GLN C C 12.920 9.939 -1.641 1.00 . A A . 35 GLN C 1 1 9 4358 1 1 35 GLN CA C 13.773 10.865 -2.514 1.00 . A A . 35 GLN CA 1 1 9 4359 1 1 35 GLN CB C 14.082 12.167 -1.772 1.00 . A A . 35 GLN CB 1 1 9 4360 1 1 35 GLN CD C 12.189 12.200 -0.140 1.00 . A A . 35 GLN CD 1 1 9 4361 1 1 35 GLN CG C 12.775 12.864 -1.388 1.00 . A A . 35 GLN CG 1 1 9 4362 1 1 35 GLN H H 12.087 11.597 -3.642 1.00 . A A . 35 GLN H 1 1 9 4363 1 1 35 GLN HA H 14.692 10.376 -2.796 1.00 . A A . 35 GLN HA 1 1 9 4364 1 1 35 GLN HB2 H 14.649 11.945 -0.879 1.00 . A A . 35 GLN HB2 1 1 9 4365 1 1 35 GLN HB3 H 14.658 12.817 -2.413 1.00 . A A . 35 GLN HB3 1 1 9 4366 1 1 35 GLN HE21 H 10.429 11.837 -0.986 1.00 . A A . 35 GLN HE21 1 1 9 4367 1 1 35 GLN HE22 H 10.580 11.322 0.624 1.00 . A A . 35 GLN HE22 1 1 9 4368 1 1 35 GLN HG2 H 12.970 13.906 -1.183 1.00 . A A . 35 GLN HG2 1 1 9 4369 1 1 35 GLN HG3 H 12.070 12.782 -2.201 1.00 . A A . 35 GLN HG3 1 1 9 4370 1 1 35 GLN N N 13.011 11.281 -3.725 1.00 . A A . 35 GLN N 1 1 9 4371 1 1 35 GLN NE2 N 10.964 11.749 -0.169 1.00 . A A . 35 GLN NE2 1 1 9 4372 1 1 35 GLN O O 13.220 9.826 -0.465 1.00 . A A . 35 GLN O 1 1 9 4373 1 1 35 GLN OXT O 11.984 9.359 -2.166 1.00 . A A . 35 GLN OXT 1 1 9 4374 1 1 35 GLN OE1 O 12.853 12.088 0.872 1.00 . A A . 35 GLN OE1 1 1 10 4375 1 1 1 GLU C C 3.037 3.550 8.887 1.00 . A A . 1 GLU C 1 1 10 4376 1 1 1 GLU CA C 4.120 4.321 9.647 1.00 . A A . 1 GLU CA 1 1 10 4377 1 1 1 GLU CB C 5.467 3.607 9.533 1.00 . A A . 1 GLU CB 1 1 10 4378 1 1 1 GLU CD C 6.444 3.950 7.257 1.00 . A A . 1 GLU CD 1 1 10 4379 1 1 1 GLU CG C 6.426 4.460 8.699 1.00 . A A . 1 GLU CG 1 1 10 4380 1 1 1 GLU H1 H 4.255 3.522 11.568 1.00 . A A . 1 GLU H1 1 1 10 4381 1 1 1 GLU H2 H 2.780 4.299 11.243 1.00 . A A . 1 GLU H2 1 1 10 4382 1 1 1 GLU H3 H 4.182 5.216 11.528 1.00 . A A . 1 GLU H3 1 1 10 4383 1 1 1 GLU HA H 4.202 5.326 9.267 1.00 . A A . 1 GLU HA 1 1 10 4384 1 1 1 GLU HB2 H 5.882 3.460 10.521 1.00 . A A . 1 GLU HB2 1 1 10 4385 1 1 1 GLU HB3 H 5.329 2.651 9.053 1.00 . A A . 1 GLU HB3 1 1 10 4386 1 1 1 GLU HG2 H 6.098 5.489 8.713 1.00 . A A . 1 GLU HG2 1 1 10 4387 1 1 1 GLU HG3 H 7.421 4.394 9.114 1.00 . A A . 1 GLU HG3 1 1 10 4388 1 1 1 GLU N N 3.811 4.341 11.107 1.00 . A A . 1 GLU N 1 1 10 4389 1 1 1 GLU O O 2.232 4.127 8.183 1.00 . A A . 1 GLU O 1 1 10 4390 1 1 1 GLU OE1 O 5.399 3.977 6.627 1.00 . A A . 1 GLU OE1 1 1 10 4391 1 1 1 GLU OE2 O 7.501 3.540 6.807 1.00 . A A . 1 GLU OE2 1 1 10 4392 1 1 2 VAL C C 0.720 1.305 9.178 1.00 . A A . 2 VAL C 1 1 10 4393 1 1 2 VAL CA C 1.969 1.458 8.304 1.00 . A A . 2 VAL CA 1 1 10 4394 1 1 2 VAL CB C 2.618 0.099 8.032 1.00 . A A . 2 VAL CB 1 1 10 4395 1 1 2 VAL CG1 C 1.649 -0.779 7.239 1.00 . A A . 2 VAL CG1 1 1 10 4396 1 1 2 VAL CG2 C 3.897 0.302 7.219 1.00 . A A . 2 VAL CG2 1 1 10 4397 1 1 2 VAL H H 3.663 1.801 9.594 1.00 . A A . 2 VAL H 1 1 10 4398 1 1 2 VAL HA H 1.715 1.933 7.371 1.00 . A A . 2 VAL HA 1 1 10 4399 1 1 2 VAL HB H 2.859 -0.382 8.968 1.00 . A A . 2 VAL HB 1 1 10 4400 1 1 2 VAL HG11 H 2.210 -1.468 6.624 1.00 . A A . 2 VAL HG11 1 1 10 4401 1 1 2 VAL HG12 H 1.032 -0.156 6.608 1.00 . A A . 2 VAL HG12 1 1 10 4402 1 1 2 VAL HG13 H 1.024 -1.333 7.922 1.00 . A A . 2 VAL HG13 1 1 10 4403 1 1 2 VAL HG21 H 4.755 0.091 7.840 1.00 . A A . 2 VAL HG21 1 1 10 4404 1 1 2 VAL HG22 H 3.944 1.323 6.871 1.00 . A A . 2 VAL HG22 1 1 10 4405 1 1 2 VAL HG23 H 3.894 -0.368 6.371 1.00 . A A . 2 VAL HG23 1 1 10 4406 1 1 2 VAL N N 3.006 2.252 9.022 1.00 . A A . 2 VAL N 1 1 10 4407 1 1 2 VAL O O -0.231 2.048 9.042 1.00 . A A . 2 VAL O 1 1 10 4408 1 1 3 THR C C -1.749 0.380 10.190 1.00 . A A . 3 THR C 1 1 10 4409 1 1 3 THR CA C -0.455 0.150 10.972 1.00 . A A . 3 THR CA 1 1 10 4410 1 1 3 THR CB C -0.315 1.175 12.108 1.00 . A A . 3 THR CB 1 1 10 4411 1 1 3 THR CG2 C 1.128 1.687 12.217 1.00 . A A . 3 THR CG2 1 1 10 4412 1 1 3 THR H H 1.499 -0.220 10.174 1.00 . A A . 3 THR H 1 1 10 4413 1 1 3 THR HA H -0.440 -0.849 11.379 1.00 . A A . 3 THR HA 1 1 10 4414 1 1 3 THR HB H -0.584 0.701 13.034 1.00 . A A . 3 THR HB 1 1 10 4415 1 1 3 THR HG1 H -1.674 2.444 12.676 1.00 . A A . 3 THR HG1 1 1 10 4416 1 1 3 THR HG21 H 1.800 0.848 12.323 1.00 . A A . 3 THR HG21 1 1 10 4417 1 1 3 THR HG22 H 1.217 2.330 13.080 1.00 . A A . 3 THR HG22 1 1 10 4418 1 1 3 THR HG23 H 1.381 2.242 11.326 1.00 . A A . 3 THR HG23 1 1 10 4419 1 1 3 THR N N 0.722 0.356 10.078 1.00 . A A . 3 THR N 1 1 10 4420 1 1 3 THR O O -2.691 0.974 10.676 1.00 . A A . 