NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
388407 | 1n4n | 5612 | cing | 4-filtered-FRED | STAR | entry | full | 404 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1n4n # This FRED archive file contains, for PDB entry <1n4n>: # # - 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_1n4n _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1n4n _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5207.22 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 $floral_defensin_like_protein_1 A . 1 1 stop_ save_ save_floral_defensin_like_protein_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "floral defensin like protein 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ATCKAECPTWDSVCINKKPCVACCKKAKFSDGHCSKILRRCLCTKEC _Entity.Number_of_monomers 47 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 ALA . 1 1 2 THR . 1 1 3 CYS . 1 1 4 LYS . 1 1 5 ALA . 1 1 6 GLU . 1 1 7 CYS . 1 1 8 PRO . 1 1 9 THR . 1 1 10 TRP . 1 1 11 ASP . 1 1 12 SER . 1 1 13 VAL . 1 1 14 CYS . 1 1 15 ILE . 1 1 16 ASN . 1 1 17 LYS . 1 1 18 LYS . 1 1 19 PRO . 1 1 20 CYS . 1 1 21 VAL . 1 1 22 ALA . 1 1 23 CYS . 1 1 24 CYS . 1 1 25 LYS . 1 1 26 LYS . 1 1 27 ALA . 1 1 28 LYS . 1 1 29 PHE . 1 1 30 SER . 1 1 31 ASP . 1 1 32 GLY . 1 1 33 HIS . 1 1 34 CYS . 1 1 35 SER . 1 1 36 LYS . 1 1 37 ILE . 1 1 38 LEU . 1 1 39 ARG . 1 1 40 ARG . 1 1 41 CYS . 1 1 42 LEU . 1 1 43 CYS . 1 1 44 THR . 1 1 45 LYS . 1 1 46 GLU . 1 1 47 CYS . 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 ALA 1 1 1 1 THR 2 2 1 1 CYS 3 3 1 1 LYS 4 4 1 1 ALA 5 5 1 1 GLU 6 6 1 1 CYS 7 7 1 1 PRO 8 8 1 1 THR 9 9 1 1 TRP 10 10 1 1 ASP 11 11 1 1 SER 12 12 1 1 VAL 13 13 1 1 CYS 14 14 1 1 ILE 15 15 1 1 ASN 16 16 1 1 LYS 17 17 1 1 LYS 18 18 1 1 PRO 19 19 1 1 CYS 20 20 1 1 VAL 21 21 1 1 ALA 22 22 1 1 CYS 23 23 1 1 CYS 24 24 1 1 LYS 25 25 1 1 LYS 26 26 1 1 ALA 27 27 1 1 LYS 28 28 1 1 PHE 29 29 1 1 SER 30 30 1 1 ASP 31 31 1 1 GLY 32 32 1 1 HIS 33 33 1 1 CYS 34 34 1 1 SER 35 35 1 1 LYS 36 36 1 1 ILE 37 37 1 1 LEU 38 38 1 1 ARG 39 39 1 1 ARG 40 40 1 1 CYS 41 41 1 1 LEU 42 42 1 1 CYS 43 43 1 1 THR 44 44 1 1 LYS 45 45 1 1 GLU 46 46 1 1 CYS 47 47 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 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 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 THR H . 2 . HN 1 1 1 1 2 1 1 3 CYS H . 3 . HN 1 1 2 1 1 1 1 1 ALA HA . 1 . HA 1 1 2 1 2 1 1 2 THR H . 2 . HN 1 1 3 1 1 1 1 1 ALA MB . 1 . HB# 1 1 3 1 2 1 1 2 THR H . 2 . HN 1 1 4 1 1 1 1 1 ALA MB . 1 . HB# 1 1 4 1 2 1 1 2 THR HA . 2 . HA 1 1 5 1 1 1 1 2 THR HB . 2 . HB 1 1 5 1 2 1 1 3 CYS H . 3 . HN 1 1 6 1 1 1 1 2 THR MG . 2 . HG2# 1 1 6 1 2 1 1 3 CYS H . 3 . HN 1 1 7 1 1 1 1 2 THR MG . 2 . HG2# 1 1 7 1 2 1 1 44 THR MG . 44 . HG2# 1 1 8 1 1 1 1 2 THR HA . 2 . HA 1 1 8 1 2 1 1 3 CYS H . 3 . HN 1 1 9 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 9 1 2 1 1 29 PHE QD . 29 . HD# 1 1 10 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 10 1 2 1 1 45 LYS QD . 45 . HD# 1 1 11 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 11 1 2 1 1 45 LYS HG3 . 45 . HG1 1 1 12 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 12 1 2 1 1 45 LYS HG2 . 45 . HG2 1 1 13 1 1 1 1 3 CYS H . 3 . HN 1 1 13 1 2 1 1 4 LYS H . 4 . HN 1 1 14 1 1 1 1 3 CYS HA . 3 . HA 1 1 14 1 2 1 1 4 LYS H . 4 . HN 1 1 15 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 15 1 2 1 1 4 LYS H . 4 . HN 1 1 16 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 16 1 2 1 1 4 LYS H . 4 . HN 1 1 17 1 1 1 1 4 LYS QE . 4 . HE# 1 1 17 1 2 1 1 44 THR MG . 44 . HG2# 1 1 18 1 1 1 1 4 LYS QG . 4 . HG# 1 1 18 1 2 1 1 44 THR MG . 44 . HG2# 1 1 19 1 1 1 1 4 LYS QD . 4 . HD# 1 1 19 1 2 1 1 32 GLY QA . 32 . HA# 1 1 20 1 1 1 1 4 LYS QD . 4 . HD# 1 1 20 1 2 1 1 42 LEU HB2 . 42 . HB2 1 1 21 1 1 1 1 4 LYS QD . 4 . HD# 1 1 21 1 2 1 1 42 LEU HB3 . 42 . HB1 1 1 22 1 1 1 1 4 LYS H . 4 . HN 1 1 22 1 2 1 1 5 ALA H . 5 . HN 1 1 23 1 1 1 1 4 LYS HA . 4 . HA 1 1 23 1 2 1 1 5 ALA H . 5 . HN 1 1 24 1 1 1 1 5 ALA H . 5 . HN 1 1 24 1 2 1 1 29 PHE QD . 29 . HD# 1 1 25 1 1 1 1 4 LYS QB . 4 . HB# 1 1 25 1 2 1 1 5 ALA H . 5 . HN 1 1 26 1 1 1 1 4 LYS QG . 4 . HG# 1 1 26 1 2 1 1 5 ALA H . 5 . HN 1 1 27 1 1 1 1 5 ALA H . 5 . HN 1 1 27 1 2 1 1 42 LEU HB3 . 42 . HB1 1 1 28 1 1 1 1 5 ALA H . 5 . HN 1 1 28 1 2 1 1 42 LEU QD . 42 . HD# 1 1 29 1 1 1 1 4 LYS HA . 4 . HA 1 1 29 1 2 1 1 5 ALA MB . 5 . HB# 1 1 30 1 1 1 1 5 ALA MB . 5 . HB# 1 1 30 1 2 1 1 8 PRO QD . 8 . HD# 1 1 31 1 1 1 1 5 ALA MB . 5 . HB# 1 1 31 1 2 1 1 6 GLU HB2 . 6 . HB2 1 1 32 1 1 1 1 5 ALA H . 5 . HN 1 1 32 1 2 1 1 6 GLU H . 6 . HN 1 1 33 1 1 1 1 5 ALA HA . 5 . HA 1 1 33 1 2 1 1 6 GLU H . 6 . HN 1 1 34 1 1 1 1 5 ALA MB . 5 . HB# 1 1 34 1 2 1 1 6 GLU H . 6 . HN 1 1 35 1 1 1 1 6 GLU H . 6 . HN 1 1 35 1 2 1 1 42 LEU QD . 42 . HD# 1 1 36 1 1 1 1 6 GLU HA . 6 . HA 1 1 36 1 2 1 1 42 LEU QD . 42 . HD# 1 1 37 1 1 1 1 6 GLU HA . 6 . HA 1 1 37 1 2 1 1 42 LEU HG . 42 . HG# 1 1 38 1 1 1 1 6 GLU HB2 . 6 . HB2 1 1 38 1 2 1 1 10 TRP HD1 . 10 . HD1 1 1 39 1 1 1 1 6 GLU H . 6 . HN 1 1 39 1 2 1 1 7 CYS H . 7 . HN 1 1 40 1 1 1 1 6 GLU HA . 6 . HA 1 1 40 1 2 1 1 7 CYS H . 7 . HN 1 1 41 1 1 1 1 6 GLU HB3 . 6 . HB1 1 1 41 1 2 1 1 7 CYS H . 7 . HN 1 1 42 1 1 1 1 6 GLU HB2 . 6 . HB2 1 1 42 1 2 1 1 7 CYS H . 7 . HN 1 1 43 1 1 1 1 6 GLU QG . 6 . HG# 1 1 43 1 2 1 1 7 CYS H . 7 . HN 1 1 44 1 1 1 1 7 CYS H . 7 . HN 1 1 44 1 2 1 1 43 CYS H . 43 . HN 1 1 45 1 1 1 1 5 ALA MB . 5 . HB# 1 1 45 1 2 1 1 7 CYS H . 7 . HN 1 1 46 1 1 1 1 7 CYS H . 7 . HN 1 1 46 1 2 1 1 42 LEU QD . 42 . HD# 1 1 47 1 1 1 1 7 CYS HA . 7 . HA 1 1 47 1 2 1 1 24 CYS HA . 24 . HA 1 1 48 1 1 1 1 7 CYS HB2 . 7 . HB2 1 1 48 1 2 1 1 8 PRO QD . 8 . HD# 1 1 49 1 1 1 1 8 PRO HA . 8 . HA 1 1 49 1 2 1 1 9 THR H . 9 . HN 1 1 50 1 1 1 1 8 PRO QG . 8 . HG# 1 1 50 1 2 1 1 9 THR H . 9 . HN 1 1 51 1 1 1 1 8 PRO HA . 8 . HA 1 1 51 1 2 1 1 9 THR MG . 9 . HG2# 1 1 52 1 1 1 1 8 PRO HB2 . 8 . HB2 1 1 52 1 2 1 1 9 THR MG . 9 . HG2# 1 1 53 1 1 1 1 8 PRO HB3 . 8 . HB1 1 1 53 1 2 1 1 9 THR MG . 9 . HG2# 1 1 54 1 1 1 1 8 PRO QG . 8 . HG# 1 1 54 1 2 1 1 9 THR MG . 9 . HG2# 1 1 55 1 1 1 1 9 THR MG . 9 . HG2# 1 1 55 1 2 1 1 26 LYS QD . 26 . HD# 1 1 56 1 1 1 1 9 THR H . 9 . HN 1 1 56 1 2 1 1 10 TRP H . 10 . HN 1 1 57 1 1 1 1 9 THR HA . 9 . HA 1 1 57 1 2 1 1 10 TRP H . 10 . HN 1 1 58 1 1 1 1 8 PRO HA . 8 . HA 1 1 58 1 2 1 1 10 TRP H . 10 . HN 1 1 59 1 1 1 1 9 THR MG . 9 . HG2# 1 1 59 1 2 1 1 10 TRP H . 10 . HN 1 1 60 1 1 1 1 7 CYS HB3 . 7 . HB1 1 1 60 1 2 1 1 10 TRP H . 10 . HN 1 1 61 1 1 1 1 7 CYS HB3 . 7 . HB1 1 1 61 1 2 1 1 10 TRP HB3 . 10 . HB1 1 1 62 1 1 1 1 10 TRP HB3 . 10 . HB1 1 1 62 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 63 1 1 1 1 10 TRP HB2 . 10 . HB2 1 1 63 1 2 1 1 11 ASP H . 11 . HN 1 1 64 1 1 1 1 7 CYS H . 7 . HN 1 1 64 1 2 1 1 10 TRP HB2 . 10 . HB2 1 1 65 1 1 1 1 7 CYS HB3 . 7 . HB1 1 1 65 1 2 1 1 10 TRP HB2 . 10 . HB2 1 1 66 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 66 1 2 1 1 41 CYS H . 41 . HN 1 1 67 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 67 1 2 1 1 11 ASP HA . 11 . HA 1 1 68 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 68 1 2 1 1 40 ARG HA . 40 . HA 1 1 69 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 69 1 2 1 1 40 ARG QD . 40 . HD# 1 1 70 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 70 1 2 1 1 40 ARG QG . 40 . HG# 1 1 71 1 1 1 1 7 CYS HB3 . 7 . HB1 1 1 71 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 72 1 1 1 1 10 TRP HE3 . 10 . HE3 1 1 72 1 2 1 1 20 CYS HA . 20 . HA 1 1 73 1 1 1 1 10 TRP HE3 . 10 . HE3 1 1 73 1 2 1 1 23 CYS HA . 23 . HA 1 1 74 1 1 1 1 10 TRP HE3 . 10 . HE3 1 1 74 1 2 1 1 23 CYS HB3 . 23 . HB1 1 1 75 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 75 1 2 1 1 20 CYS HA . 20 . HA 1 1 76 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 76 1 2 1 1 23 CYS HB2 . 23 . HB2 1 1 77 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 77 1 2 1 1 23 CYS HB3 . 23 . HB1 1 1 78 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 78 1 2 1 1 20 CYS QB . 20 . HB# 1 1 79 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 79 1 2 1 1 19 PRO QG . 19 . HG# 1 1 80 1 1 1 1 10 TRP HZ3 . 10 . HZ3 1 1 80 1 2 1 1 19 PRO HB2 . 19 . HB2 1 1 81 1 1 1 1 10 TRP HH2 . 10 . HH2 1 1 81 1 2 1 1 14 CYS HA . 14 . HA 1 1 82 1 1 1 1 10 TRP HH2 . 10 . HH2 1 1 82 1 2 1 1 20 CYS HA . 20 . HA 1 1 83 1 1 1 1 10 TRP HH2 . 10 . HH2 1 1 83 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 84 1 1 1 1 10 TRP HH2 . 10 . HH2 1 1 84 1 2 1 1 19 PRO HB2 . 19 . HB2 1 1 85 1 1 1 1 10 TRP HH2 . 10 . HH2 1 1 85 1 2 1 1 19 PRO QG . 19 . HG# 1 1 86 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 86 1 2 1 1 14 CYS HA . 14 . HA 1 1 87 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 87 1 2 1 1 12 SER QB . 12 . HB# 1 1 88 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 88 1 2 1 1 14 CYS QB . 14 . HB# 1 1 89 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 89 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 90 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 90 1 2 1 1 19 PRO HB2 . 19 . HB2 1 1 91 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 91 1 2 1 1 19 PRO QG . 19 . HG# 1 1 92 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 92 1 2 1 1 39 ARG QG . 39 . HG# 1 1 93 1 1 1 1 10 TRP H . 10 . HN 1 1 93 1 2 1 1 11 ASP H . 11 . HN 1 1 94 1 1 1 1 10 TRP HA . 10 . HA 1 1 94 1 2 1 1 11 ASP H . 11 . HN 1 1 95 1 1 1 1 10 TRP HB3 . 10 . HB1 1 1 95 1 2 1 1 11 ASP H . 11 . HN 1 1 96 1 1 1 1 11 ASP H . 11 . HN 1 1 96 1 2 1 1 12 SER H . 12 . HN 1 1 97 1 1 1 1 11 ASP HA . 11 . HA 1 1 97 1 2 1 1 12 SER H . 12 . HN 1 1 98 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 98 1 2 1 1 12 SER H . 12 . HN 1 1 99 1 1 1 1 12 SER HA . 12 . HA 1 1 99 1 2 1 1 13 VAL H . 13 . HN 1 1 100 1 1 1 1 12 SER QB . 12 . HB# 1 1 100 1 2 1 1 13 VAL H . 13 . HN 1 1 101 1 1 1 1 13 VAL HA . 13 . HA 1 1 101 1 2 1 1 39 ARG QG . 39 . HG# 1 1 102 1 1 1 1 13 VAL HA . 13 . HA 1 1 102 1 2 1 1 39 ARG QB . 39 . HB# 1 1 103 1 1 1 1 13 VAL HA . 13 . HA 1 1 103 1 2 1 1 40 ARG QG . 40 . HG# 1 1 104 1 1 1 1 12 SER QB . 12 . HB# 1 1 104 1 2 1 1 13 VAL HB . 13 . HB 1 1 105 1 1 1 1 13 VAL HB . 13 . HB 1 1 105 1 2 1 1 38 LEU QD . 38 . HD# 1 1 106 1 1 1 1 13 VAL HA . 13 . HA 1 1 106 1 2 1 1 14 CYS H . 14 . HN 1 1 107 1 1 1 1 13 VAL MG1 . 13 . HG1# 1 1 107 1 2 1 1 14 CYS H . 14 . HN 1 1 108 1 1 1 1 14 CYS QB . 14 . HB# 1 1 108 1 2 1 1 34 CYS HA . 34 . HA 1 1 109 1 1 1 1 14 CYS QB . 14 . HB# 1 1 109 1 2 1 1 34 CYS QB . 34 . HB# 1 1 110 1 1 1 1 10 TRP HE1 . 10 . HE1 1 1 110 1 2 1 1 14 CYS QB . 14 . HB# 1 1 111 1 1 1 1 14 CYS HA . 14 . HA 1 1 111 1 2 1 1 15 ILE H . 15 . HN 1 1 112 1 1 1 1 10 TRP HZ2 . 10 . HZ2 1 1 112 1 2 1 1 15 ILE H . 15 . HN 1 1 113 1 1 1 1 14 CYS HA . 14 . HA 1 1 113 1 2 1 1 15 ILE HB . 15 . HB 1 1 114 1 1 1 1 15 ILE H . 15 . HN 1 1 114 1 2 1 1 16 ASN H . 16 . HN 1 1 115 1 1 1 1 15 ILE HA . 15 . HA 1 1 115 1 2 1 1 16 ASN H . 16 . HN 1 1 116 1 1 1 1 15 ILE HB . 15 . HB 1 1 116 1 2 1 1 16 ASN H . 16 . HN 1 1 117 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 117 1 2 1 1 16 ASN H . 16 . HN 1 1 118 1 1 1 1 16 ASN H . 16 . HN 1 1 118 1 2 1 1 17 LYS H . 17 . HN 1 1 119 1 1 1 1 14 CYS HA . 14 . HA 1 1 119 1 2 1 1 16 ASN H . 16 . HN 1 1 120 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 120 1 2 1 1 16 ASN HA . 16 . HA 1 1 121 1 1 1 1 16 ASN HB3 . 16 . HB1 1 1 121 1 2 1 1 18 LYS H . 18 . HN 1 1 122 1 1 1 1 16 ASN HB3 . 16 . HB1 1 1 122 1 2 1 1 17 LYS H . 17 . HN 1 1 123 1 1 1 1 16 ASN HB3 . 16 . HB1 1 1 123 1 2 1 1 19 PRO QG . 19 . HG# 1 1 124 1 1 1 1 16 ASN HB2 . 16 . HB2 1 1 124 1 2 1 1 17 LYS H . 17 . HN 1 1 125 1 1 1 1 16 ASN HA . 16 . HA 1 1 125 1 2 1 1 17 LYS H . 17 . HN 1 1 126 1 1 1 1 17 LYS HA . 17 . HA 1 1 126 1 2 1 1 18 LYS H . 18 . HN 1 1 127 1 1 1 1 17 LYS H . 17 . HN 1 1 127 1 2 1 1 18 LYS H . 18 . HN 1 1 128 1 1 1 1 17 LYS QB . 17 . HB# 1 1 128 1 2 1 1 18 LYS H . 18 . HN 1 1 129 1 1 1 1 18 LYS H . 18 . HN 1 1 129 1 2 1 1 19 PRO QD . 19 . HD# 1 1 130 1 1 1 1 18 LYS HA . 18 . HA 1 1 130 1 2 1 1 21 VAL HB . 21 . HB 1 1 131 1 1 1 1 19 PRO HA . 19 . HA 1 1 131 1 2 1 1 22 ALA MB . 22 . HB# 1 1 132 1 1 1 1 18 LYS HA . 18 . HA 1 1 132 1 2 1 1 19 PRO QD . 19 . HD# 1 1 133 1 1 1 1 18 LYS QB . 18 . HB# 1 1 133 1 2 1 1 19 PRO QD . 19 . HD# 1 1 134 1 1 1 1 18 LYS QG . 18 . HG# 1 1 134 1 2 1 1 19 PRO QD . 19 . HD# 1 1 135 1 1 1 1 16 ASN HB3 . 16 . HB1 1 1 135 1 2 1 1 19 PRO QD . 19 . HD# 1 1 136 1 1 1 1 16 ASN HB2 . 16 . HB2 1 1 136 1 2 1 1 19 PRO QD . 19 . HD# 1 1 137 1 1 1 1 19 PRO HA . 19 . HA 1 1 137 1 2 1 1 20 CYS H . 20 . HN 1 1 138 1 1 1 1 18 LYS HA . 18 . HA 1 1 138 1 2 1 1 20 CYS H . 20 . HN 1 1 139 1 1 1 1 17 LYS HA . 17 . HA 1 1 139 1 2 1 1 20 CYS H . 20 . HN 1 1 140 1 1 1 1 19 PRO HB2 . 19 . HB2 1 1 140 1 2 1 1 20 CYS H . 20 . HN 1 1 141 1 1 1 1 19 PRO QG . 19 . HG# 1 1 141 1 2 1 1 20 CYS H . 20 . HN 1 1 142 1 1 1 1 19 PRO QD . 19 . HD# 1 1 142 1 2 1 1 20 CYS H . 20 . HN 1 1 143 1 1 1 1 20 CYS HA . 20 . HA 1 1 143 1 2 1 1 23 CYS HB3 . 23 . HB1 1 1 144 1 1 1 1 20 CYS HA . 20 . HA 1 1 144 1 2 1 1 23 CYS HB2 . 23 . HB2 1 1 145 1 1 1 1 20 CYS H . 20 . HN 1 1 145 1 2 1 1 21 VAL H . 21 . HN 1 1 146 1 1 1 1 20 CYS QB . 20 . HB# 1 1 146 1 2 1 1 21 VAL H . 21 . HN 1 1 147 1 1 1 1 18 LYS HA . 18 . HA 1 1 147 1 2 1 1 21 VAL H . 21 . HN 1 1 148 1 1 1 1 21 VAL HA . 21 . HA 1 1 148 1 2 1 1 22 ALA H . 22 . HN 1 1 149 1 1 1 1 21 VAL HA . 21 . HA 1 1 149 1 2 1 1 32 GLY QA . 32 . HA# 1 1 150 1 1 1 1 21 VAL HA . 21 . HA 1 1 150 1 2 1 1 31 ASP HA . 31 . HA 1 1 151 1 1 1 1 18 LYS HA . 18 . HA 1 1 151 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 152 1 1 1 1 18 LYS QB . 18 . HB# 1 1 152 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 153 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 153 1 2 1 1 22 ALA HA . 22 . HA 1 1 154 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 154 1 2 1 1 25 LYS QD . 25 . HD# 1 1 155 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 155 1 2 1 1 25 LYS QG . 25 . HG# 1 1 156 1 1 1 1 21 VAL H . 21 . HN 1 1 156 1 2 1 1 22 ALA H . 22 . HN 1 1 157 1 1 1 1 21 VAL HB . 21 . HB 1 1 157 1 2 1 1 22 ALA H . 22 . HN 1 1 158 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 158 1 2 1 1 22 ALA H . 22 . HN 1 1 159 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 159 1 2 1 1 22 ALA H . 22 . HN 1 1 160 1 1 1 1 22 ALA H . 22 . HN 1 1 160 1 2 1 1 23 CYS H . 23 . HN 1 1 161 1 1 1 1 22 ALA HA . 22 . HA 1 1 161 1 2 1 1 23 CYS H . 23 . HN 1 1 162 1 1 1 1 22 ALA MB . 22 . HB# 1 1 162 1 2 1 1 23 CYS H . 23 . HN 1 1 163 1 1 1 1 20 CYS HA . 20 . HA 1 1 163 1 2 1 1 23 CYS H . 23 . HN 1 1 164 1 1 1 1 23 CYS H . 23 . HN 1 1 164 1 2 1 1 24 CYS H . 24 . HN 1 1 165 1 1 1 1 23 CYS HA . 23 . HA 1 1 165 1 2 1 1 24 CYS H . 24 . HN 1 1 166 1 1 1 1 23 CYS HB3 . 23 . HB1 1 1 166 1 2 1 1 24 CYS H . 24 . HN 1 1 167 1 1 1 1 23 CYS HB2 . 23 . HB2 1 1 167 1 2 1 1 24 CYS H . 24 . HN 1 1 168 1 1 1 1 21 VAL HA . 21 . HA 1 1 168 1 2 1 1 24 CYS H . 24 . HN 1 1 169 1 1 1 1 24 CYS HA . 24 . HA 1 1 169 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 170 1 1 1 1 24 CYS HA . 24 . HA 1 1 170 1 2 1 1 27 ALA MB . 27 . HB# 1 1 171 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 171 1 2 1 1 25 LYS H . 25 . HN 1 1 172 1 1 1 1 21 VAL HA . 21 . HA 1 1 172 1 2 1 1 24 CYS HB3 . 24 . HB1 1 1 173 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 173 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 174 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 174 1 2 1 1 24 CYS HB3 . 24 . HB1 1 1 175 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 175 1 2 1 1 24 CYS HB3 . 24 . HB1 1 1 176 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 176 1 2 1 1 25 LYS H . 25 . HN 1 1 177 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 177 1 2 1 1 43 CYS HA . 43 . HA 1 1 178 1 1 1 1 21 VAL HA . 21 . HA 1 1 178 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 179 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 179 1 2 1 1 25 LYS QE . 25 . HE# 1 1 180 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 180 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 181 1 1 1 1 24 CYS H . 24 . HN 1 1 181 1 2 1 1 25 LYS H . 25 . HN 1 1 182 1 1 1 1 22 ALA HA . 22 . HA 1 1 182 1 2 1 1 25 LYS H . 25 . HN 1 1 183 1 1 1 1 25 LYS HA . 25 . HA 1 1 183 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 184 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 184 1 2 1 1 25 LYS QE . 25 . HE# 1 1 185 1 1 1 1 25 LYS H . 25 . HN 1 1 185 1 2 1 1 26 LYS H . 26 . HN 1 1 186 1 1 1 1 25 LYS HA . 25 . HA 1 1 186 1 2 1 1 26 LYS H . 26 . HN 1 1 187 1 1 1 1 25 LYS QB . 25 . HB# 1 1 187 1 2 1 1 26 LYS H . 26 . HN 1 1 188 1 1 1 1 26 LYS H . 26 . HN 1 1 188 1 2 1 1 27 ALA H . 27 . HN 1 1 189 1 1 1 1 26 LYS HA . 26 . HA 1 1 189 1 2 1 1 27 ALA H . 27 . HN 1 1 190 1 1 1 1 26 LYS QB . 26 . HB# 1 1 190 1 2 1 1 27 ALA H . 27 . HN 1 1 191 1 1 1 1 24 CYS HA . 24 . HA 1 1 191 1 2 1 1 27 ALA H . 27 . HN 1 1 192 1 1 1 1 27 ALA H . 27 . HN 1 1 192 1 2 1 1 29 PHE QD . 29 . HD# 1 1 193 1 1 1 1 8 PRO QD . 8 . HD# 1 1 193 1 2 1 1 27 ALA MB . 27 . HB# 1 1 194 1 1 1 1 8 PRO QG . 8 . HG# 1 1 194 1 2 1 1 27 ALA MB . 27 . HB# 1 1 195 1 1 1 1 27 ALA H . 27 . HN 1 1 195 1 2 1 1 28 LYS H . 28 . HN 1 1 196 1 1 1 1 27 ALA HA . 27 . HA 1 1 196 1 2 1 1 28 LYS H . 28 . HN 1 1 197 1 1 1 1 27 ALA MB . 27 . HB# 1 1 197 1 2 1 1 28 LYS H . 28 . HN 1 1 198 1 1 1 1 25 LYS HA . 25 . HA 1 1 198 1 2 1 1 28 LYS H . 28 . HN 1 1 199 1 1 1 1 28 LYS H . 28 . HN 1 1 199 1 2 1 1 29 PHE H . 29 . HN 1 1 200 1 1 1 1 28 LYS HA . 28 . HA 1 1 200 1 2 1 1 29 PHE H . 29 . HN 1 1 201 1 1 1 1 27 ALA H . 27 . HN 1 1 201 1 2 1 1 29 PHE H . 29 . HN 1 1 202 1 1 1 1 25 LYS HA . 25 . HA 1 1 202 1 2 1 1 29 PHE H . 29 . HN 1 1 203 1 1 1 1 28 LYS HB3 . 28 . HB1 1 1 203 1 2 1 1 29 PHE H . 29 . HN 1 1 204 1 1 1 1 28 LYS HB2 . 28 . HB2 1 1 204 1 2 1 1 29 PHE H . 29 . HN 1 1 205 1 1 1 1 27 ALA MB . 27 . HB# 1 1 205 1 2 1 1 29 PHE H . 29 . HN 1 1 206 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 206 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 207 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 207 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 208 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 208 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 209 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 209 1 2 1 1 43 CYS HB2 . 43 . HB2 1 1 210 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 210 1 2 1 1 45 LYS HB3 . 45 . HB1 1 1 211 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 211 1 2 1 1 45 LYS HB2 . 45 . HB2 1 1 212 1 1 1 1 27 ALA MB . 27 . HB# 1 1 212 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 213 1 1 1 1 29 PHE QD . 29 . HD# 1 1 213 1 2 1 1 44 THR HA . 44 . HA 1 1 214 1 1 1 1 29 PHE QD . 29 . HD# 1 1 214 1 2 1 1 45 LYS HA . 45 . HA 1 1 215 1 1 1 1 24 CYS HA . 24 . HA 1 1 215 1 2 1 1 29 PHE QD . 29 . HD# 1 1 216 1 1 1 1 8 PRO QD . 8 . HD# 1 1 216 1 2 1 1 29 PHE QD . 29 . HD# 1 1 217 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 217 1 2 1 1 29 PHE QD . 29 . HD# 1 1 218 1 1 1 1 29 PHE QD . 29 . HD# 1 1 218 1 2 1 1 45 LYS QE . 45 . HE# 1 1 219 1 1 1 1 29 PHE QD . 29 . HD# 1 1 219 1 2 1 1 43 CYS HB3 . 43 . HB1 1 1 220 1 1 1 1 29 PHE QD . 29 . HD# 1 1 220 1 2 1 1 43 CYS HB2 . 43 . HB2 1 1 221 1 1 1 1 8 PRO QG . 8 . HG# 1 1 221 1 2 1 1 29 PHE QD . 29 . HD# 1 1 222 1 1 1 1 29 PHE QD . 29 . HD# 1 1 222 1 2 1 1 45 LYS HB2 . 45 . HB2 1 1 223 1 1 1 1 29 PHE QD . 29 . HD# 1 1 223 1 2 1 1 45 LYS QG . 45 . HG# 1 1 224 1 1 1 1 5 ALA MB . 5 . HB# 1 1 224 1 2 1 1 29 PHE QD . 29 . HD# 1 1 225 1 1 1 1 29 PHE QD . 29 . HD# 1 1 225 1 2 1 1 45 LYS QD . 45 . HD# 1 1 226 1 1 1 1 27 ALA MB . 27 . HB# 1 1 226 1 2 1 1 29 PHE QE . 29 . HE# 1 1 227 1 1 1 1 5 ALA MB . 5 . HB# 1 1 227 1 2 1 1 29 PHE QE . 29 . HE# 1 1 228 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 228 1 2 1 1 30 SER H . 30 . HN 1 1 229 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 229 1 2 1 1 30 SER H . 30 . HN 1 1 230 1 1 1 1 30 SER H . 30 . HN 1 1 230 1 2 1 1 45 LYS HB2 . 45 . HB2 1 1 231 1 1 1 1 30 SER H . 30 . HN 1 1 231 1 2 1 1 45 LYS HB3 . 45 . HB1 1 1 232 1 1 1 1 29 PHE QD . 29 . HD# 1 1 232 1 2 1 1 30 SER H . 30 . HN 1 1 233 1 1 1 1 30 SER H . 30 . HN 1 1 233 1 2 1 1 45 LYS HA . 45 . HA 1 1 234 1 1 1 1 30 SER H . 30 . HN 1 1 234 1 2 1 1 31 ASP H . 31 . HN 1 1 235 1 1 1 1 30 SER HA . 30 . HA 1 1 235 1 2 1 1 31 ASP H . 31 . HN 1 1 236 1 1 1 1 30 SER QB . 30 . HB# 1 1 236 1 2 1 1 31 ASP H . 31 . HN 1 1 237 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 237 1 2 1 1 31 ASP H . 31 . HN 1 1 238 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 238 1 2 1 1 31 ASP H . 31 . HN 1 1 239 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 239 1 2 1 1 31 ASP HA . 31 . HA 1 1 240 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 240 1 2 1 1 31 ASP HA . 31 . HA 1 1 241 1 1 1 1 31 ASP H . 31 . HN 1 1 241 1 2 1 1 32 GLY H . 32 . HN 1 1 242 1 1 1 1 31 ASP HA . 31 . HA 1 1 242 1 2 1 1 32 GLY H . 32 . HN 1 1 243 1 1 1 1 31 ASP HB2 . 31 . HB2 1 1 243 1 2 1 1 32 GLY H . 32 . HN 1 1 244 1 1 1 1 31 ASP HB3 . 31 . HB1 1 1 244 1 2 1 1 32 GLY H . 32 . HN 1 1 245 1 1 1 1 21 VAL HA . 21 . HA 1 1 245 1 2 1 1 32 GLY H . 32 . HN 1 1 246 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 246 1 2 1 1 32 GLY H . 32 . HN 1 1 247 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 247 1 2 1 1 32 GLY H . 32 . HN 1 1 248 1 1 1 1 32 GLY QA . 32 . HA# 1 1 248 1 2 1 1 43 CYS HA . 43 . HA 1 1 249 1 1 1 1 32 GLY H . 32 . HN 1 1 249 1 2 1 1 33 HIS H . 33 . HN 1 1 250 1 1 1 1 32 GLY QA . 32 . HA# 1 1 250 1 2 1 1 33 HIS H . 33 . HN 1 1 251 1 1 1 1 33 HIS H . 33 . HN 1 1 251 1 2 1 1 42 LEU HB2 . 42 . HB2 1 1 252 1 1 1 1 33 HIS H . 33 . HN 1 1 252 1 2 1 1 42 LEU HB3 . 42 . HB1 1 1 253 1 1 1 1 17 LYS HA . 17 . HA 1 1 253 1 2 1 1 33 HIS HA . 33 . HA 1 1 254 1 1 1 1 17 LYS QB . 17 . HB# 1 1 254 1 2 1 1 33 HIS HA . 33 . HA 1 1 255 1 1 1 1 17 LYS QD . 17 . HD# 1 1 255 1 2 1 1 33 HIS HA . 33 . HA 1 1 256 1 1 1 1 17 LYS QG . 17 . HG# 1 1 256 1 2 1 1 33 HIS HA . 33 . HA 1 1 257 1 1 1 1 33 HIS HB3 . 33 . HB1 1 1 257 1 2 1 1 34 CYS H . 34 . HN 1 1 258 1 1 1 1 33 HIS HB2 . 33 . HB2 1 1 258 1 2 1 1 34 CYS H . 34 . HN 1 1 259 1 1 1 1 32 GLY QA . 32 . HA# 1 1 259 1 2 1 1 33 HIS HB2 . 33 . HB2 1 1 260 1 1 1 1 33 HIS HE1 . 33 . HE1 1 1 260 1 2 1 1 42 LEU HB3 . 42 . HB1 1 1 261 1 1 1 1 33 HIS HE1 . 33 . HE1 1 1 261 1 2 1 1 42 LEU HB2 . 42 . HB2 1 1 262 1 1 1 1 33 HIS HD2 . 33 . HD2 1 1 262 1 2 1 1 42 LEU HB3 . 42 . HB1 1 1 263 1 1 1 1 33 HIS HD2 . 33 . HD2 1 1 263 1 2 1 1 42 LEU HB2 . 42 . HB2 1 1 264 1 1 1 1 33 HIS HA . 33 . HA 1 1 264 1 2 1 1 34 CYS H . 34 . HN 1 1 265 1 1 1 1 34 CYS HA . 34 . HA 1 1 265 1 2 1 1 41 CYS HA . 41 . HA 1 1 266 1 1 1 1 33 HIS HB2 . 33 . HB2 1 1 266 1 2 1 1 34 CYS QB . 34 . HB# 1 1 267 1 1 1 1 33 HIS HA . 33 . HA 1 1 267 1 2 1 1 34 CYS QB . 34 . HB# 1 1 268 1 1 1 1 34 CYS HA . 34 . HA 1 1 268 1 2 1 1 35 SER H . 35 . HN 1 1 269 1 1 1 1 35 SER QB . 35 . HB# 1 1 269 1 2 1 1 42 LEU HB2 . 42 . HB2 1 1 270 1 1 1 1 35 SER QB . 35 . HB# 1 1 270 1 2 1 1 40 ARG H . 40 . HN 1 1 271 1 1 1 1 35 SER QB . 35 . HB# 1 1 271 1 2 1 1 42 LEU QD . 42 . HD# 1 1 272 1 1 1 1 35 SER HA . 35 . HA 1 1 272 1 2 1 1 36 LYS H . 36 . HN 1 1 273 1 1 1 1 35 SER QB . 35 . HB# 1 1 273 1 2 1 1 36 LYS HA . 36 . HA 1 1 274 1 1 1 1 35 SER HA . 35 . HA 1 1 274 1 2 1 1 36 LYS QB . 36 . HB# 1 1 275 1 1 1 1 36 LYS QD . 36 . HD# 1 1 275 1 2 1 1 39 ARG QD . 39 . HD# 1 1 276 1 1 1 1 36 LYS QG . 36 . HG# 1 1 276 1 2 1 1 39 ARG QB . 39 . HB# 1 1 277 1 1 1 1 36 LYS QG . 36 . HG# 1 1 277 1 2 1 1 37 ILE HB . 37 . HB 1 1 278 1 1 1 1 36 LYS QG . 36 . HG# 1 1 278 1 2 1 1 37 ILE QG . 37 . HG1# 1 1 279 1 1 1 1 36 LYS H . 36 . HN 1 1 279 1 2 1 1 37 ILE H . 37 . HN 1 1 280 1 1 1 1 36 LYS HA . 36 . HA 1 1 280 1 2 1 1 37 ILE H . 37 . HN 1 1 281 1 1 1 1 36 LYS QB . 36 . HB# 1 1 281 1 2 1 1 37 ILE H . 37 . HN 1 1 282 1 1 1 1 37 ILE H . 37 . HN 1 1 282 1 2 1 1 38 LEU H . 38 . HN 1 1 283 1 1 1 1 37 ILE HA . 37 . HA 1 1 283 1 2 1 1 38 LEU H . 38 . HN 1 1 284 1 1 1 1 37 ILE HB . 37 . HB 1 1 284 1 2 1 1 38 LEU H . 38 . HN 1 1 285 1 1 1 1 35 SER QB . 35 . HB# 1 1 285 1 2 1 1 38 LEU HB3 . 38 . HB1 1 1 286 1 1 1 1 38 LEU HB3 . 38 . HB1 1 1 286 1 2 1 1 39 ARG QB . 39 . HB# 1 1 287 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 287 1 2 1 1 40 ARG QD . 40 . HD# 1 1 288 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 288 1 2 1 1 40 ARG HE . 40 . HE 1 1 289 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 289 1 2 1 1 40 ARG H . 40 . HN 1 1 290 1 1 1 1 38 LEU H . 38 . HN 1 1 290 1 2 1 1 39 ARG H . 39 . HN 1 1 291 1 1 1 1 38 LEU HA . 38 . HA 1 1 291 1 2 1 1 39 ARG H . 39 . HN 1 1 292 1 1 1 1 38 LEU HG . 38 . HG 1 1 292 1 2 1 1 39 ARG H . 39 . HN 1 1 293 1 1 1 1 13 VAL MG1 . 13 . HG1# 1 1 293 1 2 1 1 39 ARG QB . 39 . HB# 1 1 294 1 1 1 1 13 VAL MG2 . 13 . HG2# 1 1 294 1 2 1 1 39 ARG QB . 39 . HB# 1 1 295 1 1 1 1 37 ILE MG . 37 . HG2# 1 1 295 1 2 1 1 39 ARG QB . 39 . HB# 1 1 296 1 1 1 1 13 VAL MG1 . 13 . HG1# 1 1 296 1 2 1 1 39 ARG QG . 39 . HG# 1 1 297 1 1 1 1 13 VAL MG1 . 13 . HG1# 1 1 297 1 2 1 1 39 ARG QD . 39 . HD# 1 1 298 1 1 1 1 37 ILE HA . 37 . HA 1 1 298 1 2 1 1 39 ARG QD . 39 . HD# 1 1 299 1 1 1 1 13 VAL MG1 . 13 . HG1# 1 1 299 1 2 1 1 39 ARG HE . 39 . HE 1 1 300 1 1 1 1 39 ARG H . 39 . HN 1 1 300 1 2 1 1 40 ARG H . 40 . HN 1 1 301 1 1 1 1 39 ARG HA . 39 . HA 1 1 301 1 2 1 1 40 ARG H . 40 . HN 1 1 302 1 1 1 1 35 SER H . 35 . HN 1 1 302 1 2 1 1 40 ARG H . 40 . HN 1 1 303 1 1 1 1 38 LEU QD . 38 . HD# 1 1 303 1 2 1 1 40 ARG QG . 40 . HG# 1 1 304 1 1 1 1 38 LEU QD . 38 . HD# 1 1 304 1 2 1 1 40 ARG QD . 40 . HD# 1 1 305 1 1 1 1 38 LEU QD . 38 . HD# 1 1 305 1 2 1 1 40 ARG QB . 40 . HB# 1 1 306 1 1 1 1 37 ILE MD . 37 . HD# 1 1 306 1 2 1 1 40 ARG HE . 40 . HE 1 1 307 1 1 1 1 40 ARG HA . 40 . HA 1 1 307 1 2 1 1 41 CYS H . 41 . HN 1 1 308 1 1 1 1 40 ARG QG . 40 . HG# 1 1 308 1 2 1 1 41 CYS H . 41 . HN 1 1 309 1 1 1 1 40 ARG QB . 40 . HB# 1 1 309 1 2 1 1 41 CYS H . 41 . HN 1 1 310 1 1 1 1 41 CYS HA . 41 . HA 1 1 310 1 2 1 1 42 LEU H . 42 . HN 1 1 311 1 1 1 1 35 SER HA . 35 . HA 1 1 311 1 2 1 1 42 LEU H . 42 . HN 1 1 312 1 1 1 1 4 LYS QB . 4 . HB# 1 1 312 1 2 1 1 42 LEU QD . 42 . HD# 1 1 313 1 1 1 1 4 LYS QD . 4 . HD# 1 1 313 1 2 1 1 42 LEU QD . 42 . HD# 1 1 314 1 1 1 1 35 SER QB . 35 . HB# 1 1 314 1 2 1 1 42 LEU HG . 42 . HG 1 1 315 1 1 1 1 6 GLU QG . 6 . HG# 1 1 315 1 2 1 1 42 LEU HG . 42 . HG 1 1 316 1 1 1 1 4 LYS QB . 4 . HB# 1 1 316 1 2 1 1 42 LEU HG . 42 . HG 1 1 317 1 1 1 1 42 LEU HA . 42 . HA 1 1 317 1 2 1 1 43 CYS H . 43 . HN 1 1 318 1 1 1 1 42 LEU HB3 . 42 . HB1 1 1 318 1 2 1 1 43 CYS H . 43 . HN 1 1 319 1 1 1 1 42 LEU HB2 . 42 . HB2 1 1 319 1 2 1 1 43 CYS H . 43 . HN 1 1 320 1 1 1 1 42 LEU QD . 42 . HD# 1 1 320 1 2 1 1 43 CYS H . 43 . HN 1 1 321 1 1 1 1 42 LEU HG . 42 . HG 1 1 321 1 2 1 1 43 CYS H . 43 . HN 1 1 322 1 1 1 1 4 LYS HA . 4 . HA 1 1 322 1 2 1 1 43 CYS H . 43 . HN 1 1 323 1 1 1 1 33 HIS H . 33 . HN 1 1 323 1 2 1 1 43 CYS HA . 43 . HA 1 1 324 1 1 1 1 43 CYS HA . 43 . HA 1 1 324 1 2 1 1 44 THR MG . 44 . HG2# 1 1 325 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 325 1 2 1 1 43 CYS HB2 . 43 . HB2 1 1 326 1 1 1 1 43 CYS HA . 43 . HA 1 1 326 1 2 1 1 44 THR H . 44 . HN 1 1 327 1 1 1 1 43 CYS HB3 . 43 . HB1 1 1 327 1 2 1 1 44 THR H . 44 . HN 1 1 328 1 1 1 1 43 CYS HB2 . 43 . HB2 1 1 328 1 2 1 1 44 THR H . 44 . HN 1 1 329 1 1 1 1 29 PHE QD . 29 . HD# 1 1 329 1 2 1 1 44 THR H . 44 . HN 1 1 330 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 330 1 2 1 1 44 THR H . 44 . HN 1 1 331 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 331 1 2 1 1 44 THR H . 44 . HN 1 1 332 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 332 1 2 1 1 44 THR H . 44 . HN 1 1 333 1 1 1 1 3 CYS H . 3 . HN 1 1 333 1 2 1 1 44 THR HA . 44 . HA 1 1 334 1 1 1 1 2 THR MG . 2 . HG2# 1 1 334 1 2 1 1 44 THR HA . 44 . HA 1 1 335 1 1 1 1 2 THR MG . 2 . HG2# 1 1 335 1 2 1 1 44 THR HB . 44 . HB 1 1 336 1 1 1 1 44 THR HA . 44 . HA 1 1 336 1 2 1 1 45 LYS H . 45 . HN 1 1 337 1 1 1 1 44 THR HB . 44 . HB 1 1 337 1 2 1 1 45 LYS H . 45 . HN 1 1 338 1 1 1 1 44 THR MG . 44 . HG2# 1 1 338 1 2 1 1 45 LYS H . 45 . HN 1 1 339 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 339 1 2 1 1 45 LYS H . 45 . HN 1 1 340 1 1 1 1 44 THR HA . 44 . HA 1 1 340 1 2 1 1 45 LYS HA . 45 . HA 1 1 341 1 1 1 1 44 THR HB . 44 . HB 1 1 341 1 2 1 1 45 LYS HA . 45 . HA 1 1 342 1 1 1 1 30 SER QB . 30 . HB# 1 1 342 1 2 1 1 45 LYS HA . 45 . HA 1 1 343 1 1 1 1 45 LYS HA . 45 . HA 1 1 343 1 2 1 1 46 GLU QG . 46 . HG# 1 1 344 1 1 1 1 45 LYS HA . 45 . HA 1 1 344 1 2 1 1 46 GLU H . 46 . HN 1 1 345 1 1 1 1 45 LYS HB2 . 45 . HB2 1 1 345 1 2 1 1 46 GLU H . 46 . HN 1 1 346 1 1 1 1 45 LYS HB3 . 45 . HB1 1 1 346 1 2 1 1 46 GLU H . 46 . HN 1 1 347 1 1 1 1 45 LYS QG . 45 . HG# 1 1 347 1 2 1 1 46 GLU H . 46 . HN 1 1 348 1 1 1 1 3 CYS H . 3 . HN 1 1 348 1 2 1 1 46 GLU H . 46 . HN 1 1 349 1 1 1 1 2 THR MG . 2 . HG2# 1 1 349 1 2 1 1 46 GLU HA . 46 . HA 1 1 350 1 1 1 1 45 LYS QG . 45 . HG# 1 1 350 1 2 1 1 46 GLU QB . 46 . HB# 1 1 351 1 1 1 1 1 ALA MB . 1 . HB# 1 1 351 1 2 1 1 46 GLU QB . 46 . HB# 1 1 352 1 1 1 1 46 GLU HA . 46 . HA 1 1 352 1 2 1 1 47 CYS H . 47 . HN 1 1 353 1 1 1 1 2 THR HA . 2 . HA 1 1 353 1 2 1 1 47 CYS H . 47 . HN 1 1 354 1 1 1 1 46 GLU QB . 46 . HB# 1 1 354 1 2 1 1 47 CYS H . 47 . HN 1 1 355 1 1 1 1 46 GLU QG . 46 . HG# 1 1 355 1 2 1 1 47 CYS H . 47 . HN 1 1 356 1 1 1 1 3 CYS H . 3 . HN 1 1 356 1 2 1 1 47 CYS H . 47 . HN 1 1 357 1 1 1 1 1 ALA HA . 1 . HA 1 1 357 1 2 1 1 47 CYS H . 47 . HN 1 1 358 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 358 1 2 1 1 47 CYS HA . 47 . HA 1 1 359 1 1 1 1 45 LYS QE . 45 . HE# 1 1 359 1 2 1 1 47 CYS HA . 47 . HA 1 1 360 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 360 1 2 1 1 47 CYS HB3 . 47 . HB1 1 1 361 1 1 1 1 45 LYS QE . 45 . HE# 1 1 361 1 2 1 1 47 CYS HB3 . 47 . HB1 1 1 362 1 1 1 1 45 LYS QG . 45 . HG# 1 1 362 1 2 1 1 47 CYS HB3 . 47 . HB1 1 1 363 1 1 1 1 3 CYS H . 3 . HN 1 1 363 1 2 1 1 45 LYS H . 45 . HN 1 1 364 1 1 1 1 4 LYS HA . 4 . HA 1 1 364 1 2 1 1 45 LYS H . 45 . HN 1 1 365 1 1 1 1 5 ALA H . 5 . HN 1 1 365 1 2 1 1 43 CYS H . 43 . HN 1 1 366 1 1 1 1 5 ALA H . 5 . HN 1 1 366 1 2 1 1 44 THR HA . 44 . HA 1 1 367 1 1 1 1 6 GLU HA . 6 . HA 1 1 367 1 2 1 1 43 CYS H . 43 . HN 1 1 368 1 1 1 1 6 GLU HA . 6 . HA 1 1 368 1 2 1 1 42 LEU HA . 42 . HA 1 1 369 1 1 1 1 7 CYS H . 7 . HN 1 1 369 1 2 1 1 42 LEU HA . 42 . HA 1 1 370 1 1 1 1 31 ASP H . 31 . HN 1 1 370 1 2 1 1 45 LYS HA . 45 . HA 1 1 371 1 1 1 1 31 ASP H . 31 . HN 1 1 371 1 2 1 1 44 THR H . 44 . HN 1 1 372 1 1 1 1 32 GLY QA . 32 . HA# 1 1 372 1 2 1 1 44 THR H . 44 . HN 1 1 373 1 1 1 1 33 HIS H . 33 . HN 1 1 373 1 2 1 1 42 LEU H . 42 . HN 1 1 374 1 1 1 1 34 CYS HA . 34 . HA 1 1 374 1 2 1 1 42 LEU H . 42 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 5.0 0.0 5.0 1 1 2 1 . . . . . 2.8 0.0 2.8 1 1 3 1 . . . . . 2.8 0.0 4.3 1 1 4 1 . . . . . 4.5 0.0 6.0 1 1 5 1 . . . . . 5.0 0.0 5.0 1 1 6 1 . . . . . 3.0 0.0 4.5 1 1 7 1 . . . . . 4.0 0.0 7.0 1 1 8 1 . . . . . 4.5 0.0 4.5 1 1 9 1 . . . . . 3.5 0.0 5.5 1 1 10 1 . . . . . 4.5 0.0 5.5 1 1 11 1 . . . . . 3.5 0.0 3.5 1 1 12 1 . . . . . 3.5 0.0 3.5 1 1 13 1 . . . . . 4.5 0.0 4.5 1 1 14 1 . . . . . 2.3 0.3 2.3 1 1 15 1 . . . . . 