3 THR O 1 1 10 4421 1 1 3 THR OG1 O -1.184 2.271 11.868 1.00 . A A . 3 THR OG1 1 1 10 4422 1 1 4 CYS C C -3.877 -1.149 8.135 1.00 . A A . 4 CYS C 1 1 10 4423 1 1 4 CYS CA C -3.007 0.112 8.136 1.00 . A A . 4 CYS CA 1 1 10 4424 1 1 4 CYS CB C -2.468 0.398 6.732 1.00 . A A . 4 CYS CB 1 1 10 4425 1 1 4 CYS H H -1.013 -0.550 8.607 1.00 . A A . 4 CYS H 1 1 10 4426 1 1 4 CYS HA H -3.575 0.959 8.490 1.00 . A A . 4 CYS HA 1 1 10 4427 1 1 4 CYS HB2 H -3.294 0.496 6.042 1.00 . A A . 4 CYS HB2 1 1 10 4428 1 1 4 CYS HB3 H -1.901 1.319 6.751 1.00 . A A . 4 CYS HB3 1 1 10 4429 1 1 4 CYS N N -1.790 -0.082 8.974 1.00 . A A . 4 CYS N 1 1 10 4430 1 1 4 CYS O O -3.520 -2.164 8.700 1.00 . A A . 4 CYS O 1 1 10 4431 1 1 4 CYS SG S -1.387 -0.956 6.190 1.00 . A A . 4 CYS SG 1 1 10 4432 1 1 5 GLU C C -5.522 -3.165 6.243 1.00 . A A . 5 GLU C 1 1 10 4433 1 1 5 GLU CA C -5.911 -2.283 7.434 1.00 . A A . 5 GLU CA 1 1 10 4434 1 1 5 GLU CB C -7.316 -1.705 7.245 1.00 . A A . 5 GLU CB 1 1 10 4435 1 1 5 GLU CD C -9.529 -2.533 6.436 1.00 . A A . 5 GLU CD 1 1 10 4436 1 1 5 GLU CG C -8.354 -2.821 7.372 1.00 . A A . 5 GLU CG 1 1 10 4437 1 1 5 GLU H H -5.273 -0.263 7.038 1.00 . A A . 5 GLU H 1 1 10 4438 1 1 5 GLU HA H -5.860 -2.843 8.354 1.00 . A A . 5 GLU HA 1 1 10 4439 1 1 5 GLU HB2 H -7.500 -0.955 8.000 1.00 . A A . 5 GLU HB2 1 1 10 4440 1 1 5 GLU HB3 H -7.392 -1.256 6.265 1.00 . A A . 5 GLU HB3 1 1 10 4441 1 1 5 GLU HG2 H -7.903 -3.766 7.104 1.00 . A A . 5 GLU HG2 1 1 10 4442 1 1 5 GLU HG3 H -8.711 -2.868 8.390 1.00 . A A . 5 GLU HG3 1 1 10 4443 1 1 5 GLU N N -5.013 -1.091 7.491 1.00 . A A . 5 GLU N 1 1 10 4444 1 1 5 GLU O O -5.270 -2.670 5.163 1.00 . A A . 5 GLU O 1 1 10 4445 1 1 5 GLU OE1 O -10.037 -1.425 6.480 1.00 . A A . 5 GLU OE1 1 1 10 4446 1 1 5 GLU OE2 O -9.900 -3.424 5.690 1.00 . A A . 5 GLU OE2 1 1 10 4447 1 1 6 PRO C C -6.169 -5.434 4.312 1.00 . A A . 6 PRO C 1 1 10 4448 1 1 6 PRO CA C -5.109 -5.412 5.416 1.00 . A A . 6 PRO CA 1 1 10 4449 1 1 6 PRO CB C -5.038 -6.749 6.152 1.00 . A A . 6 PRO CB 1 1 10 4450 1 1 6 PRO CD C -5.791 -5.121 7.748 1.00 . A A . 6 PRO CD 1 1 10 4451 1 1 6 PRO CG C -5.912 -6.569 7.349 1.00 . A A . 6 PRO CG 1 1 10 4452 1 1 6 PRO HA H -4.142 -5.166 5.007 1.00 . A A . 6 PRO HA 1 1 10 4453 1 1 6 PRO HB2 H -5.415 -7.545 5.524 1.00 . A A . 6 PRO HB2 1 1 10 4454 1 1 6 PRO HB3 H -4.026 -6.958 6.461 1.00 . A A . 6 PRO HB3 1 1 10 4455 1 1 6 PRO HD2 H -6.725 -4.761 8.158 1.00 . A A . 6 PRO HD2 1 1 10 4456 1 1 6 PRO HD3 H -4.983 -4.985 8.449 1.00 . A A . 6 PRO HD3 1 1 10 4457 1 1 6 PRO HG2 H -6.939 -6.804 7.098 1.00 . A A . 6 PRO HG2 1 1 10 4458 1 1 6 PRO HG3 H -5.572 -7.200 8.156 1.00 . A A . 6 PRO HG3 1 1 10 4459 1 1 6 PRO N N -5.484 -4.448 6.482 1.00 . A A . 6 PRO N 1 1 10 4460 1 1 6 PRO O O -7.354 -5.458 4.573 1.00 . A A . 6 PRO O 1 1 10 4461 1 1 7 GLY C C -7.309 -4.020 1.791 1.00 . A A . 7 GLY C 1 1 10 4462 1 1 7 GLY CA C -6.720 -5.422 1.952 1.00 . A A . 7 GLY CA 1 1 10 4463 1 1 7 GLY H H -4.783 -5.388 2.890 1.00 . A A . 7 GLY H 1 1 10 4464 1 1 7 GLY HA2 H -6.218 -5.713 1.039 1.00 . A A . 7 GLY HA2 1 1 10 4465 1 1 7 GLY HA3 H -7.516 -6.121 2.168 1.00 . A A . 7 GLY HA3 1 1 10 4466 1 1 7 GLY N N -5.745 -5.415 3.077 1.00 . A A . 7 GLY N 1 1 10 4467 1 1 7 GLY O O -8.508 -3.831 1.842 1.00 . A A . 7 GLY O 1 1 10 4468 1 1 8 THR C C -5.942 -0.725 0.817 1.00 . A A . 8 THR C 1 1 10 4469 1 1 8 THR CA C -6.995 -1.641 1.452 1.00 . A A . 8 THR CA 1 1 10 4470 1 1 8 THR CB C -7.306 -1.182 2.876 1.00 . A A . 8 THR CB 1 1 10 4471 1 1 8 THR CG2 C -7.727 0.288 2.861 1.00 . A A . 8 THR CG2 1 1 10 4472 1 1 8 THR H H -5.511 -3.204 1.573 1.00 . A A . 8 THR H 1 1 10 4473 1 1 8 THR HA H -7.895 -1.641 0.863 1.00 . A A . 8 THR HA 1 1 10 4474 1 1 8 THR HB H -6.425 -1.292 3.491 1.00 . A A . 8 THR HB 1 1 10 4475 1 1 8 THR HG1 H -8.003 -2.487 4.138 1.00 . A A . 8 THR HG1 1 1 10 4476 1 1 8 THR HG21 H -8.321 0.484 1.980 1.00 . A A . 8 THR HG21 1 1 10 4477 1 1 8 THR HG22 H -6.846 0.915 2.849 1.00 . A A . 8 THR HG22 1 1 10 4478 1 1 8 THR HG23 H -8.310 0.505 3.744 1.00 . A A . 8 THR HG23 1 1 10 4479 1 1 8 THR N N -6.474 -3.032 1.605 1.00 . A A . 8 THR N 1 1 10 4480 1 1 8 THR O O -6.272 0.196 0.099 1.00 . A A . 8 THR O 1 1 10 4481 1 1 8 THR OG1 O -8.358 -1.974 3.409 1.00 . A A . 8 THR OG1 1 1 10 4482 1 1 9 THR C C -3.982 1.375 0.610 1.00 . A A . 9 THR C 1 1 10 4483 1 1 9 THR CA C -3.600 -0.107 0.519 1.00 . A A . 9 THR CA 1 1 10 4484 1 1 9 THR CB C -3.440 -0.556 -0.941 1.00 . A A . 9 THR CB 1 1 10 4485 1 1 9 THR CG2 C -4.593 -0.027 -1.797 1.00 . A A . 9 THR CG2 1 1 10 4486 1 1 9 THR H H -4.452 -1.708 1.681 1.00 . A A . 9 THR H 1 1 10 4487 1 1 9 THR HA H -2.679 -0.279 1.052 1.00 . A A . 9 THR HA 1 1 10 4488 1 1 9 THR HB H -3.433 -1.635 -0.983 1.00 . A A . 9 THR HB 1 1 10 4489 1 1 9 THR HG1 H -1.798 -0.756 -1.965 1.00 . A A . 9 THR HG1 1 1 10 4490 1 1 9 THR HG21 H -4.315 -0.070 -2.839 1.00 . A A . 9 THR HG21 1 1 10 4491 1 1 9 THR HG22 H -4.808 0.996 -1.525 1.00 . A A . 9 THR HG22 1 1 10 4492 1 1 9 THR HG23 H -5.470 -0.636 -1.635 1.00 . A A . 9 THR HG23 1 1 10 4493 1 1 9 THR N N -4.685 -0.966 1.090 1.00 . A A . 9 THR N 1 1 10 4494 1 1 9 THR O O -4.980 1.730 1.205 1.00 . A A . 9 THR O 1 1 10 4495 1 1 9 THR OG1 O -2.211 -0.058 -1.450 1.00 . A A . 9 THR OG1 1 1 10 4496 1 1 10 PHE C C -2.358 4.528 -0.476 1.00 . A A . 10 PHE C 1 1 10 4497 1 1 10 PHE CA C -3.510 3.701 0.104 1.00 . A A . 10 PHE CA 1 1 10 4498 1 1 10 PHE CB C -3.667 4.007 1.595 1.00 . A A . 10 PHE CB 1 1 10 4499 1 1 10 PHE CD1 C -1.254 3.944 2.324 1.00 . A A . 10 PHE CD1 1 1 10 4500 1 1 10 PHE CD2 C -2.750 2.204 3.103 1.00 . A A . 10 PHE CD2 1 1 10 4501 1 1 10 PHE CE1 C -0.199 3.354 3.031 1.00 . A A . 10 PHE CE1 1 1 10 4502 1 1 10 PHE CE2 C -1.695 1.613 3.810 1.00 . A A . 10 PHE CE2 1 1 10 4503 1 1 10 PHE CG C -2.530 3.370 2.361 1.00 . A A . 10 PHE CG 1 1 10 4504 1 1 10 PHE CZ C -0.418 2.188 3.773 1.00 . A A . 10 PHE CZ 1 1 10 4505 1 1 10 PHE H H -2.386 1.938 -0.431 1.00 . A A . 10 PHE H 1 1 10 4506 1 1 10 PHE HA H -4.429 3.913 -0.417 1.00 . A A . 10 PHE HA 1 1 10 4507 1 1 10 PHE HB2 H -3.647 5.076 1.744 1.00 . A A . 10 PHE HB2 1 1 10 4508 1 1 10 PHE HB3 H -4.606 3.613 1.951 1.00 . A A . 10 PHE HB3 1 1 10 4509 1 1 10 PHE HD1 H -1.084 4.845 1.751 1.00 . A A . 10 PHE HD1 1 1 10 4510 1 1 10 PHE HD2 H -3.734 1.760 3.133 1.00 . A A . 10 PHE HD2 1 1 10 4511 1 1 10 PHE HE1 H 0.786 3.798 3.002 1.00 . A A . 10 PHE HE1 1 1 10 4512 1 1 10 PHE HE2 H -1.865 0.714 4.382 1.00 . A A . 10 PHE HE2 1 1 10 4513 1 1 10 PHE HZ H 0.396 1.732 4.318 1.00 . A A . 10 PHE HZ 1 1 10 4514 1 1 10 PHE N N -3.192 2.242 0.036 1.00 . A A . 10 PHE N 1 1 10 4515 1 1 10 PHE O O -1.342 4.000 -0.880 1.00 . A A . 10 PHE O 1 1 10 4516 1 1 11 LYS C C -0.531 7.156 0.120 1.00 . A A . 11 LYS C 1 1 10 4517 1 1 11 LYS CA C -1.426 6.698 -1.034 1.00 . A A . 11 LYS CA 1 1 10 4518 1 1 11 LYS CB C -2.148 7.889 -1.662 1.00 . A A . 11 LYS CB 1 1 10 4519 1 1 11 LYS CD C -2.732 9.017 -3.814 1.00 . A A . 11 LYS CD 1 1 10 4520 1 1 11 LYS CE C -1.717 10.157 -3.896 1.00 . A A . 11 LYS CE 1 1 10 4521 1 1 11 LYS CG C -2.071 7.788 -3.187 1.00 . A A . 11 LYS CG 1 1 10 4522 1 1 11 LYS H H -3.335 6.225 -0.157 1.00 . A A . 11 LYS H 1 1 10 4523 1 1 11 LYS HA H -0.848 6.175 -1.779 1.00 . A A . 11 LYS HA 1 1 10 4524 1 1 11 LYS HB2 H -3.183 7.887 -1.352 1.00 . A A . 11 LYS HB2 1 1 10 4525 1 1 11 LYS HB3 H -1.678 8.807 -1.340 1.00 . A A . 11 LYS HB3 1 1 10 4526 1 1 11 LYS HD2 H -3.080 8.770 -4.807 1.00 . A A . 11 LYS HD2 1 1 10 4527 1 1 11 LYS HD3 H -3.569 9.326 -3.206 1.00 . A A . 11 LYS HD3 1 1 10 4528 1 1 11 LYS HE2 H -2.093 11.032 -3.386 1.00 . A A . 11 LYS HE2 1 1 10 4529 1 1 11 LYS HE3 H -0.772 9.850 -3.473 1.00 . A A . 11 LYS HE3 1 1 10 4530 1 1 11 LYS HG2 H -1.035 7.741 -3.491 1.00 . A A . 11 LYS HG2 1 1 10 4531 1 1 11 LYS HG3 H -2.584 6.898 -3.515 1.00 . A A . 11 LYS HG3 1 1 10 4532 1 1 11 LYS HZ1 H -1.134 9.599 -5.815 1.00 . A A . 11 LYS HZ1 1 1 10 4533 1 1 11 LYS HZ2 H -0.946 11.255 -5.487 1.00 . A A . 11 LYS HZ2 1 1 10 4534 1 1 11 LYS HZ3 H -2.491 10.613 -5.772 1.00 . A A . 11 LYS HZ3 1 1 10 4535 1 1 11 LYS N N -2.510 5.824 -0.501 1.00 . A A . 11 LYS N 1 1 10 4536 1 1 11 LYS NZ N -1.560 10.426 -5.353 1.00 . A A . 11 LYS NZ 1 1 10 4537 1 1 11 LYS O O -1.008 7.527 1.174 1.00 . A A . 11 LYS O 1 1 10 4538 1 1 12 ASP C C 2.768 8.472 0.531 1.00 . A A . 12 ASP C 1 1 10 4539 1 1 12 ASP CA C 1.668 7.547 1.048 1.00 . A A . 12 ASP CA 1 1 10 4540 1 1 12 ASP CB C 2.272 6.246 1.582 1.00 . A A . 12 ASP CB 1 1 10 4541 1 1 12 ASP CG C 2.920 6.505 2.944 1.00 . A A . 12 ASP CG 1 1 10 4542 1 1 12 ASP H H 1.134 6.811 -0.910 1.00 . A A . 12 ASP H 1 1 10 4543 1 1 12 ASP HA H 1.107 8.033 1.824 1.00 . A A . 12 ASP HA 1 1 10 4544 1 1 12 ASP HB2 H 1.491 5.504 1.689 1.00 . A A . 12 ASP HB2 1 1 10 4545 1 1 12 ASP HB3 H 3.021 5.887 0.891 1.00 . A A . 12 ASP HB3 1 1 10 4546 1 1 12 ASP N N 0.762 7.123 -0.058 1.00 . A A . 12 ASP N 1 1 10 4547 1 1 12 ASP O O 3.035 9.512 1.099 1.00 . A A . 12 ASP O 1 1 10 4548 1 1 12 ASP OD1 O 2.238 7.023 3.812 1.00 . A A . 