3.5 0.0 3.5 1 1 16 1 . . . . . 4.5 0.0 4.5 1 1 17 1 . . . . . 5.0 0.0 7.5 1 1 18 1 . . . . . 3.0 0.0 5.5 1 1 19 1 . . . . . 4.5 0.0 6.5 1 1 20 1 . . . . . 4.0 0.0 5.0 1 1 21 1 . . . . . 4.5 0.0 5.5 1 1 22 1 . . . . . 4.5 0.0 4.5 1 1 23 1 . . . . . 2.3 0.3 2.3 1 1 24 1 . . . . . 4.5 0.0 6.5 1 1 25 1 . . . . . 3.0 0.0 4.0 1 1 26 1 . . . . . 4.5 0.0 5.5 1 1 27 1 . . . . . 4.5 0.0 4.5 1 1 28 1 . . . . . 4.5 0.0 7.5 1 1 29 1 . . . . . 4.5 0.0 6.0 1 1 30 1 . . . . . 4.5 0.0 7.0 1 1 31 1 . . . . . 4.5 0.0 6.0 1 1 32 1 . . . . . 5.0 0.0 5.0 1 1 33 1 . . . . . 2.3 0.3 2.3 1 1 34 1 . . . . . 2.8 0.0 4.3 1 1 35 1 . . . . . 4.5 0.0 7.5 1 1 36 1 . . . . . 4.0 0.0 7.0 1 1 37 1 . . . . . 3.5 0.0 4.5 1 1 38 1 . . . . . 5.0 0.0 5.7 1 1 39 1 . . . . . 4.5 0.0 4.5 1 1 40 1 . . . . . 2.3 0.3 2.3 1 1 41 1 . . . . . 3.5 0.0 3.5 1 1 42 1 . . . . . 4.0 0.0 4.0 1 1 43 1 . . . . . 4.5 0.0 5.5 1 1 44 1 . . . . . 4.5 0.0 4.5 1 1 45 1 . . . . . 4.5 0.0 6.0 1 1 46 1 . . . . . 4.5 0.0 7.5 1 1 47 1 . . . . . 4.5 0.0 4.5 1 1 48 1 . . . . . 4.5 0.0 5.5 1 1 49 1 . . . . . 4.0 0.0 4.0 1 1 50 1 . . . . . 4.5 0.0 5.5 1 1 51 1 . . . . . 4.5 0.0 6.0 1 1 52 1 . . . . . 3.5 0.0 5.0 1 1 53 1 . . . . . 3.5 0.0 5.0 1 1 54 1 . . . . . 3.5 0.0 6.0 1 1 55 1 . . . . . 4.5 0.0 7.0 1 1 56 1 . . . . . 3.5 0.0 3.5 1 1 57 1 . . . . . 4.0 0.0 4.0 1 1 58 1 . . . . . 5.0 0.0 5.0 1 1 59 1 . . . . . 5.0 0.0 6.5 1 1 60 1 . . . . . 4.5 0.0 4.5 1 1 61 1 . . . . . 3.0 0.0 3.0 1 1 62 1 . . . . . 4.5 0.0 4.5 1 1 63 1 . . . . . . 0.0 4.5 1 1 64 1 . . . . . 5.0 0.0 5.0 1 1 65 1 . . . . . 3.0 0.0 3.0 1 1 66 1 . . . . . 4.0 0.0 4.0 1 1 67 1 . . . . . 4.0 0.0 4.0 1 1 68 1 . . . . . 3.5 0.0 3.5 1 1 69 1 . . . . . 4.5 0.0 5.5 1 1 70 1 . . . . . 4.5 0.0 5.5 1 1 71 1 . . . . . 4.5 0.0 4.5 1 1 72 1 . . . . . 4.5 0.0 4.5 1 1 73 1 . . . . . 5.5 0.0 5.5 1 1 74 1 . . . . . 4.5 0.0 4.5 1 1 75 1 . . . . . 3.5 0.0 3.5 1 1 76 1 . . . . . 4.0 0.0 4.0 1 1 77 1 . . . . . 5.0 0.0 5.0 1 1 78 1 . . . . . 4.0 0.0 5.0 1 1 79 1 . . . . . 5.0 0.0 6.0 1 1 80 1 . . . . . 3.5 0.0 3.5 1 1 81 1 . . . . . 4.5 0.0 4.5 1 1 82 1 . . . . . 4.5 0.0 4.5 1 1 83 1 . . . . . 3.0 0.0 3.0 1 1 84 1 . . . . . 3.0 0.0 3.0 1 1 85 1 . . . . . 3.5 0.0 4.5 1 1 86 1 . . . . . 2.8 0.0 2.8 1 1 87 1 . . . . . 4.5 0.0 5.5 1 1 88 1 . . . . . 5.0 0.0 6.0 1 1 89 1 . . . . . 4.5 0.0 4.5 1 1 90 1 . . . . . 4.5 0.0 4.5 1 1 91 1 . . . . . 4.5 0.0 5.5 1 1 92 1 . . . . . 5.0 0.0 6.0 1 1 93 1 . . . . . 5.0 0.0 5.0 1 1 94 1 . . . . . 2.3 0.3 2.3 1 1 95 1 . . . . . 4.5 0.0 4.5 1 1 96 1 . . . . . 3.0 0.0 3.0 1 1 97 1 . . . . . 4.0 0.0 4.0 1 1 98 1 . . . . . 3.5 0.0 3.5 1 1 99 1 . . . . . 2.8 0.0 2.8 1 1 100 1 . . . . . 2.8 0.0 3.8 1 1 101 1 . . . . . 4.5 0.0 5.5 1 1 102 1 . . . . . 4.5 0.0 5.5 1 1 103 1 . . . . . 4.5 0.0 5.5 1 1 104 1 . . . . . 5.0 0.0 6.0 1 1 105 1 . . . . . 5.0 0.0 8.0 1 1 106 1 . . . . . 2.8 0.0 2.8 1 1 107 1 . . . . . 4.5 0.0 6.0 1 1 108 1 . . . . . 4.5 0.0 5.5 1 1 109 1 . . . . . 4.0 0.0 6.0 1 1 110 1 . . . . . 5.0 0.0 6.0 1 1 111 1 . . . . . 2.8 0.0 2.8 1 1 112 1 . . . . . 4.5 0.0 4.5 1 1 113 1 . . . . . 5.0 0.0 5.0 1 1 114 1 . . . . . 2.8 0.0 2.8 1 1 115 1 . . . . . 4.0 0.0 4.0 1 1 116 1 . . . . . 3.0 0.0 3.0 1 1 117 1 . . . . . 4.5 0.0 6.0 1 1 118 1 . . . . . 5.0 0.0 5.0 1 1 119 1 . . . . . 4.5 0.0 4.5 1 1 120 1 . . . . . 5.0 0.0 6.5 1 1 121 1 . . . . . 4.5 0.0 4.5 1 1 122 1 . . . . . 4.5 0.0 4.5 1 1 123 1 . . . . . 4.5 0.0 5.5 1 1 124 1 . . . . . 5.0 0.0 5.0 1 1 125 1 . . . . . 2.8 0.0 2.8 1 1 126 1 . . . . . 4.5 0.0 4.5 1 1 127 1 . . . . . 3.5 0.0 3.5 1 1 128 1 . . . . . 4.0 0.0 5.0 1 1 129 1 . . . . . 3.0 2.0 4.0 1 1 130 1 . . . . . 3.5 0.0 3.5 1 1 131 1 . . . . . 3.0 0.0 4.5 1 1 132 1 . . . . . 5.0 0.0 6.0 1 1 133 1 . . . . . 3.0 0.0 5.0 1 1 134 1 . . . . . 4.5 0.0 6.5 1 1 135 1 . . . . . 4.0 0.0 5.0 1 1 136 1 . . . . . 4.5 0.0 5.5 1 1 137 1 . . . . . 4.5 0.0 4.5 1 1 138 1 . . . . . 4.5 0.0 4.5 1 1 139 1 . . . . . 4.5 0.0 4.5 1 1 140 1 . . . . . 4.0 0.0 4.0 1 1 141 1 . . . . . 3.5 0.0 4.5 1 1 142 1 . . . . . 3.5 0.0 4.5 1 1 143 1 . . . . . 4.0 0.0 4.0 1 1 144 1 . . . . . 3.5 0.0 3.5 1 1 145 1 . . . . . 2.8 0.0 2.8 1 1 146 1 . . . . . 3.0 0.0 4.0 1 1 147 1 . . . . . 4.0 0.0 4.0 1 1 148 1 . . . . . 4.5 0.0 4.5 1 1 149 1 . . . . . 4.5 0.0 5.5 1 1 150 1 . . . . . 4.5 0.0 4.5 1 1 151 1 . . . . . 3.0 0.0 4.5 1 1 152 1 . . . . . 4.0 0.0 5.5 1 1 153 1 . . . . . 4.0 0.0 5.5 1 1 154 1 . . . . . 3.5 0.0 6.0 1 1 155 1 . . . . . 4.0 0.0 6.5 1 1 156 1 . . . . . 3.5 0.0 3.5 1 1 157 1 . . . . . 2.8 0.0 2.8 1 1 158 1 . . . . . 4.0 0.0 5.5 1 1 159 1 . . . . . 4.5 0.0 6.0 1 1 160 1 . . . . . 3.5 0.0 3.5 1 1 161 1 . . . . . 4.5 0.0 4.5 1 1 162 1 . . . . . 2.8 0.0 4.3 1 1 163 1 . . . . . 3.5 0.0 3.5 1 1 164 1 . . . . . 3.0 0.0 3.0 1 1 165 1 . . . . . 4.5 0.0 4.5 1 1 166 1 . . . . . 3.0 0.0 3.0 1 1 167 1 . . . . . 3.5 0.0 3.5 1 1 168 1 . . . . . 4.0 0.0 4.0 1 1 169 1 . . . . . 4.0 0.0 4.0 1 1 170 1 . . . . . 2.8 0.0 4.3 1 1 171 1 . . . . . 4.5 0.0 4.5 1 1 172 1 . . . . . 4.0 0.0 4.0 1 1 173 1 . . . . . 3.0 0.0 3.0 1 1 174 1 . . . . . 5.0 0.0 6.5 1 1 175 1 . . . . . 5.0 0.0 6.5 1 1 176 1 . . . . . 4.5 0.0 4.5 1 1 177 1 . . . . . 4.5 0.0 4.5 1 1 178 1 . . . . . 3.5 0.0 3.5 1 1 179 1 . . . . . 4.0 0.0 5.0 1 1 180 1 . . . . . 4.5 0.0 4.5 1 1 181 1 . . . . . 3.5 0.0 3.5 1 1 182 1 . . . . . 4.5 0.0 4.5 1 1 183 1 . . . . . 4.5 0.0 4.5 1 1 184 1 . . . . . 3.0 0.0 5.5 1 1 185 1 . . . . . 2.8 0.0 2.8 1 1 186 1 . . . . . 4.0 0.0 4.0 1 1 187 1 . . . . . 2.8 0.0 3.8 1 1 188 1 . . . . . 2.8 0.0 2.8 1 1 189 1 . . . . . 3.5 0.0 3.5 1 1 190 1 . . . . . 3.5 0.0 4.5 1 1 191 1 . . . . . 4.5 0.0 4.5 1 1 192 1 . . . . . 4.5 0.0 6.5 1 1 193 1 . . . . . 3.0 0.0 5.5 1 1 194 1 . . . . . 3.0 0.0 5.5 1 1 195 1 . . . . . 2.8 0.0 2.8 1 1 196 1 . . . . . 3.5 0.0 3.5 1 1 197 1 . . . . . 3.5 0.0 5.0 1 1 198 1 . . . . . 3.5 0.0 4.0 1 1 199 1 . . . . . 2.8 0.0 2.8 1 1 200 1 . . . . . 3.0 0.0 3.0 1 1 201 1 . . . . . 4.5 0.0 4.5 1 1 202 1 . . . . . 3.5 0.0 3.5 1 1 203 1 . . . . . 5.0 0.0 5.0 1 1 204 1 . . . . . 5.0 0.0 5.0 1 1 205 1 . . . . . 4.5 0.0 6.0 1 1 206 1 . . . . . 3.5 0.0 3.5 1 1 207 1 . . . . . 4.5 0.0 4.5 1 1 208 1 . . . . . 3.0 0.0 3.0 1 1 209 1 . . . . . 4.0 0.0 4.0 1 1 210 1 . . . . . 4.5 0.0 4.5 1 1 211 1 . . . . . 5.0 0.0 5.0 1 1 212 1 . . . . . 5.0 0.0 6.5 1 1 213 1 . . . . . 2.8 0.0 4.8 1 1 214 1 . . . . . 4.0 0.0 6.0 1 1 215 1 . . . . . 4.0 0.0 6.0 1 1 216 1 . . . . . 3.5 0.0 6.5 1 1 217 1 . . . . . 4.5 0.0 6.5 1 1 218 1 . . . . . 3.5 0.0 6.5 1 1 219 1 . . . . . 3.0 0.0 5.0 1 1 220 1 . . . . . 4.0 0.0 6.0 1 1 221 1 . . . . . 4.0 0.0 7.0 1 1 222 1 . . . . . 4.0 0.0 6.0 1 1 223 1 . . . . . 2.3 0.3 5.3 1 1 224 1 . . . . . 2.8 0.0 6.3 1 1 225 1 . . . . . 4.0 0.0 7.0 1 1 226 1 . . . . . 5.0 0.0 8.5 1 1 227 1 . . . . . 2.3 0.3 5.8 1 1 228 1 . . . . . 2.8 0.0 2.8 1 1 229 1 . . . . . 4.0 0.0 4.0 1 1 230 1 . . . . . 3.0 0.0 3.0 1 1 231 1 . . . . . 3.0 0.0 3.0 1 1 232 1 . . . . . 4.0 0.0 6.0 1 1 233 1 . . . . . 3.5 0.0 3.5 1 1 234 1 . . . . . 3.0 0.0 3.0 1 1 235 1 . . . . . 3.5 0.0 3.5 1 1 236 1 . . . . . 3.5 0.0 4.5 1 1 237 1 . . . . . 3.0 0.0 3.0 1 1 238 1 . . . . . 4.5 0.0 4.5 1 1 239 1 . . . . . 3.5 0.0 5.0 1 1 240 1 . . . . . 4.0 0.0 5.5 1 1 241 1 . . . . . 4.5 0.0 4.5 1 1 242 1 . . . . . 2.3 0.0 2.3 1 1 243 1 . . . . . 4.0 0.0 4.0 1 1 244 1 . . . . . 4.0 0.0 4.0 1 1 245 1 . . . . . 3.5 0.0 3.5 1 1 246 1 . . . . . 2.3 0.0 3.8 1 1 247 1 . . . . . 3.0 0.0 4.5 1 1 248 1 . . . . . 2.8 0.0 3.8 1 1 249 1 . . . . . 4.5 0.0 4.5 1 1 250 1 . . . . . 2.3 0.3 3.3 1 1 251 1 . . . . . 4.5 0.0 4.5 1 1 252 1 . . . . . 5.0 0.0 5.0 1 1 253 1 . . . . . 4.5 0.0 4.5 1 1 254 1 . . . . . 4.0 0.0 5.0 1 1 255 1 . . . . . 4.0 0.0 5.0 1 1 256 1 . . . . . 3.5 0.0 4.5 1 1 257 1 . . . . . 4.0 0.0 4.0 1 1 258 1 . . . . . 3.5 0.0 3.5 1 1 259 1 . . . . . 4.5 0.0 5.5 1 1 260 1 . . . . . 3.0 0.0 3.0 1 1 261 1 . . . . . 4.5 0.0 4.5 1 1 262 1 . . . . . 4.0 0.0 4.0 1 1 263 1 . . . . . 5.0 0.0 5.0 1 1 264 1 . . . . . 3.5 0.0 3.5 1 1 265 1 . . . . . 3.5 0.0 3.5 1 1 266 1 . . . . . 4.0 0.0 5.0 1 1 267 1 . . . . . 4.5 0.0 5.5 1 1 268 1 . . . . . 4.0 0.0 4.0 1 1 269 1 . . . . . 5.0 0.0 6.0 1 1 270 1 . . . . . 5.0 0.0 6.0 1 1 271 1 . . . . . 4.0 0.0 8.0 1 1 272 1 . . . . . 2.8 0.0 2.8 1 1 273 1 . . . . . 4.0 0.0 5.0 1 1 274 1 . . . . . 4.5 0.0 5.5 1 1 275 1 . . . . . 5.0 0.0 7.0 1 1 276 1 . . . . . 4.5 0.0 6.5 1 1 277 1 . . . . . 4.5 0.0 5.5 1 1 278 1 . . . . . 4.5 0.0 6.5 1 1 279 1 . . . . . 4.0 0.0 4.0 1 1 280 1 . . . . . 4.0 0.0 4.0 1 1 281 1 . . . . . 3.5 0.0 4.5 1 1 282 1 . . . . . 4.0 0.0 4.0 1 1 283 1 . . . . . 4.0 0.0 4.0 1 1 284 1 . . . . . 4.0 0.0 4.0 1 1 285 1 . . . . . 5.0 0.0 6.0 1 1 286 1 . . . . . 5.0 0.0 6.0 1 1 287 1 . . . . . 4.5 0.0 5.5 1 1 288 1 . . . . . 4.5 0.0 4.5 1 1 289 1 . . . . . 4.5 0.0 4.5 1 1 290 1 . . . . . 4.0 0.0 4.0 1 1 291 1 . . . . . 5.0 0.0 5.0 1 1 292 1 . . . . . 4.5 0.0 4.5 1 1 293 1 . . . . . 3.5 0.0 6.0 1 1 294 1 . . . . . 4.0 0.0 6.5 1 1 295 1 . . . . . 5.0 0.0 7.5 1 1 296 1 . . . . . 3.5 0.0 6.0 1 1 297 1 . . . . . 4.5 0.0 6.5 1 1 298 1 . . . . . 5.0 0.0 6.0 1 1 299 1 . . . . . 4.5 0.0 6.0 1 1 300 1 . . . . . 4.5 0.0 4.5 1 1 301 1 . . . . . 3.5 0.0 3.5 1 1 302 1 . . . . . 4.5 0.0 4.5 1 1 303 1 . . . . . 4.5 0.0 8.5 1 1 304 1 . . . . . 5.0 0.0 9.0 1 1 305 1 . . . . . 4.0 0.0 8.0 1 1 306 1 . . . . . 5.0 0.0 6.5 1 1 307 1 . . . . . 3.0 0.0 3.5 1 1 308 1 . . . . . 3.5 0.0 4.5 1 1 309 1 . . . . . 4.5 0.0 5.5 1 1 310 1 . . . . . 2.3 0.3 2.3 1 1 311 1 . . . . . 5.0 0.0 5.0 1 1 312 1 . . . . . 4.0 0.0 8.0 1 1 313 1 . . . . . 4.0 0.0 8.0 1 1 314 1 . . . . . 4.5 0.0 5.5 1 1 315 1 . . . . . 4.5 0.0 5.5 1 1 316 1 . . . . . 4.5 0.0 5.5 1 1 317 1 . . . . . 2.3 0.3 2.3 1 1 318 1 . . . . . 4.5 0.0 4.5 1 1 319 1 . . . . . 5.0 0.0 5.0 1 1 320 1 . . . . . 4.5 0.0 7.5 1 1 321 1 . . . . . 5.0 0.0 5.0 1 1 322 1 . . . . . 4.5 0.0 4.5 1 1 323 1 . . . . . . 0.0 3.6 1 1 324 1 . . . . . 4.5 0.0 6.0 1 1 325 1 . . . . . 5.0 0.0 5.0 1 1 326 1 . . . . . 2.3 0.3 2.3 1 1 327 1 . . . . . 3.5 0.0 3.5 1 1 328 1 . . . . . 4.5 0.0 4.5 1 1 329 1 . . . . . 4.5 0.0 6.5 1 1 330 1 . . . . . 4.0 0.0 4.0 1 1 331 1 . . . . . 4.5 0.0 4.5 1 1 332 1 . . . . . 4.5 0.0 4.5 1 1 333 1 . . . . . 5.0 0.0 5.0 1 1 334 1 . . . . . 3.5 0.0 5.0 1 1 335 1 . . . . . 2.8 0.0 4.3 1 1 336 1 . . . . . 2.3 0.3 2.3 1 1 337 1 . . . . . 3.0 0.0 3.0 1 1 338 1 . . . . . 3.5 0.0 5.0 1 1 339 1 . . . . . 4.5 0.0 4.5 1 1 340 1 . . . . . 4.5 0.0 4.5 1 1 341 1 . . . . . 4.5 0.0 4.5 1 1 342 1 . . . . . 3.0 0.0 4.0 1 1 343 1 . . . . . 4.0 0.0 5.0 1 1 344 1 . . . . . 4.5 0.0 4.5 1 1 345 1 . . . . . 3.5 0.0 3.5 1 1 346 1 . . . . . 4.5 0.0 4.5 1 1 347 1 . . . . . 4.0 0.0 5.0 1 1 348 1 . . . . . 5.0 0.0 5.0 1 1 349 1 . . . . . 4.0 0.0 5.5 1 1 350 1 . . . . . 4.0 0.0 6.0 1 1 351 1 . . . . . 4.0 0.0 6.5 1 1 352 1 . . . . . 2.3 0.0 2.3 1 1 353 1 . . . . . 4.5 0.0 4.5 1 1 354 1 . . . . . 4.0 0.0 5.0 1 1 355 1 . . . . . 3.5 0.0 4.5 1 1 356 1 . . . . . 4.5 0.0 4.5 1 1 357 1 . . . . . 4.5 3.5 4.5 1 1 358 1 . . . . . 4.5 0.0 5.2 1 1 359 1 . . . . . 5.0 0.0 6.0 1 1 360 1 . . . . . 4.5 0.0 4.5 1 1 361 1 . . . . . 5.0 0.0 6.0 1 1 362 1 . . . . . 4.5 0.0 5.5 1 1 363 1 . . . . . 4.0 0.0 4.0 1 1 364 1 . . . . . 3.5 0.0 3.9 1 1 365 1 . . . . . 3.3 0.0 3.7 1 1 366 1 . . . . . 3.5 0.0 3.9 1 1 367 1 . . . . . 3.2 0.0 3.6 1 1 368 1 . . . . . 2.3 0.0 2.5 1 1 369 1 . . . . . 3.2 0.0 3.6 1 1 370 1 . . . . . 4.5 0.0 4.5 1 1 371 1 . . . . . 3.3 0.0 3.7 1 1 372 1 . . . . . 3.2 0.0 4.6 1 1 373 1 . . . . . 4.0 0.0 4.5 1 1 374 1 . . . . . 4.5 0.0 4.5 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 5 ALA H . 5 . HN 1 2 1 1 2 1 1 43 CYS O . 43 . O 1 2 2 1 1 1 1 5 ALA N . 5 . N 1 2 2 1 2 1 1 43 CYS O . 43 . O 1 2 3 1 1 1 1 7 CYS H . 7 . HN 1 2 3 1 2 1 1 41 CYS O . 41 . O 1 2 4 1 1 1 1 7 CYS N . 7 . N 1 2 4 1 2 1 1 41 CYS O . 41 . O 1 2 5 1 1 1 1 17 LYS O . 17 . O 1 2 5 1 2 1 1 21 VAL H . 21 . HN 1 2 6 1 1 1 1 17 LYS O . 17 . O 1 2 6 1 2 1 1 21 VAL N . 21 . N 1 2 7 1 1 1 1 18 LYS O . 18 . O 1 2 7 1 2 1 1 22 ALA H . 22 . HN 1 2 8 1 1 1 1 18 LYS O . 18 . O 1 2 8 1 2 1 1 22 ALA N . 22 . N 1 2 9 1 1 1 1 19 PRO O . 19 . O 1 2 9 1 2 1 1 23 CYS H . 23 . HN 1 2 10 1 1 1 1 19 PRO O . 19 . O 1 2 10 1 2 1 1 23 CYS N . 23 . N 1 2 11 1 1 1 1 20 CYS O . 20 . O 1 2 11 1 2 1 1 24 CYS H . 24 . HN 1 2 12 1 1 1 1 20 CYS O . 20 . O 1 2 12 1 2 1 1 24 CYS N . 24 . N 1 2 13 1 1 1 1 21 VAL O . 21 . O 1 2 13 1 2 1 1 25 LYS H . 25 . HN 1 2 14 1 1 1 1 21 VAL O . 21 . O 1 2 14 1 2 1 1 25 LYS N . 25 . N 1 2 15 1 1 1 1 22 ALA O . 22 . O 1 2 15 1 2 1 1 26 LYS H . 26 . HN 1 2 16 1 1 1 1 22 ALA O . 22 . O 1 2 16 1 2 1 1 26 LYS N . 26 . N 1 2 17 1 1 1 1 23 CYS O . 23 . O 1 2 17 1 2 1 1 27 ALA H . 27 . HN 1 2 18 1 1 1 1 23 CYS O . 23 . O 1 2 18 1 2 1 1 27 ALA N . 27 . N 1 2 19 1 1 1 1 25 LYS O . 25 . O 1 2 19 1 2 1 1 28 LYS H . 28 . HN 1 2 20 1 1 1 1 25 LYS O . 25 . O 1 2 20 1 2 1 1 28 LYS N . 28 . N 1 2 21 1 1 1 1 24 CYS O . 24 . O 1 2 21 1 2 1 1 29 PHE H . 29 . HN 1 2 22 1 1 1 1 24 CYS O . 24 . O 1 2 22 1 2 1 1 29 PHE N . 29 . N 1 2 23 1 1 1 1 33 HIS H . 33 . HN 1 2 23 1 2 1 1 42 LEU O . 42 . O 1 2 24 1 1 1 1 33 HIS N . 33 . N 1 2 24 1 2 1 1 42 LEU O . 42 . O 1 2 25 1 1 1 1 5 ALA O . 5 . O 1 2 25 1 2 1 1 43 CYS H . 43 . HN 1 2 26 1 1 1 1 5 ALA O . 5 . O 1 2 26 1 2 1 1 43 CYS N . 43 . N 1 2 27 1 1 1 1 31 ASP O . 31 . O 1 2 27 1 2 1 1 44 THR H . 44 . HN 1 2 28 1 1 1 1 31 ASP O . 31 . O 1 2 28 1 2 1 1 44 THR N . 44 . N 1 2 29 1 1 1 1 3 CYS O . 3 . O 1 2 29 1 2 1 1 45 LYS H . 45 . HN 1 2 30 1 1 1 1 3 CYS O . 3 . O 1 2 30 1 2 1 1 45 LYS N . 45 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.9 1.3 2.2 1 2 2 1 . . . . . 2.7 2.1 3.0 1 2 3 1 . . . . . 1.9 1.3 2.2 1 2 4 1 . . . . . 2.7 2.1 3.0 1 2 5 1 . . . . . 1.9 1.3 2.2 1 2 6 1 . . . . . 2.7 2.1 3.0 1 2 7 1 . . . . . 1.9 1.3 2.2 1 2 8 1 . . . . . 2.7 2.1 3.0 1 2 9 1 . . . . . 1.9 1.3 2.2 1 2 10 1 . . . . . 2.7 2.1 3.0 1 2 11 1 . . . . . 1.9 1.3 2.2 1 2 12 1 . . . . . 2.7 2.1 3.0 1 2 13 1 . . . . . 1.9 1.3 2.2 1 2 14 1 . . . . . 2.7 2.1 3.0 1 2 15 1 . . . . . 1.9 1.3 2.2 1 2 16 1 . . . . . 2.7 2.1 3.0 1 2 17 1 . . . . . 1.9 1.3 2.2 1 2 18 1 . . . . . 2.7 2.1 3.0 1 2 19 1 . . . . . 1.9 1.3 2.2 1 2 20 1 . . . . . 2.7 2.1 3.0 1 2 21 1 . . . . . 1.9 1.3 2.2 1 2 22 1 . . . . . 2.7 2.1 3.0 1 2 23 1 . . . . . 1.9 1.3 2.2 1 2 24 1 . . . . . 2.7 2.1 3.0 1 2 25 1 . . . . . 1.9 1.3 2.2 1 2 26 1 . . . . . 2.7 2.1 3.0 1 2 27 1 . . . . . 1.9 1.3 2.2 1 2 28 1 . . . . . 2.7 2.1 3.0 1 2 29 1 . . . . . 1.9 1.3 2.2 1 2 30 1 . . . . . 2.7 2.1 3.0 1 2 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 ALA C C -8.785 9.592 -9.387 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -9.535 10.105 -10.614 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -9.669 11.620 -10.565 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -10.841 8.695 -11.397 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -11.569 10.175 -11.023 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H -11.152 9.102 -9.783 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H -8.979 9.844 -11.500 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H -10.040 11.918 -9.596 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H -10.358 11.945 -11.330 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H -8.703 12.072 -10.735 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N -10.868 9.476 -10.710 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O -8.095 10.347 -8.702 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 THR C C -8.038 6.203 -8.258 1.00 . A A . 2 THR C 1 1 1 14 1 1 2 THR CA C -8.266 7.682 -7.972 1.00 . A A . 2 THR CA 1 1 1 15 1 1 2 THR CB C -9.103 7.835 -6.685 1.00 . A A . 2 THR CB 1 1 1 16 1 1 2 THR CG2 C -8.296 7.435 -5.457 1.00 . A A . 2 THR CG2 1 1 1 17 1 1 2 THR H H -9.483 7.745 -9.689 1.00 . A A . 2 THR H 1 1 1 18 1 1 2 THR HA H -7.312 8.169 -7.827 1.00 . A A . 2 THR HA 1 1 1 19 1 1 2 THR HB H -9.968 7.191 -6.757 1.00 . A A . 2 THR HB 1 1 1 20 1 1 2 THR HG1 H -8.856 9.786 -6.884 1.00 . A A . 2 THR HG1 1 1 1 21 1 1 2 THR HG21 H -7.941 8.322 -4.954 1.00 . A A . 2 THR HG21 1 1 1 22 1 1 2 THR HG22 H -7.454 6.831 -5.760 1.00 . A A . 2 THR HG22 1 1 1 23 1 1 2 THR HG23 H -8.922 6.867 -4.784 1.00 . A A . 2 THR HG23 1 1 1 24 1 1 2 THR N N -8.928 8.302 -9.110 1.00 . A A . 2 THR N 1 1 1 25 1 1 2 THR O O -8.984 5.478 -8.566 1.00 . A A . 2 THR O 1 1 1 26 1 1 2 THR OG1 O -9.541 9.194 -6.548 1.00 . A A . 2 THR OG1 1 1 1 27 1 1 3 CYS C C -5.793 3.720 -7.243 1.00 . A A . 3 CYS C 1 1 1 28 1 1 3 CYS CA C -6.468 4.369 -8.444 1.00 . A A . 3 CYS CA 1 1 1 29 1 1 3 CYS CB C -5.582 4.263 -9.689 1.00 . A A . 3 CYS CB 1 1 1 30 1 1 3 CYS H H -6.071 6.388 -7.939 1.00 . A A . 3 CYS H 1 1 1 31 1 1 3 CYS HA H -7.395 3.850 -8.635 1.00 . A A . 3 CYS HA 1 1 1 32 1 1 3 CYS HB2 H -4.798 5.007 -9.632 1.00 . A A . 3 CYS HB2 1 1 1 33 1 1 3 CYS HB3 H -5.139 3.278 -9.727 1.00 . A A . 3 CYS HB3 1 1 1 34 1 1 3 CYS N N -6.793 5.762 -8.175 1.00 . A A . 3 CYS N 1 1 1 35 1 1 3 CYS O O -4.941 4.328 -6.593 1.00 . A A . 3 CYS O 1 1 1 36 1 1 3 CYS SG S -6.477 4.534 -11.251 1.00 . A A . 3 CYS SG 1 1 1 37 1 1 4 LYS C C -5.223 0.344 -6.267 1.00 . A A . 4 LYS C 1 1 1 38 1 1 4 LYS CA C -5.640 1.739 -5.831 1.00 . A A . 4 LYS CA 1 1 1 39 1 1 4 LYS CB C -6.670 1.617 -4.708 1.00 . A A . 4 LYS CB 1 1 1 40 1 1 4 LYS CD C -7.257 0.209 -2.704 1.00 . A A . 4 LYS CD 1 1 1 41 1 1 4 LYS CE C -7.929 -0.905 -3.503 1.00 . A A . 4 LYS CE 1 1 1 42 1 1 4 LYS CG C -6.141 0.873 -3.491 1.00 . A A . 4 LYS CG 1 1 1 43 1 1 4 LYS H H -6.875 2.064 -7.513 1.00 . A A . 4 LYS H 1 1 1 44 1 1 4 LYS HA H -4.771 2.264 -5.459 1.00 . A A . 4 LYS HA 1 1 1 45 1 1 4 LYS HB2 H -6.971 2.607 -4.398 1.00 . A A . 4 LYS HB2 1 1 1 46 1 1 4 LYS HB3 H -7.534 1.086 -5.081 1.00 . A A . 4 LYS HB3 1 1 1 47 1 1 4 LYS HD2 H -6.842 -0.210 -1.799 1.00 . A A . 4 LYS HD2 1 1 1 48 1 1 4 LYS HD3 H -7.996 0.955 -2.450 1.00 . A A . 4 LYS HD3 1 1 1 49 1 1 4 LYS HE2 H -8.716 -1.335 -2.902 1.00 . A A . 4 LYS HE2 1 1 1 50 1 1 4 LYS HE3 H -8.356 -0.478 -4.399 1.00 . A A . 4 LYS HE3 1 1 1 51 1 1 4 LYS HG2 H -5.448 0.114 -3.820 1.00 . A A . 4 LYS HG2 1 1 1 52 1 1 4 LYS HG3 H -5.629 1.575 -2.848 1.00 . A A . 4 LYS HG3 1 1 1 53 1 1 4 LYS HZ1 H -6.085 -1.900 -3.338 1.00 . A A . 4 LYS HZ1 1 1 1 54 1 1 4 LYS HZ2 H -6.745 -1.919 -4.898 1.00 . A A . 4 LYS HZ2 1 1 1 55 1 1 4 LYS HZ3 H -7.387 -2.919 -3.699 1.00 . A A . 4 LYS HZ3 1 1 1 56 1 1 4 LYS N N -6.189 2.486 -6.954 1.00 . A A . 4 LYS N 1 1 1 57 1 1 4 LYS NZ N -6.974 -1.983 -3.889 1.00 . A A . 4 LYS NZ 1 1 1 58 1 1 4 LYS O O -5.930 -0.321 -7.023 1.00 . A A . 4 LYS O 1 1 1 59 1 1 5 ALA C C -2.591 -1.786 -4.939 1.00 . A A . 5 ALA C 1 1 1 60 1 1 5 ALA CA C -3.554 -1.410 -6.043 1.00 . A A . 5 ALA CA 1 1 1 61 1 1 5 ALA CB C -2.856 -1.428 -7.396 1.00 . A A . 5 ALA CB 1 1 1 62 1 1 5 ALA H H -3.593 0.492 -5.134 1.00 . A A . 5 ALA H 1 1 1 63 1 1 5 ALA HA H -4.372 -2.116 -6.063 1.00 . A A . 5 ALA HA 1 1 1 64 1 1 5 ALA HB1 H -3.020 -2.382 -7.874 1.00 . A A . 5 ALA HB1 1 1 1 65 1 1 5 ALA HB2 H -1.796 -1.273 -7.256 1.00 . A A . 5 ALA HB2 1 1 1 66 1 1 5 ALA HB3 H -3.255 -0.640 -8.018 1.00 . A A . 5 ALA HB3 1 1 1 67 1 1 5 ALA N N -4.090 -0.093 -5.755 1.00 . A A . 5 ALA N 1 1 1 68 1 1 5 ALA O O -1.728 -0.990 -4.576 1.00 . A A . 5 ALA O 1 1 1 69 1 1 6 GLU C C -0.501 -3.651 -3.806 1.00 . A A . 6 GLU C 1 1 1 70 1 1 6 GLU CA C -1.902 -3.401 -3.291 1.00 . A A . 6 GLU CA 1 1 1 71 1 1 6 GLU CB C -2.442 -4.662 -2.590 1.00 . A A . 6 GLU CB 1 1 1 72 1 1 6 GLU CD C -4.841 -3.731 -2.529 1.00 . A A . 6 GLU CD 1 1 1 73 1 1 6 GLU CG C -3.731 -4.460 -1.784 1.00 . A A . 6 GLU CG 1 1 1 74 1 1 6 GLU H H -3.474 -3.553 -4.683 1.00 . A A . 6 GLU H 1 1 1 75 1 1 6 GLU HA H -1.861 -2.596 -2.572 1.00 . A A . 6 GLU HA 1 1 1 76 1 1 6 GLU HB2 H -2.615 -5.429 -3.320 1.00 . A A . 6 GLU HB2 1 1 1 77 1 1 6 GLU HB3 H -1.682 -5.014 -1.907 1.00 . A A . 6 GLU HB3 1 1 1 78 1 1 6 GLU HG2 H -4.104 -5.430 -1.492 1.00 . A A . 6 GLU HG2 1 1 1 79 1 1 6 GLU HG3 H -3.489 -3.896 -0.894 1.00 . A A . 6 GLU HG3 1 1 1 80 1 1 6 GLU N N -2.755 -2.969 -4.378 1.00 . A A . 6 GLU N 1 1 1 81 1 1 6 GLU O O -0.324 -4.156 -4.916 1.00 . A A . 6 GLU O 1 1 1 82 1 1 6 GLU OE1 O -4.765 -2.490 -2.667 1.00 . A A . 6 GLU OE1 1 1 1 83 1 1 6 GLU OE2 O -5.800 -4.388 -2.978 1.00 . A A . 6 GLU OE2 1 1 1 84 1 1 7 CYS C C 2.132 -4.857 -3.885 1.00 . A A . 7 CYS C 1 1 1 85 1 1 7 CYS CA C 1.886 -3.450 -3.332 1.00 . A A . 7 CYS CA 1 1 1 86 1 1 7 CYS CB C 2.744 -3.186 -2.086 1.00 . A A . 7 CYS CB 1 1 1 87 1 1 7 CYS H H 0.235 -2.875 -2.129 1.00 . A A . 7 CYS H 1 1 1 88 1 1 7 CYS HA H 2.135 -2.724 -4.093 1.00 . A A . 7 CYS HA 1 1 1 89 1 1 7 CYS HB2 H 2.900 -2.122 -1.990 1.00 . A A . 7 CYS HB2 1 1 1 90 1 1 7 CYS HB3 H 2.212 -3.542 -1.216 1.00 . A A . 7 CYS HB3 1 1 1 91 1 1 7 CYS N N 0.476 -3.281 -2.993 1.00 . A A . 7 CYS N 1 1 1 92 1 1 7 CYS O O 1.810 -5.852 -3.235 1.00 . A A . 7 CYS O 1 1 1 93 1 1 7 CYS SG S 4.390 -3.978 -2.088 1.00 . A A . 7 CYS SG 1 1 1 94 1 1 8 PRO C C 3.779 -7.168 -4.934 1.00 . A A . 8 PRO C 1 1 1 95 1 1 8 PRO CA C 2.928 -6.233 -5.783 1.00 . A A . 8 PRO CA 1 1 1 96 1 1 8 PRO CB C 3.680 -5.829 -7.055 1.00 . A A . 8 PRO CB 1 1 1 97 1 1 8 PRO CD C 3.034 -3.803 -5.967 1.00 . A A . 8 PRO CD 1 1 1 98 1 1 8 PRO CG C 3.252 -4.427 -7.317 1.00 . A A . 8 PRO CG 1 1 1 99 1 1 8 PRO HA H 2.007 -6.731 -6.049 1.00 . A A . 8 PRO HA 1 1 1 100 1 1 8 PRO HB2 H 4.744 -5.894 -6.883 1.00 . A A . 8 PRO HB2 1 1 1 101 1 1 8 PRO HB3 H 3.400 -6.485 -7.866 1.00 . A A . 8 PRO HB3 1 1 1 102 1 1 8 PRO HD2 H 3.941 -3.334 -5.617 1.00 . A A . 8 PRO HD2 1 1 1 103 1 1 8 PRO HD3 H 2.228 -3.085 -6.010 1.00 . A A . 8 PRO HD3 1 1 1 104 1 1 8 PRO HG2 H 4.028 -3.901 -7.853 1.00 . A A . 8 PRO HG2 1 1 1 105 1 1 8 PRO HG3 H 2.333 -4.423 -7.885 1.00 . A A . 8 PRO HG3 1 1 1 106 1 1 8 PRO N N 2.671 -4.949 -5.116 1.00 . A A . 8 PRO N 1 1 1 107 1 1 8 PRO O O 3.476 -8.351 -4.792 1.00 . A A . 8 PRO O 1 1 1 108 1 1 9 THR C C 5.238 -7.340 -2.055 1.00 . A A . 9 THR C 1 1 1 109 1 1 9 THR CA C 5.719 -7.387 -3.503 1.00 . A A . 9 THR CA 1 1 1 110 1 1 9 THR CB C 7.157 -6.844 -3.599 1.00 . A A . 9 THR CB 1 1 1 111 1 1 9 THR CG2 C 7.876 -7.427 -4.805 1.00 . A A . 9 THR CG2 1 1 1 112 1 1 9 THR H H 5.011 -5.670 -4.491 1.00 . A A . 9 THR H 1 1 1 113 1 1 9 THR HA H 5.716 -8.412 -3.844 1.00 . A A . 9 THR HA 1 1 1 114 1 1 9 THR HB H 7.694 -7.124 -2.704 1.00 . A A . 9 THR HB 1 1 1 115 1 1 9 THR HG1 H 6.728 -5.043 -2.900 1.00 . A A . 9 THR HG1 1 1 1 116 1 1 9 THR HG21 H 8.622 -6.728 -5.153 1.00 . A A . 9 THR HG21 1 1 1 117 1 1 9 THR HG22 H 7.163 -7.614 -5.593 1.00 . A A . 9 THR HG22 1 1 1 118 1 1 9 THR HG23 H 8.355 -8.354 -4.525 1.00 . A A . 9 THR HG23 1 1 1 119 1 1 9 THR N N 4.832 -6.622 -4.355 1.00 . A A . 9 THR N 1 1 1 120 1 1 9 THR O O 6.025 -7.131 -1.133 1.00 . A A . 9 THR O 1 1 1 121 1 1 9 THR OG1 O 7.128 -5.410 -3.700 1.00 . A A . 9 THR OG1 1 1 1 122 1 1 10 TRP C C 2.347 -8.583 -0.332 1.00 . A A . 10 TRP C 1 1 1 123 1 1 10 TRP CA C 3.361 -7.469 -0.533 1.00 . A A . 10 TRP CA 1 1 1 124 1 1 10 TRP CB C 2.673 -6.125 -0.309 1.00 . A A . 10 TRP CB 1 1 1 125 1 1 10 TRP CD1 C 1.419 -6.057 1.911 1.00 . A A . 10 TRP CD1 1 1 1 126 1 1 10 TRP CD2 C 3.425 -5.062 1.946 1.00 . A A . 10 TRP CD2 1 1 1 127 1 1 10 TRP CE2 C 2.861 -4.964 3.231 1.00 . A A . 10 TRP CE2 1 1 1 128 1 1 10 TRP CE3 C 4.685 -4.502 1.714 1.00 . A A . 10 TRP CE3 1 1 1 129 1 1 10 TRP CG C 2.499 -5.781 1.129 1.00 . A A . 10 TRP CG 1 1 1 130 1 1 10 TRP CH2 C 4.750 -3.784 4.023 1.00 . A A . 10 TRP CH2 1 1 1 131 1 1 10 TRP CZ2 C 3.522 -4.323 4.282 1.00 . A A . 10 TRP CZ2 1 1 1 132 1 1 10 TRP CZ3 C 5.332 -3.867 2.754 1.00 . A A . 10 TRP CZ3 1 1 1 133 1 1 10 TRP H H 3.348 -7.665 -2.636 1.00 . A A . 10 TRP H 1 1 1 134 1 1 10 TRP HA H 4.158 -7.582 0.185 1.00 . A A . 10 TRP HA 1 1 1 135 1 1 10 TRP HB2 H 3.264 -5.346 -0.768 1.00 . A A . 10 TRP HB2 1 1 1 136 1 1 10 TRP HB3 H 1.696 -6.147 -0.770 1.00 . A A . 10 TRP HB3 1 1 1 137 1 1 10 TRP HD1 H 0.534 -6.583 1.562 1.00 . A A . 10 TRP HD1 1 1 1 138 1 1 10 TRP HE1 H 1.011 -5.677 3.943 1.00 . A A . 10 TRP HE1 1 1 1 139 1 1 10 TRP HE3 H 5.151 -4.554 0.740 1.00 . A A . 10 TRP HE3 1 1 1 140 1 1 10 TRP HH2 H 5.294 -3.277 4.806 1.00 . A A . 10 TRP HH2 1 1 1 141 1 1 10 TRP HZ2 H 3.096 -4.247 5.269 1.00 . A A . 10 TRP HZ2 1 1 1 142 1 1 10 TRP HZ3 H 6.302 -3.423 2.592 1.00 . A A . 10 TRP HZ3 1 1 1 143 1 1 10 TRP N N 3.936 -7.516 -1.863 1.00 . A A . 10 TRP N 1 1 1 144 1 1 10 TRP NE1 N 1.633 -5.585 3.188 1.00 . A A . 10 TRP NE1 1 1 1 145 1 1 10 TRP O O 1.293 -8.606 -0.970 1.00 . A A . 10 TRP O 1 1 1 146 1 1 11 ASP C C 1.981 -10.978 2.356 1.00 . A A . 11 ASP C 1 1 1 147 1 1 11 ASP CA C 1.774 -10.590 0.901 1.00 . A A . 11 ASP CA 1 1 1 148 1 1 11 ASP CB C 2.031 -11.784 -0.022 1.00 . A A . 11 ASP CB 1 1 1 149 1 1 11 ASP CG C 0.843 -12.724 -0.078 1.00 . A A . 11 ASP CG 1 1 1 150 1 1 11 ASP H H 3.504 -9.394 1.069 1.00 . A A . 11 ASP H 1 1 1 151 1 1 11 ASP HA H 0.757 -10.251 0.771 1.00 . A A . 11 ASP HA 1 1 1 152 1 1 11 ASP HB2 H 2.232 -11.424 -1.021 1.00 . A A . 11 ASP HB2 1 1 1 153 1 1 11 ASP HB3 H 2.888 -12.334 0.339 1.00 . A A . 11 ASP HB3 1 1 1 154 1 1 11 ASP N N 2.659 -9.482 0.581 1.00 . A A . 11 ASP N 1 1 1 155 1 1 11 ASP O O 2.227 -12.134 2.691 1.00 . A A . 11 ASP O 1 1 1 156 1 1 11 ASP OD1 O -0.261 -12.258 -0.439 1.00 . A A . 11 ASP OD1 1 1 1 157 1 1 11 ASP OD2 O 1.006 -13.917 0.232 1.00 . A A . 11 ASP OD2 1 1 1 158 1 1 12 SER C C 1.361 -9.094 5.429 1.00 . A A . 12 SER C 1 1 1 159 1 1 12 SER CA C 2.100 -10.174 4.647 1.00 . A A . 12 SER CA 1 1 1 160 1 1 12 SER CB C 3.594 -10.148 4.989 1.00 . A A . 12 SER CB 1 1 1 161 1 1 12 SER H H 1.727 -9.076 2.889 1.00 . A A . 12 SER H 1 1 1 162 1 1 12 SER HA H 1.693 -11.139 4.910 1.00 . A A . 12 SER HA 1 1 1 163 1 1 12 SER HB2 H 4.005 -9.185 4.723 1.00 . A A . 12 SER HB2 1 1 1 164 1 1 12 SER HB3 H 3.721 -10.313 6.048 1.00 . A A . 12 SER HB3 1 1 1 165 1 1 12 SER HG H 3.671 -11.682 3.763 1.00 . A A . 12 SER HG 1 1 1 166 1 1 12 SER N N 1.906 -9.978 3.221 1.00 . A A . 12 SER N 1 1 1 167 1 1 12 SER O O 0.819 -8.151 4.844 1.00 . A A . 12 SER O 1 1 1 168 1 1 12 SER OG O 4.298 -11.154 4.281 1.00 . A A . 12 SER OG 1 1 1 169 1 1 13 VAL C C 1.501 -7.035 7.821 1.00 . A A . 13 VAL C 1 1 1 170 1 1 13 VAL CA C 0.658 -8.292 7.613 1.00 . A A . 13 VAL CA 1 1 1 171 1 1 13 VAL CB C 0.345 -8.931 8.985 1.00 . A A . 13 VAL CB 1 1 1 172 1 1 13 VAL CG1 C -0.343 -7.939 9.912 1.00 . A A . 13 VAL CG1 1 1 1 173 1 1 13 VAL CG2 C -0.508 -10.179 8.810 1.00 . A A . 13 VAL CG2 1 1 1 174 1 1 13 VAL H H 1.783 -10.015 7.146 1.00 . A A . 13 VAL H 1 1 1 175 1 1 13 VAL HA H -0.275 -8.017 7.145 1.00 . A A . 13 VAL HA 1 1 1 176 1 1 13 VAL HB H 1.279 -9.224 9.442 1.00 . A A . 13 VAL HB 1 1 1 177 1 1 13 VAL HG11 H -0.803 -8.471 10.731 1.00 . A A . 13 VAL HG11 1 1 1 178 1 1 13 VAL HG12 H -1.100 -7.399 9.362 1.00 . A A . 13 VAL HG12 1 1 1 179 1 1 13 VAL HG13 H 0.386 -7.243 10.299 1.00 . A A . 13 VAL HG13 1 1 1 180 1 1 13 VAL HG21 H -1.553 -9.910 8.854 1.00 . A A . 13 VAL HG21 1 1 1 181 1 1 13 VAL HG22 H -0.284 -10.882 9.598 1.00 . A A . 13 VAL HG22 1 1 1 182 1 1 13 VAL HG23 H -0.292 -10.631 7.853 1.00 . A A . 13 VAL HG23 1 1 1 183 1 1 13 VAL N N 1.337 -9.241 6.745 1.00 . A A . 13 VAL N 1 1 1 184 1 1 13 VAL O O 2.638 -7.104 8.285 1.00 . A A . 13 VAL O 1 1 1 185 1 1 14 CYS C C 1.651 -4.192 9.100 1.00 . A A . 14 CYS C 1 1 1 186 1 1 14 CYS CA C 1.600 -4.611 7.634 1.00 . A A . 14 CYS CA 1 1 1 187 1 1 14 CYS CB C 0.888 -3.533 6.815 1.00 . A A . 14 CYS CB 1 1 1 188 1 1 14 CYS H H 0.014 -5.908 7.120 1.00 . A A . 14 CYS H 1 1 1 189 1 1 14 CYS HA H 2.609 -4.721 7.267 1.00 . A A . 14 CYS HA 1 1 1 190 1 1 14 CYS HB2 H 1.235 -3.579 5.793 1.00 . A A . 14 CYS HB2 1 1 1 191 1 1 14 CYS HB3 H -0.176 -3.718 6.837 1.00 . A A . 14 CYS HB3 1 1 1 192 1 1 14 CYS N N 0.925 -5.891 7.480 1.00 . A A . 14 CYS N 1 1 1 193 1 1 14 CYS O O 0.627 -4.158 9.787 1.00 . A A . 14 CYS O 1 1 1 194 1 1 14 CYS SG S 1.171 -1.838 7.421 1.00 . A A . 14 CYS SG 1 1 1 195 1 1 15 ILE C C 3.086 -1.915 11.033 1.00 . A A . 15 ILE C 1 1 1 196 1 1 15 ILE CA C 3.032 -3.439 10.946 1.00 . A A . 15 ILE CA 1 1 1 197 1 1 15 ILE CB C 4.328 -4.039 11.538 1.00 . A A . 15 ILE CB 1 1 1 198 1 1 15 ILE CD1 C 5.598 -6.232 11.842 1.00 . A A . 15 ILE CD1 1 1 1 199 1 1 15 ILE CG1 C 4.314 -5.565 11.396 1.00 . A A . 15 ILE CG1 1 1 1 200 1 1 15 ILE CG2 C 4.487 -3.639 13.001 1.00 . A A . 15 ILE CG2 1 1 1 201 1 1 15 ILE H H 3.617 -3.906 8.972 1.00 . A A . 15 ILE H 1 1 1 202 1 1 15 ILE HA H 2.193 -3.797 11.525 1.00 . A A . 15 ILE HA 1 1 1 203 1 1 15 ILE HB H 5.166 -3.641 10.988 1.00 . A A . 15 ILE HB 1 1 1 204 1 1 15 ILE HD11 H 5.841 -7.035 11.162 1.00 . A A . 15 ILE HD11 1 1 1 205 1 1 15 ILE HD12 H 5.471 -6.629 12.838 1.00 . A A . 15 ILE HD12 1 1 1 206 1 1 15 ILE HD13 H 6.399 -5.507 11.842 1.00 . A A . 15 ILE HD13 1 1 1 207 1 1 15 ILE HG12 H 3.510 -5.967 11.993 1.00 . A A . 15 ILE HG12 1 1 1 208 1 1 15 ILE HG13 H 4.149 -5.821 10.360 1.00 . A A . 15 ILE HG13 1 1 1 209 1 1 15 ILE HG21 H 5.383 -3.047 13.116 1.00 . A A . 15 ILE HG21 1 1 1 210 1 1 15 ILE HG22 H 4.562 -4.527 13.611 1.00 . A A . 15 ILE HG22 1 1 1 211 1 1 15 ILE HG23 H 3.630 -3.060 13.311 1.00 . A A . 15 ILE HG23 1 1 1 212 1 1 15 ILE N N 2.843 -3.863 9.568 1.00 . A A . 15 ILE N 1 1 1 213 1 1 15 ILE O O 2.600 -1.317 11.991 1.00 . A A . 15 ILE O 1 1 1 214 1 1 16 ASN C C 3.524 0.673 8.569 1.00 . A A . 16 ASN C 1 1 1 215 1 1 16 ASN CA C 3.788 0.160 9.983 1.00 . A A . 16 ASN CA 1 1 1 216 1 1 16 ASN CB C 5.179 0.585 10.475 1.00 . A A . 16 ASN CB 1 1 1 217 1 1 16 ASN CG C 5.297 2.080 10.717 1.00 . A A . 16 ASN CG 1 1 1 218 1 1 16 ASN H H 4.031 -1.817 9.277 1.00 . A A . 16 ASN H 1 1 1 219 1 1 16 ASN HA H 3.040 0.569 10.647 1.00 . A A . 16 ASN HA 1 1 1 220 1 1 16 ASN HB2 H 5.395 0.075 11.401 1.00 . A A . 16 ASN HB2 1 1 1 221 1 1 16 ASN HB3 H 5.914 0.301 9.735 1.00 . A A . 16 ASN HB3 1 1 1 222 1 1 16 ASN HD21 H 5.243 1.786 12.681 1.00 . A A . 16 ASN HD21 1 1 1 223 1 1 16 ASN HD22 H 5.369 3.432 12.168 1.00 . A A . 16 ASN HD22 1 1 1 224 1 1 16 ASN N N 3.672 -1.291 10.020 1.00 . A A . 16 ASN N 1 1 1 225 1 1 16 ASN ND2 N 5.308 2.473 11.982 1.00 . A A . 16 ASN ND2 1 1 1 226 1 1 16 ASN O O 3.733 -0.048 7.595 1.00 . A A . 16 ASN O 1 1 1 227 1 1 16 ASN OD1 O 5.373 2.875 9.782 1.00 . A A . 16 ASN OD1 1 1 1 228 1 1 17 LYS C C 3.963 2.718 6.313 1.00 . A A . 17 LYS C 1 1 1 229 1 1 17 LYS CA C 2.719 2.526 7.189 1.00 . A A . 17 LYS CA 1 1 1 230 1 1 17 LYS CB C 2.034 3.879 7.424 1.00 . A A . 17 LYS CB 1 1 1 231 1 1 17 LYS CD C 0.720 5.813 6.487 1.00 . A A . 17 LYS CD 1 1 1 232 1 1 17 LYS CE C -0.176 6.298 5.352 1.00 . A A . 17 LYS CE 1 1 1 233 1 1 17 LYS CG C 1.327 4.445 6.196 1.00 . A A . 17 LYS CG 1 1 1 234 1 1 17 LYS H H 2.885 2.416 9.294 1.00 . A A . 17 LYS H 1 1 1 235 1 1 17 LYS HA H 2.030 1.875 6.672 1.00 . A A . 17 LYS HA 1 1 1 236 1 1 17 LYS HB2 H 1.302 3.764 8.210 1.00 . A A . 17 LYS HB2 1 1 1 237 1 1 17 LYS HB3 H 2.779 4.593 7.743 1.00 . A A . 17 LYS HB3 1 1 1 238 1 1 17 LYS HD2 H 0.132 5.748 7.390 1.00 . A A . 17 LYS HD2 1 1 1 239 1 1 17 LYS HD3 H 1.521 6.525 6.630 1.00 . A A . 17 LYS HD3 1 1 1 240 1 1 17 LYS HE2 H -0.960 5.573 5.198 1.00 . A A . 17 LYS HE2 1 1 1 241 1 1 17 LYS HE3 H -0.615 7.243 5.639 1.00 . A A . 17 LYS HE3 1 1 1 242 1 1 17 LYS HG2 H 2.043 4.542 5.393 1.00 . A A . 17 LYS HG2 1 1 1 243 1 1 17 LYS HG3 H 0.540 3.767 5.900 1.00 . A A . 17 LYS HG3 1 1 1 244 1 1 17 LYS HZ1 H 0.793 5.553 3.655 1.00 . A A . 17 LYS HZ1 1 1 1 245 1 1 17 LYS HZ2 H 1.452 6.997 4.238 1.00 . A A . 17 LYS HZ2 1 1 1 246 1 1 17 LYS HZ3 H -0.012 7.020 3.389 1.00 . A A . 17 LYS HZ3 1 1 1 247 1 1 17 LYS N N 3.042 1.907 8.472 1.00 . A A . 17 LYS N 1 1 1 248 1 1 17 LYS NZ N 0.568 6.479 4.077 1.00 . A A . 17 LYS NZ 1 1 1 249 1 1 17 LYS O O 3.881 2.593 5.092 1.00 . A A . 17 LYS O 1 1 1 250 1 1 18 LYS C C 6.671 2.166 5.191 1.00 . A A . 18 LYS C 1 1 1 251 1 1 18 LYS CA C 6.357 3.276 6.209 1.00 . A A . 18 LYS CA 1 1 1 252 1 1 18 LYS CB C 7.531 3.469 7.176 1.00 . A A . 18 LYS CB 1 1 1 253 1 1 18 LYS CD C 8.675 4.962 8.853 1.00 . A A . 18 LYS CD 1 1 1 254 1 1 18 LYS CE C 8.947 3.833 9.835 1.00 . A A . 18 LYS CE 1 1 1 255 1 1 18 LYS CG C 7.411 4.716 8.040 1.00 . A A . 18 LYS CG 1 1 1 256 1 1 18 LYS H H 5.093 3.136 7.917 1.00 . A A . 18 LYS H 1 1 1 257 1 1 18 LYS HA H 6.225 4.196 5.657 1.00 . A A . 18 LYS HA 1 1 1 258 1 1 18 LYS HB2 H 7.590 2.610 7.828 1.00 . A A . 18 LYS HB2 1 1 1 259 1 1 18 LYS HB3 H 8.445 3.540 6.605 1.00 . A A . 18 LYS HB3 1 1 1 260 1 1 18 LYS HD2 H 9.513 5.046 8.178 1.00 . A A . 18 LYS HD2 1 1 1 261 1 1 18 LYS HD3 H 8.561 5.885 9.403 1.00 . A A . 18 LYS HD3 1 1 1 262 1 1 18 LYS HE2 H 8.136 3.786 10.545 1.00 . A A . 18 LYS HE2 1 1 1 263 1 1 18 LYS HE3 H 9.001 2.902 9.289 1.00 . A A . 18 LYS HE3 1 1 1 264 1 1 18 LYS HG2 H 7.236 5.568 7.401 1.00 . A A . 18 LYS HG2 1 1 1 265 1 1 18 LYS HG3 H 6.577 4.594 8.716 1.00 . A A . 18 LYS HG3 1 1 1 266 1 1 18 LYS HZ1 H 10.406 3.231 11.206 1.00 . A A . 18 LYS HZ1 1 1 1 267 1 1 18 LYS HZ2 H 10.176 4.906 11.141 1.00 . A A . 18 LYS HZ2 1 1 1 268 1 1 18 LYS HZ3 H 11.016 4.120 9.902 1.00 . A A . 18 LYS HZ3 1 1 1 269 1 1 18 LYS N N 5.101 3.040 6.939 1.00 . A A . 18 LYS N 1 1 1 270 1 1 18 LYS NZ N 10.225 4.036 10.573 1.00 . A A . 18 LYS NZ 1 1 1 271 1 1 18 LYS O O 6.830 2.466 4.009 1.00 . A A . 18 LYS O 1 1 1 272 1 1 19 PRO C C 6.146 -0.205 3.455 1.00 . A A . 19 PRO C 1 1 1 273 1 1 19 PRO CA C 7.045 -0.238 4.690 1.00 . A A . 19 PRO CA 1 1 1 274 1 1 19 PRO CB C 6.707 -1.467 5.539 1.00 . A A . 19 PRO CB 1 1 1 275 1 1 19 PRO CD C 6.607 0.399 7.002 1.00 . A A . 19 PRO CD 1 1 1 276 1 1 19 PRO CG C 7.021 -1.044 6.925 1.00 . A A . 19 PRO CG 1 1 1 277 1 1 19 PRO HA H 8.082 -0.267 4.393 1.00 . A A . 19 PRO HA 1 1 1 278 1 1 19 PRO HB2 H 5.658 -1.703 5.426 1.00 . A A . 19 PRO HB2 1 1 1 279 1 1 19 PRO HB3 H 7.304 -2.310 5.231 1.00 . A A . 19 PRO HB3 1 1 1 280 1 1 19 PRO HD2 H 5.579 0.480 7.325 1.00 . A A . 19 PRO HD2 1 1 1 281 1 1 19 PRO HD3 H 7.257 0.942 7.671 1.00 . A A . 19 PRO HD3 1 1 1 282 1 1 19 PRO HG2 H 6.456 -1.638 7.629 1.00 . A A . 19 PRO HG2 1 1 1 283 1 1 19 PRO HG3 H 8.080 -1.142 7.111 1.00 . A A . 19 PRO HG3 1 1 1 284 1 1 19 PRO N N 6.762 0.878 5.612 1.00 . A A . 19 PRO N 1 1 1 285 1 1 19 PRO O O 6.605 -0.365 2.319 1.00 . A A . 19 PRO O 1 1 1 286 1 1 20 CYS C C 4.163 1.265 1.708 1.00 . A A . 20 CYS C 1 1 1 287 1 1 20 CYS CA C 3.874 0.089 2.637 1.00 . A A . 20 CYS CA 1 1 1 288 1 1 20 CYS CB C 2.475 0.223 3.247 1.00 . A A . 20 CYS CB 1 1 1 289 1 1 20 CYS H H 4.574 0.149 4.626 1.00 . A A . 20 CYS H 1 1 1 290 1 1 20 CYS HA H 3.933 -0.831 2.066 1.00 . A A . 20 CYS HA 1 1 1 291 1 1 20 CYS HB2 H 2.272 -0.646 3.854 1.00 . A A . 20 CYS HB2 1 1 1 292 1 1 20 CYS HB3 H 2.447 1.104 3.872 1.00 . A A . 20 CYS HB3 1 1 1 293 1 1 20 CYS N N 4.863 0.019 3.699 1.00 . A A . 20 CYS N 1 1 1 294 1 1 20 CYS O O 4.254 1.095 0.491 1.00 . A A . 20 CYS O 1 1 1 295 1 1 20 CYS SG S 1.134 0.365 2.029 1.00 . A A . 20 CYS SG 1 1 1 296 1 1 21 VAL C C 5.891 3.446 0.696 1.00 . A A . 21 VAL C 1 1 1 297 1 1 21 VAL CA C 4.625 3.652 1.517 1.00 . A A . 21 VAL CA 1 1 1 298 1 1 21 VAL CB C 4.800 4.894 2.422 1.00 . A A . 21 VAL CB 1 1 1 299 1 1 21 VAL CG1 C 5.028 6.146 1.589 1.00 . A A . 21 VAL CG1 1 1 1 300 1 1 21 VAL CG2 C 3.594 5.075 3.327 1.00 . A A . 21 VAL CG2 1 1 1 301 1 1 21 VAL H H 4.261 2.517 3.271 1.00 . A A . 21 VAL H 1 1 1 302 1 1 21 VAL HA H 3.796 3.831 0.844 1.00 . A A . 21 VAL HA 1 1 1 303 1 1 21 VAL HB H 5.670 4.740 3.044 1.00 . A A . 21 VAL HB 1 1 1 304 1 1 21 VAL HG11 H 5.822 5.967 0.878 1.00 . A A . 21 VAL HG11 1 1 1 305 1 1 21 VAL HG12 H 5.304 6.965 2.237 1.00 . A A . 21 VAL HG12 1 1 1 306 1 1 21 VAL HG13 H 4.121 6.397 1.059 1.00 . A A . 21 VAL HG13 1 1 1 307 1 1 21 VAL HG21 H 3.569 4.278 4.056 1.00 . A A . 21 VAL HG21 1 1 1 308 1 1 21 VAL HG22 H 2.691 5.049 2.735 1.00 . A A . 21 VAL HG22 1 1 1 309 1 1 21 VAL HG23 H 3.665 6.025 3.835 1.00 . A A . 21 VAL HG23 1 1 1 310 1 1 21 VAL N N 4.329 2.452 2.291 1.00 . A A . 21 VAL N 1 1 1 311 1 1 21 VAL O O 5.980 3.891 -0.445 1.00 . A A . 21 VAL O 1 1 1 312 1 1 22 ALA C C 7.845 1.684 -0.683 1.00 . A A . 22 ALA C 1 1 1 313 1 1 22 ALA CA C 8.112 2.464 0.598 1.00 . A A . 22 ALA CA 1 1 1 314 1 1 22 ALA CB C 9.055 1.692 1.510 1.00 . A A . 22 ALA CB 1 1 1 315 1 1 22 ALA H H 6.720 2.408 2.194 1.00 . A A . 22 ALA H 1 1 1 316 1 1 22 ALA HA H 8.579 3.405 0.346 1.00 . A A . 22 ALA HA 1 1 1 317 1 1 22 ALA HB1 H 8.685 1.728 2.524 1.00 . A A . 22 ALA HB1 1 1 1 318 1 1 22 ALA HB2 H 10.038 2.135 1.469 1.00 . A A . 22 ALA HB2 1 1 1 319 1 1 22 ALA HB3 H 9.110 0.664 1.183 1.00 . A A . 22 ALA HB3 1 1 1 320 1 1 22 ALA N N 6.860 2.751 1.280 1.00 . A A . 22 ALA N 1 1 1 321 1 1 22 ALA O O 8.350 2.043 -1.753 1.00 . A A . 22 ALA O 1 1 1 322 1 1 23 CYS C C 5.936 0.667 -2.758 1.00 . A A . 23 CYS C 1 1 1 323 1 1 23 CYS CA C 6.686 -0.171 -1.740 1.00 . A A . 23 CYS CA 1 1 1 324 1 1 23 CYS CB C 5.812 -1.366 -1.376 1.00 . A A . 23 CYS CB 1 1 1 325 1 1 23 CYS H H 6.642 0.411 0.299 1.00 . A A . 23 CYS H 1 1 1 326 1 1 23 CYS HA H 7.603 -0.527 -2.183 1.00 . A A . 23 CYS HA 1 1 1 327 1 1 23 CYS HB2 H 6.231 -1.879 -0.527 1.00 . A A . 23 CYS HB2 1 1 1 328 1 1 23 CYS HB3 H 4.822 -1.015 -1.125 1.00 . A A . 23 CYS HB3 1 1 1 329 1 1 23 CYS N N 7.029 0.635 -0.576 1.00 . A A . 23 CYS N 1 1 1 330 1 1 23 CYS O O 6.260 0.669 -3.943 1.00 . A A . 23 CYS O 1 1 1 331 1 1 23 CYS SG S 5.648 -2.544 -2.763 1.00 . A A . 23 CYS SG 1 1 1 332 1 1 24 CYS C C 4.938 3.238 -3.883 1.00 . A A . 24 CYS C 1 1 1 333 1 1 24 CYS CA C 4.098 2.204 -3.137 1.00 . A A . 24 CYS CA 1 1 1 334 1 1 24 CYS CB C 3.016 2.886 -2.307 1.00 . A A . 24 CYS CB 1 1 1 335 1 1 24 CYS H H 4.711 1.303 -1.321 1.00 . A A . 24 CYS H 1 1 1 336 1 1 24 CYS HA H 3.622 1.559 -3.863 1.00 . A A . 24 CYS HA 1 1 1 337 1 1 24 CYS HB2 H 3.483 3.506 -1.557 1.00 . A A . 24 CYS HB2 1 1 1 338 1 1 24 CYS HB3 H 2.408 3.501 -2.949 1.00 . A A . 24 CYS HB3 1 1 1 339 1 1 24 CYS N N 4.923 1.365 -2.283 1.00 . A A . 24 CYS N 1 1 1 340 1 1 24 CYS O O 4.722 3.477 -5.067 1.00 . A A . 24 CYS O 1 1 1 341 1 1 24 CYS SG S 1.917 1.711 -1.455 1.00 . A A . 24 CYS SG 1 1 1 342 1 1 25 LYS C C 7.599 4.204 -4.940 1.00 . A A . 25 LYS C 1 1 1 343 1 1 25 LYS CA C 6.771 4.828 -3.822 1.00 . A A . 25 LYS CA 1 1 1 344 1 1 25 LYS CB C 7.687 5.489 -2.790 1.00 . A A . 25 LYS CB 1 1 1 345 1 1 25 LYS CD C 7.907 7.112 -0.876 1.00 . A A . 25 LYS CD 1 1 1 346 1 1 25 LYS CE C 8.505 6.083 0.071 1.00 . A A . 25 LYS CE 1 1 1 347 1 1 25 LYS CG C 6.962 6.469 -1.879 1.00 . A A . 25 LYS CG 1 1 1 348 1 1 25 LYS H H 6.044 3.600 -2.253 1.00 . A A . 25 LYS H 1 1 1 349 1 1 25 LYS HA H 6.134 5.586 -4.254 1.00 . A A . 25 LYS HA 1 1 1 350 1 1 25 LYS HB2 H 8.132 4.720 -2.175 1.00 . A A . 25 LYS HB2 1 1 1 351 1 1 25 LYS HB3 H 8.469 6.023 -3.307 1.00 . A A . 25 LYS HB3 1 1 1 352 1 1 25 LYS HD2 H 8.707 7.600 -1.411 1.00 . A A . 25 LYS HD2 1 1 1 353 1 1 25 LYS HD3 H 7.359 7.843 -0.299 1.00 . A A . 25 LYS HD3 1 1 1 354 1 1 25 LYS HE2 H 7.701 5.557 0.565 1.00 . A A . 25 LYS HE2 1 1 1 355 1 1 25 LYS HE3 H 9.094 5.384 -0.504 1.00 . A A . 25 LYS HE3 1 1 1 356 1 1 25 LYS HG2 H 6.517 7.243 -2.484 1.00 . A A . 25 LYS HG2 1 1 1 357 1 1 25 LYS HG3 H 6.188 5.939 -1.343 1.00 . A A . 25 LYS HG3 1 1 1 358 1 1 25 LYS HZ1 H 10.253 7.059 0.666 1.00 . A A . 25 LYS HZ1 1 1 1 359 1 1 25 LYS HZ2 H 9.611 6.025 1.841 1.00 . A A . 25 LYS HZ2 1 1 1 360 1 1 25 LYS HZ3 H 8.878 7.520 1.539 1.00 . A A . 25 LYS HZ3 1 1 1 361 1 1 25 LYS N N 5.906 3.836 -3.197 1.00 . A A . 25 LYS N 1 1 1 362 1 1 25 LYS NZ N 9.373 6.716 1.101 1.00 . A A . 25 LYS NZ 1 1 1 363 1 1 25 LYS O O 7.669 4.750 -6.040 1.00 . A A . 25 LYS O 1 1 1 364 1 1 26 LYS C C 8.122 1.781 -6.784 1.00 . A A . 26 LYS C 1 1 1 365 1 1 26 LYS CA C 9.016 2.380 -5.693 1.00 . A A . 26 LYS CA 1 1 1 366 1 1 26 LYS CB C 9.951 1.319 -5.076 1.00 . A A . 26 LYS CB 1 1 1 367 1 1 26 LYS CD C 8.674 -0.868 -5.187 1.00 . A A . 26 LYS CD 1 1 1 368 1 1 26 LYS CE C 9.741 -1.540 -6.036 1.00 . A A . 26 LYS CE 1 1 1 369 1 1 26 LYS CG C 9.264 0.209 -4.284 1.00 . A A . 26 LYS CG 1 1 1 370 1 1 26 LYS H H 8.115 2.644 -3.783 1.00 . A A . 26 LYS H 1 1 1 371 1 1 26 LYS HA H 9.628 3.142 -6.155 1.00 . A A . 26 LYS HA 1 1 1 372 1 1 26 LYS HB2 H 10.513 0.855 -5.872 1.00 . A A . 26 LYS HB2 1 1 1 373 1 1 26 LYS HB3 H 10.644 1.820 -4.414 1.00 . A A . 26 LYS HB3 1 1 1 374 1 1 26 LYS HD2 H 8.197 -1.616 -4.572 1.00 . A A . 26 LYS HD2 1 1 1 375 1 1 26 LYS HD3 H 7.942 -0.414 -5.838 1.00 . A A . 26 LYS HD3 1 1 1 376 1 1 26 LYS HE2 H 10.278 -0.781 -6.585 1.00 . A A . 26 LYS HE2 1 1 1 377 1 1 26 LYS HE3 H 10.425 -2.065 -5.385 1.00 . A A . 26 LYS HE3 1 1 1 378 1 1 26 LYS HG2 H 9.987 -0.248 -3.627 1.00 . A A . 26 LYS HG2 1 1 1 379 1 1 26 LYS HG3 H 8.469 0.645 -3.695 1.00 . A A . 26 LYS HG3 1 1 1 380 1 1 26 LYS HZ1 H 9.902 -2.986 -7.533 1.00 . A A . 26 LYS HZ1 1 1 1 381 1 1 26 LYS HZ2 H 8.530 -2.006 -7.669 1.00 . A A . 26 LYS HZ2 1 1 1 382 1 1 26 LYS HZ3 H 8.589 -3.219 -6.491 1.00 . A A . 26 LYS HZ3 1 1 1 383 1 1 26 LYS N N 8.212 3.051 -4.672 1.00 . A A . 26 LYS N 1 1 1 384 1 1 26 LYS NZ N 9.150 -2.506 -7.000 1.00 . A A . 26 LYS NZ 1 1 1 385 1 1 26 LYS O O 8.602 1.375 -7.842 1.00 . A A . 26 LYS O 1 1 1 386 1 1 27 ALA C C 5.231 2.337 -8.277 1.00 . A A . 27 ALA C 1 1 1 387 1 1 27 ALA CA C 5.854 1.203 -7.466 1.00 . A A . 27 ALA CA 1 1 1 388 1 1 27 ALA CB C 4.778 0.403 -6.745 1.00 . A A . 27 ALA CB 1 1 1 389 1 1 27 ALA H H 6.501 2.073 -5.651 1.00 . A A . 27 ALA H 1 1 1 390 1 1 27 ALA HA H 6.377 0.538 -8.138 1.00 . A A . 27 ALA HA 1 1 1 391 1 1 27 ALA HB1 H 4.666 0.776 -5.738 1.00 . A A . 27 ALA HB1 1 1 1 392 1 1 27 ALA HB2 H 5.063 -0.638 -6.714 1.00 . A A . 27 ALA HB2 1 1 1 393 1 1 27 ALA HB3 H 3.840 0.504 -7.272 1.00 . A A . 27 ALA HB3 1 1 1 394 1 1 27 ALA N N 6.822 1.733 -6.515 1.00 . A A . 27 ALA N 1 1 1 395 1 1 27 ALA O O 4.406 2.099 -9.162 1.00 . A A . 27 ALA O 1 1 1 396 1 1 28 LYS C C 3.731 5.114 -8.237 1.00 . A A . 28 LYS C 1 1 1 397 1 1 28 LYS CA C 5.176 4.775 -8.636 1.00 . A A . 28 LYS CA 1 1 1 398 1 1 28 LYS CB C 5.323 4.635 -10.159 1.00 . A A . 28 LYS CB 1 1 1 399 1 1 28 LYS CD C 5.517 5.753 -12.398 1.00 . A A . 28 LYS CD 1 1 1 400 1 1 28 LYS CE C 4.681 4.661 -13.048 1.00 . A A . 28 LYS CE 1 1 1 401 1 1 28 LYS CG C 5.158 5.935 -10.932 1.00 . A A . 28 LYS CG 1 1 1 402 1 1 28 LYS H H 6.316 3.662 -7.248 1.00 . A A . 28 LYS H 1 1 1 403 1 1 28 LYS HA H 5.809 5.587 -8.308 1.00 . A A . 28 LYS HA 1 1 1 404 1 1 28 LYS HB2 H 6.304 4.239 -10.376 1.00 . A A . 28 LYS HB2 1 1 1 405 1 1 28 LYS HB3 H 4.580 3.935 -10.515 1.00 . A A . 28 LYS HB3 1 1 1 406 1 1 28 LYS HD2 H 5.343 6.683 -12.919 1.00 . A A . 28 LYS HD2 1 1 1 407 1 1 28 LYS HD3 H 6.561 5.487 -12.472 1.00 . A A . 28 LYS HD3 1 1 1 408 1 1 28 LYS HE2 H 4.766 3.760 -12.459 1.00 . A A . 28 LYS HE2 1 1 1 409 1 1 28 LYS HE3 H 3.649 4.980 -13.069 1.00 . A A . 28 LYS HE3 1 1 1 410 1 1 28 LYS HG2 H 4.131 6.259 -10.859 1.00 . A A . 28 LYS HG2 1 1 1 411 1 1 28 LYS HG3 H 5.806 6.684 -10.501 1.00 . A A . 28 LYS HG3 1 1 1 412 1 1 28 LYS HZ1 H 4.413 3.803 -14.934 1.00 . A A . 28 LYS HZ1 1 1 1 413 1 1 28 LYS HZ2 H 6.024 3.847 -14.423 1.00 . A A . 28 LYS HZ2 1 1 1 414 1 1 28 LYS HZ3 H 5.270 5.262 -14.960 1.00 . A A . 28 LYS HZ3 1 1 1 415 1 1 28 LYS N N 5.651 3.566 -7.962 1.00 . A A . 28 LYS N 1 1 1 416 1 1 28 LYS NZ N 5.128 4.374 -14.439 1.00 . A A . 28 LYS NZ 1 1 1 417 1 1 28 LYS O O 2.873 5.387 -9.082 1.00 . A A . 28 LYS O 1 1 1 418 1 1 29 PHE C C 2.334 6.653 -5.438 1.00 . A A . 29 PHE C 1 1 1 419 1 1 29 PHE CA C 2.182 5.461 -6.376 1.00 . A A . 29 PHE CA 1 1 1 420 1 1 29 PHE CB C 1.552 4.275 -5.630 1.00 . A A . 29 PHE CB 1 1 1 421 1 1 29 PHE CD1 C 1.783 2.423 -7.320 1.00 . A A . 29 PHE CD1 1 1 1 422 1 1 29 PHE CD2 C -0.402 3.035 -6.597 1.00 . A A . 29 PHE CD2 1 1 1 423 1 1 29 PHE CE1 C 1.241 1.460 -8.151 1.00 . A A . 29 PHE CE1 1 1 1 424 1 1 29 PHE CE2 C -0.951 2.075 -7.424 1.00 . A A . 29 PHE CE2 1 1 1 425 1 1 29 PHE CG C 0.969 3.222 -6.534 1.00 . A A . 29 PHE CG 1 1 1 426 1 1 29 PHE CZ C -0.128 1.286 -8.203 1.00 . A A . 29 PHE CZ 1 1 1 427 1 1 29 PHE H H 4.223 4.917 -6.312 1.00 . A A . 29 PHE H 1 1 1 428 1 1 29 PHE HA H 1.539 5.746 -7.197 1.00 . A A . 29 PHE HA 1 1 1 429 1 1 29 PHE HB2 H 2.305 3.806 -5.018 1.00 . A A . 29 PHE HB2 1 1 1 430 1 1 29 PHE HB3 H 0.760 4.640 -4.992 1.00 . A A . 29 PHE HB3 1 1 1 431 1 1 29 PHE HD1 H 2.854 2.557 -7.281 1.00 . A A . 29 PHE HD1 1 1 1 432 1 1 29 PHE HD2 H -1.048 3.652 -5.989 1.00 . A A . 29 PHE HD2 1 1 1 433 1 1 29 PHE HE1 H 1.887 0.845 -8.760 1.00 . A A . 29 PHE HE1 1 1 1 434 1 1 29 PHE HE2 H -2.022 1.942 -7.463 1.00 . A A . 29 PHE HE2 1 1 1 435 1 1 29 PHE HZ H -0.554 0.535 -8.851 1.00 . A A . 29 PHE HZ 1 1 1 436 1 1 29 PHE N N 3.488 5.122 -6.931 1.00 . A A . 29 PHE N 1 1 1 437 1 1 29 PHE O O 3.384 6.821 -4.818 1.00 . A A . 29 PHE O 1 1 1 438 1 1 30 SER C C 1.567 8.363 -3.057 1.00 . A A . 30 SER C 1 1 1 439 1 1 30 SER CA C 1.327 8.687 -4.534 1.00 . A A . 30 SER CA 1 1 1 440 1 1 30 SER CB C 0.011 9.446 -4.702 1.00 . A A . 30 SER CB 1 1 1 441 1 1 30 SER H H 0.508 7.304 -5.904 1.00 . A A . 30 SER H 1 1 1 442 1 1 30 SER HA H 2.133 9.310 -4.883 1.00 . A A . 30 SER HA 1 1 1 443 1 1 30 SER HB2 H -0.741 9.007 -4.063 1.00 . A A . 30 SER HB2 1 1 1 444 1 1 30 SER HB3 H 0.156 10.481 -4.433 1.00 . A A . 30 SER HB3 1 1 1 445 1 1 30 SER HG H -0.130 10.163 -6.540 1.00 . A A . 30 SER HG 1 1 1 446 1 1 30 SER N N 1.304 7.486 -5.366 1.00 . A A . 30 SER N 1 1 1 447 1 1 30 SER O O 2.407 8.986 -2.409 1.00 . A A . 30 SER O 1 1 1 448 1 1 30 SER OG O -0.437 9.380 -6.047 1.00 . A A . 30 SER OG 1 1 1 449 1 1 31 ASP C C 0.324 5.635 -0.888 1.00 . A A . 31 ASP C 1 1 1 450 1 1 31 ASP CA C 0.972 6.991 -1.132 1.00 . A A . 31 ASP CA 1 1 1 451 1 1 31 ASP CB C 0.355 8.034 -0.191 1.00 . A A . 31 ASP CB 1 1 1 452 1 1 31 ASP CG C 0.455 7.622 1.268 1.00 . A A . 31 ASP CG 1 1 1 453 1 1 31 ASP H H 0.179 6.925 -3.102 1.00 . A A . 31 ASP H 1 1 1 454 1 1 31 ASP HA H 2.028 6.911 -0.919 1.00 . A A . 31 ASP HA 1 1 1 455 1 1 31 ASP HB2 H 0.871 8.974 -0.317 1.00 . A A . 31 ASP HB2 1 1 1 456 1 1 31 ASP HB3 H -0.688 8.164 -0.440 1.00 . A A . 31 ASP HB3 1 1 1 457 1 1 31 ASP N N 0.832 7.389 -2.534 1.00 . A A . 31 ASP N 1 1 1 458 1 1 31 ASP O O -0.628 5.259 -1.573 1.00 . A A . 31 ASP O 1 1 1 459 1 1 31 ASP OD1 O 1.578 7.332 1.735 1.00 . A A . 31 ASP OD1 1 1 1 460 1 1 31 ASP OD2 O -0.588 7.566 1.959 1.00 . A A . 31 ASP OD2 1 1 1 461 1 1 32 GLY C C -0.290 3.566 1.802 1.00 . A A . 32 GLY C 1 1 1 462 1 1 32 GLY CA C 0.316 3.606 0.419 1.00 . A A . 32 GLY CA 1 1 1 463 1 1 32 GLY H H 1.602 5.273 0.600 1.00 . A A . 32 GLY H 1 1 1 464 1 1 32 GLY HA2 H -0.446 3.345 -0.303 1.00 . A A . 32 GLY HA2 1 1 1 465 1 1 32 GLY HA3 H 1.113 2.879 0.365 1.00 . A A . 32 GLY HA3 1 1 1 466 1 1 32 GLY N N 0.847 4.910 0.089 1.00 . A A . 32 GLY N 1 1 1 467 1 1 32 GLY O O 0.231 4.173 2.740 1.00 . A A . 32 GLY O 1 1 1 468 1 1 33 HIS C C -2.421 1.265 3.477 1.00 . A A . 33 HIS C 1 1 1 469 1 1 33 HIS CA C -2.073 2.719 3.205 1.00 . A A . 33 HIS CA 1 1 1 470 1 1 33 HIS CB C -3.333 3.593 3.226 1.00 . A A . 33 HIS CB 1 1 1 471 1 1 33 HIS CD2 C -4.423 3.669 0.860 1.00 . A A . 33 HIS CD2 1 1 1 472 1 1 33 HIS CE1 C -6.099 2.313 1.238 1.00 . A A . 33 HIS CE1 1 1 1 473 1 1 33 HIS CG C -4.337 3.268 2.153 1.00 . A A . 33 HIS CG 1 1 1 474 1 1 33 HIS H H -1.747 2.376 1.142 1.00 . A A . 33 HIS H 1 1 1 475 1 1 33 HIS HA H -1.398 3.061 3.976 1.00 . A A . 33 HIS HA 1 1 1 476 1 1 33 HIS HB2 H -3.824 3.474 4.180 1.00 . A A . 33 HIS HB2 1 1 1 477 1 1 33 HIS HB3 H -3.040 4.622 3.110 1.00 . A A . 33 HIS HB3 1 1 1 478 1 1 33 HIS HD1 H -5.615 1.953 3.192 1.00 . A A . 33 HIS HD1 1 1 1 479 1 1 33 HIS HD2 H -3.734 4.315 0.342 1.00 . A A . 33 HIS HD2 1 1 1 480 1 1 33 HIS HE1 H -6.974 1.699 1.094 1.00 . A A . 33 HIS HE1 1 1 1 481 1 1 33 HIS N N -1.387 2.846 1.932 1.00 . A A . 33 HIS N 1 1 1 482 1 1 33 HIS ND1 N -5.405 2.418 2.356 1.00 . A A . 33 HIS ND1 1 1 1 483 1 1 33 HIS NE2 N -5.527 3.062 0.319 1.00 . A A . 33 HIS NE2 1 1 1 484 1 1 33 HIS O O -2.982 0.574 2.631 1.00 . A A . 33 HIS O 1 1 1 485 1 1 34 CYS C C -3.806 -0.802 5.323 1.00 . A A . 34 CYS C 1 1 1 486 1 1 34 CYS CA C -2.324 -0.566 5.053 1.00 . A A . 34 CYS CA 1 1 1 487 1 1 34 CYS CB C -1.485 -0.913 6.279 1.00 . A A . 34 CYS CB 1 1 1 488 1 1 34 CYS H H -1.618 1.413 5.281 1.00 . A A . 34 CYS H 1 1 1 489 1 1 34 CYS HA H -2.019 -1.201 4.235 1.00 . A A . 34 CYS HA 1 1 1 490 1 1 34 CYS HB2 H -1.791 -0.291 7.108 1.00 . A A . 34 CYS HB2 1 1 1 491 1 1 34 CYS HB3 H -1.640 -1.951 6.534 1.00 . A A . 34 CYS HB3 1 1 1 492 1 1 34 CYS N N -2.070 0.810 4.658 1.00 . A A . 34 CYS N 1 1 1 493 1 1 34 CYS O O -4.464 -0.004 5.992 1.00 . A A . 34 CYS O 1 1 1 494 1 1 34 CYS SG S 0.301 -0.661 6.019 1.00 . A A . 34 CYS SG 1 1 1 495 1 1 35 SER C C -6.016 -2.706 6.365 1.00 . A A . 35 SER C 1 1 1 496 1 1 35 SER CA C -5.718 -2.262 4.935 1.00 . A A . 35 SER CA 1 1 1 497 1 1 35 SER CB C -6.078 -3.385 3.957 1.00 . A A . 35 SER CB 1 1 1 498 1 1 35 SER H H -3.733 -2.480 4.248 1.00 . A A . 35 SER H 1 1 1 499 1 1 35 SER HA H -6.313 -1.392 4.705 1.00 . A A . 35 SER HA 1 1 1 500 1 1 35 SER HB2 H -5.819 -3.080 2.954 1.00 . A A . 35 SER HB2 1 1 1 501 1 1 35 SER HB3 H -5.522 -4.274 4.216 1.00 . A A . 35 SER HB3 1 1 1 502 1 1 35 SER HG H -7.843 -3.560 3.116 1.00 . A A . 35 SER HG 1 1 1 503 1 1 35 SER N N -4.319 -1.897 4.782 1.00 . A A . 35 SER N 1 1 1 504 1 1 35 SER O O -5.109 -3.035 7.132 1.00 . A A . 35 SER O 1 1 1 505 1 1 35 SER OG O -7.465 -3.687 3.994 1.00 . A A . 35 SER OG 1 1 1 506 1 1 36 LYS C C -7.996 -4.642 8.047 1.00 . A A . 36 LYS C 1 1 1 507 1 1 36 LYS CA C -7.741 -3.136 8.021 1.00 . A A . 36 LYS CA 1 1 1 508 1 1 36 LYS CB C -9.017 -2.376 8.404 1.00 . A A . 36 LYS CB 1 1 1 509 1 1 36 LYS CD C -10.946 -2.114 10.007 1.00 . A A . 36 LYS CD 1 1 1 510 1 1 36 LYS CE C -10.614 -0.675 10.373 1.00 . A A . 36 LYS CE 1 1 1 511 1 1 36 LYS CG C -9.698 -2.911 9.654 1.00 . A A . 36 LYS CG 1 1 1 512 1 1 36 LYS H H -7.961 -2.457 6.037 1.00 . A A . 36 LYS H 1 1 1 513 1 1 36 LYS HA H -6.962 -2.900 8.730 1.00 . A A . 36 LYS HA 1 1 1 514 1 1 36 LYS HB2 H -8.767 -1.340 8.572 1.00 . A A . 36 LYS HB2 1 1 1 515 1 1 36 LYS HB3 H -9.718 -2.439 7.584 1.00 . A A . 36 LYS HB3 1 1 1 516 1 1 36 LYS HD2 H -11.611 -2.113 9.157 1.00 . A A . 36 LYS HD2 1 1 1 517 1 1 36 LYS HD3 H -11.436 -2.586 10.847 1.00 . A A . 36 LYS HD3 1 1 1 518 1 1 36 LYS HE2 H -9.928 -0.678 11.206 1.00 . A A . 36 LYS HE2 1 1 1 519 1 1 36 LYS HE3 H -10.145 -0.201 9.523 1.00 . A A . 36 LYS HE3 1 1 1 520 1 1 36 LYS HG2 H -9.978 -3.941 9.481 1.00 . A A . 36 LYS HG2 1 1 1 521 1 1 36 LYS HG3 H -9.003 -2.860 10.479 1.00 . A A . 36 LYS HG3 1 1 1 522 1 1 36 LYS HZ1 H -11.594 0.805 11.475 1.00 . A A . 36 LYS HZ1 1 1 1 523 1 1 36 LYS HZ2 H -12.556 -0.542 11.131 1.00 . A A . 36 LYS HZ2 1 1 1 524 1 1 36 LYS HZ3 H -12.217 0.586 9.917 1.00 . A A . 36 LYS HZ3 1 1 1 525 1 1 36 LYS N N -7.294 -2.721 6.703 1.00 . A A . 36 LYS N 1 1 1 526 1 1 36 LYS NZ N -11.830 0.097 10.750 1.00 . A A . 36 LYS NZ 1 1 1 527 1 1 36 LYS O O -7.865 -5.284 9.084 1.00 . A A . 36 LYS O 1 1 1 528 1 1 37 ILE C C -7.426 -7.470 6.890 1.00 . A A . 37 ILE C 1 1 1 529 1 1 37 ILE CA C -8.685 -6.607 6.768 1.00 . A A . 37 ILE CA 1 1 1 530 1 1 37 ILE CB C -9.364 -6.916 5.416 1.00 . A A . 37 ILE CB 1 1 1 531 1 1 37 ILE CD1 C -10.911 -5.962 3.639 1.00 . A A . 37 ILE CD1 1 1 1 532 1 1 37 ILE CG1 C -10.385 -5.836 5.054 1.00 . A A . 37 ILE CG1 1 1 1 533 1 1 37 ILE CG2 C -10.038 -8.283 5.462 1.00 . A A . 37 ILE CG2 1 1 1 534 1 1 37 ILE H H -8.478 -4.607 6.111 1.00 . A A . 37 ILE H 1 1 1 535 1 1 37 ILE HA H -9.369 -6.873 7.560 1.00 . A A . 37 ILE HA 1 1 1 536 1 1 37 ILE HB H -8.598 -6.944 4.660 1.00 . A A . 37 ILE HB 1 1 1 537 1 1 37 ILE HD11 H -11.057 -4.978 3.220 1.00 . A A . 37 ILE HD11 1 1 1 538 1 1 37 ILE HD12 H -11.852 -6.492 3.651 1.00 . A A . 37 ILE HD12 1 1 1 539 1 1 37 ILE HD13 H -10.197 -6.509 3.037 1.00 . A A . 37 ILE HD13 1 1 1 540 1 1 37 ILE HG12 H -11.225 -5.902 5.729 1.00 . A A . 37 ILE HG12 1 1 1 541 1 1 37 ILE HG13 H -9.923 -4.864 5.153 1.00 . A A . 37 ILE HG13 1 1 1 542 1 1 37 ILE HG21 H -10.958 -8.249 4.897 1.00 . A A . 37 ILE HG21 1 1 1 543 1 1 37 ILE HG22 H -10.254 -8.544 6.487 1.00 . A A . 37 ILE HG22 1 1 1 544 1 1 37 ILE HG23 H -9.379 -9.024 5.033 1.00 . A A . 37 ILE HG23 1 1 1 545 1 1 37 ILE N N -8.382 -5.184 6.895 1.00 . A A . 37 ILE N 1 1 1 546 1 1 37 ILE O O -6.946 -7.739 7.986 1.00 . A A . 37 ILE O 1 1 1 547 1 1 38 LEU C C -4.451 -7.951 5.981 1.00 . A A . 38 LEU C 1 1 1 548 1 1 38 LEU CA C -5.714 -8.763 5.716 1.00 . A A . 38 LEU CA 1 1 1 549 1 1 38 LEU CB C -5.604 -9.466 4.367 1.00 . A A . 38 LEU CB 1 1 1 550 1 1 38 LEU CD1 C -4.936 -11.671 5.356 1.00 . A A . 38 LEU CD1 1 1 1 551 1 1 38 LEU CD2 C -4.516 -11.212 2.937 1.00 . A A . 38 LEU CD2 1 1 1 552 1 1 38 LEU CG C -4.588 -10.605 4.327 1.00 . A A . 38 LEU CG 1 1 1 553 1 1 38 LEU H H -7.340 -7.678 4.904 1.00 . A A . 38 LEU H 1 1 1 554 1 1 38 LEU HA H -5.819 -9.506 6.492 1.00 . A A . 38 LEU HA 1 1 1 555 1 1 38 LEU HB2 H -6.573 -9.857 4.107 1.00 . A A . 38 LEU HB2 1 1 1 556 1 1 38 LEU HB3 H -5.319 -8.735 3.626 1.00 . A A . 38 LEU HB3 1 1 1 557 1 1 38 LEU HD11 H -5.747 -12.279 4.984 1.00 . A A . 38 LEU HD11 1 1 1 558 1 1 38 LEU HD12 H -5.235 -11.197 6.279 1.00 . A A . 38 LEU HD12 1 1 1 559 1 1 38 LEU HD13 H -4.072 -12.294 5.534 1.00 . A A . 38 LEU HD13 1 1 1 560 1 1 38 LEU HD21 H -4.175 -10.465 2.235 1.00 . A A . 38 LEU HD21 1 1 1 561 1 1 38 LEU HD22 H -5.496 -11.559 2.645 1.00 . A A . 38 LEU HD22 1 1 1 562 1 1 38 LEU HD23 H -3.827 -12.043 2.942 1.00 . A A . 38 LEU HD23 1 1 1 563 1 1 38 LEU HG H -3.616 -10.205 4.574 1.00 . A A . 38 LEU HG 1 1 1 564 1 1 38 LEU N N -6.904 -7.914 5.747 1.00 . A A . 38 LEU N 1 1 1 565 1 1 38 LEU O O -3.339 -8.477 5.963 1.00 . A A . 38 LEU O 1 1 1 566 1 1 39 ARG C C -2.614 -5.595 5.336 1.00 . A A . 39 ARG C 1 1 1 567 1 1 39 ARG CA C -3.566 -5.743 6.531 1.00 . A A . 39 ARG CA 1 1 1 568 1 1 39 ARG CB C -2.821 -6.217 7.785 1.00 . A A . 39 ARG CB 1 1 1 569 1 1 39 ARG CD C -2.814 -3.969 8.906 1.00 . A A . 39 ARG CD 1 1 1 570 1 1 39 ARG CG C -1.979 -5.150 8.455 1.00 . A A . 39 ARG CG 1 1 1 571 1 1 39 ARG CZ C -2.455 -1.786 9.995 1.00 . A A . 39 ARG CZ 1 1 1 572 1 1 39 ARG H H -5.566 -6.339 6.242 1.00 . A A . 39 ARG H 1 1 1 573 1 1 39 ARG HA H -4.009 -4.780 6.736 1.00 . A A . 39 ARG HA 1 1 1 574 1 1 39 ARG HB2 H -3.544 -6.572 8.503 1.00 . A A . 39 ARG HB2 1 1 1 575 1 1 39 ARG HB3 H -2.171 -7.036 7.511 1.00 . A A . 39 ARG HB3 1 1 1 576 1 1 39 ARG HD2 H -3.249 -3.497 8.036 1.00 . A A . 39 ARG HD2 1 1 1 577 1 1 39 ARG HD3 H -3.602 -4.326 9.553 1.00 . A A . 39 ARG HD3 1 1 1 578 1 1 39 ARG HE H -1.090 -3.252 9.875 1.00 . A A . 39 ARG HE 1 1 1 579 1 1 39 ARG HG2 H -1.491 -5.580 9.316 1.00 . A A . 39 ARG HG2 1 1 1 580 1 1 39 ARG HG3 H -1.232 -4.804 7.753 1.00 . A A . 39 ARG HG3 1 1 1 581 1 1 39 ARG HH11 H -4.260 -2.002 9.092 1.00 . A A . 39 ARG HH11 1 1 1 582 1 1 39 ARG HH12 H -4.015 -0.493 9.909 1.00 . A A . 39 ARG HH12 1 1 1 583 1 1 39 ARG HH21 H -0.747 -1.264 10.958 1.00 . A A . 39 ARG HH21 1 1 1 584 1 1 39 ARG HH22 H -2.004 -0.071 10.980 1.00 . A A . 39 ARG HH22 1 1 1 585 1 1 39 ARG N N -4.650 -6.669 6.236 1.00 . A A . 39 ARG N 1 1 1 586 1 1 39 ARG NE N -2.010 -2.986 9.631 1.00 . A A . 39 ARG NE 1 1 1 587 1 1 39 ARG NH1 N -3.674 -1.393 9.638 1.00 . A A . 39 ARG NH1 1 1 1 588 1 1 39 ARG NH2 N -1.673 -0.974 10.700 1.00 . A A . 39 ARG NH2 1 1 1 589 1 1 39 ARG O O -1.423 -5.319 5.499 1.00 . A A . 39 ARG O 1 1 1 590 1 1 40 ARG C C -2.010 -4.155 2.662 1.00 . A A . 40 ARG C 1 1 1 591 1 1 40 ARG CA C -2.366 -5.618 2.907 1.00 . A A . 40 ARG CA 1 1 1 592 1 1 40 ARG CB C -3.120 -6.162 1.692 1.00 . A A . 40 ARG CB 1 1 1 593 1 1 40 ARG CD C -3.783 -8.138 0.297 1.00 . A A . 40 ARG CD 1 1 1 594 1 1 40 ARG CG C -3.127 -7.675 1.591 1.00 . A A . 40 ARG CG 1 1 1 595 1 1 40 ARG CZ C -2.690 -10.329 -0.089 1.00 . A A . 40 ARG CZ 1 1 1 596 1 1 40 ARG H H -4.112 -5.967 4.062 1.00 . A A . 40 ARG H 1 1 1 597 1 1 40 ARG HA H -1.453 -6.181 3.036 1.00 . A A . 40 ARG HA 1 1 1 598 1 1 40 ARG HB2 H -4.144 -5.823 1.740 1.00 . A A . 40 ARG HB2 1 1 1 599 1 1 40 ARG HB3 H -2.663 -5.766 0.796 1.00 . A A . 40 ARG HB3 1 1 1 600 1 1 40 ARG HD2 H -4.804 -7.786 0.281 1.00 . A A . 40 ARG HD2 1 1 1 601 1 1 40 ARG HD3 H -3.243 -7.712 -0.536 1.00 . A A . 40 ARG HD3 1 1 1 602 1 1 40 ARG HE H -4.637 -10.055 0.322 1.00 . A A . 40 ARG HE 1 1 1 603 1 1 40 ARG HG2 H -2.109 -8.034 1.617 1.00 . A A . 40 ARG HG2 1 1 1 604 1 1 40 ARG HG3 H -3.676 -8.081 2.429 1.00 . A A . 40 ARG HG3 1 1 1 605 1 1 40 ARG HH11 H -1.457 -8.755 -0.428 1.00 . A A . 40 ARG HH11 1 1 1 606 1 1 40 ARG HH12 H -0.721 -10.323 -0.579 1.00 . A A . 40 ARG HH12 1 1 1 607 1 1 40 ARG HH21 H -3.618 -12.119 0.109 1.00 . A A . 40 ARG HH21 1 1 1 608 1 1 40 ARG HH22 H -1.916 -12.199 -0.269 1.00 . A A . 40 ARG HH22 1 1 1 609 1 1 40 ARG N N -3.156 -5.759 4.130 1.00 . A A . 40 ARG N 1 1 1 610 1 1 40 ARG NE N -3.782 -9.595 0.170 1.00 . A A . 40 ARG NE 1 1 1 611 1 1 40 ARG NH1 N -1.534 -9.749 -0.387 1.00 . A A . 40 ARG NH1 1 1 1 612 1 1 40 ARG NH2 N -2.758 -11.652 -0.083 1.00 . A A . 40 ARG NH2 1 1 1 613 1 1 40 ARG O O -2.704 -3.255 3.130 1.00 . A A . 40 ARG O 1 1 1 614 1 1 41 CYS C C -1.230 -2.055 0.377 1.00 . A A . 41 CYS C 1 1 1 615 1 1 41 CYS CA C -0.496 -2.578 1.603 1.00 . A A . 41 CYS CA 1 1 1 616 1 1 41 CYS CB C 1.009 -2.569 1.343 1.00 . A A . 41 CYS CB 1 1 1 617 1 1 41 CYS H H -0.429 -4.687 1.573 1.00 . A A . 41 CYS H 1 1 1 618 1 1 41 CYS HA H -0.715 -1.942 2.446 1.00 . A A . 41 CYS HA 1 1 1 619 1 1 41 CYS HB2 H 1.528 -2.737 2.275 1.00 . A A . 41 CYS HB2 1 1 1 620 1 1 41 CYS HB3 H 1.252 -3.365 0.654 1.00 . A A . 41 CYS HB3 1 1 1 621 1 1 41 CYS N N -0.937 -3.928 1.924 1.00 . A A . 41 CYS N 1 1 1 622 1 1 41 CYS O O -0.904 -2.426 -0.746 1.00 . A A . 41 CYS O 1 1 1 623 1 1 41 CYS SG S 1.636 -1.015 0.637 1.00 . A A . 41 CYS SG 1 1 1 624 1 1 42 LEU C C -2.309 0.646 -1.007 1.00 . A A . 42 LEU C 1 1 1 625 1 1 42 LEU CA C -2.981 -0.621 -0.502 1.00 . A A . 42 LEU CA 1 1 1 626 1 1 42 LEU CB C -4.409 -0.288 -0.042 1.00 . A A . 42 LEU CB 1 1 1 627 1 1 42 LEU CD1 C -4.904 -2.567 0.917 1.00 . A A . 42 LEU CD1 1 1 1 628 1 1 42 LEU CD2 C -6.767 -0.981 0.477 1.00 . A A . 42 LEU CD2 1 1 1 629 1 1 42 LEU CG C -5.402 -1.459 0.009 1.00 . A A . 42 LEU CG 1 1 1 630 1 1 42 LEU H H -2.426 -0.929 1.516 1.00 . A A . 42 LEU H 1 1 1 631 1 1 42 LEU HA H -3.018 -1.347 -1.302 1.00 . A A . 42 LEU HA 1 1 1 632 1 1 42 LEU HB2 H -4.344 0.135 0.951 1.00 . A A . 42 LEU HB2 1 1 1 633 1 1 42 LEU HB3 H -4.808 0.472 -0.705 1.00 . A A . 42 LEU HB3 1 1 1 634 1 1 42 LEU HD11 H -4.612 -3.418 0.320 1.00 . A A . 42 LEU HD11 1 1 1 635 1 1 42 LEU HD12 H -5.691 -2.858 1.597 1.00 . A A . 42 LEU HD12 1 1 1 636 1 1 42 LEU HD13 H -4.053 -2.215 1.482 1.00 . A A . 42 LEU HD13 1 1 1 637 1 1 42 LEU HD21 H -7.439 -0.930 -0.367 1.00 . A A . 42 LEU HD21 1 1 1 638 1 1 42 LEU HD22 H -6.673 -0.001 0.922 1.00 . A A . 42 LEU HD22 1 1 1 639 1 1 42 LEU HD23 H -7.160 -1.672 1.209 1.00 . A A . 42 LEU HD23 1 1 1 640 1 1 42 LEU HG H -5.515 -1.868 -0.983 1.00 . A A . 42 LEU HG 1 1 1 641 1 1 42 LEU N N -2.212 -1.195 0.594 1.00 . A A . 42 LEU N 1 1 1 642 1 1 42 LEU O O -2.246 1.643 -0.289 1.00 . A A . 42 LEU O 1 1 1 643 1 1 43 CYS C C -2.214 2.611 -3.573 1.00 . A A . 43 CYS C 1 1 1 644 1 1 43 CYS CA C -1.190 1.789 -2.811 1.00 . A A . 43 CYS CA 1 1 1 645 1 1 43 CYS CB C -0.041 1.388 -3.738 1.00 . A A . 43 CYS CB 1 1 1 646 1 1 43 CYS H H -1.924 -0.190 -2.782 1.00 . A A . 43 CYS H 1 1 1 647 1 1 43 CYS HA H -0.799 2.385 -2.000 1.00 . A A . 43 CYS HA 1 1 1 648 1 1 43 CYS HB2 H -0.428 0.778 -4.537 1.00 . A A . 43 CYS HB2 1 1 1 649 1 1 43 CYS HB3 H 0.395 2.283 -4.159 1.00 . A A . 43 CYS HB3 1 1 1 650 1 1 43 CYS N N -1.831 0.622 -2.237 1.00 . A A . 43 CYS N 1 1 1 651 1 1 43 CYS O O -2.997 2.074 -4.355 1.00 . A A . 43 CYS O 1 1 1 652 1 1 43 CYS SG S 1.294 0.456 -2.923 1.00 . A A . 43 CYS SG 1 1 1 653 1 1 44 THR C C -2.395 5.863 -4.786 1.00 . A A . 44 THR C 1 1 1 654 1 1 44 THR CA C -3.142 4.800 -3.997 1.00 . A A . 44 THR CA 1 1 1 655 1 1 44 THR CB C -4.089 5.467 -2.982 1.00 . A A . 44 THR CB 1 1 1 656 1 1 44 THR CG2 C -5.373 4.665 -2.834 1.00 . A A . 44 THR CG2 1 1 1 657 1 1 44 THR H H -1.562 4.278 -2.697 1.00 . A A . 44 THR H 1 1 1 658 1 1 44 THR HA H -3.737 4.213 -4.682 1.00 . A A . 44 THR HA 1 1 1 659 1 1 44 THR HB H -4.340 6.454 -3.343 1.00 . A A . 44 THR HB 1 1 1 660 1 1 44 THR HG1 H -2.513 5.813 -1.836 1.00 . A A . 44 THR HG1 1 1 1 661 1 1 44 THR HG21 H -5.252 3.702 -3.306 1.00 . A A . 44 THR HG21 1 1 1 662 1 1 44 THR HG22 H -6.186 5.197 -3.305 1.00 . A A . 44 THR HG22 1 1 1 663 1 1 44 THR HG23 H -5.593 4.527 -1.785 1.00 . A A . 44 THR HG23 1 1 1 664 1 1 44 THR N N -2.212 3.906 -3.338 1.00 . A A . 44 THR N 1 1 1 665 1 1 44 THR O O -1.335 6.328 -4.364 1.00 . A A . 44 THR O 1 1 1 666 1 1 44 THR OG1 O -3.442 5.586 -1.706 1.00 . A A . 44 THR OG1 1 1 1 667 1 1 45 LYS C C -3.333 7.916 -7.671 1.00 . A A . 45 LYS C 1 1 1 668 1 1 45 LYS CA C -2.316 7.233 -6.779 1.00 . A A . 45 LYS CA 1 1 1 669 1 1 45 LYS CB C -1.213 6.617 -7.645 1.00 . A A . 45 LYS CB 1 1 1 670 1 1 45 LYS CD C -0.574 5.025 -9.480 1.00 . A A . 45 LYS CD 1 1 1 671 1 1 45 LYS CE C -0.585 5.712 -10.839 1.00 . A A . 45 LYS CE 1 1 1 672 1 1 45 LYS CG C -1.696 5.519 -8.578 1.00 . A A . 45 LYS CG 1 1 1 673 1 1 45 LYS H H -3.784 5.816 -6.223 1.00 . A A . 45 LYS H 1 1 1 674 1 1 45 LYS HA H -1.873 7.976 -6.134 1.00 . A A . 45 LYS HA 1 1 1 675 1 1 45 LYS HB2 H -0.770 7.396 -8.246 1.00 . A A . 45 LYS HB2 1 1 1 676 1 1 45 LYS HB3 H -0.455 6.202 -6.997 1.00 . A A . 45 LYS HB3 1 1 1 677 1 1 45 LYS HD2 H 0.372 5.222 -8.998 1.00 . A A . 45 LYS HD2 1 1 1 678 1 1 45 LYS HD3 H -0.689 3.961 -9.625 1.00 . A A . 45 LYS HD3 1 1 1 679 1 1 45 LYS HE2 H 0.257 5.354 -11.411 1.00 . A A . 45 LYS HE2 1 1 1 680 1 1 45 LYS HE3 H -1.500 5.448 -11.350 1.00 . A A . 45 LYS HE3 1 1 1 681 1 1 45 LYS HG2 H -2.061 4.692 -7.987 1.00 . A A . 45 LYS HG2 1 1 1 682 1 1 45 LYS HG3 H -2.496 5.907 -9.192 1.00 . A A . 45 LYS HG3 1 1 1 683 1 1 45 LYS HZ1 H -1.455 7.616 -10.751 1.00 . A A . 45 LYS HZ1 1 1 1 684 1 1 45 LYS HZ2 H 0.039 7.580 -11.536 1.00 . A A . 45 LYS HZ2 1 1 1 685 1 1 45 LYS HZ3 H -0.025 7.480 -9.853 1.00 . A A . 45 LYS HZ3 1 1 1 686 1 1 45 LYS N N -2.941 6.232 -5.934 1.00 . A A . 45 LYS N 1 1 1 687 1 1 45 LYS NZ N -0.499 7.196 -10.739 1.00 . A A . 45 LYS NZ 1 1 1 688 1 1 45 LYS O O -4.495 7.506 -7.753 1.00 . A A . 45 LYS O 1 1 1 689 1 1 46 GLU C C -3.844 9.029 -10.578 1.00 . A A . 46 GLU C 1 1 1 690 1 1 46 GLU CA C -3.678 9.745 -9.240 1.00 . A A . 46 GLU CA 1 1 1 691 1 1 46 GLU CB C -3.036 11.127 -9.455 1.00 . A A . 46 GLU CB 1 1 1 692 1 1 46 GLU CD C -0.595 10.488 -9.129 1.00 . A A . 46 GLU CD 1 1 1 693 1 1 46 GLU CG C -1.635 11.083 -10.063 1.00 . A A . 46 GLU CG 1 1 1 694 1 1 46 GLU H H -1.925 9.209 -8.204 1.00 . A A . 46 GLU H 1 1 1 695 1 1 46 GLU HA H -4.650 9.877 -8.790 1.00 . A A . 46 GLU HA 1 1 1 696 1 1 46 GLU HB2 H -3.669 11.703 -10.114 1.00 . A A . 