12 ASP OD1 1 1 10 4549 1 1 12 ASP OD2 O 4.086 6.180 3.095 1.00 . A A . 12 ASP OD2 1 1 10 4550 1 1 13 LYS C C 4.268 9.275 -2.554 1.00 . A A . 13 LYS C 1 1 10 4551 1 1 13 LYS CA C 4.506 8.961 -1.071 1.00 . A A . 13 LYS CA 1 1 10 4552 1 1 13 LYS CB C 5.781 8.141 -0.870 1.00 . A A . 13 LYS CB 1 1 10 4553 1 1 13 LYS CD C 7.411 8.107 1.025 1.00 . A A . 13 LYS CD 1 1 10 4554 1 1 13 LYS CE C 7.920 6.941 1.874 1.00 . A A . 13 LYS CE 1 1 10 4555 1 1 13 LYS CG C 5.959 7.846 0.620 1.00 . A A . 13 LYS CG 1 1 10 4556 1 1 13 LYS H H 3.192 7.254 -0.972 1.00 . A A . 13 LYS H 1 1 10 4557 1 1 13 LYS HA H 4.571 9.874 -0.503 1.00 . A A . 13 LYS HA 1 1 10 4558 1 1 13 LYS HB2 H 5.700 7.210 -1.416 1.00 . A A . 13 LYS HB2 1 1 10 4559 1 1 13 LYS HB3 H 6.631 8.701 -1.230 1.00 . A A . 13 LYS HB3 1 1 10 4560 1 1 13 LYS HD2 H 8.020 8.202 0.138 1.00 . A A . 13 LYS HD2 1 1 10 4561 1 1 13 LYS HD3 H 7.466 9.019 1.600 1.00 . A A . 13 LYS HD3 1 1 10 4562 1 1 13 LYS HE2 H 7.638 7.081 2.909 1.00 . A A . 13 LYS HE2 1 1 10 4563 1 1 13 LYS HE3 H 7.533 6.006 1.500 1.00 . A A . 13 LYS HE3 1 1 10 4564 1 1 13 LYS HG2 H 5.305 8.486 1.194 1.00 . A A . 13 LYS HG2 1 1 10 4565 1 1 13 LYS HG3 H 5.713 6.814 0.815 1.00 . A A . 13 LYS HG3 1 1 10 4566 1 1 13 LYS HZ1 H 9.729 7.961 1.744 1.00 . A A . 13 LYS HZ1 1 1 10 4567 1 1 13 LYS HZ2 H 9.670 6.533 0.825 1.00 . A A . 13 LYS HZ2 1 1 10 4568 1 1 13 LYS HZ3 H 9.840 6.454 2.513 1.00 . A A . 13 LYS HZ3 1 1 10 4569 1 1 13 LYS N N 3.416 8.101 -0.533 1.00 . A A . 13 LYS N 1 1 10 4570 1 1 13 LYS NZ N 9.401 6.976 1.728 1.00 . A A . 13 LYS NZ 1 1 10 4571 1 1 13 LYS O O 3.352 9.995 -2.898 1.00 . A A . 13 LYS O 1 1 10 4572 1 1 14 CYS C C 4.131 7.916 -5.574 1.00 . A A . 14 CYS C 1 1 10 4573 1 1 14 CYS CA C 4.890 9.054 -4.885 1.00 . A A . 14 CYS CA 1 1 10 4574 1 1 14 CYS CB C 6.303 9.171 -5.447 1.00 . A A . 14 CYS CB 1 1 10 4575 1 1 14 CYS H H 5.827 8.186 -3.152 1.00 . A A . 14 CYS H 1 1 10 4576 1 1 14 CYS HA H 4.366 9.988 -5.011 1.00 . A A . 14 CYS HA 1 1 10 4577 1 1 14 CYS HB2 H 6.258 9.471 -6.484 1.00 . A A . 14 CYS HB2 1 1 10 4578 1 1 14 CYS HB3 H 6.857 9.906 -4.880 1.00 . A A . 14 CYS HB3 1 1 10 4579 1 1 14 CYS N N 5.084 8.758 -3.437 1.00 . A A . 14 CYS N 1 1 10 4580 1 1 14 CYS O O 4.261 7.707 -6.764 1.00 . A A . 14 CYS O 1 1 10 4581 1 1 14 CYS SG S 7.130 7.567 -5.319 1.00 . A A . 14 CYS SG 1 1 10 4582 1 1 15 ASN C C 1.528 5.513 -4.508 1.00 . A A . 15 ASN C 1 1 10 4583 1 1 15 ASN CA C 2.579 6.062 -5.475 1.00 . A A . 15 ASN CA 1 1 10 4584 1 1 15 ASN CB C 3.628 4.994 -5.789 1.00 . A A . 15 ASN CB 1 1 10 4585 1 1 15 ASN CG C 3.918 4.984 -7.289 1.00 . A A . 15 ASN CG 1 1 10 4586 1 1 15 ASN H H 3.244 7.362 -3.885 1.00 . A A . 15 ASN H 1 1 10 4587 1 1 15 ASN HA H 2.112 6.395 -6.387 1.00 . A A . 15 ASN HA 1 1 10 4588 1 1 15 ASN HB2 H 4.536 5.212 -5.247 1.00 . A A . 15 ASN HB2 1 1 10 4589 1 1 15 ASN HB3 H 3.255 4.025 -5.493 1.00 . A A . 15 ASN HB3 1 1 10 4590 1 1 15 ASN HD21 H 5.238 3.505 -7.158 1.00 . A A . 15 ASN HD21 1 1 10 4591 1 1 15 ASN HD22 H 4.978 4.117 -8.730 1.00 . A A . 15 ASN HD22 1 1 10 4592 1 1 15 ASN N N 3.339 7.179 -4.844 1.00 . A A . 15 ASN N 1 1 10 4593 1 1 15 ASN ND2 N 4.783 4.132 -7.764 1.00 . A A . 15 ASN ND2 1 1 10 4594 1 1 15 ASN O O 0.390 5.938 -4.507 1.00 . A A . 15 ASN O 1 1 10 4595 1 1 15 ASN OD1 O 3.352 5.758 -8.037 1.00 . A A . 15 ASN OD1 1 1 10 4596 1 1 16 THR C C 1.563 2.818 -1.976 1.00 . A A . 16 THR C 1 1 10 4597 1 1 16 THR CA C 0.917 3.983 -2.733 1.00 . A A . 16 THR CA 1 1 10 4598 1 1 16 THR CB C -0.254 3.512 -3.616 1.00 . A A . 16 THR CB 1 1 10 4599 1 1 16 THR CG2 C -0.809 2.170 -3.121 1.00 . A A . 16 THR CG2 1 1 10 4600 1 1 16 THR H H 2.818 4.234 -3.711 1.00 . A A . 16 THR H 1 1 10 4601 1 1 16 THR HA H 0.576 4.735 -2.039 1.00 . A A . 16 THR HA 1 1 10 4602 1 1 16 THR HB H 0.092 3.396 -4.633 1.00 . A A . 16 THR HB 1 1 10 4603 1 1 16 THR HG1 H -1.819 4.384 -4.374 1.00 . A A . 16 THR HG1 1 1 10 4604 1 1 16 THR HG21 H -1.562 1.816 -3.810 1.00 . A A . 16 THR HG21 1 1 10 4605 1 1 16 THR HG22 H -1.250 2.301 -2.143 1.00 . A A . 16 THR HG22 1 1 10 4606 1 1 16 THR HG23 H -0.007 1.449 -3.061 1.00 . A A . 16 THR HG23 1 1 10 4607 1 1 16 THR N N 1.898 4.566 -3.692 1.00 . A A . 16 THR N 1 1 10 4608 1 1 16 THR O O 2.667 2.410 -2.273 1.00 . A A . 16 THR O 1 1 10 4609 1 1 16 THR OG1 O -1.286 4.486 -3.582 1.00 . A A . 16 THR OG1 1 1 10 4610 1 1 17 CYS C C 0.357 0.099 0.030 1.00 . A A . 17 CYS C 1 1 10 4611 1 1 17 CYS CA C 1.443 1.147 -0.228 1.00 . A A . 