46 GLU HB2 1 1 1 697 1 1 46 GLU HB3 H -2.974 11.631 -8.502 1.00 . A A . 46 GLU HB3 1 1 1 698 1 1 46 GLU HG2 H -1.669 10.483 -10.960 1.00 . A A . 46 GLU HG2 1 1 1 699 1 1 46 GLU HG3 H -1.337 12.088 -10.317 1.00 . A A . 46 GLU HG3 1 1 1 700 1 1 46 GLU N N -2.868 8.956 -8.332 1.00 . A A . 46 GLU N 1 1 1 701 1 1 46 GLU O O -2.952 8.296 -11.023 1.00 . A A . 46 GLU O 1 1 1 702 1 1 46 GLU OE1 O -0.311 11.097 -8.081 1.00 . A A . 46 GLU OE1 1 1 1 703 1 1 46 GLU OE2 O -0.093 9.382 -9.427 1.00 . A A . 46 GLU OE2 1 1 1 704 1 1 47 CYS C C -6.632 9.234 -12.980 1.00 . A A . 47 CYS C 1 1 1 705 1 1 47 CYS CA C -5.313 8.654 -12.492 1.00 . A A . 47 CYS CA 1 1 1 706 1 1 47 CYS CB C -5.420 7.131 -12.394 1.00 . A A . 47 CYS CB 1 1 1 707 1 1 47 CYS H H -5.644 9.845 -10.791 1.00 . A A . 47 CYS H 1 1 1 708 1 1 47 CYS HA H -4.532 8.912 -13.188 1.00 . A A . 47 CYS HA 1 1 1 709 1 1 47 CYS HB2 H -5.599 6.727 -13.379 1.00 . A A . 47 CYS HB2 1 1 1 710 1 1 47 CYS HB3 H -4.488 6.737 -12.014 1.00 . A A . 47 CYS HB3 1 1 1 711 1 1 47 CYS N N -4.987 9.249 -11.204 1.00 . A A . 47 CYS N 1 1 1 712 1 1 47 CYS O O -7.081 8.870 -14.082 1.00 . A A . 47 CYS O 1 1 1 713 1 1 47 CYS OXT O -7.214 10.050 -12.232 1.00 . A A . 47 CYS OXT 1 1 1 714 1 1 47 CYS SG S -6.756 6.543 -11.306 1.00 . A A . 47 CYS SG 1 1 2 715 1 1 1 ALA C C -11.519 8.897 -5.676 1.00 . A A . 1 ALA C 1 1 2 716 1 1 1 ALA CA C -12.829 9.496 -6.162 1.00 . A A . 1 ALA CA 1 1 2 717 1 1 1 ALA CB C -13.603 8.488 -7.000 1.00 . A A . 1 ALA CB 1 1 2 718 1 1 1 ALA H1 H -11.809 11.273 -6.498 1.00 . A A . 1 ALA H1 1 1 2 719 1 1 1 ALA H2 H -13.423 11.309 -6.994 1.00 . A A . 1 ALA H2 1 1 2 720 1 1 1 ALA H3 H -12.272 10.473 -7.916 1.00 . A A . 1 ALA H3 1 1 2 721 1 1 1 ALA HA H -13.430 9.757 -5.307 1.00 . A A . 1 ALA HA 1 1 2 722 1 1 1 ALA HB1 H -13.316 8.585 -8.037 1.00 . A A . 1 ALA HB1 1 1 2 723 1 1 1 ALA HB2 H -14.662 8.676 -6.901 1.00 . A A . 1 ALA HB2 1 1 2 724 1 1 1 ALA HB3 H -13.381 7.488 -6.657 1.00 . A A . 1 ALA HB3 1 1 2 725 1 1 1 ALA N N -12.570 10.726 -6.941 1.00 . A A . 1 ALA N 1 1 2 726 1 1 1 ALA O O -10.449 9.288 -6.137 1.00 . A A . 1 ALA O 1 1 2 727 1 1 2 THR C C -10.443 5.831 -4.561 1.00 . A A . 2 THR C 1 1 2 728 1 1 2 THR CA C -10.425 7.311 -4.203 1.00 . A A . 2 THR CA 1 1 2 729 1 1 2 THR CB C -10.358 7.476 -2.674 1.00 . A A . 2 THR CB 1 1 2 730 1 1 2 THR CG2 C -8.990 7.074 -2.142 1.00 . A A . 2 THR CG2 1 1 2 731 1 1 2 THR H H -12.486 7.692 -4.411 1.00 . A A . 2 THR H 1 1 2 732 1 1 2 THR HA H -9.552 7.773 -4.641 1.00 . A A . 2 THR HA 1 1 2 733 1 1 2 THR HB H -11.107 6.842 -2.222 1.00 . A A . 2 THR HB 1 1 2 734 1 1 2 THR HG1 H -10.059 9.102 -1.593 1.00 . A A . 2 THR HG1 1 1 2 735 1 1 2 THR HG21 H -8.398 7.959 -1.964 1.00 . A A . 2 THR HG21 1 1 2 736 1 1 2 THR HG22 H -8.491 6.447 -2.867 1.00 . A A . 2 THR HG22 1 1 2 737 1 1 2 THR HG23 H -9.109 6.529 -1.218 1.00 . A A . 2 THR HG23 1 1 2 738 1 1 2 THR N N -11.606 7.960 -4.744 1.00 . A A . 2 THR N 1 1 2 739 1 1 2 THR O O -11.275 5.071 -4.066 1.00 . A A . 2 THR O 1 1 2 740 1 1 2 THR OG1 O -10.625 8.843 -2.326 1.00 . A A . 2 THR OG1 1 1 2 741 1 1 3 CYS C C -8.416 3.278 -5.084 1.00 . A A . 3 CYS C 1 1 2 742 1 1 3 CYS CA C -9.455 4.055 -5.878 1.00 . A A . 3 CYS CA 1 1 2 743 1 1 3 CYS CB C -9.133 4.006 -7.373 1.00 . A A . 3 CYS CB 1 1 2 744 1 1 3 CYS H H -8.909 6.095 -5.806 1.00 . A A . 3 CYS H 1 1 2 745 1 1 3 CYS HA H -10.421 3.601 -5.716 1.00 . A A . 3 CYS HA 1 1 2 746 1 1 3 CYS HB2 H -8.357 4.727 -7.589 1.00 . A A . 3 CYS HB2 1 1 2 747 1 1 3 CYS HB3 H -8.782 3.017 -7.630 1.00 . A A . 3 CYS HB3 1 1 2 748 1 1 3 CYS N N -9.538 5.435 -5.435 1.00 . A A . 3 CYS N 1 1 2 749 1 1 3 CYS O O -7.273 3.715 -4.943 1.00 . A A . 3 CYS O 1 1 2 750 1 1 3 CYS SG S -10.555 4.396 -8.443 1.00 . A A . 3 CYS SG 1 1 2 751 1 1 4 LYS C C -7.676 -0.033 -4.559 1.00 . A A . 4 LYS C 1 1 2 752 1 1 4 LYS CA C -7.925 1.264 -3.814 1.00 . A A . 4 LYS CA 1 1 2 753 1 1 4 LYS CB C -8.505 0.934 -2.441 1.00 . A A . 4 LYS CB 1 1 2 754 1 1 4 LYS CD C -8.253 -0.855 -0.678 1.00 . A A . 4 LYS CD 1 1 2 755 1 1 4 LYS CE C -8.880 -1.993 -1.482 1.00 . A A . 4 LYS CE 1 1 2 756 1 1 4 LYS CG C -7.537 0.146 -1.570 1.00 . A A . 4 LYS CG 1 1 2 757 1 1 4 LYS H H -9.740 1.824 -4.739 1.00 . A A . 4 LYS H 1 1 2 758 1 1 4 LYS HA H -6.983 1.780 -3.688 1.00 . A A . 4 LYS HA 1 1 2 759 1 1 4 LYS HB2 H -8.752 1.855 -1.932 1.00 . A A . 4 LYS HB2 1 1 2 760 1 1 4 LYS HB3 H -9.403 0.348 -2.569 1.00 . A A . 4 LYS HB3 1 1 2 761 1 1 4 LYS HD2 H -7.536 -1.270 0.016 1.00 . A A . 4 LYS HD2 1 1 2 762 1 1 4 LYS HD3 H -9.028 -0.341 -0.131 1.00 . A A . 4 LYS HD3 1 1 2 763 1 1 4 LYS HE2 H -9.398 -2.652 -0.802 1.00 . A A . 4 LYS HE2 1 1 2 764 1 1 4 LYS HE3 H -9.588 -1.573 -2.182 1.00 . A A . 4 LYS HE3 1 1 2 765 1 1 4 LYS HG2 H -6.851 -0.388 -2.210 1.00 . A A . 4 LYS HG2 1 1 2 766 1 1 4 LYS HG3 H -6.986 0.837 -0.949 1.00 . A A . 4 LYS HG3 1 1 2 767 1 1 4 LYS HZ1 H -7.000 -2.228 -2.372 1.00 . A A . 4 LYS HZ1 1 1 2 768 1 1 4 LYS HZ2 H -8.236 -3.052 -3.169 1.00 . A A . 4 LYS HZ2 1 1 2 769 1 1 4 LYS HZ3 H -7.619 -3.660 -1.714 1.00 . A A . 4 LYS HZ3 1 1 2 770 1 1 4 LYS N N -8.819 2.118 -4.580 1.00 . A A . 4 LYS N 1 1 2 771 1 1 4 LYS NZ N -7.864 -2.785 -2.236 1.00 . A A . 4 LYS NZ 1 1 2 772 1 1 4 LYS O O -8.605 -0.657 -5.069 1.00 . A A . 4 LYS O 1 1 2 773 1 1 5 ALA C C -4.685 -2.108 -4.713 1.00 . A A . 5 ALA C 1 1 2 774 1 1 5 ALA CA C -6.031 -1.672 -5.247 1.00 . A A . 5 ALA CA 1 1 2 775 1 1 5 ALA CB C -5.971 -1.483 -6.757 1.00 . A A . 5 ALA CB 1 1 2 776 1 1 5 ALA H H -5.733 0.101 -4.139 1.00 . A A . 5 ALA H 1 1 2 777 1 1 5 ALA HA H -6.767 -2.430 -5.022 1.00 . A A . 5 ALA HA 1 1 2 778 1 1 5 ALA HB1 H -6.869 -0.987 -7.093 1.00 . A A . 5 ALA HB1 1 1 2 779 1 1 5 ALA HB2 H -5.891 -2.447 -7.237 1.00 . A A . 5 ALA HB2 1 1 2 780 1 1 5 ALA HB3 H -5.110 -0.882 -7.011 1.00 . A A . 5 ALA HB3 1 1 2 781 1 1 5 ALA N N -6.425 -0.442 -4.590 1.00 . A A . 5 ALA N 1 1 2 782 1 1 5 ALA O O -3.769 -1.296 -4.600 1.00 . A A . 5 ALA O 1 1 2 783 1 1 6 GLU C C -2.275 -3.867 -4.920 1.00 . A A . 6 GLU C 1 1 2 784 1 1 6 GLU CA C -3.334 -3.897 -3.836 1.00 . A A . 6 GLU CA 1 1 2 785 1 1 6 GLU CB C -3.506 -5.321 -3.286 1.00 . A A . 6 GLU CB 1 1 2 786 1 1 6 GLU CD C -5.892 -5.169 -2.332 1.00 . A A . 6 GLU CD 1 1 2 787 1 1 6 GLU CG C -4.412 -5.419 -2.057 1.00 . A A . 6 GLU CG 1 1 2 788 1 1 6 GLU H H -5.344 -3.980 -4.460 1.00 . A A . 6 GLU H 1 1 2 789 1 1 6 GLU HA H -3.022 -3.246 -3.032 1.00 . A A . 6 GLU HA 1 1 2 790 1 1 6 GLU HB2 H -3.906 -5.951 -4.058 1.00 . A A . 6 GLU HB2 1 1 2 791 1 1 6 GLU HB3 H -2.532 -5.697 -3.009 1.00 . A A . 6 GLU HB3 1 1 2 792 1 1 6 GLU HG2 H -4.312 -6.408 -1.639 1.00 . A A . 6 GLU HG2 1 1 2 793 1 1 6 GLU HG3 H -4.074 -4.694 -1.329 1.00 . A A . 6 GLU HG3 1 1 2 794 1 1 6 GLU N N -4.571 -3.375 -4.364 1.00 . A A . 6 GLU N 1 1 2 795 1 1 6 GLU O O -2.557 -4.175 -6.079 1.00 . A A . 6 GLU O 1 1 2 796 1 1 6 GLU OE1 O -6.295 -5.081 -3.506 1.00 . A A . 6 GLU OE1 1 1 2 797 1 1 6 GLU OE2 O -6.667 -5.061 -1.356 1.00 . A A . 6 GLU OE2 1 1 2 798 1 1 7 CYS C C 0.206 -4.656 -6.259 1.00 . A A . 7 CYS C 1 1 2 799 1 1 7 CYS CA C 0.038 -3.354 -5.478 1.00 . A A . 7 CYS CA 1 1 2 800 1 1 7 CYS CB C 1.339 -3.011 -4.742 1.00 . A A . 7 CYS CB 1 1 2 801 1 1 7 CYS H H -0.947 -3.206 -3.597 1.00 . A A . 7 CYS H 1 1 2 802 1 1 7 CYS HA H -0.192 -2.560 -6.173 1.00 . A A . 7 CYS HA 1 1 2 803 1 1 7 CYS HB2 H 1.164 -2.169 -4.090 1.00 . A A . 7 CYS HB2 1 1 2 804 1 1 7 CYS HB3 H 1.644 -3.861 -4.150 1.00 . A A . 7 CYS HB3 1 1 2 805 1 1 7 CYS N N -1.076 -3.461 -4.538 1.00 . A A . 7 CYS N 1 1 2 806 1 1 7 CYS O O 0.314 -5.732 -5.672 1.00 . A A . 7 CYS O 1 1 2 807 1 1 7 CYS SG S 2.727 -2.578 -5.850 1.00 . A A . 7 CYS SG 1 1 2 808 1 1 8 PRO C C 1.598 -6.542 -8.191 1.00 . A A . 8 PRO C 1 1 2 809 1 1 8 PRO CA C 0.333 -5.743 -8.476 1.00 . A A . 8 PRO CA 1 1 2 810 1 1 8 PRO CB C 0.384 -5.141 -9.884 1.00 . A A . 8 PRO CB 1 1 2 811 1 1 8 PRO CD C 0.047 -3.323 -8.371 1.00 . A A . 8 PRO CD 1 1 2 812 1 1 8 PRO CG C -0.271 -3.809 -9.756 1.00 . A A . 8 PRO CG 1 1 2 813 1 1 8 PRO HA H -0.526 -6.392 -8.391 1.00 . A A . 8 PRO HA 1 1 2 814 1 1 8 PRO HB2 H 1.413 -5.047 -10.200 1.00 . A A . 8 PRO HB2 1 1 2 815 1 1 8 PRO HB3 H -0.152 -5.779 -10.570 1.00 . A A . 8 PRO HB3 1 1 2 816 1 1 8 PRO HD2 H 0.964 -2.752 -8.372 1.00 . A A . 8 PRO HD2 1 1 2 817 1 1 8 PRO HD3 H -0.768 -2.731 -7.982 1.00 . A A . 8 PRO HD3 1 1 2 818 1 1 8 PRO HG2 H 0.131 -3.130 -10.493 1.00 . A A . 8 PRO HG2 1 1 2 819 1 1 8 PRO HG3 H -1.339 -3.912 -9.881 1.00 . A A . 8 PRO HG3 1 1 2 820 1 1 8 PRO N N 0.203 -4.570 -7.602 1.00 . A A . 8 PRO N 1 1 2 821 1 1 8 PRO O O 1.573 -7.769 -8.137 1.00 . A A . 8 PRO O 1 1 2 822 1 1 9 THR C C 4.132 -6.706 -6.207 1.00 . A A . 9 THR C 1 1 2 823 1 1 9 THR CA C 3.969 -6.483 -7.707 1.00 . A A . 9 THR CA 1 1 2 824 1 1 9 THR CB C 5.152 -5.650 -8.237 1.00 . A A . 9 THR CB 1 1 2 825 1 1 9 THR CG2 C 5.181 -5.653 -9.758 1.00 . A A . 9 THR CG2 1 1 2 826 1 1 9 THR H H 2.659 -4.862 -8.043 1.00 . A A . 9 THR H 1 1 2 827 1 1 9 THR HA H 3.978 -7.441 -8.206 1.00 . A A . 9 THR HA 1 1 2 828 1 1 9 THR HB H 6.071 -6.088 -7.874 1.00 . A A . 9 THR HB 1 1 2 829 1 1 9 THR HG1 H 4.533 -4.282 -6.945 1.00 . A A . 9 THR HG1 1 1 2 830 1 1 9 THR HG21 H 4.353 -5.071 -10.135 1.00 . A A . 9 THR HG21 1 1 2 831 1 1 9 THR HG22 H 5.102 -6.668 -10.118 1.00 . A A . 9 THR HG22 1 1 2 832 1 1 9 THR HG23 H 6.110 -5.220 -10.101 1.00 . A A . 9 THR HG23 1 1 2 833 1 1 9 THR N N 2.701 -5.838 -7.998 1.00 . A A . 9 THR N 1 1 2 834 1 1 9 THR O O 5.152 -6.337 -5.623 1.00 . A A . 9 THR O 1 1 2 835 1 1 9 THR OG1 O 5.060 -4.299 -7.760 1.00 . A A . 9 THR OG1 1 1 2 836 1 1 10 TRP C C 2.667 -8.965 -3.854 1.00 . A A . 10 TRP C 1 1 2 837 1 1 10 TRP CA C 3.160 -7.556 -4.158 1.00 . A A . 10 TRP CA 1 1 2 838 1 1 10 TRP CB C 2.293 -6.537 -3.413 1.00 . A A . 10 TRP CB 1 1 2 839 1 1 10 TRP CD1 C 1.744 -7.165 -0.992 1.00 . A A . 10 TRP CD1 1 1 2 840 1 1 10 TRP CD2 C 3.559 -5.875 -1.226 1.00 . A A . 10 TRP CD2 1 1 2 841 1 1 10 TRP CE2 C 3.385 -6.152 0.142 1.00 . A A . 10 TRP CE2 1 1 2 842 1 1 10 TRP CE3 C 4.633 -5.074 -1.622 1.00 . A A . 10 TRP CE3 1 1 2 843 1 1 10 TRP CG C 2.512 -6.545 -1.933 1.00 . A A . 10 TRP CG 1 1 2 844 1 1 10 TRP CH2 C 5.291 -4.869 0.697 1.00 . A A . 10 TRP CH2 1 1 2 845 1 1 10 TRP CZ2 C 4.252 -5.653 1.115 1.00 . A A . 10 TRP CZ2 1 1 2 846 1 1 10 TRP CZ3 C 5.486 -4.579 -0.657 1.00 . A A . 10 TRP CZ3 1 1 2 847 1 1 10 TRP H H 2.329 -7.569 -6.101 1.00 . A A . 10 TRP H 1 1 2 848 1 1 10 TRP HA H 4.183 -7.461 -3.826 1.00 . A A . 10 TRP HA 1 1 2 849 1 1 10 TRP HB2 H 2.519 -5.546 -3.778 1.00 . A A . 10 TRP HB2 1 1 2 850 1 1 10 TRP HB3 H 1.252 -6.756 -3.598 1.00 . A A . 10 TRP HB3 1 1 2 851 1 1 10 TRP HD1 H 0.858 -7.749 -1.217 1.00 . A A . 10 TRP HD1 1 1 2 852 1 1 10 TRP HE1 H 1.908 -7.304 1.105 1.00 . A A . 10 TRP HE1 1 1 2 853 1 1 10 TRP HE3 H 4.800 -4.838 -2.663 1.00 . A A . 10 TRP HE3 1 1 2 854 1 1 10 TRP HH2 H 5.983 -4.459 1.417 1.00 . A A . 10 TRP HH2 1 1 2 855 1 1 10 TRP HZ2 H 4.122 -5.865 2.167 1.00 . A A . 10 TRP HZ2 1 1 2 856 1 1 10 TRP HZ3 H 6.316 -3.951 -0.944 1.00 . A A . 10 TRP HZ3 1 1 2 857 1 1 10 TRP N N 3.123 -7.299 -5.586 1.00 . A A . 10 TRP N 1 1 2 858 1 1 10 TRP NE1 N 2.271 -6.948 0.262 1.00 . A A . 10 TRP NE1 1 1 2 859 1 1 10 TRP O O 1.501 -9.285 -4.082 1.00 . A A . 10 TRP O 1 1 2 860 1 1 11 ASP C C 4.111 -11.604 -1.807 1.00 . A A . 11 ASP C 1 1 2 861 1 1 11 ASP CA C 3.231 -11.166 -2.971 1.00 . A A . 11 ASP CA 1 1 2 862 1 1 11 ASP CB C 3.423 -12.105 -4.165 1.00 . A A . 11 ASP CB 1 1 2 863 1 1 11 ASP CG C 2.810 -13.475 -3.928 1.00 . A A . 11 ASP CG 1 1 2 864 1 1 11 ASP H H 4.467 -9.465 -3.165 1.00 . A A . 11 ASP H 1 1 2 865 1 1 11 ASP HA H 2.197 -11.193 -2.658 1.00 . A A . 11 ASP HA 1 1 2 866 1 1 11 ASP HB2 H 2.957 -11.669 -5.037 1.00 . A A . 11 ASP HB2 1 1 2 867 1 1 11 ASP HB3 H 4.480 -12.231 -4.351 1.00 . A A . 11 ASP HB3 1 1 2 868 1 1 11 ASP N N 3.559 -9.790 -3.327 1.00 . A A . 11 ASP N 1 1 2 869 1 1 11 ASP O O 4.943 -12.504 -1.928 1.00 . A A . 11 ASP O 1 1 2 870 1 1 11 ASP OD1 O 2.117 -13.650 -2.900 1.00 . A A . 11 ASP OD1 1 1 2 871 1 1 11 ASP OD2 O 3.007 -14.369 -4.778 1.00 . A A . 11 ASP OD2 1 1 2 872 1 1 12 SER C C 4.005 -10.682 1.745 1.00 . A A . 12 SER C 1 1 2 873 1 1 12 SER CA C 4.728 -11.209 0.513 1.00 . A A . 12 SER CA 1 1 2 874 1 1 12 SER CB C 6.118 -10.567 0.413 1.00 . A A . 12 SER CB 1 1 2 875 1 1 12 SER H H 3.285 -10.207 -0.654 1.00 . A A . 12 SER H 1 1 2 876 1 1 12 SER HA H 4.836 -12.280 0.599 1.00 . A A . 12 SER HA 1 1 2 877 1 1 12 SER HB2 H 6.011 -9.498 0.301 1.00 . A A . 12 SER HB2 1 1 2 878 1 1 12 SER HB3 H 6.675 -10.779 1.314 1.00 . A A . 12 SER HB3 1 1 2 879 1 1 12 SER HG H 6.282 -11.692 -1.190 1.00 . A A . 12 SER HG 1 1 2 880 1 1 12 SER N N 3.946 -10.928 -0.681 1.00 . A A . 12 SER N 1 1 2 881 1 1 12 SER O O 3.114 -9.835 1.635 1.00 . A A . 12 SER O 1 1 2 882 1 1 12 SER OG O 6.841 -11.069 -0.699 1.00 . A A . 12 SER OG 1 1 2 883 1 1 13 VAL C C 4.338 -9.379 4.549 1.00 . A A . 13 VAL C 1 1 2 884 1 1 13 VAL CA C 3.780 -10.741 4.158 1.00 . A A . 13 VAL CA 1 1 2 885 1 1 13 VAL CB C 4.034 -11.751 5.299 1.00 . A A . 13 VAL CB 1 1 2 886 1 1 13 VAL CG1 C 3.361 -11.299 6.587 1.00 . A A . 13 VAL CG1 1 1 2 887 1 1 13 VAL CG2 C 3.553 -13.139 4.900 1.00 . A A . 13 VAL CG2 1 1 2 888 1 1 13 VAL H H 5.110 -11.841 2.940 1.00 . A A . 13 VAL H 1 1 2 889 1 1 13 VAL HA H 2.713 -10.656 3.999 1.00 . A A . 13 VAL HA 1 1 2 890 1 1 13 VAL HB H 5.099 -11.802 5.475 1.00 . A A . 13 VAL HB 1 1 2 891 1 1 13 VAL HG11 H 2.324 -11.071 6.391 1.00 . A A . 13 VAL HG11 1 1 2 892 1 1 13 VAL HG12 H 3.859 -10.417 6.962 1.00 . A A . 13 VAL HG12 1 1 2 893 1 1 13 VAL HG13 H 3.424 -12.088 7.322 1.00 . A A . 13 VAL HG13 1 1 2 894 1 1 13 VAL HG21 H 4.405 -13.787 4.755 1.00 . A A . 13 VAL HG21 1 1 2 895 1 1 13 VAL HG22 H 2.989 -13.074 3.982 1.00 . A A . 13 VAL HG22 1 1 2 896 1 1 13 VAL HG23 H 2.925 -13.540 5.681 1.00 . A A . 13 VAL HG23 1 1 2 897 1 1 13 VAL N N 4.393 -11.175 2.914 1.00 . A A . 13 VAL N 1 1 2 898 1 1 13 VAL O O 5.533 -9.231 4.803 1.00 . A A . 13 VAL O 1 1 2 899 1 1 14 CYS C C 3.826 -6.753 6.380 1.00 . A A . 14 CYS C 1 1 2 900 1 1 14 CYS CA C 3.855 -7.027 4.880 1.00 . A A . 14 CYS CA 1 1 2 901 1 1 14 CYS CB C 2.935 -6.049 4.157 1.00 . A A . 14 CYS CB 1 1 2 902 1 1 14 CYS H H 2.535 -8.571 4.322 1.00 . A A . 14 CYS H 1 1 2 903 1 1 14 CYS HA H 4.863 -6.880 4.522 1.00 . A A . 14 CYS HA 1 1 2 904 1 1 14 CYS HB2 H 3.137 -6.093 3.097 1.00 . A A . 14 CYS HB2 1 1 2 905 1 1 14 CYS HB3 H 1.909 -6.334 4.335 1.00 . A A . 14 CYS HB3 1 1 2 906 1 1 14 CYS N N 3.468 -8.388 4.559 1.00 . A A . 14 CYS N 1 1 2 907 1 1 14 CYS O O 2.960 -7.247 7.104 1.00 . A A . 14 CYS O 1 1 2 908 1 1 14 CYS SG S 3.129 -4.322 4.683 1.00 . A A . 14 CYS SG 1 1 2 909 1 1 15 ILE C C 5.000 -4.020 8.300 1.00 . A A . 15 ILE C 1 1 2 910 1 1 15 ILE CA C 4.864 -5.539 8.222 1.00 . A A . 15 ILE CA 1 1 2 911 1 1 15 ILE CB C 6.073 -6.199 8.926 1.00 . A A . 15 ILE CB 1 1 2 912 1 1 15 ILE CD1 C 7.208 -8.443 9.366 1.00 . A A . 15 ILE CD1 1 1 2 913 1 1 15 ILE CG1 C 5.994 -7.726 8.813 1.00 . A A . 15 ILE CG1 1 1 2 914 1 1 15 ILE CG2 C 6.134 -5.775 10.390 1.00 . A A . 15 ILE CG2 1 1 2 915 1 1 15 ILE H H 5.408 -5.562 6.186 1.00 . A A . 15 ILE H 1 1 2 916 1 1 15 ILE HA H 3.956 -5.844 8.725 1.00 . A A . 15 ILE HA 1 1 2 917 1 1 15 ILE HB H 6.974 -5.855 8.441 1.00 . A A . 15 ILE HB 1 1 2 918 1 1 15 ILE HD11 H 7.325 -8.199 10.412 1.00 . A A . 15 ILE HD11 1 1 2 919 1 1 15 ILE HD12 H 8.089 -8.130 8.823 1.00 . A A . 15 ILE HD12 1 1 2 920 1 1 15 ILE HD13 H 7.077 -9.509 9.257 1.00 . A A . 15 ILE HD13 1 1 2 921 1 1 15 ILE HG12 H 5.129 -8.075 9.356 1.00 . A A . 15 ILE HG12 1 1 2 922 1 1 15 ILE HG13 H 5.894 -7.997 7.772 1.00 . A A . 15 ILE HG13 1 1 2 923 1 1 15 ILE HG21 H 6.137 -6.653 11.019 1.00 . A A . 15 ILE HG21 1 1 2 924 1 1 15 ILE HG22 H 5.273 -5.167 10.625 1.00 . A A . 15 ILE HG22 1 1 2 925 1 1 15 ILE HG23 H 7.035 -5.205 10.562 1.00 . A A . 15 ILE HG23 1 1 2 926 1 1 15 ILE N N 4.769 -5.933 6.826 1.00 . A A . 15 ILE N 1 1 2 927 1 1 15 ILE O O 4.140 -3.326 8.856 1.00 . A A . 15 ILE O 1 1 2 928 1 1 16 ASN C C 5.511 -1.445 6.542 1.00 . A A . 16 ASN C 1 1 2 929 1 1 16 ASN CA C 6.334 -2.076 7.666 1.00 . A A . 16 ASN CA 1 1 2 930 1 1 16 ASN CB C 7.832 -1.812 7.464 1.00 . A A . 16 ASN CB 1 1 2 931 1 1 16 ASN CG C 8.226 -0.375 7.761 1.00 . A A . 16 ASN CG 1 1 2 932 1 1 16 ASN H H 6.701 -4.117 7.262 1.00 . A A . 16 ASN H 1 1 2 933 1 1 16 ASN HA H 6.021 -1.654 8.610 1.00 . A A . 16 ASN HA 1 1 2 934 1 1 16 ASN HB2 H 8.395 -2.460 8.118 1.00 . A A . 16 ASN HB2 1 1 2 935 1 1 16 ASN HB3 H 8.092 -2.032 6.438 1.00 . A A . 16 ASN HB3 1 1 2 936 1 1 16 ASN HD21 H 9.388 -0.973 9.256 1.00 . A A . 16 ASN HD21 1 1 2 937 1 1 16 ASN HD22 H 9.333 0.732 8.981 1.00 . A A . 16 ASN HD22 1 1 2 938 1 1 16 ASN N N 6.074 -3.510 7.705 1.00 . A A . 16 ASN N 1 1 2 939 1 1 16 ASN ND2 N 9.067 -0.187 8.765 1.00 . A A . 16 ASN ND2 1 1 2 940 1 1 16 ASN O O 5.256 -2.085 5.525 1.00 . A A . 16 ASN O 1 1 2 941 1 1 16 ASN OD1 O 7.780 0.557 7.096 1.00 . A A . 16 ASN OD1 1 1 2 942 1 1 17 LYS C C 5.078 1.011 4.573 1.00 . A A . 17 LYS C 1 1 2 943 1 1 17 LYS CA C 4.245 0.480 5.744 1.00 . A A . 17 LYS CA 1 1 2 944 1 1 17 LYS CB C 3.456 1.621 6.401 1.00 . A A . 17 LYS CB 1 1 2 945 1 1 17 LYS CD C 2.155 -0.168 7.632 1.00 . A A . 17 LYS CD 1 1 2 946 1 1 17 LYS CE C 1.797 -0.705 9.011 1.00 . A A . 17 LYS CE 1 1 2 947 1 1 17 LYS CG C 2.765 1.227 7.705 1.00 . A A . 17 LYS CG 1 1 2 948 1 1 17 LYS H H 5.289 0.248 7.577 1.00 . A A . 17 LYS H 1 1 2 949 1 1 17 LYS HA H 3.537 -0.239 5.354 1.00 . A A . 17 LYS HA 1 1 2 950 1 1 17 LYS HB2 H 4.133 2.436 6.610 1.00 . A A . 17 LYS HB2 1 1 2 951 1 1 17 LYS HB3 H 2.700 1.963 5.709 1.00 . A A . 17 LYS HB3 1 1 2 952 1 1 17 LYS HD2 H 1.259 -0.126 7.032 1.00 . A A . 17 LYS HD2 1 1 2 953 1 1 17 LYS HD3 H 2.867 -0.836 7.170 1.00 . A A . 17 LYS HD3 1 1 2 954 1 1 17 LYS HE2 H 2.607 -0.487 9.690 1.00 . A A . 17 LYS HE2 1 1 2 955 1 1 17 LYS HE3 H 0.899 -0.210 9.353 1.00 . A A . 17 LYS HE3 1 1 2 956 1 1 17 LYS HG2 H 3.487 1.251 8.507 1.00 . A A . 17 LYS HG2 1 1 2 957 1 1 17 LYS HG3 H 1.977 1.940 7.906 1.00 . A A . 17 LYS HG3 1 1 2 958 1 1 17 LYS HZ1 H 0.956 -2.439 8.191 1.00 . A A . 17 LYS HZ1 1 1 2 959 1 1 17 LYS HZ2 H 1.098 -2.478 9.875 1.00 . A A . 17 LYS HZ2 1 1 2 960 1 1 17 LYS HZ3 H 2.473 -2.686 8.907 1.00 . A A . 17 LYS HZ3 1 1 2 961 1 1 17 LYS N N 5.071 -0.209 6.738 1.00 . A A . 17 LYS N 1 1 2 962 1 1 17 LYS NZ N 1.562 -2.179 8.994 1.00 . A A . 17 LYS NZ 1 1 2 963 1 1 17 LYS O O 4.573 1.123 3.455 1.00 . A A . 17 LYS O 1 1 2 964 1 1 18 LYS C C 7.270 0.984 2.540 1.00 . A A . 18 LYS C 1 1 2 965 1 1 18 LYS CA C 7.250 1.864 3.803 1.00 . A A . 18 LYS CA 1 1 2 966 1 1 18 LYS CB C 8.671 2.036 4.358 1.00 . A A . 18 LYS CB 1 1 2 967 1 1 18 LYS CD C 10.979 2.998 4.037 1.00 . A A . 18 LYS CD 1 1 2 968 1 1 18 LYS CE C 11.758 1.699 4.191 1.00 . A A . 18 LYS CE 1 1 2 969 1 1 18 LYS CG C 9.611 2.770 3.410 1.00 . A A . 18 LYS CG 1 1 2 970 1 1 18 LYS H H 6.687 1.222 5.751 1.00 . A A . 18 LYS H 1 1 2 971 1 1 18 LYS HA H 6.875 2.838 3.524 1.00 . A A . 18 LYS HA 1 1 2 972 1 1 18 LYS HB2 H 8.619 2.593 5.282 1.00 . A A . 18 LYS HB2 1 1 2 973 1 1 18 LYS HB3 H 9.087 1.060 4.559 1.00 . A A . 18 LYS HB3 1 1 2 974 1 1 18 LYS HD2 H 11.544 3.668 3.407 1.00 . A A . 18 LYS HD2 1 1 2 975 1 1 18 LYS HD3 H 10.847 3.445 5.011 1.00 . A A . 18 LYS HD3 1 1 2 976 1 1 18 LYS HE2 H 12.656 1.898 4.756 1.00 . A A . 18 LYS HE2 1 1 2 977 1 1 18 LYS HE3 H 11.146 0.990 4.729 1.00 . A A . 18 LYS HE3 1 1 2 978 1 1 18 LYS HG2 H 9.732 2.182 2.513 1.00 . A A . 18 LYS HG2 1 1 2 979 1 1 18 LYS HG3 H 9.176 3.727 3.159 1.00 . A A . 18 LYS HG3 1 1 2 980 1 1 18 LYS HZ1 H 12.323 1.874 2.188 1.00 . A A . 18 LYS HZ1 1 1 2 981 1 1 18 LYS HZ2 H 11.362 0.521 2.511 1.00 . A A . 18 LYS HZ2 1 1 2 982 1 1 18 LYS HZ3 H 12.989 0.531 2.973 1.00 . A A . 18 LYS HZ3 1 1 2 983 1 1 18 LYS N N 6.347 1.336 4.836 1.00 . A A . 18 LYS N 1 1 2 984 1 1 18 LYS NZ N 12.134 1.115 2.874 1.00 . A A . 18 LYS NZ 1 1 2 985 1 1 18 LYS O O 7.077 1.500 1.440 1.00 . A A . 18 LYS O 1 1 2 986 1 1 19 PRO C C 6.291 -1.078 0.612 1.00 . A A . 19 PRO C 1 1 2 987 1 1 19 PRO CA C 7.514 -1.263 1.503 1.00 . A A . 19 PRO CA 1 1 2 988 1 1 19 PRO CB C 7.468 -2.646 2.156 1.00 . A A . 19 PRO CB 1 1 2 989 1 1 19 PRO CD C 7.756 -1.086 3.920 1.00 . A A . 19 PRO CD 1 1 2 990 1 1 19 PRO CG C 8.163 -2.455 3.452 1.00 . A A . 19 PRO CG 1 1 2 991 1 1 19 PRO HA H 8.416 -1.159 0.918 1.00 . A A . 19 PRO HA 1 1 2 992 1 1 19 PRO HB2 H 6.439 -2.941 2.301 1.00 . A A . 19 PRO HB2 1 1 2 993 1 1 19 PRO HB3 H 7.970 -3.371 1.535 1.00 . A A . 19 PRO HB3 1 1 2 994 1 1 19 PRO HD2 H 6.862 -1.145 4.523 1.00 . A A . 19 PRO HD2 1 1 2 995 1 1 19 PRO HD3 H 8.558 -0.624 4.477 1.00 . A A . 19 PRO HD3 1 1 2 996 1 1 19 PRO HG2 H 7.843 -3.208 4.158 1.00 . A A . 19 PRO HG2 1 1 2 997 1 1 19 PRO HG3 H 9.232 -2.500 3.308 1.00 . A A . 19 PRO HG3 1 1 2 998 1 1 19 PRO N N 7.497 -0.352 2.662 1.00 . A A . 19 PRO N 1 1 2 999 1 1 19 PRO O O 6.391 -1.050 -0.619 1.00 . A A . 19 PRO O 1 1 2 1000 1 1 20 CYS C C 3.868 0.569 -0.197 1.00 . A A . 20 CYS C 1 1 2 1001 1 1 20 CYS CA C 3.885 -0.761 0.550 1.00 . A A . 20 CYS CA 1 1 2 1002 1 1 20 CYS CB C 2.714 -0.825 1.530 1.00 . A A . 20 CYS CB 1 1 2 1003 1 1 20 CYS H H 5.136 -0.969 2.233 1.00 . A A . 20 CYS H 1 1 2 1004 1 1 20 CYS HA H 3.789 -1.566 -0.166 1.00 . A A . 20 CYS HA 1 1 2 1005 1 1 20 CYS HB2 H 2.767 -1.749 2.086 1.00 . A A . 20 CYS HB2 1 1 2 1006 1 1 20 CYS HB3 H 2.780 0.007 2.216 1.00 . A A . 20 CYS HB3 1 1 2 1007 1 1 20 CYS N N 5.139 -0.946 1.254 1.00 . A A . 20 CYS N 1 1 2 1008 1 1 20 CYS O O 3.590 0.611 -1.394 1.00 . A A . 20 CYS O 1 1 2 1009 1 1 20 CYS SG S 1.087 -0.755 0.725 1.00 . A A . 20 CYS SG 1 1 2 1010 1 1 21 VAL C C 5.106 3.011 -1.314 1.00 . A A . 21 VAL C 1 1 2 1011 1 1 21 VAL CA C 4.205 2.985 -0.082 1.00 . A A . 21 VAL CA 1 1 2 1012 1 1 21 VAL CB C 4.690 4.041 0.936 1.00 . A A . 21 VAL CB 1 1 2 1013 1 1 21 VAL CG1 C 4.741 5.425 0.308 1.00 . A A . 21 VAL CG1 1 1 2 1014 1 1 21 VAL CG2 C 3.797 4.048 2.167 1.00 . A A . 21 VAL CG2 1 1 2 1015 1 1 21 VAL H H 4.401 1.549 1.465 1.00 . A A . 21 VAL H 1 1 2 1016 1 1 21 VAL HA H 3.194 3.237 -0.387 1.00 . A A . 21 VAL HA 1 1 2 1017 1 1 21 VAL HB H 5.691 3.777 1.248 1.00 . A A . 21 VAL HB 1 1 2 1018 1 1 21 VAL HG11 H 5.511 6.011 0.788 1.00 . A A . 21 VAL HG11 1 1 2 1019 1 1 21 VAL HG12 H 3.786 5.913 0.436 1.00 . A A . 21 VAL HG12 1 1 2 1020 1 1 21 VAL HG13 H 4.960 5.334 -0.746 1.00 . A A . 21 VAL HG13 1 1 2 1021 1 1 21 VAL HG21 H 4.006 4.927 2.759 1.00 . A A . 21 VAL HG21 1 1 2 1022 1 1 21 VAL HG22 H 3.989 3.164 2.756 1.00 . A A . 21 VAL HG22 1 1 2 1023 1 1 21 VAL HG23 H 2.762 4.059 1.860 1.00 . A A . 21 VAL HG23 1 1 2 1024 1 1 21 VAL N N 4.179 1.650 0.513 1.00 . A A . 21 VAL N 1 1 2 1025 1 1 21 VAL O O 4.760 3.609 -2.333 1.00 . A A . 21 VAL O 1 1 2 1026 1 1 22 ALA C C 6.545 1.550 -3.522 1.00 . A A . 22 ALA C 1 1 2 1027 1 1 22 ALA CA C 7.184 2.272 -2.338 1.00 . A A . 22 ALA CA 1 1 2 1028 1 1 22 ALA CB C 8.466 1.571 -1.912 1.00 . A A . 22 ALA CB 1 1 2 1029 1 1 22 ALA H H 6.461 1.870 -0.386 1.00 . A A . 22 ALA H 1 1 2 1030 1 1 22 ALA HA H 7.430 3.282 -2.632 1.00 . A A . 22 ALA HA 1 1 2 1031 1 1 22 ALA HB1 H 8.320 1.109 -0.947 1.00 . A A . 22 ALA HB1 1 1 2 1032 1 1 22 ALA HB2 H 9.266 2.293 -1.849 1.00 . A A . 22 ALA HB2 1 1 2 1033 1 1 22 ALA HB3 H 8.720 0.814 -2.639 1.00 . A A . 22 ALA HB3 1 1 2 1034 1 1 22 ALA N N 6.249 2.342 -1.222 1.00 . A A . 22 ALA N 1 1 2 1035 1 1 22 ALA O O 6.644 1.998 -4.668 1.00 . A A . 22 ALA O 1 1 2 1036 1 1 23 CYS C C 4.095 0.493 -4.907 1.00 . A A . 23 CYS C 1 1 2 1037 1 1 23 CYS CA C 5.190 -0.345 -4.251 1.00 . A A . 23 CYS CA 1 1 2 1038 1 1 23 CYS CB C 4.583 -1.609 -3.625 1.00 . A A . 23 CYS CB 1 1 2 1039 1 1 23 CYS H H 5.817 0.151 -2.291 1.00 . A A . 23 CYS H 1 1 2 1040 1 1 23 CYS HA H 5.916 -0.629 -4.998 1.00 . A A . 23 CYS HA 1 1 2 1041 1 1 23 CYS HB2 H 5.214 -1.935 -2.812 1.00 . A A . 23 CYS HB2 1 1 2 1042 1 1 23 CYS HB3 H 3.604 -1.369 -3.235 1.00 . A A . 23 CYS HB3 1 1 2 1043 1 1 23 CYS N N 5.870 0.441 -3.228 1.00 . A A . 23 CYS N 1 1 2 1044 1 1 23 CYS O O 3.941 0.502 -6.128 1.00 . A A . 23 CYS O 1 1 2 1045 1 1 23 CYS SG S 4.393 -3.017 -4.774 1.00 . A A . 23 CYS SG 1 1 2 1046 1 1 24 CYS C C 2.771 3.222 -5.366 1.00 . A A . 24 CYS C 1 1 2 1047 1 1 24 CYS CA C 2.259 2.047 -4.540 1.00 . A A . 24 CYS CA 1 1 2 1048 1 1 24 CYS CB C 1.464 2.547 -3.340 1.00 . A A . 24 CYS CB 1 1 2 1049 1 1 24 CYS H H 3.525 1.141 -3.110 1.00 . A A . 24 CYS H 1 1 2 1050 1 1 24 CYS HA H 1.611 1.444 -5.159 1.00 . A A . 24 CYS HA 1 1 2 1051 1 1 24 CYS HB2 H 2.120 3.094 -2.682 1.00 . A A . 24 CYS HB2 1 1 2 1052 1 1 24 CYS HB3 H 0.679 3.201 -3.674 1.00 . A A . 24 CYS HB3 1 1 2 1053 1 1 24 CYS N N 3.345 1.198 -4.078 1.00 . A A . 24 CYS N 1 1 2 1054 1 1 24 CYS O O 2.176 3.580 -6.379 1.00 . A A . 24 CYS O 1 1 2 1055 1 1 24 CYS SG S 0.703 1.204 -2.381 1.00 . A A . 24 CYS SG 1 1 2 1056 1 1 25 LYS C C 4.902 4.574 -7.033 1.00 . A A . 25 LYS C 1 1 2 1057 1 1 25 LYS CA C 4.448 4.961 -5.630 1.00 . A A . 25 LYS CA 1 1 2 1058 1 1 25 LYS CB C 5.602 5.560 -4.819 1.00 . A A . 25 LYS CB 1 1 2 1059 1 1 25 LYS CD C 3.858 6.651 -3.358 1.00 . A A . 25 LYS CD 1 1 2 1060 1 1 25 LYS CE C 3.378 7.952 -2.733 1.00 . A A . 25 LYS CE 1 1 2 1061 1 1 25 LYS CG C 5.208 6.814 -4.043 1.00 . A A . 25 LYS CG 1 1 2 1062 1 1 25 LYS H H 4.301 3.494 -4.107 1.00 . A A . 25 LYS H 1 1 2 1063 1 1 25 LYS HA H 3.672 5.706 -5.722 1.00 . A A . 25 LYS HA 1 1 2 1064 1 1 25 LYS HB2 H 5.955 4.821 -4.115 1.00 . A A . 25 LYS HB2 1 1 2 1065 1 1 25 LYS HB3 H 6.406 5.818 -5.493 1.00 . A A . 25 LYS HB3 1 1 2 1066 1 1 25 LYS HD2 H 3.132 6.329 -4.090 1.00 . A A . 25 LYS HD2 1 1 2 1067 1 1 25 LYS HD3 H 3.947 5.902 -2.585 1.00 . A A . 25 LYS HD3 1 1 2 1068 1 1 25 LYS HE2 H 3.671 8.771 -3.372 1.00 . A A . 25 LYS HE2 1 1 2 1069 1 1 25 LYS HE3 H 2.300 7.923 -2.662 1.00 . A A . 25 LYS HE3 1 1 2 1070 1 1 25 LYS HG2 H 5.959 7.010 -3.292 1.00 . A A . 25 LYS HG2 1 1 2 1071 1 1 25 LYS HG3 H 5.157 7.647 -4.729 1.00 . A A . 25 LYS HG3 1 1 2 1072 1 1 25 LYS HZ1 H 3.218 7.961 -0.647 1.00 . A A . 25 LYS HZ1 1 1 2 1073 1 1 25 LYS HZ2 H 4.240 9.163 -1.269 1.00 . A A . 25 LYS HZ2 1 1 2 1074 1 1 25 LYS HZ3 H 4.763 7.558 -1.222 1.00 . A A . 25 LYS HZ3 1 1 2 1075 1 1 25 LYS N N 3.870 3.822 -4.928 1.00 . A A . 25 LYS N 1 1 2 1076 1 1 25 LYS NZ N 3.945 8.175 -1.377 1.00 . A A . 25 LYS NZ 1 1 2 1077 1 1 25 LYS O O 4.598 5.274 -7.998 1.00 . A A . 25 LYS O 1 1 2 1078 1 1 26 LYS C C 4.860 2.587 -9.328 1.00 . A A . 26 LYS C 1 1 2 1079 1 1 26 LYS CA C 6.058 2.993 -8.466 1.00 . A A . 26 LYS CA 1 1 2 1080 1 1 26 LYS CB C 7.051 1.830 -8.344 1.00 . A A . 26 LYS CB 1 1 2 1081 1 1 26 LYS CD C 7.386 -0.599 -7.778 1.00 . A A . 26 LYS CD 1 1 2 1082 1 1 26 LYS CE C 6.804 -1.787 -7.035 1.00 . A A . 26 LYS CE 1 1 2 1083 1 1 26 LYS CG C 6.486 0.614 -7.638 1.00 . A A . 26 LYS CG 1 1 2 1084 1 1 26 LYS H H 5.806 2.915 -6.357 1.00 . A A . 26 LYS H 1 1 2 1085 1 1 26 LYS HA H 6.554 3.825 -8.945 1.00 . A A . 26 LYS HA 1 1 2 1086 1 1 26 LYS HB2 H 7.362 1.531 -9.334 1.00 . A A . 26 LYS HB2 1 1 2 1087 1 1 26 LYS HB3 H 7.916 2.169 -7.793 1.00 . A A . 26 LYS HB3 1 1 2 1088 1 1 26 LYS HD2 H 7.482 -0.849 -8.824 1.00 . A A . 26 LYS HD2 1 1 2 1089 1 1 26 LYS HD3 H 8.358 -0.367 -7.367 1.00 . A A . 26 LYS HD3 1 1 2 1090 1 1 26 LYS HE2 H 6.893 -1.609 -5.974 1.00 . A A . 26 LYS HE2 1 1 2 1091 1 1 26 LYS HE3 H 5.760 -1.879 -7.296 1.00 . A A . 26 LYS HE3 1 1 2 1092 1 1 26 LYS HG2 H 6.371 0.842 -6.589 1.00 . A A . 26 LYS HG2 1 1 2 1093 1 1 26 LYS HG3 H 5.519 0.384 -8.063 1.00 . A A . 26 LYS HG3 1 1 2 1094 1 1 26 LYS HZ1 H 8.031 -3.401 -6.545 1.00 . A A . 26 LYS HZ1 1 1 2 1095 1 1 26 LYS HZ2 H 8.156 -2.911 -8.160 1.00 . A A . 26 LYS HZ2 1 1 2 1096 1 1 26 LYS HZ3 H 6.797 -3.780 -7.642 1.00 . A A . 26 LYS HZ3 1 1 2 1097 1 1 26 LYS N N 5.604 3.451 -7.155 1.00 . A A . 26 LYS N 1 1 2 1098 1 1 26 LYS NZ N 7.499 -3.057 -7.369 1.00 . A A . 26 LYS NZ 1 1 2 1099 1 1 26 LYS O O 4.901 2.691 -10.553 1.00 . A A . 26 LYS O 1 1 2 1100 1 1 27 ALA C C 1.728 2.930 -9.784 1.00 . A A . 27 ALA C 1 1 2 1101 1 1 27 ALA CA C 2.574 1.721 -9.372 1.00 . A A . 27 ALA CA 1 1 2 1102 1 1 27 ALA CB C 1.761 0.771 -8.504 1.00 . A A . 27 ALA CB 1 1 2 1103 1 1 27 ALA H H 3.816 2.080 -7.694 1.00 . A A . 27 ALA H 1 1 2 1104 1 1 27 ALA HA H 2.871 1.187 -10.263 1.00 . A A . 27 ALA HA 1 1 2 1105 1 1 27 ALA HB1 H 0.787 1.198 -8.317 1.00 . A A . 27 ALA HB1 1 1 2 1106 1 1 27 ALA HB2 H 2.272 0.614 -7.566 1.00 . A A . 27 ALA HB2 1 1 2 1107 1 1 27 ALA HB3 H 1.648 -0.174 -9.015 1.00 . A A . 27 ALA HB3 1 1 2 1108 1 1 27 ALA N N 3.790 2.133 -8.674 1.00 . A A . 27 ALA N 1 1 2 1109 1 1 27 ALA O O 0.633 2.776 -10.326 1.00 . A A . 27 ALA O 1 1 2 1110 1 1 28 LYS C C 0.355 5.642 -9.023 1.00 . A A . 28 LYS C 1 1 2 1111 1 1 28 LYS CA C 1.603 5.388 -9.882 1.00 . A A . 28 LYS CA 1 1 2 1112 1 1 28 LYS CB C 1.259 5.409 -11.379 1.00 . A A . 28 LYS CB 1 1 2 1113 1 1 28 LYS CD C 0.820 6.752 -13.457 1.00 . A A . 28 LYS CD 1 1 2 1114 1 1 28 LYS CE C 2.028 6.166 -14.177 1.00 . A A . 28 LYS CE 1 1 2 1115 1 1 28 LYS CG C 1.035 6.801 -11.952 1.00 . A A . 28 LYS CG 1 1 2 1116 1 1 28 LYS H H 3.147 4.164 -9.110 1.00 . A A . 28 LYS H 1 1 2 1117 1 1 28 LYS HA H 2.311 6.180 -9.685 1.00 . A A . 28 LYS HA 1 1 2 1118 1 1 28 LYS HB2 H 2.068 4.949 -11.926 1.00 . A A . 28 LYS HB2 1 1 2 1119 1 1 28 LYS HB3 H 0.360 4.832 -11.535 1.00 . A A . 28 LYS HB3 1 1 2 1120 1 1 28 LYS HD2 H -0.043 6.139 -13.668 1.00 . A A . 28 LYS HD2 1 1 2 1121 1 1 28 LYS HD3 H 0.649 7.755 -13.819 1.00 . A A . 28 LYS HD3 1 1 2 1122 1 1 28 LYS HE2 H 2.874 6.818 -14.022 1.00 . A A . 28 LYS HE2 1 1 2 1123 1 1 28 LYS HE3 H 2.243 5.194 -13.759 1.00 . A A . 28 LYS HE3 1 1 2 1124 1 1 28 LYS HG2 H 0.162 7.235 -11.487 1.00 . A A . 28 LYS HG2 1 1 2 1125 1 1 28 LYS HG3 H 1.901 7.412 -11.739 1.00 . A A . 28 LYS HG3 1 1 2 1126 1 1 28 LYS HZ1 H 2.662 6.233 -16.166 1.00 . A A . 28 LYS HZ1 1 1 2 1127 1 1 28 LYS HZ2 H 1.045 6.680 -15.947 1.00 . A A . 28 LYS HZ2 1 1 2 1128 1 1 28 LYS HZ3 H 1.490 5.051 -15.859 1.00 . A A . 28 LYS HZ3 1 1 2 1129 1 1 28 LYS N N 2.262 4.127 -9.535 1.00 . A A . 28 LYS N 1 1 2 1130 1 1 28 LYS NZ N 1.789 6.023 -15.640 1.00 . A A . 28 LYS NZ 1 1 2 1131 1 1 28 LYS O O -0.660 6.166 -9.500 1.00 . A A . 28 LYS O 1 1 2 1132 1 1 29 PHE C C -0.271 6.688 -5.879 1.00 . A A . 29 PHE C 1 1 2 1133 1 1 29 PHE CA C -0.641 5.535 -6.805 1.00 . A A . 29 PHE CA 1 1 2 1134 1 1 29 PHE CB C -0.962 4.273 -5.994 1.00 . A A . 29 PHE CB 1 1 2 1135 1 1 29 PHE CD1 C -1.259 2.518 -7.771 1.00 . A A . 29 PHE CD1 1 1 2 1136 1 1 29 PHE CD2 C -3.134 3.073 -6.409 1.00 . A A . 29 PHE CD2 1 1 2 1137 1 1 29 PHE CE1 C -2.027 1.595 -8.455 1.00 . A A . 29 PHE CE1 1 1 2 1138 1 1 29 PHE CE2 C -3.906 2.152 -7.090 1.00 . A A . 29 PHE CE2 1 1 2 1139 1 1 29 PHE CG C -1.800 3.267 -6.740 1.00 . A A . 29 PHE CG 1 1 2 1140 1 1 29 PHE CZ C -3.352 1.411 -8.114 1.00 . A A . 29 PHE CZ 1 1 2 1141 1 1 29 PHE H H 1.292 4.921 -7.413 1.00 . A A . 29 PHE H 1 1 2 1142 1 1 29 PHE HA H -1.513 5.819 -7.377 1.00 . A A . 29 PHE HA 1 1 2 1143 1 1 29 PHE HB2 H -0.037 3.792 -5.721 1.00 . A A . 29 PHE HB2 1 1 2 1144 1 1 29 PHE HB3 H -1.492 4.549 -5.094 1.00 . A A . 29 PHE HB3 1 1 2 1145 1 1 29 PHE HD1 H -0.222 2.658 -8.039 1.00 . A A . 29 PHE HD1 1 1 2 1146 1 1 29 PHE HD2 H -3.573 3.652 -5.609 1.00 . A A . 29 PHE HD2 1 1 2 1147 1 1 29 PHE HE1 H -1.591 1.018 -9.257 1.00 . A A . 29 PHE HE1 1 1 2 1148 1 1 29 PHE HE2 H -4.943 2.010 -6.821 1.00 . A A . 29 PHE HE2 1 1 2 1149 1 1 29 PHE HZ H -3.953 0.690 -8.648 1.00 . A A . 29 PHE HZ 1 1 2 1150 1 1 29 PHE N N 0.450 5.307 -7.745 1.00 . A A . 29 PHE N 1 1 2 1151 1 1 29 PHE O O 0.908 6.897 -5.590 1.00 . A A . 29 PHE O 1 1 2 1152 1 1 30 SER C C -0.300 8.191 -3.306 1.00 . A A . 30 SER C 1 1 2 1153 1 1 30 SER CA C -1.064 8.591 -4.564 1.00 . A A . 30 SER CA 1 1 2 1154 1 1 30 SER CB C -2.411 9.207 -4.194 1.00 . A A . 30 SER CB 1 1 2 1155 1 1 30 SER H H -2.187 7.224 -5.719 1.00 . A A . 30 SER H 1 1 2 1156 1 1 30 SER HA H -0.482 9.318 -5.108 1.00 . A A . 30 SER HA 1 1 2 1157 1 1 30 SER HB2 H -2.857 8.640 -3.389 1.00 . A A . 30 SER HB2 1 1 2 1158 1 1 30 SER HB3 H -2.265 10.229 -3.879 1.00 . A A . 30 SER HB3 1 1 2 1159 1 1 30 SER HG H -3.287 10.063 -5.746 1.00 . A A . 30 SER HG 1 1 2 1160 1 1 30 SER N N -1.275 7.439 -5.439 1.00 . A A . 30 SER N 1 1 2 1161 1 1 30 SER O O 0.607 8.898 -2.870 1.00 . A A . 30 SER O 1 1 2 1162 1 1 30 SER OG O -3.288 9.189 -5.307 1.00 . A A . 30 SER OG 1 1 2 1163 1 1 31 ASP C C -0.535 5.111 -1.287 1.00 . A A . 31 ASP C 1 1 2 1164 1 1 31 ASP CA C -0.017 6.511 -1.554 1.00 . A A . 31 ASP CA 1 1 2 1165 1 1 31 ASP CB C -0.243 7.407 -0.333 1.00 . A A . 31 ASP CB 1 1 2 1166 1 1 31 ASP CG C 0.896 7.287 0.661 1.00 . A A . 31 ASP CG 1 1 2 1167 1 1 31 ASP H H -1.389 6.526 -3.161 1.00 . A A . 31 ASP H 1 1 2 1168 1 1 31 ASP HA H 1.042 6.443 -1.747 1.00 . A A . 31 ASP HA 1 1 2 1169 1 1 31 ASP HB2 H -0.315 8.436 -0.654 1.00 . A A . 31 ASP HB2 1 1 2 1170 1 1 31 ASP HB3 H -1.160 7.117 0.158 1.00 . A A . 31 ASP HB3 1 1 2 1171 1 1 31 ASP N N -0.665 7.043 -2.747 1.00 . A A . 31 ASP N 1 1 2 1172 1 1 31 ASP O O -1.479 4.659 -1.938 1.00 . A A . 31 ASP O 1 1 2 1173 1 1 31 ASP OD1 O 2.050 7.602 0.282 1.00 . A A . 31 ASP OD1 1 1 2 1174 1 1 31 ASP OD2 O 0.650 6.859 1.800 1.00 . A A . 31 ASP OD2 1 1 2 1175 1 1 32 GLY C C -0.265 2.770 1.433 1.00 . A A . 32 GLY C 1 1 2 1176 1 1 32 GLY CA C -0.317 3.071 -0.043 1.00 . A A . 32 GLY CA 1 1 2 1177 1 1 32 GLY H H 0.843 4.838 0.120 1.00 . A A . 32 GLY H 1 1 2 1178 1 1 32 GLY HA2 H -1.331 2.921 -0.391 1.00 . A A . 32 GLY HA2 1 1 2 1179 1 1 32 GLY HA3 H 0.333 2.383 -0.562 1.00 . A A . 32 GLY HA3 1 1 2 1180 1 1 32 GLY N N 0.089 4.425 -0.356 1.00 . A A . 32 GLY N 1 1 2 1181 1 1 32 GLY O O 0.507 3.369 2.176 1.00 . A A . 32 GLY O 1 1 2 1182 1 1 33 HIS C C -1.208 -0.058 3.391 1.00 . A A . 33 HIS C 1 1 2 1183 1 1 33 HIS CA C -1.156 1.451 3.252 1.00 . A A . 33 HIS CA 1 1 2 1184 1 1 33 HIS CB C -2.367 2.103 3.928 1.00 . A A . 33 HIS CB 1 1 2 1185 1 1 33 HIS CD2 C -4.358 2.272 2.257 1.00 . A A . 33 HIS CD2 1 1 2 1186 1 1 33 HIS CE1 C -5.552 0.601 3.016 1.00 . A A . 33 HIS CE1 1 1 2 1187 1 1 33 HIS CG C -3.690 1.740 3.312 1.00 . A A . 33 HIS CG 1 1 2 1188 1 1 33 HIS H H -1.685 1.391 1.206 1.00 . A A . 33 HIS H 1 1 2 1189 1 1 33 HIS HA H -0.251 1.806 3.736 1.00 . A A . 33 HIS HA 1 1 2 1190 1 1 33 HIS HB2 H -2.394 1.801 4.964 1.00 . A A . 33 HIS HB2 1 1 2 1191 1 1 33 HIS HB3 H -2.257 3.173 3.878 1.00 . A A . 33 HIS HB3 1 1 2 1192 1 1 33 HIS HD1 H -4.254 0.105 4.515 1.00 . A A . 33 HIS HD1 1 1 2 1193 1 1 33 HIS HD2 H -4.032 3.091 1.637 1.00 . A A . 33 HIS HD2 1 1 2 1194 1 1 33 HIS HE1 H -6.331 -0.138 3.123 1.00 . A A . 33 HIS HE1 1 1 2 1195 1 1 33 HIS N N -1.094 1.837 1.857 1.00 . A A . 33 HIS N 1 1 2 1196 1 1 33 HIS ND1 N -4.469 0.694 3.763 1.00 . A A . 33 HIS ND1 1 1 2 1197 1 1 33 HIS NE2 N -5.511 1.546 2.099 1.00 . A A . 33 HIS NE2 1 1 2 1198 1 1 33 HIS O O -2.024 -0.741 2.769 1.00 . A A . 33 HIS O 1 1 2 1199 1 1 34 CYS C C -1.432 -2.465 5.263 1.00 . A A . 34 CYS C 1 1 2 1200 1 1 34 CYS CA C -0.214 -1.980 4.482 1.00 . A A . 34 CYS CA 1 1 2 1201 1 1 34 CYS CB C 1.068 -2.222 5.271 1.00 . A A . 34 CYS CB 1 1 2 1202 1 1 34 CYS H H 0.289 0.057 4.671 1.00 . A A . 34 CYS H 1 1 2 1203 1 1 34 CYS HA H -0.161 -2.501 3.539 1.00 . A A . 34 CYS HA 1 1 2 1204 1 1 34 CYS HB2 H 1.905 -1.860 4.693 1.00 . A A . 34 CYS HB2 1 1 2 1205 1 1 34 CYS HB3 H 1.016 -1.666 6.196 1.00 . A A . 34 CYS HB3 1 1 2 1206 1 1 34 CYS N N -0.322 -0.558 4.217 1.00 . A A . 34 CYS N 1 1 2 1207 1 1 34 CYS O O -1.767 -1.902 6.307 1.00 . A A . 34 CYS O 1 1 2 1208 1 1 34 CYS SG S 1.410 -3.951 5.690 1.00 . A A . 34 CYS SG 1 1 2 1209 1 1 35 SER C C -2.892 -4.957 6.566 1.00 . A A . 35 SER C 1 1 2 1210 1 1 35 SER CA C -3.280 -4.029 5.418 1.00 . A A . 35 SER CA 1 1 2 1211 1 1 35 SER CB C -4.187 -4.761 4.424 1.00 . A A . 35 SER CB 1 1 2 1212 1 1 35 SER H H -1.793 -3.902 3.916 1.00 . A A . 35 SER H 1 1 2 1213 1 1 35 SER HA H -3.822 -3.189 5.824 1.00 . A A . 35 SER HA 1 1 2 1214 1 1 35 SER HB2 H -5.034 -5.173 4.952 1.00 . A A . 35 SER HB2 1 1 2 1215 1 1 35 SER HB3 H -4.536 -4.062 3.679 1.00 . A A . 35 SER HB3 1 1 2 1216 1 1 35 SER HG H -2.819 -5.444 3.198 1.00 . A A . 35 SER HG 1 1 2 1217 1 1 35 SER N N -2.099 -3.495 4.755 1.00 . A A . 35 SER N 1 1 2 1218 1 1 35 SER O O -1.850 -5.610 6.528 1.00 . A A . 35 SER O 1 1 2 1219 1 1 35 SER OG O -3.504 -5.815 3.774 1.00 . A A . 35 SER OG 1 1 2 1220 1 1 36 LYS C C -4.062 -7.243 8.537 1.00 . A A . 36 LYS C 1 1 2 1221 1 1 36 LYS CA C -3.498 -5.838 8.750 1.00 . A A . 36 LYS CA 1 1 2 1222 1 1 36 LYS CB C -4.144 -5.190 9.981 1.00 . A A . 36 LYS CB 1 1 2 1223 1 1 36 LYS CD C -4.883 -5.401 12.374 1.00 . A A . 36 LYS CD 1 1 2 1224 1 1 36 LYS CE C -4.953 -6.305 13.594 1.00 . A A . 36 LYS CE 1 1 2 1225 1 1 36 LYS CG C -4.169 -6.078 11.214 1.00 . A A . 36 LYS CG 1 1 2 1226 1 1 36 LYS H H -4.545 -4.452 7.552 1.00 . A A . 36 LYS H 1 1 2 1227 1 1 36 LYS HA H -2.431 -5.905 8.903 1.00 . A A . 36 LYS HA 1 1 2 1228 1 1 36 LYS HB2 H -3.597 -4.291 10.226 1.00 . A A . 36 LYS HB2 1 1 2 1229 1 1 36 LYS HB3 H -5.161 -4.923 9.737 1.00 . A A . 36 LYS HB3 1 1 2 1230 1 1 36 LYS HD2 H -4.348 -4.500 12.636 1.00 . A A . 36 LYS HD2 1 1 2 1231 1 1 36 LYS HD3 H -5.887 -5.148 12.066 1.00 . A A . 36 LYS HD3 1 1 2 1232 1 1 36 LYS HE2 H -5.468 -7.215 13.323 1.00 . A A . 36 LYS HE2 1 1 2 1233 1 1 36 LYS HE3 H -3.947 -6.541 13.909 1.00 . A A . 36 LYS HE3 1 1 2 1234 1 1 36 LYS HG2 H -4.688 -6.995 10.970 1.00 . A A . 36 LYS HG2 1 1 2 1235 1 1 36 LYS HG3 H -3.154 -6.303 11.506 1.00 . A A . 36 LYS HG3 1 1 2 1236 1 1 36 LYS HZ1 H -6.697 -5.846 14.650 1.00 . A A . 36 LYS HZ1 1 1 2 1237 1 1 36 LYS HZ2 H -5.522 -4.631 14.707 1.00 . A A . 36 LYS HZ2 1 1 2 1238 1 1 36 LYS HZ3 H -5.332 -6.034 15.632 1.00 . A A . 36 LYS HZ3 1 1 2 1239 1 1 36 LYS N N -3.737 -5.002 7.583 1.00 . A A . 36 LYS N 1 1 2 1240 1 1 36 LYS NZ N -5.677 -5.659 14.725 1.00 . A A . 36 LYS NZ 1 1 2 1241 1 1 36 LYS O O -3.589 -8.210 9.129 1.00 . A A . 36 LYS O 1 1 2 1242 1 1 37 ILE C C -4.833 -9.605 6.716 1.00 . A A . 37 ILE C 1 1 2 1243 1 1 37 ILE CA C -5.754 -8.604 7.429 1.00 . A A . 37 ILE CA 1 1 2 1244 1 1 37 ILE CB C -7.025 -8.385 6.580 1.00 . A A . 37 ILE CB 1 1 2 1245 1 1 37 ILE CD1 C -9.155 -6.987 6.417 1.00 . A A . 37 ILE CD1 1 1 2 1246 1 1 37 ILE CG1 C -7.928 -7.333 7.235 1.00 . A A . 37 ILE CG1 1 1 2 1247 1 1 37 ILE CG2 C -7.782 -9.696 6.398 1.00 . A A . 37 ILE CG2 1 1 2 1248 1 1 37 ILE H H -5.431 -6.521 7.284 1.00 . A A . 37 ILE H 1 1 2 1249 1 1 37 ILE HA H -6.056 -9.029 8.375 1.00 . A A . 37 ILE HA 1 1 2 1250 1 1 37 ILE HB H -6.721 -8.032 5.609 1.00 . A A . 37 ILE HB 1 1 2 1251 1 1 37 ILE HD11 H -8.896 -6.247 5.673 1.00 . A A . 37 ILE HD11 1 1 2 1252 1 1 37 ILE HD12 H -9.921 -6.590 7.067 1.00 . A A . 37 ILE HD12 1 1 2 1253 1 1 37 ILE HD13 H -9.524 -7.876 5.926 1.00 . A A . 37 ILE HD13 1 1 2 1254 1 1 37 ILE HG12 H -8.263 -7.702 8.192 1.00 . A A . 37 ILE HG12 1 1 2 1255 1 1 37 ILE HG13 H -7.361 -6.425 7.383 1.00 . A A . 37 ILE HG13 1 1 2 1256 1 1 37 ILE HG21 H -7.256 -10.490 6.907 1.00 . A A . 37 ILE HG21 1 1 2 1257 1 1 37 ILE HG22 H -7.852 -9.928 5.345 1.00 . A A . 37 ILE HG22 1 1 2 1258 1 1 37 ILE HG23 H -8.775 -9.599 6.811 1.00 . A A . 37 ILE HG23 1 1 2 1259 1 1 37 ILE N N -5.092 -7.334 7.707 1.00 . A A . 37 ILE N 1 1 2 1260 1 1 37 ILE O O -4.261 -10.492 7.348 1.00 . A A . 37 ILE O 1 1 2 1261 1 1 38 LEU C C -2.471 -9.895 4.423 1.00 . A A . 38 LEU C 1 1 2 1262 1 1 38 LEU CA C -3.895 -10.408 4.617 1.00 . A A . 38 LEU CA 1 1 2 1263 1 1 38 LEU CB C -4.543 -10.659 3.257 1.00 . A A . 38 LEU CB 1 1 2 1264 1 1 38 LEU CD1 C -4.120 -13.131 3.301 1.00 . A A . 38 LEU CD1 1 1 2 1265 1 1 38 LEU CD2 C -4.646 -11.997 1.138 1.00 . A A . 38 LEU CD2 1 1 2 1266 1 1 38 LEU CG C -3.971 -11.850 2.492 1.00 . A A . 38 LEU CG 1 1 2 1267 1 1 38 LEU H H -5.209 -8.773 4.936 1.00 . A A . 38 LEU H 1 1 2 1268 1 1 38 LEU HA H -3.853 -11.341 5.157 1.00 . A A . 38 LEU HA 1 1 2 1269 1 1 38 LEU HB2 H -5.598 -10.816 3.405 1.00 . A A . 38 LEU HB2 1 1 2 1270 1 1 38 LEU HB3 H -4.410 -9.776 2.651 1.00 . A A . 38 LEU HB3 1 1 2 1271 1 1 38 LEU HD11 H -5.017 -13.648 2.995 1.00 . A A . 38 LEU HD11 1 1 2 1272 1 1 38 LEU HD12 H -4.185 -12.888 4.352 1.00 . A A . 38 LEU HD12 1 1 2 1273 1 1 38 LEU HD13 H -3.263 -13.766 3.131 1.00 . A A . 38 LEU HD13 1 1 2 1274 1 1 38 LEU HD21 H -4.521 -13.009 0.781 1.00 . A A . 38 LEU HD21 1 1 2 1275 1 1 38 LEU HD22 H -4.197 -11.310 0.436 1.00 . A A . 38 LEU HD22 1 1 2 1276 1 1 38 LEU HD23 H -5.699 -11.777 1.234 1.00 . A A . 38 LEU HD23 1 1 2 1277 1 1 38 LEU HG H -2.917 -11.677 2.330 1.00 . A A . 38 LEU HG 1 1 2 1278 1 1 38 LEU N N -4.715 -9.481 5.397 1.00 . A A . 38 LEU N 1 1 2 1279 1 1 38 LEU O O -1.665 -10.518 3.735 1.00 . A A . 38 LEU O 1 1 2 1280 1 1 39 ARG C C -0.524 -7.739 3.498 1.00 . A A . 39 ARG C 1 1 2 1281 1 1 39 ARG CA C -0.854 -8.134 4.935 1.00 . A A . 39 ARG CA 1 1 2 1282 1 1 39 ARG CB C 0.244 -9.057 5.481 1.00 . A A . 39 ARG CB 1 1 2 1283 1 1 39 ARG CD C -0.798 -9.796 7.664 1.00 . A A . 39 ARG CD 1 1 2 1284 1 1 39 ARG CG C 0.363 -9.071 6.998 1.00 . A A . 39 ARG CG 1 1 2 1285 1 1 39 ARG CZ C -1.415 -10.620 9.915 1.00 . A A . 39 ARG CZ 1 1 2 1286 1 1 39 ARG H H -2.869 -8.317 5.552 1.00 . A A . 39 ARG H 1 1 2 1287 1 1 39 ARG HA H -0.879 -7.236 5.536 1.00 . A A . 39 ARG HA 1 1 2 1288 1 1 39 ARG HB2 H 0.042 -10.065 5.153 1.00 . A A . 39 ARG HB2 1 1 2 1289 1 1 39 ARG HB3 H 1.194 -8.742 5.072 1.00 . A A . 39 ARG HB3 1 1 2 1290 1 1 39 ARG HD2 H -1.697 -9.214 7.525 1.00 . A A . 39 ARG HD2 1 1 2 1291 1 1 39 ARG HD3 H -0.919 -10.762 7.196 1.00 . A A . 39 ARG HD3 1 1 2 1292 1 1 39 ARG HE H 0.266 -9.628 9.465 1.00 . A A . 39 ARG HE 1 1 2 1293 1 1 39 ARG HG2 H 1.283 -9.567 7.268 1.00 . A A . 39 ARG HG2 1 1 2 1294 1 1 39 ARG HG3 H 0.389 -8.050 7.351 1.00 . A A . 39 ARG HG3 1 1 2 1295 1 1 39 ARG HH11 H -2.826 -10.955 8.491 1.00 . A A . 39 ARG HH11 1 1 2 1296 1 1 39 ARG HH12 H -3.205 -11.560 10.070 1.00 . A A . 39 ARG HH12 1 1 2 1297 1 1 39 ARG HH21 H -0.236 -10.417 11.552 1.00 . A A . 39 ARG HH21 1 1 2 1298 1 1 39 ARG HH22 H -1.729 -11.251 11.816 1.00 . A A . 39 ARG HH22 1 1 2 1299 1 1 39 ARG N N -2.177 -8.757 5.029 1.00 . A A . 39 ARG N 1 1 2 1300 1 1 39 ARG NE N -0.571 -9.985 9.098 1.00 . A A . 39 ARG NE 1 1 2 1301 1 1 39 ARG NH1 N -2.574 -11.084 9.458 1.00 . A A . 39 ARG NH1 1 1 2 1302 1 1 39 ARG NH2 N -1.102 -10.775 11.198 1.00 . A A . 39 ARG NH2 1 1 2 1303 1 1 39 ARG O O 0.642 -7.684 3.106 1.00 . A A . 39 ARG O 1 1 2 1304 1 1 40 ARG C C -1.167 -5.519 1.280 1.00 . A A . 40 ARG C 1 1 2 1305 1 1 40 ARG CA C -1.352 -7.028 1.341 1.00 . A A . 40 ARG CA 1 1 2 1306 1 1 40 ARG CB C -2.520 -7.450 0.450 1.00 . A A . 40 ARG CB 1 1 2 1307 1 1 40 ARG CD C -3.569 -9.327 -0.851 1.00 . A A . 40 ARG CD 1 1 2 1308 1 1 40 ARG CG C -2.684 -8.955 0.331 1.00 . A A . 40 ARG CG 1 1 2 1309 1 1 40 ARG CZ C -5.823 -8.820 -1.732 1.00 . A A . 40 ARG CZ 1 1 2 1310 1 1 40 ARG H H -2.462 -7.488 3.085 1.00 . A A . 40 ARG H 1 1 2 1311 1 1 40 ARG HA H -0.448 -7.501 0.983 1.00 . A A . 40 ARG HA 1 1 2 1312 1 1 40 ARG HB2 H -3.433 -7.042 0.857 1.00 . A A . 40 ARG HB2 1 1 2 1313 1 1 40 ARG HB3 H -2.367 -7.047 -0.540 1.00 . A A . 40 ARG HB3 1 1 2 1314 1 1 40 ARG HD2 H -3.058 -9.058 -1.763 1.00 . A A . 40 ARG HD2 1 1 2 1315 1 1 40 ARG HD3 H -3.734 -10.395 -0.836 1.00 . A A . 40 ARG HD3 1 1 2 1316 1 1 40 ARG HE H -5.019 -8.007 -0.088 1.00 . A A . 40 ARG HE 1 1 2 1317 1 1 40 ARG HG2 H -1.711 -9.404 0.196 1.00 . A A . 40 ARG HG2 1 1 2 1318 1 1 40 ARG HG3 H -3.133 -9.331 1.239 1.00 . A A . 40 ARG HG3 1 1 2 1319 1 1 40 ARG HH11 H -4.808 -10.232 -2.774 1.00 . A A . 40 ARG HH11 1 1 2 1320 1 1 40 ARG HH12 H -6.368 -9.827 -3.407 1.00 . A A . 40 ARG HH12 1 1 2 1321 1 1 40 ARG HH21 H -7.082 -7.444 -0.930 1.00 . A A . 40 ARG HH21 1 1 2 1322 1 1 40 ARG HH22 H -7.664 -8.237 -2.355 1.00 . A A . 40 ARG HH22 1 1 2 1323 1 1 40 ARG N N -1.552 -7.443 2.718 1.00 . A A . 40 ARG N 1 1 2 1324 1 1 40 ARG NE N -4.866 -8.646 -0.817 1.00 . A A . 40 ARG NE 1 1 2 1325 1 1 40 ARG NH1 N -5.654 -9.699 -2.716 1.00 . A A . 40 ARG NH1 1 1 2 1326 1 1 40 ARG NH2 N -6.948 -8.115 -1.665 1.00 . A A . 40 ARG NH2 1 1 2 1327 1 1 40 ARG O O -1.679 -4.787 2.132 1.00 . A A . 40 ARG O 1 1 2 1328 1 1 41 CYS C C -1.357 -2.970 -0.580 1.00 . A A . 41 CYS C 1 1 2 1329 1 1 41 CYS CA C -0.186 -3.640 0.124 1.00 . A A . 41 CYS CA 1 1 2 1330 1 1 41 CYS CB C 1.090 -3.422 -0.680 1.00 . A A . 41 CYS CB 1 1 2 1331 1 1 41 CYS H H -0.048 -5.688 -0.356 1.00 . A A . 41 CYS H 1 1 2 1332 1 1 41 CYS HA H -0.068 -3.205 1.104 1.00 . A A . 41 CYS HA 1 1 2 1333 1 1 41 CYS HB2 H 1.930 -3.810 -0.123 1.00 . A A . 41 CYS HB2 1 1 2 1334 1 1 41 CYS HB3 H 1.012 -3.948 -1.620 1.00 . A A . 41 CYS HB3 1 1 2 1335 1 1 41 CYS N N -0.434 -5.059 0.288 1.00 . A A . 41 CYS N 1 1 2 1336 1 1 41 CYS O O -1.480 -3.055 -1.798 1.00 . A A . 41 CYS O 1 1 2 1337 1 1 41 CYS SG S 1.428 -1.678 -1.047 1.00 . A A . 41 CYS SG 1 1 2 1338 1 1 42 LEU C C -2.966 -0.224 -0.856 1.00 . A A . 42 LEU C 1 1 2 1339 1 1 42 LEU CA C -3.359 -1.620 -0.399 1.00 . A A . 42 LEU CA 1 1 2 1340 1 1 42 LEU CB C -4.507 -1.525 0.614 1.00 . A A . 42 LEU CB 1 1 2 1341 1 1 42 LEU CD1 C -4.616 -4.000 1.081 1.00 . A A . 42 LEU CD1 1 1 2 1342 1 1 42 LEU CD2 C -6.497 -2.528 1.769 1.00 . A A . 42 LEU CD2 1 1 2 1343 1 1 42 LEU CG C -5.415 -2.759 0.727 1.00 . A A . 42 LEU CG 1 1 2 1344 1 1 42 LEU H H -2.065 -2.259 1.153 1.00 . A A . 42 LEU H 1 1 2 1345 1 1 42 LEU HA H -3.682 -2.192 -1.259 1.00 . A A . 42 LEU HA 1 1 2 1346 1 1 42 LEU HB2 H -4.075 -1.339 1.588 1.00 . A A . 42 LEU HB2 1 1 2 1347 1 1 42 LEU HB3 H -5.123 -0.671 0.349 1.00 . A A . 42 LEU HB3 1 1 2 1348 1 1 42 LEU HD11 H -4.871 -4.799 0.400 1.00 . A A . 42 LEU HD11 1 1 2 1349 1 1 42 LEU HD12 H -4.847 -4.301 2.092 1.00 . A A . 42 LEU HD12 1 1 2 1350 1 1 42 LEU HD13 H -3.560 -3.785 1.002 1.00 . A A . 42 LEU HD13 1 1 2 1351 1 1 42 LEU HD21 H -7.054 -3.442 1.918 1.00 . A A . 42 LEU HD21 1 1 2 1352 1 1 42 LEU HD22 H -7.165 -1.751 1.428 1.00 . A A . 42 LEU HD22 1 1 2 1353 1 1 42 LEU HD23 H -6.041 -2.228 2.701 1.00 . A A . 42 LEU HD23 1 1 2 1354 1 1 42 LEU HG H -5.897 -2.932 -0.223 1.00 . A A . 42 LEU HG 1 1 2 1355 1 1 42 LEU N N -2.212 -2.302 0.181 1.00 . A A . 42 LEU N 1 1 2 1356 1 1 42 LEU O O -2.659 0.640 -0.034 1.00 . A A . 42 LEU O 1 1 2 1357 1 1 43 CYS C C -3.883 2.100 -2.992 1.00 . A A . 43 CYS C 1 1 2 1358 1 1 43 CYS CA C -2.634 1.284 -2.716 1.00 . A A . 43 CYS CA 1 1 2 1359 1 1 43 CYS CB C -1.827 1.106 -4.000 1.00 . A A . 43 CYS CB 1 1 2 1360 1 1 43 CYS H H -3.247 -0.731 -2.767 1.00 . A A . 43 CYS H 1 1 2 1361 1 1 43 CYS HA H -2.030 1.806 -1.989 1.00 . A A . 43 CYS HA 1 1 2 1362 1 1 43 CYS HB2 H -2.435 0.607 -4.737 1.00 . A A . 43 CYS HB2 1 1 2 1363 1 1 43 CYS HB3 H -1.547 2.079 -4.374 1.00 . A A . 43 CYS HB3 1 1 2 1364 1 1 43 CYS N N -2.986 -0.007 -2.158 1.00 . A A . 43 CYS N 1 1 2 1365 1 1 43 CYS O O -4.903 1.563 -3.426 1.00 . A A . 43 CYS O 1 1 2 1366 1 1 43 CYS SG S -0.304 0.139 -3.780 1.00 . A A . 43 CYS SG 1 1 2 1367 1 1 44 THR C C -4.489 5.443 -3.854 1.00 . A A . 44 THR C 1 1 2 1368 1 1 44 THR CA C -4.914 4.288 -2.961 1.00 . A A . 44 THR CA 1 1 2 1369 1 1 44 THR CB C -5.471 4.832 -1.632 1.00 . A A . 44 THR CB 1 1 2 1370 1 1 44 THR CG2 C -6.455 3.852 -1.008 1.00 . A A . 44 THR CG2 1 1 2 1371 1 1 44 THR H H -2.954 3.759 -2.391 1.00 . A A . 44 THR H 1 1 2 1372 1 1 44 THR HA H -5.697 3.732 -3.457 1.00 . A A . 44 THR HA 1 1 2 1373 1 1 44 THR HB H -5.989 5.760 -1.833 1.00 . A A . 44 THR HB 1 1 2 1374 1 1 44 THR HG1 H -3.641 5.445 -1.194 1.00 . A A . 44 THR HG1 1 1 2 1375 1 1 44 THR HG21 H -5.934 3.218 -0.306 1.00 . A A . 44 THR HG21 1 1 2 1376 1 1 44 THR HG22 H -6.898 3.244 -1.783 1.00 . A A . 44 THR HG22 1 1 2 1377 1 1 44 THR HG23 H -7.230 4.400 -0.492 1.00 . A A . 44 THR HG23 1 1 2 1378 1 1 44 THR N N -3.800 3.391 -2.738 1.00 . A A . 44 THR N 1 1 2 1379 1 1 44 THR O O -3.386 5.974 -3.710 1.00 . A A . 44 THR O 1 1 2 1380 1 1 44 THR OG1 O -4.395 5.084 -0.715 1.00 . A A . 44 THR OG1 1 1 2 1381 1 1 45 LYS C C -6.330 7.622 -6.107 1.00 . A A . 45 LYS C 1 1 2 1382 1 1 45 LYS CA C -5.055 6.917 -5.685 1.00 . A A . 45 LYS CA 1 1 2 1383 1 1 45 LYS CB C -4.296 6.428 -6.925 1.00 . A A . 45 LYS CB 1 1 2 1384 1 1 45 LYS CD C -4.396 5.289 -9.175 1.00 . A A . 45 LYS CD 1 1 2 1385 1 1 45 LYS CE C -4.277 6.523 -10.067 1.00 . A A . 45 LYS CE 1 1 2 1386 1 1 45 LYS CG C -5.133 5.584 -7.873 1.00 . A A . 45 LYS CG 1 1 2 1387 1 1 45 LYS H H -6.219 5.362 -4.846 1.00 . A A . 45 LYS H 1 1 2 1388 1 1 45 LYS HA H -4.434 7.624 -5.155 1.00 . A A . 45 LYS HA 1 1 2 1389 1 1 45 LYS HB2 H -3.933 7.287 -7.470 1.00 . A A . 45 LYS HB2 1 1 2 1390 1 1 45 LYS HB3 H -3.451 5.837 -6.605 1.00 . A A . 45 LYS HB3 1 1 2 1391 1 1 45 LYS HD2 H -3.405 4.934 -8.939 1.00 . A A . 45 LYS HD2 1 1 2 1392 1 1 45 LYS HD3 H -4.933 4.520 -9.713 1.00 . A A . 45 LYS HD3 1 1 2 1393 1 1 45 LYS HE2 H -4.083 6.200 -11.078 1.00 . A A . 45 LYS HE2 1 1 2 1394 1 1 45 LYS HE3 H -5.215 7.058 -10.039 1.00 . A A . 45 LYS HE3 1 1 2 1395 1 1 45 LYS HG2 H -5.371 4.649 -7.389 1.00 . A A . 45 LYS HG2 1 1 2 1396 1 1 45 LYS HG3 H -6.047 6.115 -8.099 1.00 . A A . 45 LYS HG3 1 1 2 1397 1 1 45 LYS HZ1 H -2.422 6.914 -9.171 1.00 . A A . 45 LYS HZ1 1 1 2 1398 1 1 45 LYS HZ2 H -3.555 8.169 -8.980 1.00 . A A . 45 LYS HZ2 1 1 2 1399 1 1 45 LYS HZ3 H -2.791 7.933 -10.468 1.00 . A A . 45 LYS HZ3 1 1 2 1400 1 1 45 LYS N N -5.354 5.825 -4.775 1.00 . A A . 45 LYS N 1 1 2 1401 1 1 45 LYS NZ N -3.184 7.445 -9.642 1.00 . A A . 45 LYS NZ 1 1 2 1402 1 1 45 LYS O O -7.434 7.128 -5.875 1.00 . A A . 45 LYS O 1 1 2 1403 1 1 46 GLU C C -7.830 9.005 -8.498 1.00 . A A . 46 GLU C 1 1 2 1404 1 1 46 GLU CA C -7.269 9.572 -7.196 1.00 . A A . 46 GLU CA 1 1 2 1405 1 1 46 GLU CB C -6.829 11.034 -7.392 1.00 . A A . 46 GLU CB 1 1 2 1406 1 1 46 GLU CD C -4.376 10.643 -7.943 1.00 . A A . 46 GLU CD 1 1 2 1407 1 1 46 GLU CG C -5.699 11.227 -8.404 1.00 . A A . 46 GLU CG 1 1 2 1408 1 1 46 GLU H H -5.243 9.096 -6.874 1.00 . A A . 46 GLU H 1 1 2 1409 1 1 46 GLU HA H -8.043 9.538 -6.443 1.00 . A A . 46 GLU HA 1 1 2 1410 1 1 46 GLU HB2 H -7.680 11.609 -7.727 1.00 . A A . 46 GLU HB2 1 1 2 1411 1 1 46 GLU HB3 H -6.498 11.423 -6.440 1.00 . A A . 46 GLU HB3 1 1 2 1412 1 1 46 GLU HG2 H -5.979 10.746 -9.328 1.00 . A A . 46 GLU HG2 1 1 2 1413 1 1 46 GLU HG3 H -5.568 12.285 -8.577 1.00 . A A . 46 GLU HG3 1 1 2 1414 1 1 46 GLU N N -6.158 8.770 -6.725 1.00 . A A . 46 GLU N 1 1 2 1415 1 1 46 GLU O O -7.085 8.505 -9.347 1.00 . A A . 46 GLU O 1 1 2 1416 1 1 46 GLU OE1 O -3.809 11.149 -6.957 1.00 . A A . 46 GLU OE1 1 1 2 1417 1 1 46 GLU OE2 O -3.922 9.645 -8.544 1.00 . A A . 46 GLU OE2 1 1 2 1418 1 1 47 CYS C C -11.201 9.233 -9.909 1.00 . A A . 47 CYS C 1 1 2 1419 1 1 47 CYS CA C -9.828 8.584 -9.819 1.00 . A A . 47 CYS CA 1 1 2 1420 1 1 47 CYS CB C -9.952 7.057 -9.774 1.00 . A A . 47 CYS CB 1 1 2 1421 1 1 47 CYS H H -9.678 9.482 -7.919 1.00 . A A . 47 CYS H 1 1 2 1422 1 1 47 CYS HA H -9.247 8.868 -10.683 1.00 . A A . 47 CYS HA 1 1 2 1423 1 1 47 CYS HB2 H -10.531 6.726 -10.623 1.00 . A A . 47 CYS HB2 1 1 2 1424 1 1 47 CYS HB3 H -8.964 6.623 -9.829 1.00 . A A . 47 CYS HB3 1 1 2 1425 1 1 47 CYS N N -9.142 9.080 -8.638 1.00 . A A . 47 CYS N 1 1 2 1426 1 1 47 CYS O O -12.029 8.789 -10.721 1.00 . A A . 47 CYS O 1 1 2 1427 1 1 47 CYS OXT O -11.441 10.194 -9.140 1.00 . A A . 47 CYS OXT 1 1 2 1428 1 1 47 CYS SG S -10.758 6.410 -8.272 1.00 . A A . 47 CYS SG 1 1 3 1429 1 1 1 ALA C C -7.708 9.932 -9.683 1.00 . A A . 1 ALA C 1 1 3 1430 1 1 1 ALA CA C -8.202 10.700 -10.901 1.00 . A A . 1 ALA CA 1 1 3 1431 1 1 1 ALA CB C -9.273 9.907 -11.638 1.00 . A A . 1 ALA CB 1 1 3 1432 1 1 1 ALA H1 H -6.276 11.433 -11.279 1.00 . A A . 1 ALA H1 1 1 3 1433 1 1 1 ALA H2 H -7.367 11.662 -12.552 1.00 . A A . 1 ALA H2 1 1 3 1434 1 1 1 ALA H3 H -6.728 10.122 -12.264 1.00 . A A . 1 ALA H3 1 1 3 1435 1 1 1 ALA HA H -8.639 11.630 -10.571 1.00 . A A . 1 ALA HA 1 1 3 1436 1 1 1 ALA HB1 H -10.087 10.564 -11.907 1.00 . A A . 1 ALA HB1 1 1 3 1437 1 1 1 ALA HB2 H -9.642 9.119 -10.998 1.00 . A A . 1 ALA HB2 1 1 3 1438 1 1 1 ALA HB3 H -8.848 9.474 -12.532 1.00 . A A . 1 ALA HB3 1 1 3 1439 1 1 1 ALA N N -7.071 11.003 -11.812 1.00 . A A . 1 ALA N 1 1 3 1440 1 1 1 ALA O O -6.529 9.958 -9.377 1.00 . A A . 1 ALA O 1 1 3 1441 1 1 2 THR C C -7.782 7.073 -8.225 1.00 . A A . 2 THR C 1 1 3 1442 1 1 2 THR CA C -8.208 8.479 -7.817 1.00 . A A . 2 THR CA 1 1 3 1443 1 1 2 THR CB C -9.362 8.395 -6.802 1.00 . A A . 2 THR CB 1 1 3 1444 1 1 2 THR CG2 C -8.862 7.898 -5.451 1.00 . A A . 2 THR CG2 1 1 3 1445 1 1 2 THR H H -9.537 9.245 -9.274 1.00 . A A . 2 THR H 1 1 3 1446 1 1 2 THR HA H -7.373 8.981 -7.351 1.00 . A A . 2 THR HA 1 1 3 1447 1 1 2 THR HB H -10.103 7.703 -7.175 1.00 . A A . 2 THR HB 1 1 3 1448 1 1 2 THR HG1 H -9.641 10.094 -5.835 1.00 . A A . 2 THR HG1 1 1 3 1449 1 1 2 THR HG21 H -7.925 7.377 -5.582 1.00 . A A . 2 THR HG21 1 1 3 1450 1 1 2 THR HG22 H -9.591 7.227 -5.022 1.00 . A A . 2 THR HG22 1 1 3 1451 1 1 2 THR HG23 H -8.715 8.740 -4.790 1.00 . A A . 2 THR HG23 1 1 3 1452 1 1 2 THR N N -8.601 9.243 -8.992 1.00 . A A . 2 THR N 1 1 3 1453 1 1 2 THR O O -8.545 6.348 -8.862 1.00 . A A . 2 THR O 1 1 3 1454 1 1 2 THR OG1 O -9.961 9.689 -6.646 1.00 . A A . 2 THR OG1 1 1 3 1455 1 1 3 CYS C C -5.454 4.667 -7.028 1.00 . A A . 3 CYS C 1 1 3 1456 1 1 3 CYS CA C -6.035 5.393 -8.239 1.00 . A A . 3 CYS CA 1 1 3 1457 1 1 3 CYS CB C -4.971 5.548 -9.329 1.00 . A A . 3 CYS CB 1 1 3 1458 1 1 3 CYS H H -5.982 7.329 -7.387 1.00 . A A . 3 CYS H 1 1 3 1459 1 1 3 CYS HA H -6.853 4.809 -8.632 1.00 . A A . 3 CYS HA 1 1 3 1460 1 1 3 CYS HB2 H -4.157 6.149 -8.949 1.00 . A A . 3 CYS HB2 1 1 3 1461 1 1 3 CYS HB3 H -4.598 4.573 -9.603 1.00 . A A . 3 CYS HB3 1 1 3 1462 1 1 3 CYS N N -6.557 6.701 -7.879 1.00 . A A . 3 CYS N 1 1 3 1463 1 1 3 CYS O O -4.721 5.252 -6.228 1.00 . A A . 3 CYS O 1 1 3 1464 1 1 3 CYS SG S -5.589 6.355 -10.839 1.00 . A A . 3 CYS SG 1 1 3 1465 1 1 4 LYS C C -4.940 1.173 -6.321 1.00 . A A . 4 LYS C 1 1 3 1466 1 1 4 LYS CA C -5.304 2.554 -5.812 1.00 . A A . 4 LYS CA 1 1 3 1467 1 1 4 LYS CB C -6.364 2.399 -4.721 1.00 . A A . 4 LYS CB 1 1 3 1468 1 1 4 LYS CD C -6.984 0.726 -2.933 1.00 . A A . 4 LYS CD 1 1 3 1469 1 1 4 LYS CE C -7.442 -0.386 -3.876 1.00 . A A . 4 LYS CE 1 1 3 1470 1 1 4 LYS CG C -5.876 1.571 -3.539 1.00 . A A . 4 LYS CG 1 1 3 1471 1 1 4 LYS H H -6.367 2.980 -7.587 1.00 . A A . 4 LYS H 1 1 3 1472 1 1 4 LYS HA H -4.419 3.013 -5.387 1.00 . A A . 4 LYS HA 1 1 3 1473 1 1 4 LYS HB2 H -6.644 3.379 -4.361 1.00 . A A . 4 LYS HB2 1 1 3 1474 1 1 4 LYS HB3 H -7.233 1.915 -5.141 1.00 . A A . 4 LYS HB3 1 1 3 1475 1 1 4 LYS HD2 H -6.615 0.280 -2.020 1.00 . A A . 4 LYS HD2 1 1 3 1476 1 1 4 LYS HD3 H -7.824 1.365 -2.707 1.00 . A A . 4 LYS HD3 1 1 3 1477 1 1 4 LYS HE2 H -8.261 -0.915 -3.414 1.00 . A A . 4 LYS HE2 1 1 3 1478 1 1 4 LYS HE3 H -7.782 0.064 -4.798 1.00 . A A . 4 LYS HE3 1 1 3 1479 1 1 4 LYS HG2 H -5.087 0.916 -3.877 1.00 . A A . 4 LYS HG2 1 1 3 1480 1 1 4 LYS HG3 H -5.490 2.239 -2.782 1.00 . A A . 4 LYS HG3 1 1 3 1481 1 1 4 LYS HZ1 H -5.430 -0.887 -4.174 1.00 . A A . 4 LYS HZ1 1 1 3 1482 1 1 4 LYS HZ2 H -6.499 -1.780 -5.124 1.00 . A A . 4 LYS HZ2 1 1 3 1483 1 1 4 LYS HZ3 H -6.339 -2.134 -3.476 1.00 . A A . 4 LYS HZ3 1 1 3 1484 1 1 4 LYS N N -5.784 3.385 -6.908 1.00 . A A . 4 LYS N 1 1 3 1485 1 1 4 LYS NZ N -6.353 -1.359 -4.185 1.00 . A A . 4 LYS NZ 1 1 3 1486 1 1 4 LYS O O -5.664 0.586 -7.122 1.00 . A A . 4 LYS O 1 1 3 1487 1 1 5 ALA C C -2.353 -1.116 -5.162 1.00 . A A . 5 ALA C 1 1 3 1488 1 1 5 ALA CA C -3.359 -0.658 -6.192 1.00 . A A . 5 ALA CA 1 1 3 1489 1 1 5 ALA CB C -2.733 -0.644 -7.580 1.00 . A A . 5 ALA CB 1 1 3 1490 1 1 5 ALA H H -3.318 1.184 -5.168 1.00 . A A . 5 ALA H 1 1 3 1491 1 1 5 ALA HA H -4.201 -1.337 -6.198 1.00 . A A . 5 ALA HA 1 1 3 1492 1 1 5 ALA HB1 H -1.904 -1.336 -7.609 1.00 . A A . 5 ALA HB1 1 1 3 1493 1 1 5 ALA HB2 H -2.379 0.352 -7.805 1.00 . A A . 5 ALA HB2 1 1 3 1494 1 1 5 ALA HB3 H -3.471 -0.936 -8.312 1.00 . A A . 5 ALA HB3 1 1 3 1495 1 1 5 ALA N N -3.835 0.659 -5.826 1.00 . A A . 5 ALA N 1 1 3 1496 1 1 5 ALA O O -1.461 -0.355 -4.790 1.00 . A A . 5 ALA O 1 1 3 1497 1 1 6 GLU C C -0.222 -2.981 -4.314 1.00 . A A . 6 GLU C 1 1 3 1498 1 1 6 GLU CA C -1.602 -2.876 -3.700 1.00 . A A . 6 GLU CA 1 1 3 1499 1 1 6 GLU CB C -2.076 -4.245 -3.177 1.00 . A A . 6 GLU CB 1 1 3 1500 1 1 6 GLU CD C -4.616 -3.807 -3.298 1.00 . A A . 6 GLU CD 1 1 3 1501 1 1 6 GLU CG C -3.419 -4.212 -2.439 1.00 . A A . 6 GLU CG 1 1 3 1502 1 1 6 GLU H H -3.246 -2.900 -5.015 1.00 . A A . 6 GLU H 1 1 3 1503 1 1 6 GLU HA H -1.562 -2.177 -2.877 1.00 . A A . 6 GLU HA 1 1 3 1504 1 1 6 GLU HB2 H -2.151 -4.933 -3.999 1.00 . A A . 6 GLU HB2 1 1 3 1505 1 1 6 GLU HB3 H -1.332 -4.618 -2.488 1.00 . A A . 6 GLU HB3 1 1 3 1506 1 1 6 GLU HG2 H -3.612 -5.196 -2.041 1.00 . A A . 6 GLU HG2 1 1 3 1507 1 1 6 GLU HG3 H -3.337 -3.512 -1.619 1.00 . A A . 6 GLU HG3 1 1 3 1508 1 1 6 GLU N N -2.503 -2.338 -4.690 1.00 . A A . 6 GLU N 1 1 3 1509 1 1 6 GLU O O -0.089 -3.347 -5.483 1.00 . A A . 6 GLU O 1 1 3 1510 1 1 6 GLU OE1 O -4.532 -3.868 -4.540 1.00 . A A . 6 GLU OE1 1 1 3 1511 1 1 6 GLU OE2 O -5.654 -3.415 -2.724 1.00 . A A . 6 GLU OE2 1 1 3 1512 1 1 7 CYS C C 2.479 -3.968 -4.687 1.00 . A A . 7 CYS C 1 1 3 1513 1 1 7 CYS CA C 2.165 -2.636 -4.009 1.00 . A A . 7 CYS CA 1 1 3 1514 1 1 7 CYS CB C 3.131 -2.387 -2.845 1.00 . A A . 7 CYS CB 1 1 3 1515 1 1 7 CYS H H 0.585 -2.305 -2.627 1.00 . A A . 7 CYS H 1 1 3 1516 1 1 7 CYS HA H 2.277 -1.843 -4.733 1.00 . A A . 7 CYS HA 1 1 3 1517 1 1 7 CYS HB2 H 2.807 -1.514 -2.298 1.00 . A A . 7 CYS HB2 1 1 3 1518 1 1 7 CYS HB3 H 3.116 -3.243 -2.186 1.00 . A A . 7 CYS HB3 1 1 3 1519 1 1 7 CYS N N 0.784 -2.618 -3.537 1.00 . A A . 7 CYS N 1 1 3 1520 1 1 7 CYS O O 2.325 -5.029 -4.085 1.00 . A A . 7 CYS O 1 1 3 1521 1 1 7 CYS SG S 4.864 -2.108 -3.352 1.00 . A A . 7 CYS SG 1 1 3 1522 1 1 8 PRO C C 4.230 -6.017 -6.065 1.00 . A A . 8 PRO C 1 1 3 1523 1 1 8 PRO CA C 3.216 -5.118 -6.759 1.00 . A A . 8 PRO CA 1 1 3 1524 1 1 8 PRO CB C 3.800 -4.556 -8.065 1.00 . A A . 8 PRO CB 1 1 3 1525 1 1 8 PRO CD C 3.075 -2.693 -6.754 1.00 . A A . 8 PRO CD 1 1 3 1526 1 1 8 PRO CG C 4.066 -3.111 -7.799 1.00 . A A . 8 PRO CG 1 1 3 1527 1 1 8 PRO HA H 2.326 -5.689 -6.977 1.00 . A A . 8 PRO HA 1 1 3 1528 1 1 8 PRO HB2 H 4.710 -5.085 -8.309 1.00 . A A . 8 PRO HB2 1 1 3 1529 1 1 8 PRO HB3 H 3.083 -4.683 -8.863 1.00 . A A . 8 PRO HB3 1 1 3 1530 1 1 8 PRO HD2 H 3.477 -1.896 -6.146 1.00 . A A . 8 PRO HD2 1 1 3 1531 1 1 8 PRO HD3 H 2.144 -2.392 -7.211 1.00 . A A . 8 PRO HD3 1 1 3 1532 1 1 8 PRO HG2 H 5.074 -2.985 -7.431 1.00 . A A . 8 PRO HG2 1 1 3 1533 1 1 8 PRO HG3 H 3.922 -2.538 -8.703 1.00 . A A . 8 PRO HG3 1 1 3 1534 1 1 8 PRO N N 2.900 -3.920 -5.967 1.00 . A A . 8 PRO N 1 1 3 1535 1 1 8 PRO O O 4.159 -7.240 -6.151 1.00 . A A . 8 PRO O 1 1 3 1536 1 1 9 THR C C 5.781 -6.236 -3.159 1.00 . A A . 9 THR C 1 1 3 1537 1 1 9 THR CA C 6.173 -6.121 -4.627 1.00 . A A . 9 THR CA 1 1 3 1538 1 1 9 THR CB C 7.541 -5.434 -4.769 1.00 . A A . 9 THR CB 1 1 3 1539 1 1 9 THR CG2 C 8.314 -6.009 -5.946 1.00 . A A . 9 THR CG2 1 1 3 1540 1 1 9 THR H H 5.143 -4.421 -5.315 1.00 . A A . 9 THR H 1 1 3 1541 1 1 9 THR HA H 6.244 -7.114 -5.049 1.00 . A A . 9 THR HA 1 1 3 1542 1 1 9 THR HB H 8.111 -5.605 -3.867 1.00 . A A . 9 THR HB 1 1 3 1543 1 1 9 THR HG1 H 7.081 -3.860 -5.868 1.00 . A A . 9 THR HG1 1 1 3 1544 1 1 9 THR HG21 H 8.500 -7.059 -5.776 1.00 . A A . 9 THR HG21 1 1 3 1545 1 1 9 THR HG22 H 9.255 -5.489 -6.048 1.00 . A A . 9 THR HG22 1 1 3 1546 1 1 9 THR HG23 H 7.736 -5.887 -6.850 1.00 . A A . 9 THR HG23 1 1 3 1547 1 1 9 THR N N 5.157 -5.397 -5.361 1.00 . A A . 9 THR N 1 1 3 1548 1 1 9 THR O O 6.584 -5.970 -2.263 1.00 . A A . 9 THR O 1 1 3 1549 1 1 9 THR OG1 O 7.359 -4.020 -4.959 1.00 . A A . 9 THR OG1 1 1 3 1550 1 1 10 TRP C C 2.813 -7.735 -1.605 1.00 . A A . 10 TRP C 1 1 3 1551 1 1 10 TRP CA C 3.998 -6.776 -1.589 1.00 . A A . 10 TRP CA 1 1 3 1552 1 1 10 TRP CB C 3.548 -5.419 -1.038 1.00 . A A . 10 TRP CB 1 1 3 1553 1 1 10 TRP CD1 C 2.118 -6.009 1.007 1.00 . A A . 10 TRP CD1 1 1 3 1554 1 1 10 TRP CD2 C 3.979 -4.857 1.479 1.00 . A A . 10 TRP CD2 1 1 3 1555 1 1 10 TRP CE2 C 3.299 -5.117 2.684 1.00 . A A . 10 TRP CE2 1 1 3 1556 1 1 10 TRP CE3 C 5.178 -4.143 1.521 1.00 . A A . 10 TRP CE3 1 1 3 1557 1 1 10 TRP CG C 3.216 -5.445 0.422 1.00 . A A . 10 TRP CG 1 1 3 1558 1 1 10 TRP CH2 C 4.958 -3.983 3.925 1.00 . A A . 10 TRP CH2 1 1 3 1559 1 1 10 TRP CZ2 C 3.785 -4.681 3.918 1.00 . A A . 10 TRP CZ2 1 1 3 1560 1 1 10 TRP CZ3 C 5.654 -3.712 2.742 1.00 . A A . 10 TRP CZ3 1 1 3 1561 1 1 10 TRP H H 3.944 -6.813 -3.696 1.00 . A A . 10 TRP H 1 1 3 1562 1 1 10 TRP HA H 4.775 -7.179 -0.958 1.00 . A A . 10 TRP HA 1 1 3 1563 1 1 10 TRP HB2 H 4.339 -4.699 -1.186 1.00 . A A . 10 TRP HB2 1 1 3 1564 1 1 10 TRP HB3 H 2.669 -5.095 -1.575 1.00 . A A . 10 TRP HB3 1 1 3 1565 1 1 10 TRP HD1 H 1.340 -6.534 0.462 1.00 . A A . 10 TRP HD1 1 1 3 1566 1 1 10 TRP HE1 H 1.497 -6.153 3.015 1.00 . A A . 10 TRP HE1 1 1 3 1567 1 1 10 TRP HE3 H 5.729 -3.923 0.618 1.00 . A A . 10 TRP HE3 1 1 3 1568 1 1 10 TRP HH2 H 5.369 -3.625 4.858 1.00 . A A . 10 TRP HH2 1 1 3 1569 1 1 10 TRP HZ2 H 3.265 -4.878 4.845 1.00 . A A . 10 TRP HZ2 1 1 3 1570 1 1 10 TRP HZ3 H 6.576 -3.154 2.792 1.00 . A A . 10 TRP HZ3 1 1 3 1571 1 1 10 TRP N N 4.532 -6.625 -2.931 1.00 . A A . 10 TRP N 1 1 3 1572 1 1 10 TRP NE1 N 2.166 -5.826 2.370 1.00 . A A . 10 TRP NE1 1 1 3 1573 1 1 10 TRP O O 1.917 -7.622 -2.441 1.00 . A A . 10 TRP O 1 1 3 1574 1 1 11 ASP C C 1.519 -10.067 0.869 1.00 . A A . 11 ASP C 1 1 3 1575 1 1 11 ASP CA C 1.749 -9.661 -0.579 1.00 . A A . 11 ASP CA 1 1 3 1576 1 1 11 ASP CB C 2.091 -10.905 -1.410 1.00 . A A . 11 ASP CB 1 1 3 1577 1 1 11 ASP CG C 3.404 -11.554 -0.994 1.00 . A A . 11 ASP CG 1 1 3 1578 1 1 11 ASP H H 3.561 -8.713 -0.046 1.00 . A A . 11 ASP H 1 1 3 1579 1 1 11 ASP HA H 0.846 -9.215 -0.967 1.00 . A A . 11 ASP HA 1 1 3 1580 1 1 11 ASP HB2 H 1.302 -11.633 -1.295 1.00 . A A . 11 ASP HB2 1 1 3 1581 1 1 11 ASP HB3 H 2.164 -10.624 -2.451 1.00 . A A . 11 ASP HB3 1 1 3 1582 1 1 11 ASP N N 2.816 -8.674 -0.678 1.00 . A A . 11 ASP N 1 1 3 1583 1 1 11 ASP O O 0.465 -10.606 1.214 1.00 . A A . 11 ASP O 1 1 3 1584 1 1 11 ASP OD1 O 3.518 -11.991 0.174 1.00 . A A . 11 ASP OD1 1 1 3 1585 1 1 11 ASP OD2 O 4.323 -11.616 -1.832 1.00 . A A . 11 ASP OD2 1 1 3 1586 1 1 12 SER C C 1.653 -9.235 3.937 1.00 . A A . 12 SER C 1 1 3 1587 1 1 12 SER CA C 2.486 -10.203 3.095 1.00 . A A . 12 SER CA 1 1 3 1588 1 1 12 SER CB C 3.914 -10.280 3.627 1.00 . A A . 12 SER CB 1 1 3 1589 1 1 12 SER H H 3.337 -9.426 1.337 1.00 . A A . 12 SER H 1 1 3 1590 1 1 12 SER HA H 2.042 -11.184 3.162 1.00 . A A . 12 SER HA 1 1 3 1591 1 1 12 SER HB2 H 4.339 -9.288 3.657 1.00 . A A . 12 SER HB2 1 1 3 1592 1 1 12 SER HB3 H 3.904 -10.699 4.622 1.00 . A A . 12 SER HB3 1 1 3 1593 1 1 12 SER HG H 4.200 -11.405 2.028 1.00 . A A . 