17 CYS CA 1 1 10 4612 1 1 17 CYS CB C 1.916 1.769 1.086 1.00 . A A . 17 CYS CB 1 1 10 4613 1 1 17 CYS H H -0.012 2.632 -0.786 1.00 . A A . 17 CYS H 1 1 10 4614 1 1 17 CYS HA H 2.278 0.709 -0.752 1.00 . A A . 17 CYS HA 1 1 10 4615 1 1 17 CYS HB2 H 2.053 2.833 0.952 1.00 . A A . 17 CYS HB2 1 1 10 4616 1 1 17 CYS HB3 H 1.175 1.594 1.854 1.00 . A A . 17 CYS HB3 1 1 10 4617 1 1 17 CYS N N 0.877 2.285 -1.005 1.00 . A A . 17 CYS N 1 1 10 4618 1 1 17 CYS O O -0.679 0.392 0.593 1.00 . A A . 17 CYS O 1 1 10 4619 1 1 17 CYS SG S 3.487 1.018 1.581 1.00 . A A . 17 CYS SG 1 1 10 4620 1 1 18 ARG C C -0.374 -2.679 1.292 1.00 . A A . 18 ARG C 1 1 10 4621 1 1 18 ARG CA C -0.436 -2.182 -0.155 1.00 . A A . 18 ARG CA 1 1 10 4622 1 1 18 ARG CB C -0.059 -3.301 -1.128 1.00 . A A . 18 ARG CB 1 1 10 4623 1 1 18 ARG CD C -2.257 -4.447 -0.777 1.00 . A A . 18 ARG CD 1 1 10 4624 1 1 18 ARG CG C -0.737 -4.608 -0.706 1.00 . A A . 18 ARG CG 1 1 10 4625 1 1 18 ARG CZ C -2.765 -6.809 -0.965 1.00 . A A . 18 ARG CZ 1 1 10 4626 1 1 18 ARG H H 1.427 -1.334 -0.829 1.00 . A A . 18 ARG H 1 1 10 4627 1 1 18 ARG HA H -1.422 -1.811 -0.384 1.00 . A A . 18 ARG HA 1 1 10 4628 1 1 18 ARG HB2 H -0.383 -3.035 -2.125 1.00 . A A . 18 ARG HB2 1 1 10 4629 1 1 18 ARG HB3 H 1.012 -3.437 -1.124 1.00 . A A . 18 ARG HB3 1 1 10 4630 1 1 18 ARG HD2 H -2.576 -3.613 -0.167 1.00 . A A . 18 ARG HD2 1 1 10 4631 1 1 18 ARG HD3 H -2.575 -4.311 -1.799 1.00 . A A . 18 ARG HD3 1 1 10 4632 1 1 18 ARG HE H -3.196 -5.751 0.660 1.00 . A A . 18 ARG HE 1 1 10 4633 1 1 18 ARG HG2 H -0.428 -5.404 -1.368 1.00 . A A . 18 ARG HG2 1 1 10 4634 1 1 18 ARG HG3 H -0.449 -4.852 0.306 1.00 . A A . 18 ARG HG3 1 1 10 4635 1 1 18 ARG HH11 H -3.601 -5.947 -2.567 1.00 . A A . 18 ARG HH11 1 1 10 4636 1 1 18 ARG HH12 H -3.189 -7.620 -2.745 1.00 . A A . 18 ARG HH12 1 1 10 4637 1 1 18 ARG HH21 H -1.925 -7.927 0.467 1.00 . A A . 18 ARG HH21 1 1 10 4638 1 1 18 ARG HH22 H -2.244 -8.741 -1.028 1.00 . A A . 18 ARG HH22 1 1 10 4639 1 1 18 ARG N N 0.585 -1.119 -0.377 1.00 . A A . 18 ARG N 1 1 10 4640 1 1 18 ARG NE N -2.805 -5.725 -0.239 1.00 . A A . 18 ARG NE 1 1 10 4641 1 1 18 ARG NH1 N -3.221 -6.791 -2.187 1.00 . A A . 18 ARG NH1 1 1 10 4642 1 1 18 ARG NH2 N -2.273 -7.912 -0.470 1.00 . A A . 18 ARG NH2 1 1 10 4643 1 1 18 ARG O O 0.655 -3.118 1.765 1.00 . A A . 18 ARG O 1 1 10 4644 1 1 19 CYS C C -1.453 -4.618 3.455 1.00 . A A . 19 CYS C 1 1 10 4645 1 1 19 CYS CA C -1.473 -3.086 3.413 1.00 . A A . 19 CYS CA 1 1 10 4646 1 1 19 CYS CB C -2.773 -2.546 4.010 1.00 . A A . 19 CYS CB 1 1 10 4647 1 1 19 CYS H H -2.291 -2.258 1.598 1.00 . A A . 19 CYS H 1 1 10 4648 1 1 19 CYS HA H -0.626 -2.683 3.947 1.00 . A A . 19 CYS HA 1 1 10 4649 1 1 19 CYS HB2 H -2.954 -1.548 3.637 1.00 . A A . 19 CYS HB2 1 1 10 4650 1 1 19 CYS HB3 H -3.593 -3.193 3.728 1.00 . A A . 19 CYS HB3 1 1 10 4651 1 1 19 CYS N N -1.471 -2.614 1.998 1.00 . A A . 19 CYS N 1 1 10 4652 1 1 19 CYS O O -2.391 -5.272 3.046 1.00 . A A . 19 CYS O 1 1 10 4653 1 1 19 CYS SG S -2.633 -2.503 5.815 1.00 . A A . 19 CYS SG 1 1 10 4654 1 1 20 GLY C C -1.524 -7.242 4.735 1.00 . A A . 20 GLY C 1 1 10 4655 1 1 20 GLY CA C -0.302 -6.681 4.005 1.00 . A A . 20 GLY CA 1 1 10 4656 1 1 20 GLY H H 0.360 -4.646 4.264 1.00 . A A . 20 GLY H 1 1 10 4657 1 1 20 GLY HA2 H -0.267 -7.079 3.000 1.00 . A A . 20 GLY HA2 1 1 10 4658 1 1 20 GLY HA3 H 0.594 -6.966 4.538 1.00 . A A . 20 GLY HA3 1 1 10 4659 1 1 20 GLY N N -0.388 -5.193 3.943 1.00 . A A . 20 GLY N 1 1 10 4660 1 1 20 GLY O O -2.437 -6.522 5.086 1.00 . A A . 20 GLY O 1 1 10 4661 1 1 21 SER C C -2.577 -8.939 7.181 1.00 . A A . 21 SER C 1 1 10 4662 1 1 21 SER CA C -2.706 -9.142 5.670 1.00 . A A . 21 SER CA 1 1 10 4663 1 1 21 SER CB C -2.629 -10.628 5.324 1.00 . A A . 21 SER CB 1 1 10 4664 1 1 21 SER H H -0.798 -9.089 4.671 1.00 . A A . 21 SER H 1 1 10 4665 1 1 21 SER HA H -3.632 -8.727 5.309 1.00 . A A . 21 SER HA 1 1 10 4666 1 1 21 SER HB2 H -2.026 -10.763 4.443 1.00 . A A . 21 SER HB2 1 1 10 4667 1 1 21 SER HB3 H -2.181 -11.165 6.150 1.00 . A A . 21 SER HB3 1 1 10 4668 1 1 21 SER HG H -3.929 -12.071 5.207 1.00 . A A . 21 SER HG 1 1 10 4669 1 1 21 SER N N -1.545 -8.527 4.964 1.00 . A A . 21 SER N 1 1 10 4670 1 1 21 SER O O -3.486 -9.225 7.935 1.00 . A A . 21 SER O 1 1 10 4671 1 1 21 SER OG O -3.939 -11.119 5.075 1.00 . A A . 21 SER OG 1 1 10 4672 1 1 22 ASP C C -1.452 -6.746 9.430 1.00 . A A . 22 ASP C 1 1 10 4673 1 1 22 ASP CA C -1.271 -8.228 9.093 1.00 . A A . 