12 SER HG 1 1 3 1594 1 1 12 SER N N 2.526 -9.835 1.692 1.00 . A A . 12 SER N 1 1 3 1595 1 1 12 SER O O 1.094 -8.256 3.432 1.00 . A A . 12 SER O 1 1 3 1596 1 1 12 SER OG O 4.719 -11.099 2.793 1.00 . A A . 12 SER OG 1 1 3 1597 1 1 13 VAL C C 1.614 -7.480 6.583 1.00 . A A . 13 VAL C 1 1 3 1598 1 1 13 VAL CA C 0.830 -8.726 6.177 1.00 . A A . 13 VAL CA 1 1 3 1599 1 1 13 VAL CB C 0.486 -9.555 7.438 1.00 . A A . 13 VAL CB 1 1 3 1600 1 1 13 VAL CG1 C -0.270 -8.722 8.462 1.00 . A A . 13 VAL CG1 1 1 3 1601 1 1 13 VAL CG2 C -0.315 -10.791 7.060 1.00 . A A . 13 VAL CG2 1 1 3 1602 1 1 13 VAL H H 2.050 -10.326 5.555 1.00 . A A . 13 VAL H 1 1 3 1603 1 1 13 VAL HA H -0.094 -8.425 5.706 1.00 . A A . 13 VAL HA 1 1 3 1604 1 1 13 VAL HB H 1.412 -9.881 7.890 1.00 . A A . 13 VAL HB 1 1 3 1605 1 1 13 VAL HG11 H -0.228 -7.680 8.181 1.00 . A A . 13 VAL HG11 1 1 3 1606 1 1 13 VAL HG12 H 0.181 -8.851 9.435 1.00 . A A . 13 VAL HG12 1 1 3 1607 1 1 13 VAL HG13 H -1.300 -9.044 8.498 1.00 . A A . 13 VAL HG13 1 1 3 1608 1 1 13 VAL HG21 H 0.349 -11.638 6.973 1.00 . A A . 13 VAL HG21 1 1 3 1609 1 1 13 VAL HG22 H -0.811 -10.624 6.116 1.00 . A A . 13 VAL HG22 1 1 3 1610 1 1 13 VAL HG23 H -1.053 -10.990 7.824 1.00 . A A . 13 VAL HG23 1 1 3 1611 1 1 13 VAL N N 1.581 -9.532 5.228 1.00 . A A . 13 VAL N 1 1 3 1612 1 1 13 VAL O O 2.797 -7.558 6.915 1.00 . A A . 13 VAL O 1 1 3 1613 1 1 14 CYS C C 1.912 -5.033 8.389 1.00 . A A . 14 CYS C 1 1 3 1614 1 1 14 CYS CA C 1.547 -5.063 6.911 1.00 . A A . 14 CYS CA 1 1 3 1615 1 1 14 CYS CB C 0.575 -3.921 6.620 1.00 . A A . 14 CYS CB 1 1 3 1616 1 1 14 CYS H H 0.003 -6.351 6.269 1.00 . A A . 14 CYS H 1 1 3 1617 1 1 14 CYS HA H 2.440 -4.930 6.320 1.00 . A A . 14 CYS HA 1 1 3 1618 1 1 14 CYS HB2 H -0.325 -4.331 6.187 1.00 . A A . 14 CYS HB2 1 1 3 1619 1 1 14 CYS HB3 H 0.326 -3.430 7.549 1.00 . A A . 14 CYS HB3 1 1 3 1620 1 1 14 CYS N N 0.942 -6.338 6.548 1.00 . A A . 14 CYS N 1 1 3 1621 1 1 14 CYS O O 1.097 -5.376 9.247 1.00 . A A . 14 CYS O 1 1 3 1622 1 1 14 CYS SG S 1.202 -2.652 5.475 1.00 . A A . 14 CYS SG 1 1 3 1623 1 1 15 ILE C C 3.477 -3.071 10.541 1.00 . A A . 15 ILE C 1 1 3 1624 1 1 15 ILE CA C 3.607 -4.512 10.050 1.00 . A A . 15 ILE CA 1 1 3 1625 1 1 15 ILE CB C 5.079 -4.971 10.163 1.00 . A A . 15 ILE CB 1 1 3 1626 1 1 15 ILE CD1 C 6.684 -6.847 9.511 1.00 . A A . 15 ILE CD1 1 1 3 1627 1 1 15 ILE CG1 C 5.249 -6.362 9.541 1.00 . A A . 15 ILE CG1 1 1 3 1628 1 1 15 ILE CG2 C 5.531 -4.981 11.619 1.00 . A A . 15 ILE CG2 1 1 3 1629 1 1 15 ILE H H 3.726 -4.341 7.948 1.00 . A A . 15 ILE H 1 1 3 1630 1 1 15 ILE HA H 2.994 -5.154 10.666 1.00 . A A . 15 ILE HA 1 1 3 1631 1 1 15 ILE HB H 5.696 -4.267 9.625 1.00 . A A . 15 ILE HB 1 1 3 1632 1 1 15 ILE HD11 H 6.707 -7.881 9.201 1.00 . A A . 15 ILE HD11 1 1 3 1633 1 1 15 ILE HD12 H 7.116 -6.755 10.496 1.00 . A A . 15 ILE HD12 1 1 3 1634 1 1 15 ILE HD13 H 7.251 -6.249 8.812 1.00 . A A . 15 ILE HD13 1 1 3 1635 1 1 15 ILE HG12 H 4.672 -7.075 10.111 1.00 . A A . 15 ILE HG12 1 1 3 1636 1 1 15 ILE HG13 H 4.884 -6.341 8.525 1.00 . A A . 15 ILE HG13 1 1 3 1637 1 1 15 ILE HG21 H 4.849 -4.388 12.211 1.00 . A A . 15 ILE HG21 1 1 3 1638 1 1 15 ILE HG22 H 6.525 -4.566 11.690 1.00 . A A . 15 ILE HG22 1 1 3 1639 1 1 15 ILE HG23 H 5.538 -5.997 11.986 1.00 . A A . 15 ILE HG23 1 1 3 1640 1 1 15 ILE N N 3.131 -4.606 8.677 1.00 . A A . 15 ILE N 1 1 3 1641 1 1 15 ILE O O 3.321 -2.809 11.733 1.00 . A A . 15 ILE O 1 1 3 1642 1 1 16 ASN C C 3.218 0.048 8.599 1.00 . A A . 16 ASN C 1 1 3 1643 1 1 16 ASN CA C 3.432 -0.719 9.899 1.00 . A A . 16 ASN CA 1 1 3 1644 1 1 16 ASN CB C 4.698 -0.238 10.627 1.00 . A A . 16 ASN CB 1 1 3 1645 1 1 16 ASN CG C 4.563 1.158 11.207 1.00 . A A . 16 ASN CG 1 1 3 1646 1 1 16 ASN H H 3.658 -2.414 8.666 1.00 . A A . 16 ASN H 1 1 3 1647 1 1 16 ASN HA H 2.574 -0.576 10.539 1.00 . A A . 16 ASN HA 1 1 3 1648 1 1 16 ASN HB2 H 4.918 -0.919 11.435 1.00 . A A . 16 ASN HB2 1 1 3 1649 1 1 16 ASN HB3 H 5.524 -0.239 9.931 1.00 . A A . 16 ASN HB3 1 1 3 1650 1 1 16 ASN HD21 H 3.927 0.396 12.929 1.00 . A A . 16 ASN HD21 1 1 3 1651 1 1 16 ASN HD22 H 4.013 2.122 12.856 1.00 . A A . 16 ASN HD22 1 1 3 1652 1 1 16 ASN N N 3.540 -2.139 9.598 1.00 . A A . 16 ASN N 1 1 3 1653 1 1 16 ASN ND2 N 4.130 1.236 12.456 1.00 . A A . 16 ASN ND2 1 1 3 1654 1 1 16 ASN O O 3.475 -0.488 7.521 1.00 . A A . 16 ASN O 1 1 3 1655 1 1 16 ASN OD1 O 4.841 2.158 10.540 1.00 . A A . 16 ASN OD1 1 1 3 1656 1 1 17 LYS C C 3.754 2.394 6.737 1.00 . A A . 17 LYS C 1 1 3 1657 1 1 17 LYS CA C 2.466 2.087 7.503 1.00 . A A . 17 LYS CA 1 1 3 1658 1 1 17 LYS CB C 1.762 3.396 7.878 1.00 . A A . 17 LYS CB 1 1 3 1659 1 1 17 LYS CD C 0.585 5.478 7.073 1.00 . A A . 17 LYS CD 1 1 3 1660 1 1 17 LYS CE C -0.204 6.112 5.933 1.00 . A A . 17 LYS CE 1 1 3 1661 1 1 17 LYS CG C 1.157 4.124 6.682 1.00 . A A . 17 LYS CG 1 1 3 1662 1 1 17 LYS H H 2.522 1.647 9.575 1.00 . A A . 17 LYS H 1 1 3 1663 1 1 17 LYS HA H 1.814 1.516 6.860 1.00 . A A . 17 LYS HA 1 1 3 1664 1 1 17 LYS HB2 H 0.969 3.178 8.578 1.00 . A A . 17 LYS HB2 1 1 3 1665 1 1 17 LYS HB3 H 2.476 4.055 8.349 1.00 . A A . 17 LYS HB3 1 1 3 1666 1 1 17 LYS HD2 H -0.071 5.348 7.921 1.00 . A A . 17 LYS HD2 1 1 3 1667 1 1 17 LYS HD3 H 1.398 6.135 7.345 1.00 . A A . 17 LYS HD3 1 1 3 1668 1 1 17 LYS HE2 H -1.046 5.477 5.700 1.00 . A A . 17 LYS HE2 1 1 3 1669 1 1 17 LYS HE3 H -0.564 7.078 6.257 1.00 . A A . 17 LYS HE3 1 1 3 1670 1 1 17 LYS HG2 H 1.926 4.272 5.938 1.00 . A A . 17 LYS HG2 1 1 3 1671 1 1 17 LYS HG3 H 0.367 3.515 6.266 1.00 . A A . 17 LYS HG3 1 1 3 1672 1 1 17 LYS HZ1 H 1.541 6.698 4.937 1.00 . A A . 17 LYS HZ1 1 1 3 1673 1 1 17 LYS HZ2 H 0.130 6.932 4.031 1.00 . A A . 17 LYS HZ2 1 1 3 1674 1 1 17 LYS HZ3 H 0.762 5.373 4.230 1.00 . A A . 17 LYS HZ3 1 1 3 1675 1 1 17 LYS N N 2.728 1.279 8.691 1.00 . A A . 17 LYS N 1 1 3 1676 1 1 17 LYS NZ N 0.616 6.290 4.704 1.00 . A A . 17 LYS NZ 1 1 3 1677 1 1 17 LYS O O 3.747 2.422 5.509 1.00 . A A . 17 LYS O 1 1 3 1678 1 1 18 LYS C C 6.525 1.924 5.756 1.00 . A A . 18 LYS C 1 1 3 1679 1 1 18 LYS CA C 6.143 2.947 6.839 1.00 . A A . 18 LYS CA 1 1 3 1680 1 1 18 LYS CB C 7.253 3.072 7.890 1.00 . A A . 18 LYS CB 1 1 3 1681 1 1 18 LYS CD C 8.282 4.437 9.740 1.00 . A A . 18 LYS CD 1 1 3 1682 1 1 18 LYS CE C 8.331 3.316 10.766 1.00 . A A . 18 LYS CE 1 1 3 1683 1 1 18 LYS CG C 7.099 4.286 8.794 1.00 . A A . 18 LYS CG 1 1 3 1684 1 1 18 LYS H H 4.788 2.596 8.442 1.00 . A A . 18 LYS H 1 1 3 1685 1 1 18 LYS HA H 6.027 3.907 6.356 1.00 . A A . 18 LYS HA 1 1 3 1686 1 1 18 LYS HB2 H 7.249 2.187 8.508 1.00 . A A . 18 LYS HB2 1 1 3 1687 1 1 18 LYS HB3 H 8.205 3.144 7.385 1.00 . A A . 18 LYS HB3 1 1 3 1688 1 1 18 LYS HD2 H 9.194 4.422 9.164 1.00 . A A . 18 LYS HD2 1 1 3 1689 1 1 18 LYS HD3 H 8.197 5.382 10.257 1.00 . A A . 18 LYS HD3 1 1 3 1690 1 1 18 LYS HE2 H 8.345 2.369 10.247 1.00 . A A . 18 LYS HE2 1 1 3 1691 1 1 18 LYS HE3 H 9.234 3.419 11.350 1.00 . A A . 18 LYS HE3 1 1 3 1692 1 1 18 LYS HG2 H 7.028 5.172 8.181 1.00 . A A . 18 LYS HG2 1 1 3 1693 1 1 18 LYS HG3 H 6.196 4.176 9.376 1.00 . A A . 18 LYS HG3 1 1 3 1694 1 1 18 LYS HZ1 H 6.309 2.986 11.189 1.00 . A A . 18 LYS HZ1 1 1 3 1695 1 1 18 LYS HZ2 H 6.972 4.323 11.991 1.00 . A A . 18 LYS HZ2 1 1 3 1696 1 1 18 LYS HZ3 H 7.338 2.757 12.516 1.00 . A A . 18 LYS HZ3 1 1 3 1697 1 1 18 LYS N N 4.851 2.630 7.466 1.00 . A A . 18 LYS N 1 1 3 1698 1 1 18 LYS NZ N 7.156 3.348 11.680 1.00 . A A . 18 LYS NZ 1 1 3 1699 1 1 18 LYS O O 6.730 2.313 4.607 1.00 . A A . 18 LYS O 1 1 3 1700 1 1 19 PRO C C 6.116 -0.310 3.829 1.00 . A A . 19 PRO C 1 1 3 1701 1 1 19 PRO CA C 6.955 -0.432 5.099 1.00 . A A . 19 PRO CA 1 1 3 1702 1 1 19 PRO CB C 6.593 -1.724 5.834 1.00 . A A . 19 PRO CB 1 1 3 1703 1 1 19 PRO CD C 6.407 0.024 7.427 1.00 . A A . 19 PRO CD 1 1 3 1704 1 1 19 PRO CG C 6.840 -1.406 7.261 1.00 . A A . 19 PRO CG 1 1 3 1705 1 1 19 PRO HA H 8.006 -0.430 4.849 1.00 . A A . 19 PRO HA 1 1 3 1706 1 1 19 PRO HB2 H 5.553 -1.959 5.657 1.00 . A A . 19 PRO HB2 1 1 3 1707 1 1 19 PRO HB3 H 7.213 -2.538 5.491 1.00 . A A . 19 PRO HB3 1 1 3 1708 1 1 19 PRO HD2 H 5.366 0.073 7.709 1.00 . A A . 19 PRO HD2 1 1 3 1709 1 1 19 PRO HD3 H 7.022 0.521 8.164 1.00 . A A . 19 PRO HD3 1 1 3 1710 1 1 19 PRO HG2 H 6.250 -2.055 7.892 1.00 . A A . 19 PRO HG2 1 1 3 1711 1 1 19 PRO HG3 H 7.890 -1.510 7.487 1.00 . A A . 19 PRO HG3 1 1 3 1712 1 1 19 PRO N N 6.618 0.609 6.086 1.00 . A A . 19 PRO N 1 1 3 1713 1 1 19 PRO O O 6.628 -0.415 2.710 1.00 . A A . 19 PRO O 1 1 3 1714 1 1 20 CYS C C 4.230 1.301 2.083 1.00 . A A . 20 CYS C 1 1 3 1715 1 1 20 CYS CA C 3.892 0.067 2.917 1.00 . A A . 20 CYS CA 1 1 3 1716 1 1 20 CYS CB C 2.459 0.165 3.447 1.00 . A A . 20 CYS CB 1 1 3 1717 1 1 20 CYS H H 4.488 0.001 4.940 1.00 . A A . 20 CYS H 1 1 3 1718 1 1 20 CYS HA H 3.978 -0.811 2.294 1.00 . A A . 20 CYS HA 1 1 3 1719 1 1 20 CYS HB2 H 2.242 -0.712 4.038 1.00 . A A . 20 CYS HB2 1 1 3 1720 1 1 20 CYS HB3 H 2.373 1.043 4.071 1.00 . A A . 20 CYS HB3 1 1 3 1721 1 1 20 CYS N N 4.823 -0.079 4.023 1.00 . A A . 20 CYS N 1 1 3 1722 1 1 20 CYS O O 4.365 1.216 0.862 1.00 . A A . 20 CYS O 1 1 3 1723 1 1 20 CYS SG S 1.192 0.281 2.147 1.00 . A A . 20 CYS SG 1 1 3 1724 1 1 21 VAL C C 5.994 3.526 1.251 1.00 . A A . 21 VAL C 1 1 3 1725 1 1 21 VAL CA C 4.721 3.688 2.071 1.00 . A A . 21 VAL CA 1 1 3 1726 1 1 21 VAL CB C 4.899 4.858 3.065 1.00 . A A . 21 VAL CB 1 1 3 1727 1 1 21 VAL CG1 C 5.261 6.144 2.335 1.00 . A A . 21 VAL CG1 1 1 3 1728 1 1 21 VAL CG2 C 3.639 5.056 3.890 1.00 . A A . 21 VAL CG2 1 1 3 1729 1 1 21 VAL H H 4.282 2.443 3.728 1.00 . A A . 21 VAL H 1 1 3 1730 1 1 21 VAL HA H 3.906 3.931 1.398 1.00 . A A . 21 VAL HA 1 1 3 1731 1 1 21 VAL HB H 5.708 4.612 3.737 1.00 . A A . 21 VAL HB 1 1 3 1732 1 1 21 VAL HG11 H 4.368 6.586 1.920 1.00 . A A . 21 VAL HG11 1 1 3 1733 1 1 21 VAL HG12 H 5.956 5.922 1.539 1.00 . A A . 21 VAL HG12 1 1 3 1734 1 1 21 VAL HG13 H 5.717 6.836 3.028 1.00 . A A . 21 VAL HG13 1 1 3 1735 1 1 21 VAL HG21 H 3.898 5.493 4.843 1.00 . A A . 21 VAL HG21 1 1 3 1736 1 1 21 VAL HG22 H 3.161 4.101 4.051 1.00 . A A . 21 VAL HG22 1 1 3 1737 1 1 21 VAL HG23 H 2.964 5.714 3.364 1.00 . A A . 21 VAL HG23 1 1 3 1738 1 1 21 VAL N N 4.387 2.442 2.751 1.00 . A A . 21 VAL N 1 1 3 1739 1 1 21 VAL O O 6.042 3.942 0.100 1.00 . A A . 21 VAL O 1 1 3 1740 1 1 22 ALA C C 8.045 1.848 -0.116 1.00 . A A . 22 ALA C 1 1 3 1741 1 1 22 ALA CA C 8.275 2.670 1.150 1.00 . A A . 22 ALA CA 1 1 3 1742 1 1 22 ALA CB C 9.262 1.968 2.071 1.00 . A A . 22 ALA CB 1 1 3 1743 1 1 22 ALA H H 6.899 2.577 2.765 1.00 . A A . 22 ALA H 1 1 3 1744 1 1 22 ALA HA H 8.688 3.630 0.876 1.00 . A A . 22 ALA HA 1 1 3 1745 1 1 22 ALA HB1 H 10.268 2.270 1.818 1.00 . A A . 22 ALA HB1 1 1 3 1746 1 1 22 ALA HB2 H 9.166 0.899 1.954 1.00 . A A . 22 ALA HB2 1 1 3 1747 1 1 22 ALA HB3 H 9.053 2.239 3.096 1.00 . A A . 22 ALA HB3 1 1 3 1748 1 1 22 ALA N N 7.009 2.901 1.841 1.00 . A A . 22 ALA N 1 1 3 1749 1 1 22 ALA O O 8.578 2.162 -1.191 1.00 . A A . 22 ALA O 1 1 3 1750 1 1 23 CYS C C 6.219 0.786 -2.194 1.00 . A A . 23 CYS C 1 1 3 1751 1 1 23 CYS CA C 6.886 -0.049 -1.108 1.00 . A A . 23 CYS CA 1 1 3 1752 1 1 23 CYS CB C 5.945 -1.172 -0.650 1.00 . A A . 23 CYS CB 1 1 3 1753 1 1 23 CYS H H 6.818 0.631 0.893 1.00 . A A . 23 CYS H 1 1 3 1754 1 1 23 CYS HA H 7.798 -0.478 -1.496 1.00 . A A . 23 CYS HA 1 1 3 1755 1 1 23 CYS HB2 H 6.231 -1.487 0.341 1.00 . A A . 23 CYS HB2 1 1 3 1756 1 1 23 CYS HB3 H 4.934 -0.791 -0.621 1.00 . A A . 23 CYS HB3 1 1 3 1757 1 1 23 CYS N N 7.224 0.811 0.015 1.00 . A A . 23 CYS N 1 1 3 1758 1 1 23 CYS O O 6.574 0.701 -3.373 1.00 . A A . 23 CYS O 1 1 3 1759 1 1 23 CYS SG S 5.950 -2.649 -1.723 1.00 . A A . 23 CYS SG 1 1 3 1760 1 1 24 CYS C C 5.427 3.560 -3.260 1.00 . A A . 24 CYS C 1 1 3 1761 1 1 24 CYS CA C 4.525 2.483 -2.660 1.00 . A A . 24 CYS CA 1 1 3 1762 1 1 24 CYS CB C 3.365 3.123 -1.900 1.00 . A A . 24 CYS CB 1 1 3 1763 1 1 24 CYS H H 5.049 1.617 -0.807 1.00 . A A . 24 CYS H 1 1 3 1764 1 1 24 CYS HA H 4.126 1.881 -3.462 1.00 . A A . 24 CYS HA 1 1 3 1765 1 1 24 CYS HB2 H 3.757 3.683 -1.066 1.00 . A A . 24 CYS HB2 1 1 3 1766 1 1 24 CYS HB3 H 2.834 3.793 -2.555 1.00 . A A . 24 CYS HB3 1 1 3 1767 1 1 24 CYS N N 5.265 1.603 -1.769 1.00 . A A . 24 CYS N 1 1 3 1768 1 1 24 CYS O O 5.211 3.996 -4.388 1.00 . A A . 24 CYS O 1 1 3 1769 1 1 24 CYS SG S 2.169 1.918 -1.244 1.00 . A A . 24 CYS SG 1 1 3 1770 1 1 25 LYS C C 8.097 4.519 -4.214 1.00 . A A . 25 LYS C 1 1 3 1771 1 1 25 LYS CA C 7.361 5.012 -2.981 1.00 . A A . 25 LYS CA 1 1 3 1772 1 1 25 LYS CB C 8.380 5.401 -1.900 1.00 . A A . 25 LYS CB 1 1 3 1773 1 1 25 LYS CD C 7.235 7.541 -1.173 1.00 . A A . 25 LYS CD 1 1 3 1774 1 1 25 LYS CE C 5.777 7.419 -1.586 1.00 . A A . 25 LYS CE 1 1 3 1775 1 1 25 LYS CG C 7.810 6.201 -0.732 1.00 . A A . 25 LYS CG 1 1 3 1776 1 1 25 LYS H H 6.561 3.608 -1.606 1.00 . A A . 25 LYS H 1 1 3 1777 1 1 25 LYS HA H 6.780 5.883 -3.248 1.00 . A A . 25 LYS HA 1 1 3 1778 1 1 25 LYS HB2 H 8.818 4.499 -1.502 1.00 . A A . 25 LYS HB2 1 1 3 1779 1 1 25 LYS HB3 H 9.159 5.990 -2.361 1.00 . A A . 25 LYS HB3 1 1 3 1780 1 1 25 LYS HD2 H 7.308 8.239 -0.353 1.00 . A A . 25 LYS HD2 1 1 3 1781 1 1 25 LYS HD3 H 7.808 7.907 -2.012 1.00 . A A . 25 LYS HD3 1 1 3 1782 1 1 25 LYS HE2 H 5.693 6.649 -2.338 1.00 . A A . 25 LYS HE2 1 1 3 1783 1 1 25 LYS HE3 H 5.193 7.141 -0.720 1.00 . A A . 25 LYS HE3 1 1 3 1784 1 1 25 LYS HG2 H 7.025 5.624 -0.266 1.00 . A A . 25 LYS HG2 1 1 3 1785 1 1 25 LYS HG3 H 8.598 6.378 -0.015 1.00 . A A . 25 LYS HG3 1 1 3 1786 1 1 25 LYS HZ1 H 4.434 9.020 -1.570 1.00 . A A . 25 LYS HZ1 1 1 3 1787 1 1 25 LYS HZ2 H 4.928 8.547 -3.120 1.00 . A A . 25 LYS HZ2 1 1 3 1788 1 1 25 LYS HZ3 H 5.983 9.425 -2.128 1.00 . A A . 25 LYS HZ3 1 1 3 1789 1 1 25 LYS N N 6.436 3.990 -2.505 1.00 . A A . 25 LYS N 1 1 3 1790 1 1 25 LYS NZ N 5.248 8.692 -2.138 1.00 . A A . 25 LYS NZ 1 1 3 1791 1 1 25 LYS O O 8.115 5.192 -5.243 1.00 . A A . 25 LYS O 1 1 3 1792 1 1 26 LYS C C 8.460 2.365 -6.353 1.00 . A A . 26 LYS C 1 1 3 1793 1 1 26 LYS CA C 9.425 2.763 -5.235 1.00 . A A . 26 LYS CA 1 1 3 1794 1 1 26 LYS CB C 10.285 1.571 -4.790 1.00 . A A . 26 LYS CB 1 1 3 1795 1 1 26 LYS CD C 10.422 -0.790 -3.956 1.00 . A A . 26 LYS CD 1 1 3 1796 1 1 26 LYS CE C 9.766 -2.160 -4.010 1.00 . A A . 26 LYS CE 1 1 3 1797 1 1 26 LYS CG C 9.509 0.295 -4.506 1.00 . A A . 26 LYS CG 1 1 3 1798 1 1 26 LYS H H 8.639 2.839 -3.264 1.00 . A A . 26 LYS H 1 1 3 1799 1 1 26 LYS HA H 10.079 3.535 -5.615 1.00 . A A . 26 LYS HA 1 1 3 1800 1 1 26 LYS HB2 H 11.003 1.357 -5.567 1.00 . A A . 26 LYS HB2 1 1 3 1801 1 1 26 LYS HB3 H 10.818 1.847 -3.892 1.00 . A A . 26 LYS HB3 1 1 3 1802 1 1 26 LYS HD2 H 11.328 -0.814 -4.542 1.00 . A A . 26 LYS HD2 1 1 3 1803 1 1 26 LYS HD3 H 10.663 -0.556 -2.929 1.00 . A A . 26 LYS HD3 1 1 3 1804 1 1 26 LYS HE2 H 9.607 -2.427 -5.044 1.00 . A A . 26 LYS HE2 1 1 3 1805 1 1 26 LYS HE3 H 10.430 -2.879 -3.553 1.00 . A A . 26 LYS HE3 1 1 3 1806 1 1 26 LYS HG2 H 8.738 0.507 -3.780 1.00 . A A . 26 LYS HG2 1 1 3 1807 1 1 26 LYS HG3 H 9.059 -0.055 -5.423 1.00 . A A . 26 LYS HG3 1 1 3 1808 1 1 26 LYS HZ1 H 8.599 -2.436 -2.301 1.00 . A A . 26 LYS HZ1 1 1 3 1809 1 1 26 LYS HZ2 H 7.832 -2.899 -3.737 1.00 . A A . 26 LYS HZ2 1 1 3 1810 1 1 26 LYS HZ3 H 7.999 -1.257 -3.357 1.00 . A A . 26 LYS HZ3 1 1 3 1811 1 1 26 LYS N N 8.694 3.335 -4.109 1.00 . A A . 26 LYS N 1 1 3 1812 1 1 26 LYS NZ N 8.461 -2.187 -3.300 1.00 . A A . 26 LYS NZ 1 1 3 1813 1 1 26 LYS O O 8.831 2.333 -7.525 1.00 . A A . 26 LYS O 1 1 3 1814 1 1 27 ALA C C 5.641 2.942 -7.670 1.00 . A A . 27 ALA C 1 1 3 1815 1 1 27 ALA CA C 6.184 1.708 -6.946 1.00 . A A . 27 ALA CA 1 1 3 1816 1 1 27 ALA CB C 5.058 0.953 -6.256 1.00 . A A . 27 ALA CB 1 1 3 1817 1 1 27 ALA H H 6.975 2.137 -5.030 1.00 . A A . 27 ALA H 1 1 3 1818 1 1 27 ALA HA H 6.635 1.047 -7.673 1.00 . A A . 27 ALA HA 1 1 3 1819 1 1 27 ALA HB1 H 4.107 1.334 -6.597 1.00 . A A . 27 ALA HB1 1 1 3 1820 1 1 27 ALA HB2 H 5.137 1.088 -5.187 1.00 . A A . 27 ALA HB2 1 1 3 1821 1 1 27 ALA HB3 H 5.131 -0.098 -6.492 1.00 . A A . 27 ALA HB3 1 1 3 1822 1 1 27 ALA N N 7.213 2.081 -5.980 1.00 . A A . 27 ALA N 1 1 3 1823 1 1 27 ALA O O 4.808 2.830 -8.575 1.00 . A A . 27 ALA O 1 1 3 1824 1 1 28 LYS C C 4.279 5.741 -7.517 1.00 . A A . 28 LYS C 1 1 3 1825 1 1 28 LYS CA C 5.736 5.393 -7.848 1.00 . A A . 28 LYS CA 1 1 3 1826 1 1 28 LYS CB C 5.977 5.384 -9.365 1.00 . A A . 28 LYS CB 1 1 3 1827 1 1 28 LYS CD C 6.501 6.705 -11.436 1.00 . A A . 28 LYS CD 1 1 3 1828 1 1 28 LYS CE C 7.925 6.173 -11.514 1.00 . A A . 28 LYS CE 1 1 3 1829 1 1 28 LYS CG C 6.010 6.767 -9.998 1.00 . A A . 28 LYS CG 1 1 3 1830 1 1 28 LYS H H 6.796 4.116 -6.540 1.00 . A A . 28 LYS H 1 1 3 1831 1 1 28 LYS HA H 6.368 6.151 -7.408 1.00 . A A . 28 LYS HA 1 1 3 1832 1 1 28 LYS HB2 H 6.922 4.902 -9.563 1.00 . A A . 28 LYS HB2 1 1 3 1833 1 1 28 LYS HB3 H 5.189 4.816 -9.837 1.00 . A A . 28 LYS HB3 1 1 3 1834 1 1 28 LYS HD2 H 5.852 6.052 -12.001 1.00 . A A . 28 LYS HD2 1 1 3 1835 1 1 28 LYS HD3 H 6.473 7.698 -11.860 1.00 . A A . 28 LYS HD3 1 1 3 1836 1 1 28 LYS HE2 H 8.576 6.842 -10.972 1.00 . A A . 28 LYS HE2 1 1 3 1837 1 1 28 LYS HE3 H 7.955 5.195 -11.057 1.00 . A A . 28 LYS HE3 1 1 3 1838 1 1 28 LYS HG2 H 5.013 7.183 -9.986 1.00 . A A . 28 LYS HG2 1 1 3 1839 1 1 28 LYS HG3 H 6.673 7.399 -9.426 1.00 . A A . 28 LYS HG3 1 1 3 1840 1 1 28 LYS HZ1 H 8.294 5.090 -13.262 1.00 . A A . 28 LYS HZ1 1 1 3 1841 1 1 28 LYS HZ2 H 9.411 6.326 -12.974 1.00 . A A . 28 LYS HZ2 1 1 3 1842 1 1 28 LYS HZ3 H 7.861 6.704 -13.534 1.00 . A A . 28 LYS HZ3 1 1 3 1843 1 1 28 LYS N N 6.131 4.114 -7.262 1.00 . A A . 28 LYS N 1 1 3 1844 1 1 28 LYS NZ N 8.406 6.066 -12.919 1.00 . A A . 28 LYS NZ 1 1 3 1845 1 1 28 LYS O O 3.458 5.991 -8.406 1.00 . A A . 28 LYS O 1 1 3 1846 1 1 29 PHE C C 2.748 7.262 -4.735 1.00 . A A . 29 PHE C 1 1 3 1847 1 1 29 PHE CA C 2.645 6.108 -5.730 1.00 . A A . 29 PHE CA 1 1 3 1848 1 1 29 PHE CB C 1.967 4.903 -5.064 1.00 . A A . 29 PHE CB 1 1 3 1849 1 1 29 PHE CD1 C 2.221 3.052 -6.749 1.00 . A A . 29 PHE CD1 1 1 3 1850 1 1 29 PHE CD2 C 0.025 3.815 -6.228 1.00 . A A . 29 PHE CD2 1 1 3 1851 1 1 29 PHE CE1 C 1.694 2.132 -7.635 1.00 . A A . 29 PHE CE1 1 1 3 1852 1 1 29 PHE CE2 C -0.508 2.898 -7.114 1.00 . A A . 29 PHE CE2 1 1 3 1853 1 1 29 PHE CG C 1.396 3.903 -6.035 1.00 . A A . 29 PHE CG 1 1 3 1854 1 1 29 PHE CZ C 0.328 2.055 -7.818 1.00 . A A . 29 PHE CZ 1 1 3 1855 1 1 29 PHE H H 4.685 5.568 -5.571 1.00 . A A . 29 PHE H 1 1 3 1856 1 1 29 PHE HA H 2.051 6.429 -6.574 1.00 . A A . 29 PHE HA 1 1 3 1857 1 1 29 PHE HB2 H 2.692 4.388 -4.452 1.00 . A A . 29 PHE HB2 1 1 3 1858 1 1 29 PHE HB3 H 1.161 5.252 -4.434 1.00 . A A . 29 PHE HB3 1 1 3 1859 1 1 29 PHE HD1 H 3.290 3.110 -6.607 1.00 . A A . 29 PHE HD1 1 1 3 1860 1 1 29 PHE HD2 H -0.631 4.474 -5.679 1.00 . A A . 29 PHE HD2 1 1 3 1861 1 1 29 PHE HE1 H 2.350 1.475 -8.186 1.00 . A A . 29 PHE HE1 1 1 3 1862 1 1 29 PHE HE2 H -1.577 2.841 -7.254 1.00 . A A . 29 PHE HE2 1 1 3 1863 1 1 29 PHE HZ H -0.086 1.337 -8.510 1.00 . A A . 29 PHE HZ 1 1 3 1864 1 1 29 PHE N N 3.978 5.770 -6.223 1.00 . A A . 29 PHE N 1 1 3 1865 1 1 29 PHE O O 3.799 7.460 -4.120 1.00 . A A . 29 PHE O 1 1 3 1866 1 1 30 SER C C 1.859 8.731 -2.233 1.00 . A A . 30 SER C 1 1 3 1867 1 1 30 SER CA C 1.659 9.171 -3.682 1.00 . A A . 30 SER CA 1 1 3 1868 1 1 30 SER CB C 0.345 9.940 -3.828 1.00 . A A . 30 SER CB 1 1 3 1869 1 1 30 SER H H 0.870 7.834 -5.116 1.00 . A A . 30 SER H 1 1 3 1870 1 1 30 SER HA H 2.473 9.818 -3.958 1.00 . A A . 30 SER HA 1 1 3 1871 1 1 30 SER HB2 H -0.473 9.321 -3.491 1.00 . A A . 30 SER HB2 1 1 3 1872 1 1 30 SER HB3 H 0.387 10.839 -3.230 1.00 . A A . 30 SER HB3 1 1 3 1873 1 1 30 SER HG H -0.199 11.206 -5.225 1.00 . A A . 30 SER HG 1 1 3 1874 1 1 30 SER N N 1.673 8.029 -4.591 1.00 . A A . 30 SER N 1 1 3 1875 1 1 30 SER O O 2.724 9.260 -1.533 1.00 . A A . 30 SER O 1 1 3 1876 1 1 30 SER OG O 0.122 10.299 -5.182 1.00 . A A . 30 SER OG 1 1 3 1877 1 1 31 ASP C C 0.536 5.867 -0.333 1.00 . A A . 31 ASP C 1 1 3 1878 1 1 31 ASP CA C 1.176 7.243 -0.434 1.00 . A A . 31 ASP CA 1 1 3 1879 1 1 31 ASP CB C 0.515 8.195 0.568 1.00 . A A . 31 ASP CB 1 1 3 1880 1 1 31 ASP CG C 0.601 7.676 1.991 1.00 . A A . 31 ASP CG 1 1 3 1881 1 1 31 ASP H H 0.411 7.366 -2.409 1.00 . A A . 31 ASP H 1 1 3 1882 1 1 31 ASP HA H 2.225 7.154 -0.192 1.00 . A A . 31 ASP HA 1 1 3 1883 1 1 31 ASP HB2 H 1.007 9.156 0.524 1.00 . A A . 31 ASP HB2 1 1 3 1884 1 1 31 ASP HB3 H -0.527 8.315 0.310 1.00 . A A . 31 ASP HB3 1 1 3 1885 1 1 31 ASP N N 1.075 7.757 -1.797 1.00 . A A . 31 ASP N 1 1 3 1886 1 1 31 ASP O O -0.404 5.559 -1.064 1.00 . A A . 31 ASP O 1 1 3 1887 1 1 31 ASP OD1 O 1.722 7.366 2.447 1.00 . A A . 31 ASP OD1 1 1 3 1888 1 1 31 ASP OD2 O -0.448 7.557 2.660 1.00 . A A . 31 ASP OD2 1 1 3 1889 1 1 32 GLY C C -0.119 3.548 2.112 1.00 . A A . 32 GLY C 1 1 3 1890 1 1 32 GLY CA C 0.522 3.717 0.756 1.00 . A A . 32 GLY CA 1 1 3 1891 1 1 32 GLY H H 1.798 5.359 1.125 1.00 . A A . 32 GLY H 1 1 3 1892 1 1 32 GLY HA2 H -0.221 3.522 -0.007 1.00 . A A . 32 GLY HA2 1 1 3 1893 1 1 32 GLY HA3 H 1.324 3.002 0.656 1.00 . A A . 32 GLY HA3 1 1 3 1894 1 1 32 GLY N N 1.051 5.049 0.569 1.00 . A A . 32 GLY N 1 1 3 1895 1 1 32 GLY O O 0.346 4.111 3.107 1.00 . A A . 32 GLY O 1 1 3 1896 1 1 33 HIS C C -2.255 1.066 3.534 1.00 . A A . 33 HIS C 1 1 3 1897 1 1 33 HIS CA C -1.896 2.535 3.397 1.00 . A A . 33 HIS CA 1 1 3 1898 1 1 33 HIS CB C -3.152 3.411 3.476 1.00 . A A . 33 HIS CB 1 1 3 1899 1 1 33 HIS CD2 C -4.227 3.706 1.122 1.00 . A A . 33 HIS CD2 1 1 3 1900 1 1 33 HIS CE1 C -5.876 2.285 1.346 1.00 . A A . 33 HIS CE1 1 1 3 1901 1 1 33 HIS CG C -4.144 3.180 2.369 1.00 . A A . 33 HIS CG 1 1 3 1902 1 1 33 HIS H H -1.506 2.351 1.326 1.00 . A A . 33 HIS H 1 1 3 1903 1 1 33 HIS HA H -1.235 2.804 4.208 1.00 . A A . 33 HIS HA 1 1 3 1904 1 1 33 HIS HB2 H -3.655 3.216 4.411 1.00 . A A . 33 HIS HB2 1 1 3 1905 1 1 33 HIS HB3 H -2.854 4.444 3.449 1.00 . A A . 33 HIS HB3 1 1 3 1906 1 1 33 HIS HD1 H -5.402 1.743 3.259 1.00 . A A . 33 HIS HD1 1 1 3 1907 1 1 33 HIS HD2 H -3.549 4.417 0.679 1.00 . A A . 33 HIS HD2 1 1 3 1908 1 1 33 HIS HE1 H -6.737 1.670 1.132 1.00 . A A . 33 HIS HE1 1 1 3 1909 1 1 33 HIS N N -1.187 2.776 2.157 1.00 . A A . 33 HIS N 1 1 3 1910 1 1 33 HIS ND1 N -5.194 2.292 2.475 1.00 . A A . 33 HIS ND1 1 1 3 1911 1 1 33 HIS NE2 N -5.314 3.133 0.511 1.00 . A A . 33 HIS NE2 1 1 3 1912 1 1 33 HIS O O -2.821 0.458 2.625 1.00 . A A . 33 HIS O 1 1 3 1913 1 1 34 CYS C C -3.684 -1.117 5.139 1.00 . A A . 34 CYS C 1 1 3 1914 1 1 34 CYS CA C -2.187 -0.893 4.953 1.00 . A A . 34 CYS CA 1 1 3 1915 1 1 34 CYS CB C -1.430 -1.330 6.206 1.00 . A A . 34 CYS CB 1 1 3 1916 1 1 34 CYS H H -1.465 1.052 5.351 1.00 . A A . 34 CYS H 1 1 3 1917 1 1 34 CYS HA H -1.846 -1.475 4.110 1.00 . A A . 34 CYS HA 1 1 3 1918 1 1 34 CYS HB2 H -1.856 -0.835 7.066 1.00 . A A . 34 CYS HB2 1 1 3 1919 1 1 34 CYS HB3 H -1.534 -2.399 6.325 1.00 . A A . 34 CYS HB3 1 1 3 1920 1 1 34 CYS N N -1.915 0.507 4.674 1.00 . A A . 34 CYS N 1 1 3 1921 1 1 34 CYS O O -4.334 -0.412 5.912 1.00 . A A . 34 CYS O 1 1 3 1922 1 1 34 CYS SG S 0.353 -0.944 6.172 1.00 . A A . 34 CYS SG 1 1 3 1923 1 1 35 SER C C -5.960 -3.141 5.816 1.00 . A A . 35 SER C 1 1 3 1924 1 1 35 SER CA C -5.650 -2.395 4.519 1.00 . A A . 35 SER CA 1 1 3 1925 1 1 35 SER CB C -6.106 -3.218 3.314 1.00 . A A . 35 SER CB 1 1 3 1926 1 1 35 SER H H -3.665 -2.619 3.818 1.00 . A A . 35 SER H 1 1 3 1927 1 1 35 SER HA H -6.181 -1.456 4.521 1.00 . A A . 35 SER HA 1 1 3 1928 1 1 35 SER HB2 H -7.116 -3.562 3.478 1.00 . A A . 35 SER HB2 1 1 3 1929 1 1 35 SER HB3 H -6.076 -2.600 2.428 1.00 . A A . 35 SER HB3 1 1 3 1930 1 1 35 SER HG H -4.535 -4.091 2.539 1.00 . A A . 35 SER HG 1 1 3 1931 1 1 35 SER N N -4.231 -2.091 4.425 1.00 . A A . 35 SER N 1 1 3 1932 1 1 35 SER O O -5.061 -3.676 6.468 1.00 . A A . 35 SER O 1 1 3 1933 1 1 35 SER OG O -5.269 -4.341 3.115 1.00 . A A . 35 SER OG 1 1 3 1934 1 1 36 LYS C C -7.979 -5.317 7.127 1.00 . A A . 36 LYS C 1 1 3 1935 1 1 36 LYS CA C -7.650 -3.851 7.405 1.00 . A A . 36 LYS CA 1 1 3 1936 1 1 36 LYS CB C -8.869 -3.148 8.013 1.00 . A A . 36 LYS CB 1 1 3 1937 1 1 36 LYS CD C -10.614 -3.114 9.837 1.00 . A A . 36 LYS CD 1 1 3 1938 1 1 36 LYS CE C -11.817 -3.080 8.905 1.00 . A A . 36 LYS CE 1 1 3 1939 1 1 36 LYS CG C -9.443 -3.869 9.223 1.00 . A A . 36 LYS CG 1 1 3 1940 1 1 36 LYS H H -7.900 -2.723 5.635 1.00 . A A . 36 LYS H 1 1 3 1941 1 1 36 LYS HA H -6.832 -3.806 8.109 1.00 . A A . 36 LYS HA 1 1 3 1942 1 1 36 LYS HB2 H -8.582 -2.152 8.315 1.00 . A A . 36 LYS HB2 1 1 3 1943 1 1 36 LYS HB3 H -9.642 -3.079 7.262 1.00 . A A . 36 LYS HB3 1 1 3 1944 1 1 36 LYS HD2 H -10.901 -3.601 10.756 1.00 . A A . 36 LYS HD2 1 1 3 1945 1 1 36 LYS HD3 H -10.305 -2.100 10.047 1.00 . A A . 36 LYS HD3 1 1 3 1946 1 1 36 LYS HE2 H -11.540 -2.561 7.999 1.00 . A A . 36 LYS HE2 1 1 3 1947 1 1 36 LYS HE3 H -12.100 -4.094 8.666 1.00 . A A . 36 LYS HE3 1 1 3 1948 1 1 36 LYS HG2 H -9.783 -4.847 8.912 1.00 . A A . 36 LYS HG2 1 1 3 1949 1 1 36 LYS HG3 H -8.666 -3.977 9.965 1.00 . A A . 36 LYS HG3 1 1 3 1950 1 1 36 LYS HZ1 H -12.648 -1.642 10.174 1.00 . A A . 36 LYS HZ1 1 1 3 1951 1 1 36 LYS HZ2 H -13.558 -3.063 10.059 1.00 . A A . 36 LYS HZ2 1 1 3 1952 1 1 36 LYS HZ3 H -13.569 -1.948 8.788 1.00 . A A . 36 LYS HZ3 1 1 3 1953 1 1 36 LYS N N -7.229 -3.171 6.189 1.00 . A A . 36 LYS N 1 1 3 1954 1 1 36 LYS NZ N -12.979 -2.384 9.525 1.00 . A A . 36 LYS NZ 1 1 3 1955 1 1 36 LYS O O -7.759 -6.178 7.972 1.00 . A A . 36 LYS O 1 1 3 1956 1 1 37 ILE C C -7.809 -7.947 5.669 1.00 . A A . 37 ILE C 1 1 3 1957 1 1 37 ILE CA C -8.933 -6.917 5.531 1.00 . A A . 37 ILE CA 1 1 3 1958 1 1 37 ILE CB C -9.423 -6.913 4.069 1.00 . A A . 37 ILE CB 1 1 3 1959 1 1 37 ILE CD1 C -11.020 -5.758 2.453 1.00 . A A . 37 ILE CD1 1 1 3 1960 1 1 37 ILE CG1 C -10.571 -5.916 3.892 1.00 . A A . 37 ILE CG1 1 1 3 1961 1 1 37 ILE CG2 C -9.857 -8.310 3.642 1.00 . A A . 37 ILE CG2 1 1 3 1962 1 1 37 ILE H H -8.688 -4.828 5.330 1.00 . A A . 37 ILE H 1 1 3 1963 1 1 37 ILE HA H -9.759 -7.219 6.157 1.00 . A A . 37 ILE HA 1 1 3 1964 1 1 37 ILE HB H -8.598 -6.611 3.445 1.00 . A A . 37 ILE HB 1 1 3 1965 1 1 37 ILE HD11 H -10.969 -4.716 2.173 1.00 . A A . 37 ILE HD11 1 1 3 1966 1 1 37 ILE HD12 H -12.036 -6.109 2.352 1.00 . A A . 37 ILE HD12 1 1 3 1967 1 1 37 ILE HD13 H -10.373 -6.336 1.810 1.00 . A A . 37 ILE HD13 1 1 3 1968 1 1 37 ILE HG12 H -11.421 -6.249 4.468 1.00 . A A . 37 ILE HG12 1 1 3 1969 1 1 37 ILE HG13 H -10.256 -4.947 4.250 1.00 . A A . 37 ILE HG13 1 1 3 1970 1 1 37 ILE HG21 H -10.409 -8.776 4.445 1.00 . A A . 37 ILE HG21 1 1 3 1971 1 1 37 ILE HG22 H -8.984 -8.904 3.413 1.00 . A A . 37 ILE HG22 1 1 3 1972 1 1 37 ILE HG23 H -10.485 -8.240 2.766 1.00 . A A . 37 ILE HG23 1 1 3 1973 1 1 37 ILE N N -8.528 -5.572 5.943 1.00 . A A . 37 ILE N 1 1 3 1974 1 1 37 ILE O O -7.972 -8.960 6.343 1.00 . A A . 37 ILE O 1 1 3 1975 1 1 38 LEU C C -4.242 -7.905 5.238 1.00 . A A . 38 LEU C 1 1 3 1976 1 1 38 LEU CA C -5.563 -8.640 5.080 1.00 . A A . 38 LEU CA 1 1 3 1977 1 1 38 LEU CB C -5.525 -9.485 3.812 1.00 . A A . 38 LEU CB 1 1 3 1978 1 1 38 LEU CD1 C -5.189 -11.709 4.918 1.00 . A A . 38 LEU CD1 1 1 3 1979 1 1 38 LEU CD2 C -4.480 -11.375 2.541 1.00 . A A . 38 LEU CD2 1 1 3 1980 1 1 38 LEU CG C -4.635 -10.720 3.903 1.00 . A A . 38 LEU CG 1 1 3 1981 1 1 38 LEU H H -6.597 -6.887 4.482 1.00 . A A . 38 LEU H 1 1 3 1982 1 1 38 LEU HA H -5.712 -9.285 5.933 1.00 . A A . 38 LEU HA 1 1 3 1983 1 1 38 LEU HB2 H -6.529 -9.795 3.581 1.00 . A A . 38 LEU HB2 1 1 3 1984 1 1 38 LEU HB3 H -5.163 -8.868 3.005 1.00 . A A . 38 LEU HB3 1 1 3 1985 1 1 38 LEU HD11 H -4.562 -11.711 5.798 1.00 . A A . 38 LEU HD11 1 1 3 1986 1 1 38 LEU HD12 H -5.205 -12.698 4.485 1.00 . A A . 38 LEU HD12 1 1 3 1987 1 1 38 LEU HD13 H -6.193 -11.419 5.192 1.00 . A A . 38 LEU HD13 1 1 3 1988 1 1 38 LEU HD21 H -4.768 -10.676 1.770 1.00 . A A . 38 LEU HD21 1 1 3 1989 1 1 38 LEU HD22 H -5.112 -12.249 2.488 1.00 . A A . 38 LEU HD22 1 1 3 1990 1 1 38 LEU HD23 H -3.450 -11.666 2.396 1.00 . A A . 38 LEU HD23 1 1 3 1991 1 1 38 LEU HG H -3.658 -10.407 4.243 1.00 . A A . 38 LEU HG 1 1 3 1992 1 1 38 LEU N N -6.678 -7.700 5.020 1.00 . A A . 38 LEU N 1 1 3 1993 1 1 38 LEU O O -3.171 -8.441 4.959 1.00 . A A . 38 LEU O 1 1 3 1994 1 1 39 ARG C C -2.333 -5.670 4.641 1.00 . A A . 39 ARG C 1 1 3 1995 1 1 39 ARG CA C -3.183 -5.814 5.900 1.00 . A A . 39 ARG CA 1 1 3 1996 1 1 39 ARG CB C -2.330 -6.326 7.062 1.00 . A A . 39 ARG CB 1 1 3 1997 1 1 39 ARG CD C -4.084 -5.925 8.830 1.00 . A A . 39 ARG CD 1 1 3 1998 1 1 39 ARG CG C -2.648 -5.666 8.394 1.00 . A A . 39 ARG CG 1 1 3 1999 1 1 39 ARG CZ C -4.553 -3.923 10.216 1.00 . A A . 39 ARG CZ 1 1 3 2000 1 1 39 ARG H H -5.230 -6.326 5.885 1.00 . A A . 39 ARG H 1 1 3 2001 1 1 39 ARG HA H -3.558 -4.836 6.162 1.00 . A A . 39 ARG HA 1 1 3 2002 1 1 39 ARG HB2 H -2.486 -7.389 7.167 1.00 . A A . 39 ARG HB2 1 1 3 2003 1 1 39 ARG HB3 H -1.289 -6.146 6.835 1.00 . A A . 39 ARG HB3 1 1 3 2004 1 1 39 ARG HD2 H -4.750 -5.570 8.057 1.00 . A A . 39 ARG HD2 1 1 3 2005 1 1 39 ARG HD3 H -4.220 -6.989 8.960 1.00 . A A . 39 ARG HD3 1 1 3 2006 1 1 39 ARG HE H -4.502 -5.812 10.885 1.00 . A A . 39 ARG HE 1 1 3 2007 1 1 39 ARG HG2 H -1.978 -6.057 9.145 1.00 . A A . 39 ARG HG2 1 1 3 2008 1 1 39 ARG HG3 H -2.496 -4.600 8.298 1.00 . A A . 39 ARG HG3 1 1 3 2009 1 1 39 ARG HH11 H -4.389 -3.526 8.230 1.00 . A A . 39 ARG HH11 1 1 3 2010 1 1 39 ARG HH12 H -4.617 -2.141 9.247 1.00 . A A . 39 ARG HH12 1 1 3 2011 1 1 39 ARG HH21 H -4.827 -3.986 12.224 1.00 . A A . 39 ARG HH21 1 1 3 2012 1 1 39 ARG HH22 H -4.874 -2.404 11.522 1.00 . A A . 39 ARG HH22 1 1 3 2013 1 1 39 ARG N N -4.343 -6.672 5.687 1.00 . A A . 39 ARG N 1 1 3 2014 1 1 39 ARG NE N -4.411 -5.246 10.087 1.00 . A A . 39 ARG NE 1 1 3 2015 1 1 39 ARG NH1 N -4.518 -3.132 9.147 1.00 . A A . 39 ARG NH1 1 1 3 2016 1 1 39 ARG NH2 N -4.770 -3.395 11.417 1.00 . A A . 39 ARG NH2 1 1 3 2017 1 1 39 ARG O O -1.132 -5.429 4.723 1.00 . A A . 39 ARG O 1 1 3 2018 1 1 40 ARG C C -1.875 -4.155 2.042 1.00 . A A . 40 ARG C 1 1 3 2019 1 1 40 ARG CA C -2.239 -5.622 2.225 1.00 . A A . 40 ARG CA 1 1 3 2020 1 1 40 ARG CB C -3.067 -6.115 1.037 1.00 . A A . 40 ARG CB 1 1 3 2021 1 1 40 ARG CD C -3.849 -8.082 -0.319 1.00 . A A . 40 ARG CD 1 1 3 2022 1 1 40 ARG CG C -3.200 -7.625 0.979 1.00 . A A . 40 ARG CG 1 1 3 2023 1 1 40 ARG CZ C -2.757 -10.288 -0.595 1.00 . A A . 40 ARG CZ 1 1 3 2024 1 1 40 ARG H H -3.927 -5.959 3.465 1.00 . A A . 40 ARG H 1 1 3 2025 1 1 40 ARG HA H -1.329 -6.201 2.288 1.00 . A A . 40 ARG HA 1 1 3 2026 1 1 40 ARG HB2 H -4.058 -5.689 1.102 1.00 . A A . 40 ARG HB2 1 1 3 2027 1 1 40 ARG HB3 H -2.600 -5.780 0.123 1.00 . A A . 40 ARG HB3 1 1 3 2028 1 1 40 ARG HD2 H -4.867 -7.721 -0.344 1.00 . A A . 40 ARG HD2 1 1 3 2029 1 1 40 ARG HD3 H -3.299 -7.664 -1.149 1.00 . A A . 40 ARG HD3 1 1 3 2030 1 1 40 ARG HE H -4.729 -9.989 -0.364 1.00 . A A . 40 ARG HE 1 1 3 2031 1 1 40 ARG HG2 H -2.217 -8.065 1.051 1.00 . A A . 40 ARG HG2 1 1 3 2032 1 1 40 ARG HG3 H -3.806 -7.955 1.810 1.00 . A A . 40 ARG HG3 1 1 3 2033 1 1 40 ARG HH11 H -1.498 -8.714 -0.807 1.00 . A A . 40 ARG HH11 1 1 3 2034 1 1 40 ARG HH12 H -0.747 -10.274 -0.877 1.00 . A A . 40 ARG HH12 1 1 3 2035 1 1 40 ARG HH21 H -3.735 -12.060 -0.488 1.00 . A A . 40 ARG HH21 1 1 3 2036 1 1 40 ARG HH22 H -2.020 -12.173 -0.708 1.00 . A A . 40 ARG HH22 1 1 3 2037 1 1 40 ARG N N -2.959 -5.784 3.478 1.00 . A A . 40 ARG N 1 1 3 2038 1 1 40 ARG NE N -3.858 -9.541 -0.439 1.00 . A A . 