22 ASP CA 1 1 10 4674 1 1 22 ASP CB C 0.163 -8.674 9.382 1.00 . A A . 22 ASP CB 1 1 10 4675 1 1 22 ASP CG C 0.162 -10.144 9.803 1.00 . A A . 22 ASP CG 1 1 10 4676 1 1 22 ASP H H -0.735 -8.223 7.006 1.00 . A A . 22 ASP H 1 1 10 4677 1 1 22 ASP HA H -1.964 -8.830 9.655 1.00 . A A . 22 ASP HA 1 1 10 4678 1 1 22 ASP HB2 H 0.765 -8.555 8.490 1.00 . A A . 22 ASP HB2 1 1 10 4679 1 1 22 ASP HB3 H 0.574 -8.072 10.180 1.00 . A A . 22 ASP HB3 1 1 10 4680 1 1 22 ASP N N -1.455 -8.448 7.630 1.00 . A A . 22 ASP N 1 1 10 4681 1 1 22 ASP O O -1.257 -6.325 10.554 1.00 . A A . 22 ASP O 1 1 10 4682 1 1 22 ASP OD1 O 0.154 -10.992 8.926 1.00 . A A . 22 ASP OD1 1 1 10 4683 1 1 22 ASP OD2 O 0.166 -10.397 10.996 1.00 . A A . 22 ASP OD2 1 1 10 4684 1 1 23 GLY C C -0.666 -3.819 8.916 1.00 . A A . 23 GLY C 1 1 10 4685 1 1 23 GLY CA C -2.025 -4.499 8.732 1.00 . A A . 23 GLY CA 1 1 10 4686 1 1 23 GLY H H -1.982 -6.309 7.567 1.00 . A A . 23 GLY H 1 1 10 4687 1 1 23 GLY HA2 H -2.544 -4.047 7.896 1.00 . A A . 23 GLY HA2 1 1 10 4688 1 1 23 GLY HA3 H -2.610 -4.375 9.631 1.00 . A A . 23 GLY HA3 1 1 10 4689 1 1 23 GLY N N -1.828 -5.951 8.466 1.00 . A A . 23 GLY N 1 1 10 4690 1 1 23 GLY O O -0.316 -2.906 8.196 1.00 . A A . 23 GLY O 1 1 10 4691 1 1 24 LYS C C 2.460 -4.180 9.111 1.00 . A A . 24 LYS C 1 1 10 4692 1 1 24 LYS CA C 1.438 -3.631 10.108 1.00 . A A . 24 LYS CA 1 1 10 4693 1 1 24 LYS CB C 1.814 -4.021 11.537 1.00 . A A . 24 LYS CB 1 1 10 4694 1 1 24 LYS CD C 0.311 -4.107 13.531 1.00 . A A . 24 LYS CD 1 1 10 4695 1 1 24 LYS CE C 1.369 -4.824 14.374 1.00 . A A . 24 LYS CE 1 1 10 4696 1 1 24 LYS CG C 0.998 -3.184 12.523 1.00 . A A . 24 LYS CG 1 1 10 4697 1 1 24 LYS H H -0.198 -4.993 10.449 1.00 . A A . 24 LYS H 1 1 10 4698 1 1 24 LYS HA H 1.371 -2.556 10.024 1.00 . A A . 24 LYS HA 1 1 10 4699 1 1 24 LYS HB2 H 1.604 -5.069 11.691 1.00 . A A . 24 LYS HB2 1 1 10 4700 1 1 24 LYS HB3 H 2.866 -3.837 11.696 1.00 . A A . 24 LYS HB3 1 1 10 4701 1 1 24 LYS HD2 H -0.328 -3.521 14.176 1.00 . A A . 24 LYS HD2 1 1 10 4702 1 1 24 LYS HD3 H -0.283 -4.838 13.004 1.00 . A A . 24 LYS HD3 1 1 10 4703 1 1 24 LYS HE2 H 2.288 -4.925 13.814 1.00 . A A . 24 LYS HE2 1 1 10 4704 1 1 24 LYS HE3 H 1.543 -4.291 15.296 1.00 . A A . 24 LYS HE3 1 1 10 4705 1 1 24 LYS HG2 H 1.654 -2.502 13.045 1.00 . A A . 24 LYS HG2 1 1 10 4706 1 1 24 LYS HG3 H 0.250 -2.623 11.984 1.00 . A A . 24 LYS HG3 1 1 10 4707 1 1 24 LYS HZ1 H 1.542 -6.823 14.929 1.00 . A A . 24 LYS HZ1 1 1 10 4708 1 1 24 LYS HZ2 H 0.297 -6.518 13.814 1.00 . A A . 24 LYS HZ2 1 1 10 4709 1 1 24 LYS HZ3 H 0.104 -6.084 15.446 1.00 . A A . 24 LYS HZ3 1 1 10 4710 1 1 24 LYS N N 0.102 -4.255 9.877 1.00 . A A . 24 LYS N 1 1 10 4711 1 1 24 LYS NZ N 0.783 -6.163 14.662 1.00 . A A . 24 LYS NZ 1 1 10 4712 1 1 24 LYS O O 3.507 -4.669 9.484 1.00 . A A . 24 LYS O 1 1 10 4713 1 1 25 SER C C 2.710 -4.074 5.441 1.00 . A A . 25 SER C 1 1 10 4714 1 1 25 SER CA C 3.108 -4.609 6.815 1.00 . A A . 25 SER CA 1 1 10 4715 1 1 25 SER CB C 2.967 -6.129 6.864 1.00 . A A . 25 SER CB 1 1 10 4716 1 1 25 SER H H 1.310 -3.697 7.570 1.00 . A A . 25 SER H 1 1 10 4717 1 1 25 SER HA H 4.120 -4.322 7.056 1.00 . A A . 25 SER HA 1 1 10 4718 1 1 25 SER HB2 H 1.921 -6.396 6.863 1.00 . A A . 25 SER HB2 1 1 10 4719 1 1 25 SER HB3 H 3.449 -6.561 5.996 1.00 . A A . 25 SER HB3 1 1 10 4720 1 1 25 SER HG H 4.075 -7.405 7.827 1.00 . A A . 25 SER HG 1 1 10 4721 1 1 25 SER N N 2.161 -4.099 7.845 1.00 . A A . 25 SER N 1 1 10 4722 1 1 25 SER O O 1.782 -4.555 4.823 1.00 . A A . 25 SER O 1 1 10 4723 1 1 25 SER OG O 3.573 -6.619 8.053 1.00 . A A . 25 SER OG 1 1 10 4724 1 1 26 ALA C C 4.140 -2.861 2.608 1.00 . A A . 26 ALA C 1 1 10 4725 1 1 26 ALA CA C 3.050 -2.517 3.624 1.00 . A A . 26 ALA CA 1 1 10 4726 1 1 26 ALA CB C 2.967 -1.005 3.844 1.00 . A A . 26 ALA CB 1 1 10 4727 1 1 26 ALA H H 4.144 -2.702 5.466 1.00 . A A . 26 ALA H 1 1 10 4728 1 1 26 ALA HA H 2.095 -2.894 3.294 1.00 . A A . 26 ALA HA 1 1 10 4729 1 1 26 ALA HB1 H 2.627 -0.806 4.851 1.00 . A A . 26 ALA HB1 1 1 10 4730 1 1 26 ALA HB2 H 2.270 -0.576 3.138 1.00 . A A . 26 ALA HB2 1 1 10 4731 1 1 26 ALA HB3 H 3.942 -0.565 3.701 1.00 . A A . 26 ALA HB3 1 1 10 4732 1 1 26 ALA N N 3.399 -3.079 4.955 1.00 . A A . 26 ALA N 1 1 10 4733 1 1 26 ALA O O 5.225 -3.277 2.963 1.00 . A A . 26 ALA O 1 1 10 4734 1 1 27 ALA C C 5.377 -1.733 -0.349 1.00 . A A . 27 ALA C 1 1 10 4735 1 1 27 ALA CA C 4.877 -3.015 0.307 1.00 . A A . 27 ALA CA 1 1 10 4736 1 1 27 ALA CB C 4.133 -3.865 -0.718 1.00 . A A . 