40 ARG NE 1 1 3 2039 1 1 40 ARG NH1 N -1.574 -9.712 -0.778 1.00 . A A . 40 ARG NH1 1 1 3 2040 1 1 40 ARG NH2 N -2.846 -11.613 -0.600 1.00 . A A . 40 ARG NH2 1 1 3 2041 1 1 40 ARG O O -2.639 -3.271 2.438 1.00 . A A . 40 ARG O 1 1 3 2042 1 1 41 CYS C C -0.952 -1.890 0.075 1.00 . A A . 41 CYS C 1 1 3 2043 1 1 41 CYS CA C -0.247 -2.538 1.261 1.00 . A A . 41 CYS CA 1 1 3 2044 1 1 41 CYS CB C 1.263 -2.526 1.031 1.00 . A A . 41 CYS CB 1 1 3 2045 1 1 41 CYS H H -0.140 -4.645 1.196 1.00 . A A . 41 CYS H 1 1 3 2046 1 1 41 CYS HA H -0.469 -1.970 2.151 1.00 . A A . 41 CYS HA 1 1 3 2047 1 1 41 CYS HB2 H 1.759 -2.894 1.917 1.00 . A A . 41 CYS HB2 1 1 3 2048 1 1 41 CYS HB3 H 1.498 -3.172 0.198 1.00 . A A . 41 CYS HB3 1 1 3 2049 1 1 41 CYS N N -0.710 -3.901 1.473 1.00 . A A . 41 CYS N 1 1 3 2050 1 1 41 CYS O O -0.546 -2.071 -1.071 1.00 . A A . 41 CYS O 1 1 3 2051 1 1 41 CYS SG S 1.940 -0.880 0.663 1.00 . A A . 41 CYS SG 1 1 3 2052 1 1 42 LEU C C -2.061 0.875 -1.031 1.00 . A A . 42 LEU C 1 1 3 2053 1 1 42 LEU CA C -2.740 -0.442 -0.695 1.00 . A A . 42 LEU CA 1 1 3 2054 1 1 42 LEU CB C -4.185 -0.171 -0.252 1.00 . A A . 42 LEU CB 1 1 3 2055 1 1 42 LEU CD1 C -4.736 -2.574 0.261 1.00 . A A . 42 LEU CD1 1 1 3 2056 1 1 42 LEU CD2 C -6.566 -0.908 0.028 1.00 . A A . 42 LEU CD2 1 1 3 2057 1 1 42 LEU CG C -5.185 -1.316 -0.458 1.00 . A A . 42 LEU CG 1 1 3 2058 1 1 42 LEU H H -2.275 -1.008 1.292 1.00 . A A . 42 LEU H 1 1 3 2059 1 1 42 LEU HA H -2.741 -1.074 -1.573 1.00 . A A . 42 LEU HA 1 1 3 2060 1 1 42 LEU HB2 H -4.167 0.068 0.802 1.00 . A A . 42 LEU HB2 1 1 3 2061 1 1 42 LEU HB3 H -4.546 0.700 -0.789 1.00 . A A . 42 LEU HB3 1 1 3 2062 1 1 42 LEU HD11 H -4.710 -3.398 -0.437 1.00 . A A . 42 LEU HD11 1 1 3 2063 1 1 42 LEU HD12 H -5.428 -2.799 1.059 1.00 . A A . 42 LEU HD12 1 1 3 2064 1 1 42 LEU HD13 H -3.749 -2.420 0.673 1.00 . A A . 42 LEU HD13 1 1 3 2065 1 1 42 LEU HD21 H -6.595 0.162 0.173 1.00 . A A . 42 LEU HD21 1 1 3 2066 1 1 42 LEU HD22 H -6.780 -1.404 0.963 1.00 . A A . 42 LEU HD22 1 1 3 2067 1 1 42 LEU HD23 H -7.305 -1.191 -0.708 1.00 . A A . 42 LEU HD23 1 1 3 2068 1 1 42 LEU HG H -5.254 -1.540 -1.512 1.00 . A A . 42 LEU HG 1 1 3 2069 1 1 42 LEU N N -2.000 -1.127 0.354 1.00 . A A . 42 LEU N 1 1 3 2070 1 1 42 LEU O O -2.018 1.780 -0.200 1.00 . A A . 42 LEU O 1 1 3 2071 1 1 43 CYS C C -1.908 3.117 -3.345 1.00 . A A . 43 CYS C 1 1 3 2072 1 1 43 CYS CA C -0.898 2.214 -2.661 1.00 . A A . 43 CYS CA 1 1 3 2073 1 1 43 CYS CB C 0.269 1.910 -3.600 1.00 . A A . 43 CYS CB 1 1 3 2074 1 1 43 CYS H H -1.629 0.250 -2.880 1.00 . A A . 43 CYS H 1 1 3 2075 1 1 43 CYS HA H -0.524 2.712 -1.779 1.00 . A A . 43 CYS HA 1 1 3 2076 1 1 43 CYS HB2 H -0.105 1.405 -4.475 1.00 . A A . 43 CYS HB2 1 1 3 2077 1 1 43 CYS HB3 H 0.726 2.842 -3.901 1.00 . A A . 43 CYS HB3 1 1 3 2078 1 1 43 CYS N N -1.552 0.993 -2.243 1.00 . A A . 43 CYS N 1 1 3 2079 1 1 43 CYS O O -2.691 2.662 -4.181 1.00 . A A . 43 CYS O 1 1 3 2080 1 1 43 CYS SG S 1.571 0.867 -2.873 1.00 . A A . 43 CYS SG 1 1 3 2081 1 1 44 THR C C -2.129 6.522 -4.178 1.00 . A A . 44 THR C 1 1 3 2082 1 1 44 THR CA C -2.841 5.333 -3.548 1.00 . A A . 44 THR CA 1 1 3 2083 1 1 44 THR CB C -3.842 5.836 -2.490 1.00 . A A . 44 THR CB 1 1 3 2084 1 1 44 THR CG2 C -5.092 4.973 -2.469 1.00 . A A . 44 THR CG2 1 1 3 2085 1 1 44 THR H H -1.270 4.688 -2.292 1.00 . A A . 44 THR H 1 1 3 2086 1 1 44 THR HA H -3.401 4.820 -4.317 1.00 . A A . 44 THR HA 1 1 3 2087 1 1 44 THR HB H -4.128 6.848 -2.744 1.00 . A A . 44 THR HB 1 1 3 2088 1 1 44 THR HG1 H -2.311 6.110 -1.265 1.00 . A A . 44 THR HG1 1 1 3 2089 1 1 44 THR HG21 H -5.169 4.429 -3.399 1.00 . A A . 44 THR HG21 1 1 3 2090 1 1 44 THR HG22 H -5.962 5.602 -2.347 1.00 . A A . 44 THR HG22 1 1 3 2091 1 1 44 THR HG23 H -5.035 4.275 -1.647 1.00 . A A . 44 THR HG23 1 1 3 2092 1 1 44 THR N N -1.908 4.383 -2.978 1.00 . A A . 44 THR N 1 1 3 2093 1 1 44 THR O O -1.147 7.040 -3.639 1.00 . A A . 44 THR O 1 1 3 2094 1 1 44 THR OG1 O -3.232 5.832 -1.190 1.00 . A A . 44 THR OG1 1 1 3 2095 1 1 45 LYS C C -3.183 8.580 -7.013 1.00 . A A . 45 LYS C 1 1 3 2096 1 1 45 LYS CA C -2.121 8.088 -6.045 1.00 . A A . 45 LYS CA 1 1 3 2097 1 1 45 LYS CB C -0.829 7.730 -6.793 1.00 . A A . 45 LYS CB 1 1 3 2098 1 1 45 LYS CD C 0.336 6.448 -8.591 1.00 . A A . 45 LYS CD 1 1 3 2099 1 1 45 LYS CE C 0.238 5.355 -9.640 1.00 . A A . 45 LYS CE 1 1 3 2100 1 1 45 LYS CG C -0.986 6.680 -7.881 1.00 . A A . 45 LYS CG 1 1 3 2101 1 1 45 LYS H H -3.445 6.489 -5.672 1.00 . A A . 45 LYS H 1 1 3 2102 1 1 45 LYS HA H -1.913 8.871 -5.330 1.00 . A A . 45 LYS HA 1 1 3 2103 1 1 45 LYS HB2 H -0.437 8.626 -7.250 1.00 . A A . 45 LYS HB2 1 1 3 2104 1 1 45 LYS HB3 H -0.107 7.365 -6.076 1.00 . A A . 45 LYS HB3 1 1 3 2105 1 1 45 LYS HD2 H 0.638 7.365 -9.074 1.00 . A A . 45 LYS HD2 1 1 3 2106 1 1 45 LYS HD3 H 1.079 6.164 -7.860 1.00 . A A . 45 LYS HD3 1 1 3 2107 1 1 45 LYS HE2 H -0.206 4.479 -9.190 1.00 . A A . 45 LYS HE2 1 1 3 2108 1 1 45 LYS HE3 H -0.389 5.702 -10.448 1.00 . A A . 45 LYS HE3 1 1 3 2109 1 1 45 LYS HG2 H -1.314 5.753 -7.434 1.00 . A A . 45 LYS HG2 1 1 3 2110 1 1 45 LYS HG3 H -1.718 7.019 -8.598 1.00 . A A . 45 LYS HG3 1 1 3 2111 1 1 45 LYS HZ1 H 2.327 5.404 -9.578 1.00 . A A . 45 LYS HZ1 1 1 3 2112 1 1 45 LYS HZ2 H 1.685 5.368 -11.145 1.00 . A A . 45 LYS HZ2 1 1 3 2113 1 1 45 LYS HZ3 H 1.690 3.964 -10.204 1.00 . A A . 45 LYS HZ3 1 1 3 2114 1 1 45 LYS N N -2.649 6.949 -5.315 1.00 . A A . 45 LYS N 1 1 3 2115 1 1 45 LYS NZ N 1.577 4.997 -10.182 1.00 . A A . 45 LYS NZ 1 1 3 2116 1 1 45 LYS O O -4.371 8.321 -6.810 1.00 . A A . 45 LYS O 1 1 3 2117 1 1 46 GLU C C -3.262 9.319 -10.442 1.00 . A A . 46 GLU C 1 1 3 2118 1 1 46 GLU CA C -3.719 9.736 -9.047 1.00 . A A . 46 GLU CA 1 1 3 2119 1 1 46 GLU CB C -3.896 11.261 -8.927 1.00 . A A . 46 GLU CB 1 1 3 2120 1 1 46 GLU CD C -3.733 12.618 -11.034 1.00 . A A . 46 GLU CD 1 1 3 2121 1 1 46 GLU CG C -2.990 12.095 -9.818 1.00 . A A . 46 GLU CG 1 1 3 2122 1 1 46 GLU H H -1.815 9.420 -8.204 1.00 . A A . 46 GLU H 1 1 3 2123 1 1 46 GLU HA H -4.666 9.258 -8.842 1.00 . A A . 46 GLU HA 1 1 3 2124 1 1 46 GLU HB2 H -4.917 11.507 -9.174 1.00 . A A . 46 GLU HB2 1 1 3 2125 1 1 46 GLU HB3 H -3.710 11.546 -7.902 1.00 . A A . 46 GLU HB3 1 1 3 2126 1 1 46 GLU HG2 H -2.616 12.934 -9.251 1.00 . A A . 46 GLU HG2 1 1 3 2127 1 1 46 GLU HG3 H -2.164 11.484 -10.151 1.00 . A A . 46 GLU HG3 1 1 3 2128 1 1 46 GLU N N -2.771 9.256 -8.069 1.00 . A A . 46 GLU N 1 1 3 2129 1 1 46 GLU O O -2.059 9.273 -10.719 1.00 . A A . 46 GLU O 1 1 3 2130 1 1 46 GLU OE1 O -4.959 12.363 -11.139 1.00 . A A . 46 GLU OE1 1 1 3 2131 1 1 46 GLU OE2 O -3.105 13.289 -11.874 1.00 . A A . 46 GLU OE2 1 1 3 2132 1 1 47 CYS C C -5.207 8.529 -13.477 1.00 . A A . 47 CYS C 1 1 3 2133 1 1 47 CYS CA C -3.925 8.552 -12.654 1.00 . A A . 47 CYS CA 1 1 3 2134 1 1 47 CYS CB C -3.244 7.172 -12.667 1.00 . A A . 47 CYS CB 1 1 3 2135 1 1 47 CYS H H -5.153 9.017 -11.007 1.00 . A A . 47 CYS H 1 1 3 2136 1 1 47 CYS HA H -3.253 9.276 -13.085 1.00 . A A . 47 CYS HA 1 1 3 2137 1 1 47 CYS HB2 H -2.821 7.007 -13.646 1.00 . A A . 47 CYS HB2 1 1 3 2138 1 1 47 CYS HB3 H -2.443 7.178 -11.941 1.00 . A A . 47 CYS HB3 1 1 3 2139 1 1 47 CYS N N -4.218 8.985 -11.297 1.00 . A A . 47 CYS N 1 1 3 2140 1 1 47 CYS O O -5.138 8.252 -14.689 1.00 . A A . 47 CYS O 1 1 3 2141 1 1 47 CYS OXT O -6.281 8.817 -12.894 1.00 . A A . 47 CYS OXT 1 1 3 2142 1 1 47 CYS SG S -4.316 5.733 -12.293 1.00 . A A . 47 CYS SG 1 1 4 2143 1 1 1 ALA C C -6.755 9.497 -9.204 1.00 . A A . 1 ALA C 1 1 4 2144 1 1 1 ALA CA C -7.705 10.002 -10.280 1.00 . A A . 1 ALA CA 1 1 4 2145 1 1 1 ALA CB C -8.196 8.858 -11.160 1.00 . A A . 1 ALA CB 1 1 4 2146 1 1 1 ALA H1 H -6.500 11.677 -10.497 1.00 . A A . 1 ALA H1 1 1 4 2147 1 1 1 ALA H2 H -7.754 11.586 -11.627 1.00 . A A . 1 ALA H2 1 1 4 2148 1 1 1 ALA H3 H -6.393 10.586 -11.787 1.00 . A A . 1 ALA H3 1 1 4 2149 1 1 1 ALA HA H -8.554 10.445 -9.799 1.00 . A A . 1 ALA HA 1 1 4 2150 1 1 1 ALA HB1 H -7.507 8.715 -11.980 1.00 . A A . 1 ALA HB1 1 1 4 2151 1 1 1 ALA HB2 H -9.175 9.097 -11.551 1.00 . A A . 1 ALA HB2 1 1 4 2152 1 1 1 ALA HB3 H -8.253 7.953 -10.575 1.00 . A A . 1 ALA HB3 1 1 4 2153 1 1 1 ALA N N -7.049 11.038 -11.104 1.00 . A A . 1 ALA N 1 1 4 2154 1 1 1 ALA O O -5.768 10.161 -8.886 1.00 . A A . 1 ALA O 1 1 4 2155 1 1 2 THR C C -6.224 6.229 -7.738 1.00 . A A . 2 THR C 1 1 4 2156 1 1 2 THR CA C -6.231 7.745 -7.606 1.00 . A A . 2 THR CA 1 1 4 2157 1 1 2 THR CB C -6.742 8.132 -6.203 1.00 . A A . 2 THR CB 1 1 4 2158 1 1 2 THR CG2 C -5.747 7.721 -5.127 1.00 . A A . 2 THR CG2 1 1 4 2159 1 1 2 THR H H -7.857 7.852 -8.942 1.00 . A A . 2 THR H 1 1 4 2160 1 1 2 THR HA H -5.222 8.116 -7.721 1.00 . A A . 2 THR HA 1 1 4 2161 1 1 2 THR HB H -7.676 7.620 -6.023 1.00 . A A . 2 THR HB 1 1 4 2162 1 1 2 THR HG1 H -6.179 10.003 -6.462 1.00 . A A . 2 THR HG1 1 1 4 2163 1 1 2 THR HG21 H -5.032 7.026 -5.543 1.00 . A A . 2 THR HG21 1 1 4 2164 1 1 2 THR HG22 H -6.274 7.248 -4.312 1.00 . A A . 2 THR HG22 1 1 4 2165 1 1 2 THR HG23 H -5.229 8.596 -4.762 1.00 . A A . 2 THR HG23 1 1 4 2166 1 1 2 THR N N -7.056 8.333 -8.647 1.00 . A A . 2 THR N 1 1 4 2167 1 1 2 THR O O -7.252 5.572 -7.575 1.00 . A A . 2 THR O 1 1 4 2168 1 1 2 THR OG1 O -6.960 9.549 -6.138 1.00 . A A . 2 THR OG1 1 1 4 2169 1 1 3 CYS C C -4.422 3.603 -6.941 1.00 . A A . 3 CYS C 1 1 4 2170 1 1 3 CYS CA C -4.913 4.255 -8.225 1.00 . A A . 3 CYS CA 1 1 4 2171 1 1 3 CYS CB C -3.965 3.974 -9.392 1.00 . A A . 3 CYS CB 1 1 4 2172 1 1 3 CYS H H -4.284 6.266 -8.177 1.00 . A A . 3 CYS H 1 1 4 2173 1 1 3 CYS HA H -5.886 3.852 -8.464 1.00 . A A . 3 CYS HA 1 1 4 2174 1 1 3 CYS HB2 H -3.087 4.604 -9.299 1.00 . A A . 3 CYS HB2 1 1 4 2175 1 1 3 CYS HB3 H -3.666 2.935 -9.370 1.00 . A A . 3 CYS HB3 1 1 4 2176 1 1 3 CYS N N -5.064 5.685 -8.051 1.00 . A A . 3 CYS N 1 1 4 2177 1 1 3 CYS O O -3.569 4.153 -6.242 1.00 . A A . 3 CYS O 1 1 4 2178 1 1 3 CYS SG S -4.703 4.311 -11.022 1.00 . A A . 3 CYS SG 1 1 4 2179 1 1 4 LYS C C -4.357 0.249 -5.742 1.00 . A A . 4 LYS C 1 1 4 2180 1 1 4 LYS CA C -4.618 1.715 -5.424 1.00 . A A . 4 LYS CA 1 1 4 2181 1 1 4 LYS CB C -5.752 1.825 -4.403 1.00 . A A . 4 LYS CB 1 1 4 2182 1 1 4 LYS CD C -6.614 1.229 -2.117 1.00 . A A . 4 LYS CD 1 1 4 2183 1 1 4 LYS CE C -7.454 2.500 -2.139 1.00 . A A . 4 LYS CE 1 1 4 2184 1 1 4 LYS CG C -5.383 1.352 -3.005 1.00 . A A . 4 LYS CG 1 1 4 2185 1 1 4 LYS H H -5.660 2.063 -7.224 1.00 . A A . 4 LYS H 1 1 4 2186 1 1 4 LYS HA H -3.721 2.157 -5.011 1.00 . A A . 4 LYS HA 1 1 4 2187 1 1 4 LYS HB2 H -6.057 2.858 -4.336 1.00 . A A . 4 LYS HB2 1 1 4 2188 1 1 4 LYS HB3 H -6.589 1.236 -4.748 1.00 . A A . 4 LYS HB3 1 1 4 2189 1 1 4 LYS HD2 H -7.218 0.405 -2.464 1.00 . A A . 4 LYS HD2 1 1 4 2190 1 1 4 LYS HD3 H -6.292 1.040 -1.102 1.00 . A A . 4 LYS HD3 1 1 4 2191 1 1 4 LYS HE2 H -6.894 3.293 -1.666 1.00 . A A . 4 LYS HE2 1 1 4 2192 1 1 4 LYS HE3 H -7.653 2.765 -3.167 1.00 . A A . 4 LYS HE3 1 1 4 2193 1 1 4 LYS HG2 H -4.902 0.388 -3.075 1.00 . A A . 4 LYS HG2 1 1 4 2194 1 1 4 LYS HG3 H -4.702 2.066 -2.564 1.00 . A A . 4 LYS HG3 1 1 4 2195 1 1 4 LYS HZ1 H -8.580 2.016 -0.446 1.00 . A A . 4 LYS HZ1 1 1 4 2196 1 1 4 LYS HZ2 H -9.332 1.615 -1.906 1.00 . A A . 4 LYS HZ2 1 1 4 2197 1 1 4 LYS HZ3 H -9.270 3.229 -1.404 1.00 . A A . 4 LYS HZ3 1 1 4 2198 1 1 4 LYS N N -4.978 2.441 -6.630 1.00 . A A . 4 LYS N 1 1 4 2199 1 1 4 LYS NZ N -8.748 2.328 -1.422 1.00 . A A . 4 LYS NZ 1 1 4 2200 1 1 4 LYS O O -5.153 -0.390 -6.427 1.00 . A A . 4 LYS O 1 1 4 2201 1 1 5 ALA C C -1.728 -1.997 -4.486 1.00 . A A . 5 ALA C 1 1 4 2202 1 1 5 ALA CA C -2.854 -1.649 -5.443 1.00 . A A . 5 ALA CA 1 1 4 2203 1 1 5 ALA CB C -2.414 -1.879 -6.882 1.00 . A A . 5 ALA CB 1 1 4 2204 1 1 5 ALA H H -2.663 0.317 -4.696 1.00 . A A . 5 ALA H 1 1 4 2205 1 1 5 ALA HA H -3.707 -2.279 -5.237 1.00 . A A . 5 ALA HA 1 1 4 2206 1 1 5 ALA HB1 H -2.274 -0.927 -7.373 1.00 . A A . 5 ALA HB1 1 1 4 2207 1 1 5 ALA HB2 H -3.169 -2.446 -7.404 1.00 . A A . 5 ALA HB2 1 1 4 2208 1 1 5 ALA HB3 H -1.482 -2.427 -6.890 1.00 . A A . 5 ALA HB3 1 1 4 2209 1 1 5 ALA N N -3.248 -0.262 -5.236 1.00 . A A . 5 ALA N 1 1 4 2210 1 1 5 ALA O O -0.896 -1.143 -4.180 1.00 . A A . 5 ALA O 1 1 4 2211 1 1 6 GLU C C 0.679 -3.623 -3.767 1.00 . A A . 6 GLU C 1 1 4 2212 1 1 6 GLU CA C -0.675 -3.666 -3.081 1.00 . A A . 6 GLU CA 1 1 4 2213 1 1 6 GLU CB C -0.937 -5.085 -2.556 1.00 . A A . 6 GLU CB 1 1 4 2214 1 1 6 GLU CD C -3.195 -5.909 -3.378 1.00 . A A . 6 GLU CD 1 1 4 2215 1 1 6 GLU CG C -2.389 -5.375 -2.205 1.00 . A A . 6 GLU CG 1 1 4 2216 1 1 6 GLU H H -2.403 -3.874 -4.279 1.00 . A A . 6 GLU H 1 1 4 2217 1 1 6 GLU HA H -0.664 -2.978 -2.249 1.00 . A A . 6 GLU HA 1 1 4 2218 1 1 6 GLU HB2 H -0.618 -5.798 -3.295 1.00 . A A . 6 GLU HB2 1 1 4 2219 1 1 6 GLU HB3 H -0.345 -5.229 -1.662 1.00 . A A . 6 GLU HB3 1 1 4 2220 1 1 6 GLU HG2 H -2.408 -6.111 -1.416 1.00 . A A . 6 GLU HG2 1 1 4 2221 1 1 6 GLU HG3 H -2.850 -4.463 -1.856 1.00 . A A . 6 GLU HG3 1 1 4 2222 1 1 6 GLU N N -1.705 -3.232 -4.005 1.00 . A A . 6 GLU N 1 1 4 2223 1 1 6 GLU O O 0.780 -3.858 -4.973 1.00 . A A . 6 GLU O 1 1 4 2224 1 1 6 GLU OE1 O -3.435 -5.150 -4.336 1.00 . A A . 6 GLU OE1 1 1 4 2225 1 1 6 GLU OE2 O -3.578 -7.099 -3.337 1.00 . A A . 6 GLU OE2 1 1 4 2226 1 1 7 CYS C C 3.454 -4.581 -4.150 1.00 . A A . 7 CYS C 1 1 4 2227 1 1 7 CYS CA C 3.056 -3.235 -3.555 1.00 . A A . 7 CYS CA 1 1 4 2228 1 1 7 CYS CB C 4.070 -2.816 -2.487 1.00 . A A . 7 CYS CB 1 1 4 2229 1 1 7 CYS H H 1.561 -3.128 -2.054 1.00 . A A . 7 CYS H 1 1 4 2230 1 1 7 CYS HA H 3.049 -2.496 -4.343 1.00 . A A . 7 CYS HA 1 1 4 2231 1 1 7 CYS HB2 H 3.704 -1.938 -1.977 1.00 . A A . 7 CYS HB2 1 1 4 2232 1 1 7 CYS HB3 H 4.185 -3.621 -1.775 1.00 . A A . 7 CYS HB3 1 1 4 2233 1 1 7 CYS N N 1.710 -3.311 -3.003 1.00 . A A . 7 CYS N 1 1 4 2234 1 1 7 CYS O O 3.360 -5.612 -3.484 1.00 . A A . 7 CYS O 1 1 4 2235 1 1 7 CYS SG S 5.722 -2.427 -3.161 1.00 . A A . 7 CYS SG 1 1 4 2236 1 1 8 PRO C C 5.347 -6.591 -5.373 1.00 . A A . 8 PRO C 1 1 4 2237 1 1 8 PRO CA C 4.285 -5.806 -6.133 1.00 . A A . 8 PRO CA 1 1 4 2238 1 1 8 PRO CB C 4.847 -5.296 -7.472 1.00 . A A . 8 PRO CB 1 1 4 2239 1 1 8 PRO CD C 3.997 -3.397 -6.286 1.00 . A A . 8 PRO CD 1 1 4 2240 1 1 8 PRO CG C 5.011 -3.820 -7.308 1.00 . A A . 8 PRO CG 1 1 4 2241 1 1 8 PRO HA H 3.434 -6.446 -6.318 1.00 . A A . 8 PRO HA 1 1 4 2242 1 1 8 PRO HB2 H 5.795 -5.773 -7.669 1.00 . A A . 8 PRO HB2 1 1 4 2243 1 1 8 PRO HB3 H 4.154 -5.527 -8.268 1.00 . A A . 8 PRO HB3 1 1 4 2244 1 1 8 PRO HD2 H 4.356 -2.546 -5.727 1.00 . A A . 8 PRO HD2 1 1 4 2245 1 1 8 PRO HD3 H 3.053 -3.172 -6.759 1.00 . A A . 8 PRO HD3 1 1 4 2246 1 1 8 PRO HG2 H 6.008 -3.600 -6.959 1.00 . A A . 8 PRO HG2 1 1 4 2247 1 1 8 PRO HG3 H 4.824 -3.323 -8.249 1.00 . A A . 8 PRO HG3 1 1 4 2248 1 1 8 PRO N N 3.886 -4.584 -5.426 1.00 . A A . 8 PRO N 1 1 4 2249 1 1 8 PRO O O 5.322 -7.818 -5.334 1.00 . A A . 8 PRO O 1 1 4 2250 1 1 9 THR C C 7.004 -6.532 -2.510 1.00 . A A . 9 THR C 1 1 4 2251 1 1 9 THR CA C 7.337 -6.509 -3.999 1.00 . A A . 9 THR CA 1 1 4 2252 1 1 9 THR CB C 8.687 -5.791 -4.214 1.00 . A A . 9 THR CB 1 1 4 2253 1 1 9 THR CG2 C 9.234 -6.067 -5.605 1.00 . A A . 9 THR CG2 1 1 4 2254 1 1 9 THR H H 6.243 -4.900 -4.816 1.00 . A A . 9 THR H 1 1 4 2255 1 1 9 THR HA H 7.436 -7.527 -4.350 1.00 . A A . 9 THR HA 1 1 4 2256 1 1 9 THR HB H 9.394 -6.163 -3.486 1.00 . A A . 9 THR HB 1 1 4 2257 1 1 9 THR HG1 H 7.893 -4.211 -3.319 1.00 . A A . 9 THR HG1 1 1 4 2258 1 1 9 THR HG21 H 8.527 -5.720 -6.345 1.00 . A A . 9 THR HG21 1 1 4 2259 1 1 9 THR HG22 H 9.392 -7.128 -5.727 1.00 . A A . 9 THR HG22 1 1 4 2260 1 1 9 THR HG23 H 10.172 -5.546 -5.733 1.00 . A A . 9 THR HG23 1 1 4 2261 1 1 9 THR N N 6.278 -5.876 -4.761 1.00 . A A . 9 THR N 1 1 4 2262 1 1 9 THR O O 7.856 -6.231 -1.676 1.00 . A A . 9 THR O 1 1 4 2263 1 1 9 THR OG1 O 8.532 -4.371 -4.033 1.00 . A A . 9 THR OG1 1 1 4 2264 1 1 10 TRP C C 4.336 -8.025 -0.539 1.00 . A A . 10 TRP C 1 1 4 2265 1 1 10 TRP CA C 5.352 -6.921 -0.784 1.00 . A A . 10 TRP CA 1 1 4 2266 1 1 10 TRP CB C 4.735 -5.583 -0.365 1.00 . A A . 10 TRP CB 1 1 4 2267 1 1 10 TRP CD1 C 3.479 -6.002 1.835 1.00 . A A . 10 TRP CD1 1 1 4 2268 1 1 10 TRP CD2 C 5.334 -4.767 2.043 1.00 . A A . 10 TRP CD2 1 1 4 2269 1 1 10 TRP CE2 C 4.758 -4.926 3.318 1.00 . A A . 10 TRP CE2 1 1 4 2270 1 1 10 TRP CE3 C 6.506 -4.021 1.921 1.00 . A A . 10 TRP CE3 1 1 4 2271 1 1 10 TRP CG C 4.512 -5.473 1.113 1.00 . A A . 10 TRP CG 1 1 4 2272 1 1 10 TRP CH2 C 6.468 -3.636 4.307 1.00 . A A . 10 TRP CH2 1 1 4 2273 1 1 10 TRP CZ2 C 5.324 -4.363 4.462 1.00 . A A . 10 TRP CZ2 1 1 4 2274 1 1 10 TRP CZ3 C 7.060 -3.464 3.053 1.00 . A A . 10 TRP CZ3 1 1 4 2275 1 1 10 TRP H H 5.117 -7.106 -2.880 1.00 . A A . 10 TRP H 1 1 4 2276 1 1 10 TRP HA H 6.226 -7.108 -0.181 1.00 . A A . 10 TRP HA 1 1 4 2277 1 1 10 TRP HB2 H 5.394 -4.781 -0.664 1.00 . A A . 10 TRP HB2 1 1 4 2278 1 1 10 TRP HB3 H 3.782 -5.463 -0.858 1.00 . A A . 10 TRP HB3 1 1 4 2279 1 1 10 TRP HD1 H 2.676 -6.591 1.407 1.00 . A A . 10 TRP HD1 1 1 4 2280 1 1 10 TRP HE1 H 3.025 -5.969 3.891 1.00 . A A . 10 TRP HE1 1 1 4 2281 1 1 10 TRP HE3 H 6.979 -3.877 0.960 1.00 . A A . 10 TRP HE3 1 1 4 2282 1 1 10 TRP HH2 H 6.937 -3.179 5.165 1.00 . A A . 10 TRP HH2 1 1 4 2283 1 1 10 TRP HZ2 H 4.887 -4.483 5.440 1.00 . A A . 10 TRP HZ2 1 1 4 2284 1 1 10 TRP HZ3 H 7.959 -2.874 2.976 1.00 . A A . 10 TRP HZ3 1 1 4 2285 1 1 10 TRP N N 5.766 -6.879 -2.177 1.00 . A A . 10 TRP N 1 1 4 2286 1 1 10 TRP NE1 N 3.629 -5.691 3.167 1.00 . A A . 10 TRP NE1 1 1 4 2287 1 1 10 TRP O O 3.216 -7.979 -1.045 1.00 . A A . 10 TRP O 1 1 4 2288 1 1 11 ASP C C 4.227 -10.578 2.032 1.00 . A A . 11 ASP C 1 1 4 2289 1 1 11 ASP CA C 3.846 -10.087 0.643 1.00 . A A . 11 ASP CA 1 1 4 2290 1 1 11 ASP CB C 3.908 -11.226 -0.376 1.00 . A A . 11 ASP CB 1 1 4 2291 1 1 11 ASP CG C 2.661 -12.093 -0.323 1.00 . A A . 11 ASP CG 1 1 4 2292 1 1 11 ASP H H 5.619 -8.945 0.673 1.00 . A A . 11 ASP H 1 1 4 2293 1 1 11 ASP HA H 2.837 -9.701 0.680 1.00 . A A . 11 ASP HA 1 1 4 2294 1 1 11 ASP HB2 H 3.998 -10.812 -1.369 1.00 . A A . 11 ASP HB2 1 1 4 2295 1 1 11 ASP HB3 H 4.767 -11.846 -0.166 1.00 . A A . 11 ASP HB3 1 1 4 2296 1 1 11 ASP N N 4.724 -8.987 0.279 1.00 . A A . 11 ASP N 1 1 4 2297 1 1 11 ASP O O 4.764 -11.670 2.211 1.00 . A A . 11 ASP O 1 1 4 2298 1 1 11 ASP OD1 O 2.403 -12.711 0.731 1.00 . A A . 11 ASP OD1 1 1 4 2299 1 1 11 ASP OD2 O 1.923 -12.134 -1.331 1.00 . A A . 11 ASP OD2 1 1 4 2300 1 1 12 SER C C 3.426 -9.170 5.318 1.00 . A A . 12 SER C 1 1 4 2301 1 1 12 SER CA C 4.304 -10.014 4.401 1.00 . A A . 12 SER CA 1 1 4 2302 1 1 12 SER CB C 5.785 -9.728 4.675 1.00 . A A . 12 SER CB 1 1 4 2303 1 1 12 SER H H 3.580 -8.860 2.798 1.00 . A A . 12 SER H 1 1 4 2304 1 1 12 SER HA H 4.102 -11.059 4.582 1.00 . A A . 12 SER HA 1 1 4 2305 1 1 12 SER HB2 H 5.988 -8.685 4.485 1.00 . A A . 12 SER HB2 1 1 4 2306 1 1 12 SER HB3 H 6.007 -9.955 5.708 1.00 . A A . 12 SER HB3 1 1 4 2307 1 1 12 SER HG H 6.077 -11.084 3.282 1.00 . A A . 12 SER HG 1 1 4 2308 1 1 12 SER N N 3.980 -9.725 3.014 1.00 . A A . 12 SER N 1 1 4 2309 1 1 12 SER O O 2.738 -8.251 4.857 1.00 . A A . 12 SER O 1 1 4 2310 1 1 12 SER OG O 6.624 -10.514 3.844 1.00 . A A . 12 SER OG 1 1 4 2311 1 1 13 VAL C C 3.297 -7.424 7.925 1.00 . A A . 13 VAL C 1 1 4 2312 1 1 13 VAL CA C 2.646 -8.760 7.579 1.00 . A A . 13 VAL CA 1 1 4 2313 1 1 13 VAL CB C 2.450 -9.585 8.871 1.00 . A A . 13 VAL CB 1 1 4 2314 1 1 13 VAL CG1 C 1.598 -8.825 9.878 1.00 . A A . 13 VAL CG1 1 1 4 2315 1 1 13 VAL CG2 C 1.826 -10.937 8.555 1.00 . A A . 13 VAL CG2 1 1 4 2316 1 1 13 VAL H H 4.009 -10.226 6.908 1.00 . A A . 13 VAL H 1 1 4 2317 1 1 13 VAL HA H 1.675 -8.575 7.142 1.00 . A A . 13 VAL HA 1 1 4 2318 1 1 13 VAL HB H 3.420 -9.756 9.314 1.00 . A A . 13 VAL HB 1 1 4 2319 1 1 13 VAL HG11 H 0.563 -9.110 9.762 1.00 . A A . 13 VAL HG11 1 1 4 2320 1 1 13 VAL HG12 H 1.700 -7.763 9.707 1.00 . A A . 13 VAL HG12 1 1 4 2321 1 1 13 VAL HG13 H 1.926 -9.062 10.879 1.00 . A A . 13 VAL HG13 1 1 4 2322 1 1 13 VAL HG21 H 2.581 -11.596 8.151 1.00 . A A . 13 VAL HG21 1 1 4 2323 1 1 13 VAL HG22 H 1.036 -10.808 7.830 1.00 . A A . 13 VAL HG22 1 1 4 2324 1 1 13 VAL HG23 H 1.418 -11.366 9.459 1.00 . A A . 13 VAL HG23 1 1 4 2325 1 1 13 VAL N N 3.446 -9.485 6.605 1.00 . A A . 13 VAL N 1 1 4 2326 1 1 13 VAL O O 4.468 -7.366 8.301 1.00 . A A . 13 VAL O 1 1 4 2327 1 1 14 CYS C C 3.115 -4.758 9.564 1.00 . A A . 14 CYS C 1 1 4 2328 1 1 14 CYS CA C 3.004 -5.015 8.065 1.00 . A A . 14 CYS CA 1 1 4 2329 1 1 14 CYS CB C 2.064 -3.985 7.433 1.00 . A A . 14 CYS CB 1 1 4 2330 1 1 14 CYS H H 1.603 -6.478 7.468 1.00 . A A . 14 CYS H 1 1 4 2331 1 1 14 CYS HA H 3.982 -4.911 7.622 1.00 . A A . 14 CYS HA 1 1 4 2332 1 1 14 CYS HB2 H 2.359 -3.827 6.405 1.00 . A A . 14 CYS HB2 1 1 4 2333 1 1 14 CYS HB3 H 1.055 -4.368 7.459 1.00 . A A . 14 CYS HB3 1 1 4 2334 1 1 14 CYS N N 2.528 -6.359 7.782 1.00 . A A . 14 CYS N 1 1 4 2335 1 1 14 CYS O O 2.198 -5.055 10.331 1.00 . A A . 14 CYS O 1 1 4 2336 1 1 14 CYS SG S 2.062 -2.361 8.264 1.00 . A A . 14 CYS SG 1 1 4 2337 1 1 15 ILE C C 4.235 -2.362 11.579 1.00 . A A . 15 ILE C 1 1 4 2338 1 1 15 ILE CA C 4.484 -3.855 11.361 1.00 . A A . 15 ILE CA 1 1 4 2339 1 1 15 ILE CB C 5.930 -4.216 11.776 1.00 . A A . 15 ILE CB 1 1 4 2340 1 1 15 ILE CD1 C 5.276 -6.650 12.195 1.00 . A A . 15 ILE CD1 1 1 4 2341 1 1 15 ILE CG1 C 6.212 -5.694 11.481 1.00 . A A . 15 ILE CG1 1 1 4 2342 1 1 15 ILE CG2 C 6.171 -3.908 13.249 1.00 . A A . 15 ILE CG2 1 1 4 2343 1 1 15 ILE H H 4.922 -3.970 9.300 1.00 . A A . 15 ILE H 1 1 4 2344 1 1 15 ILE HA H 3.796 -4.424 11.970 1.00 . A A . 15 ILE HA 1 1 4 2345 1 1 15 ILE HB H 6.607 -3.608 11.195 1.00 . A A . 15 ILE HB 1 1 4 2346 1 1 15 ILE HD11 H 5.849 -7.302 12.837 1.00 . A A . 15 ILE HD11 1 1 4 2347 1 1 15 ILE HD12 H 4.741 -7.241 11.466 1.00 . A A . 15 ILE HD12 1 1 4 2348 1 1 15 ILE HD13 H 4.572 -6.086 12.788 1.00 . A A . 15 ILE HD13 1 1 4 2349 1 1 15 ILE HG12 H 6.112 -5.867 10.421 1.00 . A A . 15 ILE HG12 1 1 4 2350 1 1 15 ILE HG13 H 7.222 -5.929 11.785 1.00 . A A . 15 ILE HG13 1 1 4 2351 1 1 15 ILE HG21 H 7.134 -3.434 13.366 1.00 . A A . 15 ILE HG21 1 1 4 2352 1 1 15 ILE HG22 H 6.151 -4.828 13.816 1.00 . A A . 15 ILE HG22 1 1 4 2353 1 1 15 ILE HG23 H 5.397 -3.247 13.610 1.00 . A A . 15 ILE HG23 1 1 4 2354 1 1 15 ILE N N 4.240 -4.188 9.965 1.00 . A A . 15 ILE N 1 1 4 2355 1 1 15 ILE O O 3.679 -1.945 12.595 1.00 . A A . 15 ILE O 1 1 4 2356 1 1 16 ASN C C 4.170 0.344 9.192 1.00 . A A . 16 ASN C 1 1 4 2357 1 1 16 ASN CA C 4.461 -0.123 10.616 1.00 . A A . 16 ASN CA 1 1 4 2358 1 1 16 ASN CB C 5.723 0.555 11.181 1.00 . A A . 16 ASN CB 1 1 4 2359 1 1 16 ASN CG C 5.550 2.045 11.433 1.00 . A A . 16 ASN CG 1 1 4 2360 1 1 16 ASN H H 5.046 -1.976 9.802 1.00 . A A . 16 ASN H 1 1 4 2361 1 1 16 ASN HA H 3.613 0.106 11.245 1.00 . A A . 16 ASN HA 1 1 4 2362 1 1 16 ASN HB2 H 5.982 0.084 12.118 1.00 . A A . 16 ASN HB2 1 1 4 2363 1 1 16 ASN HB3 H 6.535 0.420 10.483 1.00 . A A . 16 ASN HB3 1 1 4 2364 1 1 16 ASN HD21 H 5.579 1.745 13.396 1.00 . A A . 16 ASN HD21 1 1 4 2365 1 1 16 ASN HD22 H 5.384 3.386 12.887 1.00 . A A . 16 ASN HD22 1 1 4 2366 1 1 16 ASN N N 4.634 -1.570 10.590 1.00 . A A . 16 ASN N 1 1 4 2367 1 1 16 ASN ND2 N 5.501 2.431 12.698 1.00 . A A . 16 ASN ND2 1 1 4 2368 1 1 16 ASN O O 4.435 -0.392 8.243 1.00 . A A . 16 ASN O 1 1 4 2369 1 1 16 ASN OD1 O 5.464 2.844 10.500 1.00 . A A . 16 ASN OD1 1 1 4 2370 1 1 17 LYS C C 4.500 2.468 6.916 1.00 . A A . 17 LYS C 1 1 4 2371 1 1 17 LYS CA C 3.263 2.043 7.716 1.00 . A A . 17 LYS CA 1 1 4 2372 1 1 17 LYS CB C 2.296 3.225 7.823 1.00 . A A . 17 LYS CB 1 1 4 2373 1 1 17 LYS CD C 0.747 4.701 6.478 1.00 . A A . 17 LYS CD 1 1 4 2374 1 1 17 LYS CE C 1.766 5.659 5.892 1.00 . A A . 17 LYS CE 1 1 4 2375 1 1 17 LYS CG C 1.333 3.308 6.650 1.00 . A A . 17 LYS CG 1 1 4 2376 1 1 17 LYS H H 3.395 2.069 9.830 1.00 . A A . 17 LYS H 1 1 4 2377 1 1 17 LYS HA H 2.770 1.247 7.179 1.00 . A A . 17 LYS HA 1 1 4 2378 1 1 17 LYS HB2 H 1.720 3.125 8.732 1.00 . A A . 17 LYS HB2 1 1 4 2379 1 1 17 LYS HB3 H 2.865 4.142 7.864 1.00 . A A . 17 LYS HB3 1 1 4 2380 1 1 17 LYS HD2 H -0.103 4.647 5.816 1.00 . A A . 17 LYS HD2 1 1 4 2381 1 1 17 LYS HD3 H 0.435 5.071 7.443 1.00 . A A . 17 LYS HD3 1 1 4 2382 1 1 17 LYS HE2 H 2.330 6.103 6.697 1.00 . A A . 17 LYS HE2 1 1 4 2383 1 1 17 LYS HE3 H 2.433 5.106 5.246 1.00 . A A . 17 LYS HE3 1 1 4 2384 1 1 17 LYS HG2 H 1.861 3.041 5.747 1.00 . A A . 17 LYS HG2 1 1 4 2385 1 1 17 LYS HG3 H 0.526 2.609 6.812 1.00 . A A . 17 LYS HG3 1 1 4 2386 1 1 17 LYS HZ1 H 0.362 6.342 4.503 1.00 . A A . 17 LYS HZ1 1 1 4 2387 1 1 17 LYS HZ2 H 1.819 7.200 4.479 1.00 . A A . 17 LYS HZ2 1 1 4 2388 1 1 17 LYS HZ3 H 0.711 7.453 5.735 1.00 . A A . 17 LYS HZ3 1 1 4 2389 1 1 17 LYS N N 3.604 1.531 9.038 1.00 . A A . 17 LYS N 1 1 4 2390 1 1 17 LYS NZ N 1.119 6.737 5.108 1.00 . A A . 17 LYS NZ 1 1 4 2391 1 1 17 LYS O O 4.484 2.411 5.687 1.00 . A A . 17 LYS O 1 1 4 2392 1 1 18 LYS C C 7.343 2.344 5.911 1.00 . A A . 18 LYS C 1 1 4 2393 1 1 18 LYS CA C 6.774 3.380 6.910 1.00 . A A . 18 LYS CA 1 1 4 2394 1 1 18 LYS CB C 7.851 3.892 7.894 1.00 . A A . 18 LYS CB 1 1 4 2395 1 1 18 LYS CD C 9.194 3.563 10.000 1.00 . A A . 18 LYS CD 1 1 4 2396 1 1 18 LYS CE C 10.484 4.061 9.362 1.00 . A A . 18 LYS CE 1 1 4 2397 1 1 18 LYS CG C 8.266 2.915 8.982 1.00 . A A . 18 LYS CG 1 1 4 2398 1 1 18 LYS H H 5.513 2.965 8.582 1.00 . A A . 18 LYS H 1 1 4 2399 1 1 18 LYS HA H 6.459 4.229 6.317 1.00 . A A . 18 LYS HA 1 1 4 2400 1 1 18 LYS HB2 H 8.735 4.149 7.331 1.00 . A A . 18 LYS HB2 1 1 4 2401 1 1 18 LYS HB3 H 7.477 4.786 8.373 1.00 . A A . 18 LYS HB3 1 1 4 2402 1 1 18 LYS HD2 H 8.684 4.401 10.452 1.00 . A A . 18 LYS HD2 1 1 4 2403 1 1 18 LYS HD3 H 9.437 2.837 10.762 1.00 . A A . 18 LYS HD3 1 1 4 2404 1 1 18 LYS HE2 H 10.235 4.754 8.573 1.00 . A A . 18 LYS HE2 1 1 4 2405 1 1 18 LYS HE3 H 11.067 4.571 10.115 1.00 . A A . 18 LYS HE3 1 1 4 2406 1 1 18 LYS HG2 H 7.381 2.564 9.492 1.00 . A A . 18 LYS HG2 1 1 4 2407 1 1 18 LYS HG3 H 8.775 2.079 8.525 1.00 . A A . 18 LYS HG3 1 1 4 2408 1 1 18 LYS HZ1 H 11.034 2.792 7.796 1.00 . A A . 18 LYS HZ1 1 1 4 2409 1 1 18 LYS HZ2 H 11.129 2.074 9.325 1.00 . A A . 18 LYS HZ2 1 1 4 2410 1 1 18 LYS HZ3 H 12.307 3.186 8.839 1.00 . A A . 18 LYS HZ3 1 1 4 2411 1 1 18 LYS N N 5.559 2.919 7.601 1.00 . A A . 18 LYS N 1 1 4 2412 1 1 18 LYS NZ N 11.295 2.950 8.791 1.00 . A A . 18 LYS NZ 1 1 4 2413 1 1 18 LYS O O 7.665 2.722 4.785 1.00 . A A . 18 LYS O 1 1 4 2414 1 1 19 PRO C C 7.107 -0.039 4.060 1.00 . A A . 19 PRO C 1 1 4 2415 1 1 19 PRO CA C 7.976 0.026 5.312 1.00 . A A . 19 PRO CA 1 1 4 2416 1 1 19 PRO CB C 7.872 -1.290 6.096 1.00 . A A . 19 PRO CB 1 1 4 2417 1 1 19 PRO CD C 7.119 0.415 7.549 1.00 . A A . 19 PRO CD 1 1 4 2418 1 1 19 PRO CG C 7.876 -0.876 7.520 1.00 . A A . 19 PRO CG 1 1 4 2419 1 1 19 PRO HA H 9.003 0.216 5.035 1.00 . A A . 19 PRO HA 1 1 4 2420 1 1 19 PRO HB2 H 6.951 -1.791 5.836 1.00 . A A . 19 PRO HB2 1 1 4 2421 1 1 19 PRO HB3 H 8.709 -1.928 5.863 1.00 . A A . 19 PRO HB3 1 1 4 2422 1 1 19 PRO HD2 H 6.057 0.229 7.617 1.00 . A A . 19 PRO HD2 1 1 4 2423 1 1 19 PRO HD3 H 7.449 1.030 8.373 1.00 . A A . 19 PRO HD3 1 1 4 2424 1 1 19 PRO HG2 H 7.379 -1.621 8.125 1.00 . A A . 19 PRO HG2 1 1 4 2425 1 1 19 PRO HG3 H 8.890 -0.725 7.861 1.00 . A A . 19 PRO HG3 1 1 4 2426 1 1 19 PRO N N 7.467 1.033 6.258 1.00 . A A . 19 PRO N 1 1 4 2427 1 1 19 PRO O O 7.604 -0.147 2.935 1.00 . A A . 19 PRO O 1 1 4 2428 1 1 20 CYS C C 5.040 1.207 2.276 1.00 . A A . 20 CYS C 1 1 4 2429 1 1 20 CYS CA C 4.829 0.015 3.203 1.00 . A A . 20 CYS CA 1 1 4 2430 1 1 20 CYS CB C 3.410 0.026 3.791 1.00 . A A . 20 CYS CB 1 1 4 2431 1 1 20 CYS H H 5.485 0.147 5.201 1.00 . A A . 20 CYS H 1 1 4 2432 1 1 20 CYS HA H 4.980 -0.900 2.646 1.00 . A A . 20 CYS HA 1 1 4 2433 1 1 20 CYS HB2 H 3.279 -0.855 4.400 1.00 . A A . 20 CYS HB2 1 1 4 2434 1 1 20 CYS HB3 H 3.298 0.902 4.415 1.00 . A A . 20 CYS HB3 1 1 4 2435 1 1 20 CYS N N 5.802 0.046 4.280 1.00 . A A . 20 CYS N 1 1 4 2436 1 1 20 CYS O O 5.121 1.051 1.057 1.00 . A A . 20 CYS O 1 1 4 2437 1 1 20 CYS SG S 2.062 0.044 2.564 1.00 . A A . 20 CYS SG 1 1 4 2438 1 1 21 VAL C C 6.644 3.507 1.260 1.00 . A A . 21 VAL C 1 1 4 2439 1 1 21 VAL CA C 5.382 3.618 2.102 1.00 . A A . 21 VAL CA 1 1 4 2440 1 1 21 VAL CB C 5.494 4.859 3.012 1.00 . A A . 21 VAL CB 1 1 4 2441 1 1 21 VAL CG1 C 5.724 6.121 2.190 1.00 . A A . 21 VAL CG1 1 1 4 2442 1 1 21 VAL CG2 C 4.250 5.008 3.862 1.00 . A A . 21 VAL CG2 1 1 4 2443 1 1 21 VAL H H 5.105 2.447 3.847 1.00 . A A . 21 VAL H 1 1 4 2444 1 1 21 VAL HA H 4.535 3.756 1.443 1.00 . A A . 21 VAL HA 1 1 4 2445 1 1 21 VAL HB H 6.340 4.724 3.670 1.00 . A A . 21 VAL HB 1 1 4 2446 1 1 21 VAL HG11 H 6.670 6.047 1.674 1.00 . A A . 21 VAL HG11 1 1 4 2447 1 1 21 VAL HG12 H 5.737 6.979 2.846 1.00 . A A . 21 VAL HG12 1 1 4 2448 1 1 21 VAL HG13 H 4.928 6.231 1.469 1.00 . A A . 21 VAL HG13 1 1 4 2449 1 1 21 VAL HG21 H 4.246 5.984 4.324 1.00 . A A . 21 VAL HG21 1 1 4 2450 1 1 21 VAL HG22 H 4.245 4.247 4.629 1.00 . A A . 21 VAL HG22 1 1 4 2451 1 1 21 VAL HG23 H 3.374 4.899 3.240 1.00 . A A . 21 VAL HG23 1 1 4 2452 1 1 21 VAL N N 5.158 2.396 2.867 1.00 . A A . 21 VAL N 1 1 4 2453 1 1 21 VAL O O 6.682 3.982 0.128 1.00 . A A . 21 VAL O 1 1 4 2454 1 1 22 ALA C C 8.708 1.837 -0.142 1.00 . A A . 22 ALA C 1 1 4 2455 1 1 22 ALA CA C 8.927 2.692 1.100 1.00 . A A . 22 ALA CA 1 1 4 2456 1 1 22 ALA CB C 9.975 2.063 2.004 1.00 . A A . 22 ALA CB 1 1 4 2457 1 1 22 ALA H H 7.576 2.508 2.722 1.00 . A A . 22 ALA H 1 1 4 2458 1 1 22 ALA HA H 9.282 3.667 0.796 1.00 . A A . 22 ALA HA 1 1 4 2459 1 1 22 ALA HB1 H 10.904 2.606 1.910 1.00 . A A . 22 ALA HB1 1 1 4 2460 1 1 22 ALA HB2 H 10.128 1.035 1.712 1.00 . A A . 22 ALA HB2 1 1 4 2461 1 1 22 ALA HB3 H 9.637 2.101 3.029 1.00 . A A . 22 ALA HB3 1 1 4 2462 1 1 22 ALA N N 7.671 2.872 1.815 1.00 . A A . 22 ALA N 1 1 4 2463 1 1 22 ALA O O 9.131 2.205 -1.241 1.00 . A A . 22 ALA O 1 1 4 2464 1 1 23 CYS C C 6.887 0.541 -2.113 1.00 . A A . 23 CYS C 1 1 4 2465 1 1 23 CYS CA C 7.718 -0.194 -1.067 1.00 . A A . 23 CYS CA 1 1 4 2466 1 1 23 CYS CB C 6.945 -1.413 -0.554 1.00 . A A . 23 CYS CB 1 1 4 2467 1 1 23 CYS H H 7.696 0.486 0.940 1.00 . A A . 23 CYS H 1 1 4 2468 1 1 23 CYS HA H 8.648 -0.517 -1.510 1.00 . A A . 23 CYS HA 1 1 4 2469 1 1 23 CYS HB2 H 7.348 -1.706 0.401 1.00 . A A . 23 CYS HB2 1 1 4 2470 1 1 23 CYS HB3 H 5.907 -1.140 -0.428 1.00 . A A . 23 CYS HB3 1 1 4 2471 1 1 23 CYS N N 8.021 0.709 0.038 1.00 . A A . 23 CYS N 1 1 4 2472 1 1 23 CYS O O 7.148 0.463 -3.316 1.00 . A A . 23 CYS O 1 1 4 2473 1 1 23 CYS SG S 7.005 -2.872 -1.652 1.00 . A A . 23 CYS SG 1 1 4 2474 1 1 24 CYS C C 5.748 3.142 -3.217 1.00 . A A . 24 CYS C 1 1 4 2475 1 1 24 CYS CA C 5.005 2.019 -2.498 1.00 . A A . 24 CYS CA 1 1 4 2476 1 1 24 CYS CB C 3.852 2.580 -1.674 1.00 . A A . 24 CYS CB 1 1 4 2477 1 1 24 CYS H H 5.735 1.276 -0.662 1.00 . A A . 24 CYS H 1 1 4 2478 1 1 24 CYS HA H 4.605 1.341 -3.237 1.00 . A A . 24 CYS HA 1 1 4 2479 1 1 24 CYS HB2 H 4.251 3.194 -0.880 1.00 . A A . 24 CYS HB2 1 1 4 2480 1 1 24 CYS HB3 H 3.218 3.182 -2.309 1.00 . A A . 24 CYS HB3 1 1 4 2481 1 1 24 CYS N N 5.889 1.259 -1.635 1.00 . A A . 24 CYS N 1 1 4 2482 1 1 24 CYS O O 5.474 3.422 -4.378 1.00 . A A . 24 CYS O 1 1 4 2483 1 1 24 CYS SG S 2.817 1.293 -0.914 1.00 . A A . 24 CYS SG 1 1 4 2484 1 1 25 LYS C C 8.286 4.406 -4.289 1.00 . A A . 25 LYS C 1 1 4 2485 1 1 25 LYS CA C 7.436 4.892 -3.118 1.00 . A A . 25 LYS CA 1 1 4 2486 1 1 25 LYS CB C 8.309 5.576 -2.060 1.00 . A A . 25 LYS CB 1 1 4 2487 1 1 25 LYS CD C 7.547 7.851 -2.868 1.00 . A A . 