27 ALA CB 1 1 10 4737 1 1 27 ALA H H 2.977 -2.360 1.083 1.00 . A A . 27 ALA H 1 1 10 4738 1 1 27 ALA HA H 5.692 -3.571 0.734 1.00 . A A . 27 ALA HA 1 1 10 4739 1 1 27 ALA HB1 H 4.427 -4.897 -0.613 1.00 . A A . 27 ALA HB1 1 1 10 4740 1 1 27 ALA HB2 H 4.376 -3.518 -1.713 1.00 . A A . 27 ALA HB2 1 1 10 4741 1 1 27 ALA HB3 H 3.069 -3.773 -0.556 1.00 . A A . 27 ALA HB3 1 1 10 4742 1 1 27 ALA N N 3.858 -2.694 1.347 1.00 . A A . 27 ALA N 1 1 10 4743 1 1 27 ALA O O 6.558 -1.546 -0.566 1.00 . A A . 27 ALA O 1 1 10 4744 1 1 28 CYS C C 5.538 0.161 -2.665 1.00 . A A . 28 CYS C 1 1 10 4745 1 1 28 CYS CA C 4.857 0.422 -1.319 1.00 . A A . 28 CYS CA 1 1 10 4746 1 1 28 CYS CB C 5.819 1.101 -0.343 1.00 . A A . 28 CYS CB 1 1 10 4747 1 1 28 CYS H H 3.531 -1.046 -0.484 1.00 . A A . 28 CYS H 1 1 10 4748 1 1 28 CYS HA H 3.986 1.033 -1.456 1.00 . A A . 28 CYS HA 1 1 10 4749 1 1 28 CYS HB2 H 6.321 0.352 0.252 1.00 . A A . 28 CYS HB2 1 1 10 4750 1 1 28 CYS HB3 H 6.551 1.671 -0.896 1.00 . A A . 28 CYS HB3 1 1 10 4751 1 1 28 CYS N N 4.473 -0.857 -0.669 1.00 . A A . 28 CYS N 1 1 10 4752 1 1 28 CYS O O 6.683 -0.241 -2.726 1.00 . A A . 28 CYS O 1 1 10 4753 1 1 28 CYS SG S 4.890 2.207 0.746 1.00 . A A . 28 CYS SG 1 1 10 4754 1 1 29 THR C C 6.385 1.322 -5.445 1.00 . A A . 29 THR C 1 1 10 4755 1 1 29 THR CA C 5.448 0.166 -5.089 1.00 . A A . 29 THR CA 1 1 10 4756 1 1 29 THR CB C 4.262 0.122 -6.055 1.00 . A A . 29 THR CB 1 1 10 4757 1 1 29 THR CG2 C 3.545 1.472 -6.042 1.00 . A A . 29 THR CG2 1 1 10 4758 1 1 29 THR H H 3.920 0.723 -3.672 1.00 . A A . 29 THR H 1 1 10 4759 1 1 29 THR HA H 5.977 -0.772 -5.111 1.00 . A A . 29 THR HA 1 1 10 4760 1 1 29 THR HB H 3.574 -0.649 -5.746 1.00 . A A . 29 THR HB 1 1 10 4761 1 1 29 THR HG1 H 5.104 0.650 -7.727 1.00 . A A . 29 THR HG1 1 1 10 4762 1 1 29 THR HG21 H 3.505 1.868 -7.047 1.00 . A A . 29 THR HG21 1 1 10 4763 1 1 29 THR HG22 H 4.083 2.160 -5.406 1.00 . A A . 29 THR HG22 1 1 10 4764 1 1 29 THR HG23 H 2.541 1.343 -5.666 1.00 . A A . 29 THR HG23 1 1 10 4765 1 1 29 THR N N 4.842 0.394 -3.745 1.00 . A A . 29 THR N 1 1 10 4766 1 1 29 THR O O 6.098 2.123 -6.313 1.00 . A A . 29 THR O 1 1 10 4767 1 1 29 THR OG1 O 4.732 -0.159 -7.367 1.00 . A A . 29 THR OG1 1 1 10 4768 1 1 30 LEU C C 8.982 2.415 -6.503 1.00 . A A . 30 LEU C 1 1 10 4769 1 1 30 LEU CA C 8.454 2.527 -5.070 1.00 . A A . 30 LEU CA 1 1 10 4770 1 1 30 LEU CB C 9.590 2.347 -4.064 1.00 . A A . 30 LEU CB 1 1 10 4771 1 1 30 LEU CD1 C 9.434 0.797 -2.112 1.00 . A A . 30 LEU CD1 1 1 10 4772 1 1 30 LEU CD2 C 9.513 3.267 -1.745 1.00 . A A . 30 LEU CD2 1 1 10 4773 1 1 30 LEU CG C 9.003 2.157 -2.666 1.00 . A A . 30 LEU CG 1 1 10 4774 1 1 30 LEU H H 7.712 0.765 -4.077 1.00 . A A . 30 LEU H 1 1 10 4775 1 1 30 LEU HA H 7.979 3.482 -4.920 1.00 . A A . 30 LEU HA 1 1 10 4776 1 1 30 LEU HB2 H 10.175 1.479 -4.331 1.00 . A A . 30 LEU HB2 1 1 10 4777 1 1 30 LEU HB3 H 10.221 3.224 -4.071 1.00 . A A . 30 LEU HB3 1 1 10 4778 1 1 30 LEU HD11 H 8.708 0.457 -1.388 1.00 . A A . 30 LEU HD11 1 1 10 4779 1 1 30 LEU HD12 H 10.398 0.890 -1.637 1.00 . A A . 30 LEU HD12 1 1 10 4780 1 1 30 LEU HD13 H 9.498 0.084 -2.920 1.00 . A A . 30 LEU HD13 1 1 10 4781 1 1 30 LEU HD21 H 10.124 3.953 -2.313 1.00 . A A . 30 LEU HD21 1 1 10 4782 1 1 30 LEU HD22 H 10.101 2.835 -0.949 1.00 . A A . 30 LEU HD22 1 1 10 4783 1 1 30 LEU HD23 H 8.673 3.800 -1.323 1.00 . A A . 30 LEU HD23 1 1 10 4784 1 1 30 LEU HG H 7.925 2.198 -2.719 1.00 . A A . 30 LEU HG 1 1 10 4785 1 1 30 LEU N N 7.501 1.419 -4.777 1.00 . A A . 30 LEU N 1 1 10 4786 1 1 30 LEU O O 9.228 1.337 -7.004 1.00 . A A . 30 LEU O 1 1 10 4787 1 1 31 LYS C C 10.559 4.714 -8.818 1.00 . A A . 31 LYS C 1 1 10 4788 1 1 31 LYS CA C 9.669 3.496 -8.561 1.00 . A A . 31 LYS CA 1 1 10 4789 1 1 31 LYS CB C 8.421 3.545 -9.442 1.00 . A A . 31 LYS CB 1 1 10 4790 1 1 31 LYS CD C 8.273 1.107 -9.955 1.00 . A A . 31 LYS CD 1 1 10 4791 1 1 31 LYS CE C 6.915 1.105 -9.248 1.00 . A A . 31 LYS CE 1 1 10 4792 1 1 31 LYS CG C 8.537 2.493 -10.545 1.00 . A A . 31 LYS CG 1 1 10 4793 1 1 31 LYS H H 8.952 4.384 -6.736 1.00 . A A . 31 LYS H 1 1 10 4794 1 1 31 LYS HA H 10.214 2.583 -8.744 1.00 . A A . 31 LYS HA 1 1 10 4795 1 1 31 LYS HB2 H 7.547 3.343 -8.839 1.00 . A A . 31 LYS HB2 1 1 10 4796 1 1 31 LYS HB3 H 8.333 4.525 -9.888 1.00 . A A . 31 LYS HB3 1 1 10 4797 1 1 31 LYS HD2 H 8.270 0.373 -10.748 1.00 . A A . 31 LYS HD2 1 1 10 4798 1 1 31 LYS HD3 H 9.047 0.865 -9.242 1.00 . A A . 31 LYS HD3 1 1 10 4799 1 1 31 LYS HE2 H 7.048 1.203 -8.180 1.00 . A A . 31 LYS HE2 1 1 10 4800 1 1 31 LYS HE3 H 6.294 1.903 -9.625 1.00 . A A . 31 LYS HE3 1 1 10 4801 1 1 31 LYS HG2 H 7.813 2.700 -11.319 1.00 . A A . 31 LYS HG2 1 1 10 4802 1 1 31 LYS HG3 H 9.532 2.520 -10.965 1.00 . A A . 31 LYS HG3 1 1 10 4803 1 1 31 LYS HZ1 H 6.560 -0.907 -8.846 1.00 . A A . 31 LYS HZ1 1 1 10 4804 1 1 31 LYS HZ2 H 6.666 -0.539 -10.502 1.00 . A A . 31 LYS HZ2 1 1 10 4805 1 1 31 LYS HZ3 H 5.274 -0.120 -9.623 1.00 . A A . 31 LYS HZ3 1 1 10 4806 1 1 31 LYS N N 9.157 3.526 -7.162 1.00 . A A . 31 LYS N 1 1 10 4807 1 1 31 LYS NZ N 6.308 -0.215 -9.580 1.00 . A A . 31 LYS NZ 1 1 10 4808 1 1 31 LYS O O 11.600 4.616 -9.439 1.00 . A A . 31 LYS O 1 1 10 4809 1 1 32 ALA C C 10.913 7.989 -7.323 1.00 . A A . 32 ALA C 1 1 10 4810 1 1 32 ALA CA C 10.981 7.088 -8.556 1.00 . A A . 32 ALA CA 1 1 10 4811 1 1 32 ALA CB C 10.354 7.782 -9.766 1.00 . A A . 32 ALA CB 1 1 10 4812 1 1 32 ALA H H 9.317 5.919 -7.844 1.00 . A A . 32 ALA H 1 1 10 4813 1 1 32 ALA HA H 12.000 6.824 -8.772 1.00 . A A . 32 ALA HA 1 1 10 4814 1 1 32 ALA HB1 H 10.089 8.795 -9.501 1.00 . A A . 32 ALA HB1 1 1 10 4815 1 1 32 ALA HB2 H 9.468 7.246 -10.069 1.00 . A A . 32 ALA HB2 1 1 10 4816 1 1 32 ALA HB3 H 11.063 7.798 -10.580 1.00 . A A . 32 ALA HB3 1 1 10 4817 1 1 32 ALA N N 10.159 5.862 -8.343 1.00 . A A . 32 ALA N 1 1 10 4818 1 1 32 ALA O O 11.916 8.320 -6.724 1.00 . A A . 32 ALA O 1 1 10 4819 1 1 33 CYS C C 10.549 10.456 -5.844 1.00 . A A . 33 CYS C 1 1 10 4820 1 1 33 CYS CA C 9.586 9.269 -5.749 1.00 . A A . 33 CYS CA 1 1 10 4821 1 1 33 CYS CB C 9.934 8.386 -4.552 1.00 . A A . 33 CYS CB 1 1 10 4822 1 1 33 CYS H H 8.941 8.105 -7.444 1.00 . A A . 33 CYS H 1 1 10 4823 1 1 33 CYS HA H 8.571 9.619 -5.665 1.00 . A A . 33 CYS HA 1 1 10 4824 1 1 33 CYS HB2 H 10.515 7.539 -4.885 1.00 . A A . 33 CYS HB2 1 1 10 4825 1 1 33 CYS HB3 H 10.504 8.960 -3.835 1.00 . A A . 33 CYS HB3 1 1 10 4826 1 1 33 CYS N N 9.733 8.388 -6.943 1.00 . A A . 33 CYS N 1 1 10 4827 1 1 33 CYS O O 11.715 10.339 -5.526 1.00 . A A . 33 CYS O 1 1 10 4828 1 1 33 CYS SG S 8.410 7.798 -3.774 1.00 . A A . 33 CYS SG 1 1 10 4829 1 1 34 PRO C C 11.110 13.406 -5.048 1.00 . A A . 34 PRO C 1 1 10 4830 1 1 34 PRO CA C 10.829 12.795 -6.424 1.00 . A A . 34 PRO CA 1 1 10 4831 1 1 34 PRO CB C 9.938 13.714 -7.255 1.00 . A A . 34 PRO CB 1 1 10 4832 1 1 34 PRO CD C 8.621 11.769 -6.679 1.00 . A A . 34 PRO CD 1 1 10 4833 1 1 34 PRO CG C 8.543 13.240 -6.998 1.00 . A A . 34 PRO CG 1 1 10 4834 1 1 34 PRO HA H 11.747 12.591 -6.950 1.00 . A A . 34 PRO HA 1 1 10 4835 1 1 34 PRO HB2 H 10.055 14.739 -6.932 1.00 . A A . 34 PRO HB2 1 1 10 4836 1 1 34 PRO HB3 H 10.174 13.618 -8.303 1.00 . A A . 34 PRO HB3 1 1 10 4837 1 1 34 PRO HD2 H 7.951 11.524 -5.865 1.00 . A A . 34 PRO HD2 1 1 10 4838 1 1 34 PRO HD3 H 8.392 11.178 -7.554 1.00 . A A . 34 PRO HD3 1 1 10 4839 1 1 34 PRO HG2 H 8.120 13.778 -6.162 1.00 . A A . 34 PRO HG2 1 1 10 4840 1 1 34 PRO HG3 H 7.936 13.388 -7.878 1.00 . A A . 34 PRO HG3 1 1 10 4841 1 1 34 PRO N N 10.017 11.563 -6.281 1.00 . A A . 34 PRO N 1 1 10 4842 1 1 34 PRO O O 11.818 14.386 -4.927 1.00 . A A . 34 PRO O 1 1 10 4843 1 1 35 GLN C C 11.129 12.248 -1.676 1.00 . A A . 35 GLN C 1 1 10 4844 1 1 35 GLN CA C 10.789 13.382 -2.646 1.00 . A A . 35 GLN CA 1 1 10 4845 1 1 35 GLN CB C 9.467 14.044 -2.256 1.00 . A A . 35 GLN CB 1 1 10 4846 1 1 35 GLN CD C 7.033 13.604 -1.887 1.00 . A A . 35 GLN CD 1 1 10 4847 1 1 35 GLN CG C 8.311 13.083 -2.546 1.00 . A A . 35 GLN CG 1 1 10 4848 1 1 35 GLN H H 9.988 12.048 -4.135 1.00 . A A . 35 GLN H 1 1 10 4849 1 1 35 GLN HA H 11.579 14.116 -2.662 1.00 . A A . 35 GLN HA 1 1 10 4850 1 1 35 GLN HB2 H 9.481 14.285 -1.202 1.00 . A A . 35 GLN HB2 1 1 10 4851 1 1 35 GLN HB3 H 9.332 14.948 -2.831 1.00 . A A . 35 GLN HB3 1 1 10 4852 1 1 35 GLN HE21 H 6.999 12.183 -0.501 1.00 . A A . 35 GLN HE21 1 1 10 4853 1 1 35 GLN HE22 H 5.728 13.305 -0.421 1.00 . A A . 35 GLN HE22 1 1 10 4854 1 1 35 GLN HG2 H 8.164 13.012 -3.614 1.00 . A A . 35 GLN HG2 1 1 10 4855 1 1 35 GLN HG3 H 8.547 12.108 -2.148 1.00 . A A . 35 GLN HG3 1 1 10 4856 1 1 35 GLN N N 10.557 12.835 -4.014 1.00 . A A . 35 GLN N 1 1 10 4857 1 1 35 GLN NE2 N 6.547 12.979 -0.850 1.00 . A A . 35 GLN NE2 1 1 10 4858 1 1 35 GLN O O 10.767 11.120 -1.966 1.00 . A A . 35 GLN O 1 1 10 4859 1 1 35 GLN OXT O 11.746 12.528 -0.662 1.00 . A A . 35 GLN OXT 1 1 10 4860 1 1 35 GLN OE1 O 6.470 14.590 -2.321 1.00 . A A . 35 GLN OE1 1 1 stop_ save_
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