25 LYS CD 1 1 4 2488 1 1 25 LYS CE C 6.418 7.870 -1.841 1.00 . A A . 25 LYS CE 1 1 4 2489 1 1 25 LYS CG C 8.731 6.996 -2.424 1.00 . A A . 25 LYS CG 1 1 4 2490 1 1 25 LYS H H 6.856 3.533 -1.593 1.00 . A A . 25 LYS H 1 1 4 2491 1 1 25 LYS HA H 6.720 5.610 -3.492 1.00 . A A . 25 LYS HA 1 1 4 2492 1 1 25 LYS HB2 H 7.762 5.616 -1.131 1.00 . A A . 25 LYS HB2 1 1 4 2493 1 1 25 LYS HB3 H 9.202 4.987 -1.916 1.00 . A A . 25 LYS HB3 1 1 4 2494 1 1 25 LYS HD2 H 7.889 8.863 -3.023 1.00 . A A . 25 LYS HD2 1 1 4 2495 1 1 25 LYS HD3 H 7.165 7.457 -3.798 1.00 . A A . 25 LYS HD3 1 1 4 2496 1 1 25 LYS HE2 H 5.565 8.367 -2.278 1.00 . A A . 25 LYS HE2 1 1 4 2497 1 1 25 LYS HE3 H 6.153 6.851 -1.600 1.00 . A A . 25 LYS HE3 1 1 4 2498 1 1 25 LYS HG2 H 9.186 7.456 -1.560 1.00 . A A . 25 LYS HG2 1 1 4 2499 1 1 25 LYS HG3 H 9.451 6.951 -3.229 1.00 . A A . 25 LYS HG3 1 1 4 2500 1 1 25 LYS HZ1 H 7.256 7.924 0.069 1.00 . A A . 25 LYS HZ1 1 1 4 2501 1 1 25 LYS HZ2 H 5.942 8.970 -0.135 1.00 . A A . 25 LYS HZ2 1 1 4 2502 1 1 25 LYS HZ3 H 7.446 9.361 -0.804 1.00 . A A . 25 LYS HZ3 1 1 4 2503 1 1 25 LYS N N 6.679 3.792 -2.527 1.00 . A A . 25 LYS N 1 1 4 2504 1 1 25 LYS NZ N 6.794 8.581 -0.590 1.00 . A A . 25 LYS NZ 1 1 4 2505 1 1 25 LYS O O 8.278 5.019 -5.356 1.00 . A A . 25 LYS O 1 1 4 2506 1 1 26 LYS C C 8.936 2.225 -6.309 1.00 . A A . 26 LYS C 1 1 4 2507 1 1 26 LYS CA C 9.821 2.734 -5.172 1.00 . A A . 26 LYS CA 1 1 4 2508 1 1 26 LYS CB C 10.727 1.606 -4.661 1.00 . A A . 26 LYS CB 1 1 4 2509 1 1 26 LYS CD C 10.702 -0.699 -3.633 1.00 . A A . 26 LYS CD 1 1 4 2510 1 1 26 LYS CE C 10.482 -1.474 -4.922 1.00 . A A . 26 LYS CE 1 1 4 2511 1 1 26 LYS CG C 10.042 0.667 -3.688 1.00 . A A . 26 LYS CG 1 1 4 2512 1 1 26 LYS H H 8.953 2.834 -3.233 1.00 . A A . 26 LYS H 1 1 4 2513 1 1 26 LYS HA H 10.442 3.532 -5.554 1.00 . A A . 26 LYS HA 1 1 4 2514 1 1 26 LYS HB2 H 11.070 1.027 -5.505 1.00 . A A . 26 LYS HB2 1 1 4 2515 1 1 26 LYS HB3 H 11.582 2.043 -4.165 1.00 . A A . 26 LYS HB3 1 1 4 2516 1 1 26 LYS HD2 H 11.763 -0.570 -3.476 1.00 . A A . 26 LYS HD2 1 1 4 2517 1 1 26 LYS HD3 H 10.279 -1.258 -2.811 1.00 . A A . 26 LYS HD3 1 1 4 2518 1 1 26 LYS HE2 H 9.446 -1.381 -5.212 1.00 . A A . 26 LYS HE2 1 1 4 2519 1 1 26 LYS HE3 H 11.111 -1.052 -5.693 1.00 . A A . 26 LYS HE3 1 1 4 2520 1 1 26 LYS HG2 H 10.074 1.106 -2.702 1.00 . A A . 26 LYS HG2 1 1 4 2521 1 1 26 LYS HG3 H 9.012 0.545 -3.992 1.00 . A A . 26 LYS HG3 1 1 4 2522 1 1 26 LYS HZ1 H 11.561 -3.032 -4.052 1.00 . A A . 26 LYS HZ1 1 1 4 2523 1 1 26 LYS HZ2 H 11.140 -3.308 -5.666 1.00 . A A . 26 LYS HZ2 1 1 4 2524 1 1 26 LYS HZ3 H 9.966 -3.443 -4.451 1.00 . A A . 26 LYS HZ3 1 1 4 2525 1 1 26 LYS N N 8.997 3.294 -4.100 1.00 . A A . 26 LYS N 1 1 4 2526 1 1 26 LYS NZ N 10.813 -2.914 -4.762 1.00 . A A . 26 LYS NZ 1 1 4 2527 1 1 26 LYS O O 9.348 2.204 -7.466 1.00 . A A . 26 LYS O 1 1 4 2528 1 1 27 ALA C C 6.020 2.510 -7.624 1.00 . A A . 27 ALA C 1 1 4 2529 1 1 27 ALA CA C 6.763 1.341 -6.966 1.00 . A A . 27 ALA CA 1 1 4 2530 1 1 27 ALA CB C 5.779 0.370 -6.326 1.00 . A A . 27 ALA CB 1 1 4 2531 1 1 27 ALA H H 7.432 1.877 -5.030 1.00 . A A . 27 ALA H 1 1 4 2532 1 1 27 ALA HA H 7.319 0.808 -7.724 1.00 . A A . 27 ALA HA 1 1 4 2533 1 1 27 ALA HB1 H 4.778 0.594 -6.666 1.00 . A A . 27 ALA HB1 1 1 4 2534 1 1 27 ALA HB2 H 5.824 0.467 -5.251 1.00 . A A . 27 ALA HB2 1 1 4 2535 1 1 27 ALA HB3 H 6.037 -0.640 -6.607 1.00 . A A . 27 ALA HB3 1 1 4 2536 1 1 27 ALA N N 7.710 1.828 -5.971 1.00 . A A . 27 ALA N 1 1 4 2537 1 1 27 ALA O O 5.045 2.314 -8.353 1.00 . A A . 27 ALA O 1 1 4 2538 1 1 28 LYS C C 4.492 5.176 -7.373 1.00 . A A . 28 LYS C 1 1 4 2539 1 1 28 LYS CA C 5.923 4.954 -7.888 1.00 . A A . 28 LYS CA 1 1 4 2540 1 1 28 LYS CB C 6.009 4.984 -9.431 1.00 . A A . 28 LYS CB 1 1 4 2541 1 1 28 LYS CD C 5.622 7.509 -9.419 1.00 . A A . 28 LYS CD 1 1 4 2542 1 1 28 LYS CE C 4.670 8.607 -9.898 1.00 . A A . 28 LYS CE 1 1 4 2543 1 1 28 LYS CG C 5.315 6.177 -10.101 1.00 . A A . 28 LYS CG 1 1 4 2544 1 1 28 LYS H H 7.282 3.795 -6.760 1.00 . A A . 28 LYS H 1 1 4 2545 1 1 28 LYS HA H 6.532 5.764 -7.507 1.00 . A A . 28 LYS HA 1 1 4 2546 1 1 28 LYS HB2 H 7.050 5.003 -9.715 1.00 . A A . 28 LYS HB2 1 1 4 2547 1 1 28 LYS HB3 H 5.563 4.078 -9.815 1.00 . A A . 28 LYS HB3 1 1 4 2548 1 1 28 LYS HD2 H 5.521 7.391 -8.349 1.00 . A A . 28 LYS HD2 1 1 4 2549 1 1 28 LYS HD3 H 6.636 7.795 -9.658 1.00 . A A . 28 LYS HD3 1 1 4 2550 1 1 28 LYS HE2 H 4.977 8.927 -10.884 1.00 . A A . 28 LYS HE2 1 1 4 2551 1 1 28 LYS HE3 H 3.669 8.203 -9.949 1.00 . A A . 28 LYS HE3 1 1 4 2552 1 1 28 LYS HG2 H 5.645 6.235 -11.127 1.00 . A A . 28 LYS HG2 1 1 4 2553 1 1 28 LYS HG3 H 4.248 6.011 -10.077 1.00 . A A . 28 LYS HG3 1 1 4 2554 1 1 28 LYS HZ1 H 5.069 10.612 -9.491 1.00 . A A . 28 LYS HZ1 1 1 4 2555 1 1 28 LYS HZ2 H 5.211 9.599 -8.148 1.00 . A A . 28 LYS HZ2 1 1 4 2556 1 1 28 LYS HZ3 H 3.672 10.024 -8.727 1.00 . A A . 28 LYS HZ3 1 1 4 2557 1 1 28 LYS N N 6.501 3.724 -7.352 1.00 . A A . 28 LYS N 1 1 4 2558 1 1 28 LYS NZ N 4.661 9.791 -9.003 1.00 . A A . 28 LYS NZ 1 1 4 2559 1 1 28 LYS O O 3.524 5.243 -8.133 1.00 . A A . 28 LYS O 1 1 4 2560 1 1 29 PHE C C 3.276 6.733 -4.440 1.00 . A A . 29 PHE C 1 1 4 2561 1 1 29 PHE CA C 3.094 5.585 -5.421 1.00 . A A . 29 PHE CA 1 1 4 2562 1 1 29 PHE CB C 2.513 4.356 -4.707 1.00 . A A . 29 PHE CB 1 1 4 2563 1 1 29 PHE CD1 C 2.818 2.369 -6.219 1.00 . A A . 29 PHE CD1 1 1 4 2564 1 1 29 PHE CD2 C 0.621 3.247 -5.942 1.00 . A A . 29 PHE CD2 1 1 4 2565 1 1 29 PHE CE1 C 2.325 1.400 -7.072 1.00 . A A . 29 PHE CE1 1 1 4 2566 1 1 29 PHE CE2 C 0.123 2.279 -6.796 1.00 . A A . 29 PHE CE2 1 1 4 2567 1 1 29 PHE CG C 1.975 3.301 -5.640 1.00 . A A . 29 PHE CG 1 1 4 2568 1 1 29 PHE CZ C 0.978 1.357 -7.364 1.00 . A A . 29 PHE CZ 1 1 4 2569 1 1 29 PHE H H 5.186 5.269 -5.507 1.00 . A A . 29 PHE H 1 1 4 2570 1 1 29 PHE HA H 2.404 5.903 -6.192 1.00 . A A . 29 PHE HA 1 1 4 2571 1 1 29 PHE HB2 H 3.284 3.902 -4.106 1.00 . A A . 29 PHE HB2 1 1 4 2572 1 1 29 PHE HB3 H 1.702 4.674 -4.060 1.00 . A A . 29 PHE HB3 1 1 4 2573 1 1 29 PHE HD1 H 3.872 2.400 -5.993 1.00 . A A . 29 PHE HD1 1 1 4 2574 1 1 29 PHE HD2 H -0.051 3.969 -5.500 1.00 . A A . 29 PHE HD2 1 1 4 2575 1 1 29 PHE HE1 H 2.996 0.679 -7.516 1.00 . A A . 29 PHE HE1 1 1 4 2576 1 1 29 PHE HE2 H -0.934 2.248 -7.022 1.00 . A A . 29 PHE HE2 1 1 4 2577 1 1 29 PHE HZ H 0.591 0.600 -8.031 1.00 . A A . 29 PHE HZ 1 1 4 2578 1 1 29 PHE N N 4.376 5.319 -6.065 1.00 . A A . 29 PHE N 1 1 4 2579 1 1 29 PHE O O 4.356 6.903 -3.877 1.00 . A A . 29 PHE O 1 1 4 2580 1 1 30 SER C C 2.489 8.292 -1.928 1.00 . A A . 30 SER C 1 1 4 2581 1 1 30 SER CA C 2.287 8.693 -3.385 1.00 . A A . 30 SER CA 1 1 4 2582 1 1 30 SER CB C 0.984 9.485 -3.512 1.00 . A A . 30 SER CB 1 1 4 2583 1 1 30 SER H H 1.409 7.362 -4.765 1.00 . A A . 30 SER H 1 1 4 2584 1 1 30 SER HA H 3.108 9.316 -3.693 1.00 . A A . 30 SER HA 1 1 4 2585 1 1 30 SER HB2 H 0.198 8.963 -2.987 1.00 . A A . 30 SER HB2 1 1 4 2586 1 1 30 SER HB3 H 1.116 10.469 -3.083 1.00 . A A . 30 SER HB3 1 1 4 2587 1 1 30 SER HG H 1.341 9.974 -5.377 1.00 . A A . 30 SER HG 1 1 4 2588 1 1 30 SER N N 2.237 7.535 -4.267 1.00 . A A . 30 SER N 1 1 4 2589 1 1 30 SER O O 3.344 8.850 -1.230 1.00 . A A . 30 SER O 1 1 4 2590 1 1 30 SER OG O 0.602 9.627 -4.868 1.00 . A A . 30 SER OG 1 1 4 2591 1 1 31 ASP C C 1.115 5.508 0.039 1.00 . A A . 31 ASP C 1 1 4 2592 1 1 31 ASP CA C 1.757 6.881 -0.097 1.00 . A A . 31 ASP CA 1 1 4 2593 1 1 31 ASP CB C 1.059 7.901 0.812 1.00 . A A . 31 ASP CB 1 1 4 2594 1 1 31 ASP CG C 1.040 7.500 2.269 1.00 . A A . 31 ASP CG 1 1 4 2595 1 1 31 ASP H H 1.028 6.939 -2.082 1.00 . A A . 31 ASP H 1 1 4 2596 1 1 31 ASP HA H 2.796 6.811 0.186 1.00 . A A . 31 ASP HA 1 1 4 2597 1 1 31 ASP HB2 H 1.574 8.845 0.733 1.00 . A A . 31 ASP HB2 1 1 4 2598 1 1 31 ASP HB3 H 0.040 8.026 0.479 1.00 . A A . 31 ASP HB3 1 1 4 2599 1 1 31 ASP N N 1.692 7.338 -1.474 1.00 . A A . 31 ASP N 1 1 4 2600 1 1 31 ASP O O 0.077 5.226 -0.569 1.00 . A A . 31 ASP O 1 1 4 2601 1 1 31 ASP OD1 O 0.280 6.576 2.635 1.00 . A A . 31 ASP OD1 1 1 4 2602 1 1 31 ASP OD2 O 1.795 8.104 3.062 1.00 . A A . 31 ASP OD2 1 1 4 2603 1 1 32 GLY C C 0.603 3.160 2.409 1.00 . A A . 32 GLY C 1 1 4 2604 1 1 32 GLY CA C 1.240 3.322 1.050 1.00 . A A . 32 GLY CA 1 1 4 2605 1 1 32 GLY H H 2.557 4.954 1.286 1.00 . A A . 32 GLY H 1 1 4 2606 1 1 32 GLY HA2 H 0.500 3.100 0.290 1.00 . A A . 32 GLY HA2 1 1 4 2607 1 1 32 GLY HA3 H 2.055 2.620 0.961 1.00 . A A . 32 GLY HA3 1 1 4 2608 1 1 32 GLY N N 1.743 4.661 0.834 1.00 . A A . 32 GLY N 1 1 4 2609 1 1 32 GLY O O 1.086 3.703 3.401 1.00 . A A . 32 GLY O 1 1 4 2610 1 1 33 HIS C C -1.344 0.662 3.934 1.00 . A A . 33 HIS C 1 1 4 2611 1 1 33 HIS CA C -1.194 2.157 3.695 1.00 . A A . 33 HIS CA 1 1 4 2612 1 1 33 HIS CB C -2.574 2.832 3.683 1.00 . A A . 33 HIS CB 1 1 4 2613 1 1 33 HIS CD2 C -4.514 1.825 2.275 1.00 . A A . 33 HIS CD2 1 1 4 2614 1 1 33 HIS CE1 C -3.940 2.631 0.319 1.00 . A A . 33 HIS CE1 1 1 4 2615 1 1 33 HIS CG C -3.387 2.556 2.450 1.00 . A A . 33 HIS CG 1 1 4 2616 1 1 33 HIS H H -0.803 1.988 1.622 1.00 . A A . 33 HIS H 1 1 4 2617 1 1 33 HIS HA H -0.609 2.579 4.500 1.00 . A A . 33 HIS HA 1 1 4 2618 1 1 33 HIS HB2 H -3.140 2.480 4.531 1.00 . A A . 33 HIS HB2 1 1 4 2619 1 1 33 HIS HB3 H -2.443 3.899 3.764 1.00 . A A . 33 HIS HB3 1 1 4 2620 1 1 33 HIS HD1 H -2.287 3.622 0.998 1.00 . A A . 33 HIS HD1 1 1 4 2621 1 1 33 HIS HD2 H -5.054 1.285 3.039 1.00 . A A . 33 HIS HD2 1 1 4 2622 1 1 33 HIS HE1 H -3.924 2.846 -0.738 1.00 . A A . 33 HIS HE1 1 1 4 2623 1 1 33 HIS N N -0.479 2.405 2.454 1.00 . A A . 33 HIS N 1 1 4 2624 1 1 33 HIS ND1 N -3.057 3.047 1.204 1.00 . A A . 33 HIS ND1 1 1 4 2625 1 1 33 HIS NE2 N -4.837 1.889 0.940 1.00 . A A . 33 HIS NE2 1 1 4 2626 1 1 33 HIS O O -1.755 -0.084 3.043 1.00 . A A . 33 HIS O 1 1 4 2627 1 1 34 CYS C C -2.546 -1.637 5.550 1.00 . A A . 34 CYS C 1 1 4 2628 1 1 34 CYS CA C -1.099 -1.167 5.507 1.00 . A A . 34 CYS CA 1 1 4 2629 1 1 34 CYS CB C -0.432 -1.397 6.861 1.00 . A A . 34 CYS CB 1 1 4 2630 1 1 34 CYS H H -0.691 0.881 5.800 1.00 . A A . 34 CYS H 1 1 4 2631 1 1 34 CYS HA H -0.573 -1.740 4.760 1.00 . A A . 34 CYS HA 1 1 4 2632 1 1 34 CYS HB2 H -0.883 -0.742 7.593 1.00 . A A . 34 CYS HB2 1 1 4 2633 1 1 34 CYS HB3 H -0.582 -2.424 7.161 1.00 . A A . 34 CYS HB3 1 1 4 2634 1 1 34 CYS N N -1.009 0.236 5.137 1.00 . A A . 34 CYS N 1 1 4 2635 1 1 34 CYS O O -3.434 -0.927 6.025 1.00 . A A . 34 CYS O 1 1 4 2636 1 1 34 CYS SG S 1.358 -1.079 6.859 1.00 . A A . 34 CYS SG 1 1 4 2637 1 1 35 SER C C -4.488 -3.841 6.454 1.00 . A A . 35 SER C 1 1 4 2638 1 1 35 SER CA C -4.094 -3.435 5.038 1.00 . A A . 35 SER CA 1 1 4 2639 1 1 35 SER CB C -4.114 -4.648 4.102 1.00 . A A . 35 SER CB 1 1 4 2640 1 1 35 SER H H -2.011 -3.354 4.701 1.00 . A A . 35 SER H 1 1 4 2641 1 1 35 SER HA H -4.791 -2.693 4.676 1.00 . A A . 35 SER HA 1 1 4 2642 1 1 35 SER HB2 H -3.797 -4.342 3.117 1.00 . A A . 35 SER HB2 1 1 4 2643 1 1 35 SER HB3 H -3.435 -5.400 4.479 1.00 . A A . 35 SER HB3 1 1 4 2644 1 1 35 SER HG H -5.885 -4.800 3.273 1.00 . A A . 35 SER HG 1 1 4 2645 1 1 35 SER N N -2.768 -2.843 5.055 1.00 . A A . 35 SER N 1 1 4 2646 1 1 35 SER O O -3.632 -4.181 7.265 1.00 . A A . 35 SER O 1 1 4 2647 1 1 35 SER OG O -5.410 -5.214 4.003 1.00 . A A . 35 SER OG 1 1 4 2648 1 1 36 LYS C C -6.581 -5.638 8.154 1.00 . A A . 36 LYS C 1 1 4 2649 1 1 36 LYS CA C -6.258 -4.148 8.077 1.00 . A A . 36 LYS CA 1 1 4 2650 1 1 36 LYS CB C -7.494 -3.315 8.435 1.00 . A A . 36 LYS CB 1 1 4 2651 1 1 36 LYS CD C -9.241 -2.727 10.158 1.00 . A A . 36 LYS CD 1 1 4 2652 1 1 36 LYS CE C -8.759 -1.294 10.338 1.00 . A A . 36 LYS CE 1 1 4 2653 1 1 36 LYS CG C -8.098 -3.662 9.788 1.00 . A A . 36 LYS CG 1 1 4 2654 1 1 36 LYS H H -6.413 -3.498 6.071 1.00 . A A . 36 LYS H 1 1 4 2655 1 1 36 LYS HA H -5.471 -3.928 8.784 1.00 . A A . 36 LYS HA 1 1 4 2656 1 1 36 LYS HB2 H -7.221 -2.271 8.447 1.00 . A A . 36 LYS HB2 1 1 4 2657 1 1 36 LYS HB3 H -8.250 -3.471 7.679 1.00 . A A . 36 LYS HB3 1 1 4 2658 1 1 36 LYS HD2 H -9.980 -2.751 9.371 1.00 . A A . 36 LYS HD2 1 1 4 2659 1 1 36 LYS HD3 H -9.685 -3.068 11.082 1.00 . A A . 36 LYS HD3 1 1 4 2660 1 1 36 LYS HE2 H -7.999 -1.277 11.106 1.00 . A A . 36 LYS HE2 1 1 4 2661 1 1 36 LYS HE3 H -8.335 -0.952 9.406 1.00 . A A . 36 LYS HE3 1 1 4 2662 1 1 36 LYS HG2 H -8.475 -4.674 9.751 1.00 . A A . 36 LYS HG2 1 1 4 2663 1 1 36 LYS HG3 H -7.328 -3.592 10.543 1.00 . A A . 36 LYS HG3 1 1 4 2664 1 1 36 LYS HZ1 H -10.774 -0.891 10.714 1.00 . A A . 36 LYS HZ1 1 1 4 2665 1 1 36 LYS HZ2 H -9.920 0.421 10.074 1.00 . A A . 36 LYS HZ2 1 1 4 2666 1 1 36 LYS HZ3 H -9.705 -0.016 11.693 1.00 . A A . 36 LYS HZ3 1 1 4 2667 1 1 36 LYS N N -5.775 -3.788 6.753 1.00 . A A . 36 LYS N 1 1 4 2668 1 1 36 LYS NZ N -9.867 -0.381 10.732 1.00 . A A . 36 LYS NZ 1 1 4 2669 1 1 36 LYS O O -6.348 -6.278 9.173 1.00 . A A . 36 LYS O 1 1 4 2670 1 1 37 ILE C C -6.323 -8.517 7.033 1.00 . A A . 37 ILE C 1 1 4 2671 1 1 37 ILE CA C -7.532 -7.577 7.017 1.00 . A A . 37 ILE CA 1 1 4 2672 1 1 37 ILE CB C -8.370 -7.861 5.752 1.00 . A A . 37 ILE CB 1 1 4 2673 1 1 37 ILE CD1 C -10.287 -6.962 4.335 1.00 . A A . 37 ILE CD1 1 1 4 2674 1 1 37 ILE CG1 C -9.531 -6.869 5.644 1.00 . A A . 37 ILE CG1 1 1 4 2675 1 1 37 ILE CG2 C -8.891 -9.293 5.764 1.00 . A A . 37 ILE CG2 1 1 4 2676 1 1 37 ILE H H -7.318 -5.598 6.302 1.00 . A A . 37 ILE H 1 1 4 2677 1 1 37 ILE HA H -8.146 -7.784 7.881 1.00 . A A . 37 ILE HA 1 1 4 2678 1 1 37 ILE HB H -7.728 -7.744 4.893 1.00 . A A . 37 ILE HB 1 1 4 2679 1 1 37 ILE HD11 H -11.036 -7.736 4.405 1.00 . A A . 37 ILE HD11 1 1 4 2680 1 1 37 ILE HD12 H -9.596 -7.200 3.537 1.00 . A A . 37 ILE HD12 1 1 4 2681 1 1 37 ILE HD13 H -10.764 -6.016 4.126 1.00 . A A . 37 ILE HD13 1 1 4 2682 1 1 37 ILE HG12 H -10.232 -7.054 6.444 1.00 . A A . 37 ILE HG12 1 1 4 2683 1 1 37 ILE HG13 H -9.147 -5.863 5.735 1.00 . A A . 37 ILE HG13 1 1 4 2684 1 1 37 ILE HG21 H -8.062 -9.977 5.869 1.00 . A A . 37 ILE HG21 1 1 4 2685 1 1 37 ILE HG22 H -9.409 -9.495 4.838 1.00 . A A . 37 ILE HG22 1 1 4 2686 1 1 37 ILE HG23 H -9.572 -9.421 6.593 1.00 . A A . 37 ILE HG23 1 1 4 2687 1 1 37 ILE N N -7.143 -6.169 7.074 1.00 . A A . 37 ILE N 1 1 4 2688 1 1 37 ILE O O -6.073 -9.201 8.020 1.00 . A A . 37 ILE O 1 1 4 2689 1 1 38 LEU C C -3.175 -8.753 6.350 1.00 . A A . 38 LEU C 1 1 4 2690 1 1 38 LEU CA C -4.426 -9.437 5.813 1.00 . A A . 38 LEU CA 1 1 4 2691 1 1 38 LEU CB C -4.213 -9.855 4.357 1.00 . A A . 38 LEU CB 1 1 4 2692 1 1 38 LEU CD1 C -3.630 -12.211 4.996 1.00 . A A . 38 LEU CD1 1 1 4 2693 1 1 38 LEU CD2 C -3.148 -11.392 2.689 1.00 . A A . 38 LEU CD2 1 1 4 2694 1 1 38 LEU CG C -3.228 -11.007 4.156 1.00 . A A . 38 LEU CG 1 1 4 2695 1 1 38 LEU H H -5.846 -8.006 5.162 1.00 . A A . 38 LEU H 1 1 4 2696 1 1 38 LEU HA H -4.621 -10.319 6.405 1.00 . A A . 38 LEU HA 1 1 4 2697 1 1 38 LEU HB2 H -5.165 -10.141 3.941 1.00 . A A . 38 LEU HB2 1 1 4 2698 1 1 38 LEU HB3 H -3.845 -9.000 3.810 1.00 . A A . 38 LEU HB3 1 1 4 2699 1 1 38 LEU HD11 H -3.606 -11.944 6.042 1.00 . A A . 38 LEU HD11 1 1 4 2700 1 1 38 LEU HD12 H -2.941 -13.023 4.816 1.00 . A A . 38 LEU HD12 1 1 4 2701 1 1 38 LEU HD13 H -4.629 -12.520 4.726 1.00 . A A . 38 LEU HD13 1 1 4 2702 1 1 38 LEU HD21 H -2.937 -10.513 2.097 1.00 . A A . 38 LEU HD21 1 1 4 2703 1 1 38 LEU HD22 H -4.090 -11.818 2.377 1.00 . A A . 38 LEU HD22 1 1 4 2704 1 1 38 LEU HD23 H -2.361 -12.118 2.550 1.00 . A A . 38 LEU HD23 1 1 4 2705 1 1 38 LEU HG H -2.247 -10.687 4.475 1.00 . A A . 38 LEU HG 1 1 4 2706 1 1 38 LEU N N -5.590 -8.560 5.925 1.00 . A A . 38 LEU N 1 1 4 2707 1 1 38 LEU O O -2.128 -9.377 6.510 1.00 . A A . 38 LEU O 1 1 4 2708 1 1 39 ARG C C -1.073 -6.518 6.139 1.00 . A A . 39 ARG C 1 1 4 2709 1 1 39 ARG CA C -2.225 -6.641 7.144 1.00 . A A . 39 ARG CA 1 1 4 2710 1 1 39 ARG CB C -1.732 -7.188 8.492 1.00 . A A . 39 ARG CB 1 1 4 2711 1 1 39 ARG CD C -1.704 -4.965 9.680 1.00 . A A . 39 ARG CD 1 1 4 2712 1 1 39 ARG CG C -0.897 -6.199 9.295 1.00 . A A . 39 ARG CG 1 1 4 2713 1 1 39 ARG CZ C -0.421 -4.122 11.632 1.00 . A A . 39 ARG CZ 1 1 4 2714 1 1 39 ARG H H -4.179 -7.049 6.464 1.00 . A A . 39 ARG H 1 1 4 2715 1 1 39 ARG HA H -2.629 -5.652 7.307 1.00 . A A . 39 ARG HA 1 1 4 2716 1 1 39 ARG HB2 H -2.590 -7.463 9.088 1.00 . A A . 39 ARG HB2 1 1 4 2717 1 1 39 ARG HB3 H -1.134 -8.068 8.313 1.00 . A A . 39 ARG HB3 1 1 4 2718 1 1 39 ARG HD2 H -2.099 -4.516 8.781 1.00 . A A . 39 ARG HD2 1 1 4 2719 1 1 39 ARG HD3 H -2.521 -5.271 10.316 1.00 . A A . 39 ARG HD3 1 1 4 2720 1 1 39 ARG HE H -0.683 -3.143 9.905 1.00 . A A . 39 ARG HE 1 1 4 2721 1 1 39 ARG HG2 H -0.549 -6.683 10.194 1.00 . A A . 39 ARG HG2 1 1 4 2722 1 1 39 ARG HG3 H -0.051 -5.892 8.697 1.00 . A A . 39 ARG HG3 1 1 4 2723 1 1 39 ARG HH11 H -1.277 -5.936 11.927 1.00 . A A . 39 ARG HH11 1 1 4 2724 1 1 39 ARG HH12 H -0.346 -5.334 13.257 1.00 . A A . 39 ARG HH12 1 1 4 2725 1 1 39 ARG HH21 H 0.542 -2.337 11.658 1.00 . A A . 39 ARG HH21 1 1 4 2726 1 1 39 ARG HH22 H 0.694 -3.278 13.103 1.00 . A A . 39 ARG HH22 1 1 4 2727 1 1 39 ARG N N -3.310 -7.463 6.618 1.00 . A A . 39 ARG N 1 1 4 2728 1 1 39 ARG NE N -0.896 -3.968 10.391 1.00 . A A . 39 ARG NE 1 1 4 2729 1 1 39 ARG NH1 N -0.705 -5.218 12.331 1.00 . A A . 39 ARG NH1 1 1 4 2730 1 1 39 ARG NH2 N 0.330 -3.168 12.177 1.00 . A A . 39 ARG NH2 1 1 4 2731 1 1 39 ARG O O 0.091 -6.403 6.519 1.00 . A A . 39 ARG O 1 1 4 2732 1 1 40 ARG C C -0.075 -4.869 3.594 1.00 . A A . 40 ARG C 1 1 4 2733 1 1 40 ARG CA C -0.392 -6.354 3.809 1.00 . A A . 40 ARG CA 1 1 4 2734 1 1 40 ARG CB C -0.840 -7.000 2.493 1.00 . A A . 40 ARG CB 1 1 4 2735 1 1 40 ARG CD C -0.980 -9.071 1.083 1.00 . A A . 40 ARG CD 1 1 4 2736 1 1 40 ARG CG C -0.729 -8.519 2.478 1.00 . A A . 40 ARG CG 1 1 4 2737 1 1 40 ARG CZ C -2.628 -8.580 -0.690 1.00 . A A . 40 ARG CZ 1 1 4 2738 1 1 40 ARG H H -2.350 -6.583 4.599 1.00 . A A . 40 ARG H 1 1 4 2739 1 1 40 ARG HA H 0.506 -6.849 4.153 1.00 . A A . 40 ARG HA 1 1 4 2740 1 1 40 ARG HB2 H -1.870 -6.735 2.310 1.00 . A A . 40 ARG HB2 1 1 4 2741 1 1 40 ARG HB3 H -0.230 -6.609 1.692 1.00 . A A . 40 ARG HB3 1 1 4 2742 1 1 40 ARG HD2 H -0.251 -8.650 0.406 1.00 . A A . 40 ARG HD2 1 1 4 2743 1 1 40 ARG HD3 H -0.869 -10.145 1.109 1.00 . A A . 40 ARG HD3 1 1 4 2744 1 1 40 ARG HE H -3.030 -8.640 1.270 1.00 . A A . 40 ARG HE 1 1 4 2745 1 1 40 ARG HG2 H 0.265 -8.801 2.793 1.00 . A A . 40 ARG HG2 1 1 4 2746 1 1 40 ARG HG3 H -1.458 -8.933 3.159 1.00 . A A . 40 ARG HG3 1 1 4 2747 1 1 40 ARG HH11 H -0.762 -8.988 -1.383 1.00 . A A . 40 ARG HH11 1 1 4 2748 1 1 40 ARG HH12 H -1.940 -8.595 -2.599 1.00 . A A . 40 ARG HH12 1 1 4 2749 1 1 40 ARG HH21 H -4.586 -8.174 -0.361 1.00 . A A . 40 ARG HH21 1 1 4 2750 1 1 40 ARG HH22 H -4.082 -8.103 -2.026 1.00 . A A . 40 ARG HH22 1 1 4 2751 1 1 40 ARG N N -1.407 -6.508 4.849 1.00 . A A . 40 ARG N 1 1 4 2752 1 1 40 ARG NE N -2.323 -8.744 0.598 1.00 . A A . 40 ARG NE 1 1 4 2753 1 1 40 ARG NH1 N -1.702 -8.739 -1.630 1.00 . A A . 40 ARG NH1 1 1 4 2754 1 1 40 ARG NH2 N -3.869 -8.276 -1.046 1.00 . A A . 40 ARG NH2 1 1 4 2755 1 1 40 ARG O O -0.104 -4.082 4.539 1.00 . A A . 40 ARG O 1 1 4 2756 1 1 41 CYS C C -0.137 -2.644 0.755 1.00 . A A . 41 CYS C 1 1 4 2757 1 1 41 CYS CA C 0.538 -3.091 2.047 1.00 . A A . 41 CYS CA 1 1 4 2758 1 1 41 CYS CB C 2.057 -2.926 1.936 1.00 . A A . 41 CYS CB 1 1 4 2759 1 1 41 CYS H H 0.221 -5.143 1.633 1.00 . A A . 41 CYS H 1 1 4 2760 1 1 41 CYS HA H 0.177 -2.478 2.859 1.00 . A A . 41 CYS HA 1 1 4 2761 1 1 41 CYS HB2 H 2.488 -2.993 2.923 1.00 . A A . 41 CYS HB2 1 1 4 2762 1 1 41 CYS HB3 H 2.451 -3.728 1.326 1.00 . A A . 41 CYS HB3 1 1 4 2763 1 1 41 CYS N N 0.217 -4.483 2.357 1.00 . A A . 41 CYS N 1 1 4 2764 1 1 41 CYS O O 0.185 -3.134 -0.327 1.00 . A A . 41 CYS O 1 1 4 2765 1 1 41 CYS SG S 2.612 -1.354 1.204 1.00 . A A . 41 CYS SG 1 1 4 2766 1 1 42 LEU C C -1.203 0.194 -0.642 1.00 . A A . 42 LEU C 1 1 4 2767 1 1 42 LEU CA C -1.788 -1.155 -0.259 1.00 . A A . 42 LEU CA 1 1 4 2768 1 1 42 LEU CB C -3.277 -1.006 0.072 1.00 . A A . 42 LEU CB 1 1 4 2769 1 1 42 LEU CD1 C -3.743 -3.421 0.616 1.00 . A A . 42 LEU CD1 1 1 4 2770 1 1 42 LEU CD2 C -5.617 -1.895 -0.015 1.00 . A A . 42 LEU CD2 1 1 4 2771 1 1 42 LEU CG C -4.150 -2.228 -0.234 1.00 . A A . 42 LEU CG 1 1 4 2772 1 1 42 LEU H H -1.259 -1.339 1.778 1.00 . A A . 42 LEU H 1 1 4 2773 1 1 42 LEU HA H -1.672 -1.837 -1.087 1.00 . A A . 42 LEU HA 1 1 4 2774 1 1 42 LEU HB2 H -3.364 -0.787 1.127 1.00 . A A . 42 LEU HB2 1 1 4 2775 1 1 42 LEU HB3 H -3.667 -0.162 -0.481 1.00 . A A . 42 LEU HB3 1 1 4 2776 1 1 42 LEU HD11 H -2.690 -3.355 0.849 1.00 . A A . 42 LEU HD11 1 1 4 2777 1 1 42 LEU HD12 H -3.934 -4.333 0.071 1.00 . A A . 42 LEU HD12 1 1 4 2778 1 1 42 LEU HD13 H -4.315 -3.423 1.533 1.00 . A A . 42 LEU HD13 1 1 4 2779 1 1 42 LEU HD21 H -6.201 -2.292 -0.831 1.00 . A A . 42 LEU HD21 1 1 4 2780 1 1 42 LEU HD22 H -5.741 -0.824 0.029 1.00 . A A . 42 LEU HD22 1 1 4 2781 1 1 42 LEU HD23 H -5.951 -2.335 0.914 1.00 . A A . 42 LEU HD23 1 1 4 2782 1 1 42 LEU HG H -4.022 -2.500 -1.271 1.00 . A A . 42 LEU HG 1 1 4 2783 1 1 42 LEU N N -1.064 -1.699 0.882 1.00 . A A . 42 LEU N 1 1 4 2784 1 1 42 LEU O O -1.097 1.090 0.193 1.00 . A A . 42 LEU O 1 1 4 2785 1 1 43 CYS C C -1.225 2.436 -3.103 1.00 . A A . 43 CYS C 1 1 4 2786 1 1 43 CYS CA C -0.218 1.570 -2.360 1.00 . A A . 43 CYS CA 1 1 4 2787 1 1 43 CYS CB C 0.964 1.253 -3.267 1.00 . A A . 43 CYS CB 1 1 4 2788 1 1 43 CYS H H -0.911 -0.419 -2.518 1.00 . A A . 43 CYS H 1 1 4 2789 1 1 43 CYS HA H 0.140 2.112 -1.500 1.00 . A A . 43 CYS HA 1 1 4 2790 1 1 43 CYS HB2 H 0.607 0.760 -4.158 1.00 . A A . 43 CYS HB2 1 1 4 2791 1 1 43 CYS HB3 H 1.451 2.176 -3.542 1.00 . A A . 43 CYS HB3 1 1 4 2792 1 1 43 CYS N N -0.813 0.334 -1.890 1.00 . A A . 43 CYS N 1 1 4 2793 1 1 43 CYS O O -2.002 1.941 -3.917 1.00 . A A . 43 CYS O 1 1 4 2794 1 1 43 CYS SG S 2.212 0.185 -2.496 1.00 . A A . 43 CYS SG 1 1 4 2795 1 1 44 THR C C -1.259 5.765 -4.170 1.00 . A A . 44 THR C 1 1 4 2796 1 1 44 THR CA C -2.075 4.679 -3.483 1.00 . A A . 44 THR CA 1 1 4 2797 1 1 44 THR CB C -3.039 5.334 -2.484 1.00 . A A . 44 THR CB 1 1 4 2798 1 1 44 THR CG2 C -4.466 4.854 -2.708 1.00 . A A . 44 THR CG2 1 1 4 2799 1 1 44 THR H H -0.536 4.065 -2.178 1.00 . A A . 44 THR H 1 1 4 2800 1 1 44 THR HA H -2.656 4.146 -4.224 1.00 . A A . 44 THR HA 1 1 4 2801 1 1 44 THR HB H -3.008 6.401 -2.642 1.00 . A A . 44 THR HB 1 1 4 2802 1 1 44 THR HG1 H -1.748 5.425 -0.979 1.00 . A A . 44 THR HG1 1 1 4 2803 1 1 44 THR HG21 H -4.868 4.468 -1.783 1.00 . A A . 44 THR HG21 1 1 4 2804 1 1 44 THR HG22 H -4.471 4.074 -3.456 1.00 . A A . 44 THR HG22 1 1 4 2805 1 1 44 THR HG23 H -5.075 5.680 -3.044 1.00 . A A . 44 THR HG23 1 1 4 2806 1 1 44 THR N N -1.190 3.730 -2.831 1.00 . A A . 44 THR N 1 1 4 2807 1 1 44 THR O O -0.217 6.178 -3.657 1.00 . A A . 44 THR O 1 1 4 2808 1 1 44 THR OG1 O -2.626 5.043 -1.138 1.00 . A A . 44 THR OG1 1 1 4 2809 1 1 45 LYS C C -1.917 7.951 -7.071 1.00 . A A . 45 LYS C 1 1 4 2810 1 1 45 LYS CA C -1.017 7.260 -6.068 1.00 . A A . 45 LYS CA 1 1 4 2811 1 1 45 LYS CB C 0.205 6.695 -6.799 1.00 . A A . 45 LYS CB 1 1 4 2812 1 1 45 LYS CD C 0.763 6.086 -9.157 1.00 . A A . 45 LYS CD 1 1 4 2813 1 1 45 LYS CE C 0.843 4.916 -10.121 1.00 . A A . 45 LYS CE 1 1 4 2814 1 1 45 LYS CG C -0.120 5.774 -7.961 1.00 . A A . 45 LYS CG 1 1 4 2815 1 1 45 LYS H H -2.561 5.854 -5.683 1.00 . A A . 45 LYS H 1 1 4 2816 1 1 45 LYS HA H -0.676 8.001 -5.362 1.00 . A A . 45 LYS HA 1 1 4 2817 1 1 45 LYS HB2 H 0.790 7.517 -7.180 1.00 . A A . 45 LYS HB2 1 1 4 2818 1 1 45 LYS HB3 H 0.804 6.142 -6.090 1.00 . A A . 45 LYS HB3 1 1 4 2819 1 1 45 LYS HD2 H 0.354 6.939 -9.677 1.00 . A A . 45 LYS HD2 1 1 4 2820 1 1 45 LYS HD3 H 1.759 6.321 -8.806 1.00 . A A . 45 LYS HD3 1 1 4 2821 1 1 45 LYS HE2 H -0.158 4.564 -10.327 1.00 . A A . 45 LYS HE2 1 1 4 2822 1 1 45 LYS HE3 H 1.302 5.252 -11.040 1.00 . A A . 45 LYS HE3 1 1 4 2823 1 1 45 LYS HG2 H 0.044 4.751 -7.659 1.00 . A A . 45 LYS HG2 1 1 4 2824 1 1 45 LYS HG3 H -1.153 5.909 -8.241 1.00 . A A . 45 LYS HG3 1 1 4 2825 1 1 45 LYS HZ1 H 1.021 3.054 -9.185 1.00 . A A . 45 LYS HZ1 1 1 4 2826 1 1 45 LYS HZ2 H 2.252 4.147 -8.784 1.00 . A A . 45 LYS HZ2 1 1 4 2827 1 1 45 LYS HZ3 H 2.255 3.385 -10.294 1.00 . A A . 45 LYS HZ3 1 1 4 2828 1 1 45 LYS N N -1.723 6.220 -5.324 1.00 . A A . 45 LYS N 1 1 4 2829 1 1 45 LYS NZ N 1.647 3.796 -9.559 1.00 . A A . 45 LYS NZ 1 1 4 2830 1 1 45 LYS O O -3.092 7.610 -7.228 1.00 . A A . 45 LYS O 1 1 4 2831 1 1 46 GLU C C -2.078 8.967 -10.081 1.00 . A A . 46 GLU C 1 1 4 2832 1 1 46 GLU CA C -1.991 9.717 -8.745 1.00 . A A . 46 GLU CA 1 1 4 2833 1 1 46 GLU CB C -1.223 11.039 -8.920 1.00 . A A . 46 GLU CB 1 1 4 2834 1 1 46 GLU CD C 1.291 10.467 -8.659 1.00 . A A . 46 GLU CD 1 1 4 2835 1 1 46 GLU CG C 0.153 10.905 -9.584 1.00 . A A . 46 GLU CG 1 1 4 2836 1 1 46 GLU H H -0.376 9.112 -7.545 1.00 . A A . 46 GLU H 1 1 4 2837 1 1 46 GLU HA H -2.987 9.933 -8.396 1.00 . A A . 46 GLU HA 1 1 4 2838 1 1 46 GLU HB2 H -1.820 11.705 -9.524 1.00 . A A . 46 GLU HB2 1 1 4 2839 1 1 46 GLU HB3 H -1.082 11.485 -7.946 1.00 . A A . 46 GLU HB3 1 1 4 2840 1 1 46 GLU HG2 H 0.073 10.181 -10.377 1.00 . A A . 46 GLU HG2 1 1 4 2841 1 1 46 GLU HG3 H 0.414 11.864 -10.006 1.00 . A A . 46 GLU HG3 1 1 4 2842 1 1 46 GLU N N -1.328 8.920 -7.739 1.00 . A A . 46 GLU N 1 1 4 2843 1 1 46 GLU O O -1.130 8.286 -10.481 1.00 . A A . 46 GLU O 1 1 4 2844 1 1 46 GLU OE1 O 1.171 9.425 -7.981 1.00 . A A . 46 GLU OE1 1 1 4 2845 1 1 46 GLU OE2 O 2.345 11.144 -8.651 1.00 . A A . 46 GLU OE2 1 1 4 2846 1 1 47 CYS C C -4.623 9.015 -12.746 1.00 . A A . 47 CYS C 1 1 4 2847 1 1 47 CYS CA C -3.388 8.449 -12.068 1.00 . A A . 47 CYS CA 1 1 4 2848 1 1 47 CYS CB C -3.492 6.924 -11.932 1.00 . A A . 47 CYS CB 1 1 4 2849 1 1 47 CYS H H -3.940 9.660 -10.420 1.00 . A A . 47 CYS H 1 1 4 2850 1 1 47 CYS HA H -2.527 8.683 -12.671 1.00 . A A . 47 CYS HA 1 1 4 2851 1 1 47 CYS HB2 H -3.525 6.487 -12.918 1.00 . A A . 47 CYS HB2 1 1 4 2852 1 1 47 CYS HB3 H -2.615 6.560 -11.416 1.00 . A A . 47 CYS HB3 1 1 4 2853 1 1 47 CYS N N -3.208 9.100 -10.774 1.00 . A A . 47 CYS N 1 1 4 2854 1 1 47 CYS O O -5.144 8.388 -13.683 1.00 . A A . 47 CYS O 1 1 4 2855 1 1 47 CYS OXT O -5.071 10.100 -12.314 1.00 . A A . 47 CYS OXT 1 1 4 2856 1 1 47 CYS SG S -4.953 6.326 -11.026 1.00 . A A . 47 CYS SG 1 1 5 2857 1 1 1 ALA C C -10.502 9.034 -6.844 1.00 . A A . 1 ALA C 1 1 5 2858 1 1 1 ALA CA C -11.652 9.378 -7.787 1.00 . A A . 1 ALA CA 1 1 5 2859 1 1 1 ALA CB C -11.820 10.887 -7.899 1.00 . A A . 1 ALA CB 1 1 5 2860 1 1 1 ALA H1 H -13.696 9.425 -7.424 1.00 . A A . 1 ALA H1 1 1 5 2861 1 1 1 ALA H2 H -12.821 8.495 -6.316 1.00 . A A . 1 ALA H2 1 1 5 2862 1 1 1 ALA H3 H -13.111 7.904 -7.876 1.00 . A A . 1 ALA H3 1 1 5 2863 1 1 1 ALA HA H -11.430 8.990 -8.771 1.00 . A A . 1 ALA HA 1 1 5 2864 1 1 1 ALA HB1 H -12.835 11.156 -7.643 1.00 . A A . 1 ALA HB1 1 1 5 2865 1 1 1 ALA HB2 H -11.610 11.199 -8.911 1.00 . A A . 1 ALA HB2 1 1 5 2866 1 1 1 ALA HB3 H -11.136 11.377 -7.221 1.00 . A A . 1 ALA HB3 1 1 5 2867 1 1 1 ALA N N -12.909 8.757 -7.318 1.00 . A A . 1 ALA N 1 1 5 2868 1 1 1 ALA O O -9.692 9.891 -6.492 1.00 . A A . 1 ALA O 1 1 5 2869 1 1 2 THR C C -9.111 5.840 -5.742 1.00 . A A . 2 THR C 1 1 5 2870 1 1 2 THR CA C -9.389 7.323 -5.527 1.00 . A A . 2 THR CA 1 1 5 2871 1 1 2 THR CB C -9.778 7.566 -4.053 1.00 . A A . 2 THR CB 1 1 5 2872 1 1 2 THR CG2 C -8.591 7.331 -3.129 1.00 . A A . 2 THR CG2 1 1 5 2873 1 1 2 THR H H -11.102 7.128 -6.737 1.00 . A A . 2 THR H 1 1 5 2874 1 1 2 THR HA H -8.493 7.886 -5.743 1.00 . A A . 2 THR HA 1 1 5 2875 1 1 2 THR HB H -10.568 6.879 -3.785 1.00 . A A . 2 THR HB 1 1 5 2876 1 1 2 THR HG1 H -9.727 9.502 -4.446 1.00 . A A . 2 THR HG1 1 1 5 2877 1 1 2 THR HG21 H -7.922 8.178 -3.179 1.00 . A A . 2 THR HG21 1 1 5 2878 1 1 2 THR HG22 H -8.065 6.439 -3.438 1.00 . A A . 2 THR HG22 1 1 5 2879 1 1 2 THR HG23 H -8.942 7.209 -2.115 1.00 . A A . 2 THR HG23 1 1 5 2880 1 1 2 THR N N -10.437 7.775 -6.428 1.00 . A A . 2 THR N 1 1 5 2881 1 1 2 THR O O -10.022 5.015 -5.669 1.00 . A A . 2 THR O 1 1 5 2882 1 1 2 THR OG1 O -10.250 8.911 -3.891 1.00 . A A . 2 THR OG1 1 1 5 2883 1 1 3 CYS C C -6.733 3.584 -5.008 1.00 . A A . 3 CYS C 1 1 5 2884 1 1 3 CYS CA C -7.454 4.137 -6.232 1.00 . A A . 3 CYS CA 1 1 5 2885 1 1 3 CYS CB C -6.563 4.044 -7.475 1.00 . A A . 3 CYS CB 1 1 5 2886 1 1 3 CYS H H -7.178 6.222 -6.054 1.00 . A A . 3 CYS H 1 1 5 2887 1 1 3 CYS HA H -8.348 3.554 -6.399 1.00 . A A . 3 CYS HA 1 1 5 2888 1 1 3 CYS HB2 H -5.912 4.908 -7.508 1.00 . A A . 3 CYS HB2 1 1 5 2889 1 1 3 CYS HB3 H -5.964 3.148 -7.416 1.00 . A A . 3 CYS HB3 1 1 5 2890 1 1 3 CYS N N -7.860 5.513 -6.007 1.00 . A A . 3 CYS N 1 1 5 2891 1 1 3 CYS O O -5.847 4.234 -4.449 1.00 . A A . 3 CYS O 1 1 5 2892 1 1 3 CYS SG S -7.482 4.000 -9.046 1.00 . A A . 3 CYS SG 1 1 5 2893 1 1 4 LYS C C -6.206 0.285 -3.785 1.00 . A A . 4 LYS C 1 1 5 2894 1 1 4 LYS CA C -6.533 1.730 -3.438 1.00 . A A . 4 LYS CA 1 1 5 2895 1 1 4 LYS CB C -7.515 1.790 -2.251 1.00 . A A . 4 LYS CB 1 1 5 2896 1 1 4 LYS CD C -6.687 -0.137 -0.801 1.00 . A A . 4 LYS CD 1 1 5 2897 1 1 4 LYS CE C -7.956 -0.948 -1.032 1.00 . A A . 4 LYS CE 1 1 5 2898 1 1 4 LYS CG C -6.938 1.365 -0.896 1.00 . A A . 4 LYS CG 1 1 5 2899 1 1 4 LYS H H -7.837 1.924 -5.086 1.00 . A A . 4 LYS H 1 1 5 2900 1 1 4 LYS HA H -5.619 2.249 -3.177 1.00 . A A . 4 LYS HA 1 1 5 2901 1 1 4 LYS HB2 H -7.872 2.804 -2.154 1.00 . A A . 4 LYS HB2 1 1 5 2902 1 1 4 LYS HB3 H -8.357 1.149 -2.471 1.00 . A A . 4 LYS HB3 1 1 5 2903 1 1 4 LYS HD2 H -5.957 -0.415 -1.546 1.00 . A A . 4 LYS HD2 1 1 5 2904 1 1 4 LYS HD3 H -6.300 -0.363 0.182 1.00 . A A . 4 LYS HD3 1 1 5 2905 1 1 4 LYS HE2 H -8.623 -0.795 -0.197 1.00 . A A . 4 LYS HE2 1 1 5 2906 1 1 4 LYS HE3 H -8.430 -0.601 -1.939 1.00 . A A . 4 LYS HE3 1 1 5 2907 1 1 4 LYS HG2 H -6.003 1.880 -0.742 1.00 . A A . 4 LYS HG2 1 1 5 2908 1 1 4 LYS HG3 H -7.634 1.652 -0.120 1.00 . A A . 4 LYS HG3 1 1 5 2909 1 1 4 LYS HZ1 H -7.417 -2.636 -2.142 1.00 . A A . 4 LYS HZ1 1 1 5 2910 1 1 4 LYS HZ2 H -8.498 -2.962 -0.888 1.00 . A A . 4 LYS HZ2 1 1 5 2911 1 1 4 LYS HZ3 H -6.866 -2.671 -0.540 1.00 . A A . 4 LYS HZ3 1 1 5 2912 1 1 4 LYS N N -7.124 2.385 -4.597 1.00 . A A . 4 LYS N 1 1 5 2913 1 1 4 LYS NZ N -7.669 -2.404 -1.162 1.00 . A A . 4 LYS NZ 1 1 5 2914 1 1 4 LYS O O -7.044 -0.434 -4.329 1.00 . A A . 4 LYS O 1 1 5 2915 1 1 5 ALA C C -3.356 -1.813 -2.830 1.00 . A A . 5 ALA C 1 1 5 2916 1 1 5 ALA CA C -4.556 -1.497 -3.702 1.00 . A A . 5 ALA CA 1 1 5 2917 1 1 5 ALA CB C -4.208 -1.685 -5.173 1.00 . A A . 5 ALA CB 1 1 5 2918 1 1 5 ALA H H -4.383 0.489 -2.997 1.00 . A A . 5 ALA H 1 1 5 2919 1 1 5 ALA HA H -5.364 -2.169 -3.451 1.00 . A A . 5 ALA HA 1 1 5 2920 1 1 5 ALA HB1 H -5.097 -1.960 -5.721 1.00 . A A . 5 ALA HB1 1 1 5 2921 1 1 5 ALA HB2 H -3.468 -2.466 -5.271 1.00 . A A . 5 ALA HB2 1 1 5 2922 1 1 5 ALA HB3 H -3.811 -0.762 -5.570 1.00 . A A . 5 ALA HB3 1 1 5 2923 1 1 5 ALA N N -4.999 -0.136 -3.448 1.00 . A A . 5 ALA N 1 1 5 2924 1 1 5 ALA O O -2.452 -0.988 -2.700 1.00 . A A . 5 ALA O 1 1 5 2925 1 1 6 GLU C C -1.016 -3.620 -2.211 1.00 . A A . 6 GLU C 1 1 5 2926 1 1 6 GLU CA C -2.254 -3.390 -1.365 1.00 . A A . 6 GLU CA 1 1 5 2927 1 1 6 GLU CB C -2.569 -4.667 -0.558 1.00 . A A . 6 GLU CB 1 1 5 2928 1 1 6 GLU CD C -5.051 -4.097 -0.266 1.00 . A A . 6 GLU CD 1 1 5 2929 1 1 6 GLU CG C -3.765 -4.568 0.392 1.00 . A A . 6 GLU CG 1 1 5 2930 1 1 6 GLU H H -4.104 -3.606 -2.355 1.00 . A A . 6 GLU H 1 1 5 2931 1 1 6 GLU HA H -2.059 -2.578 -0.680 1.00 . A A . 6 GLU HA 1 1 5 2932 1 1 6 GLU HB2 H -2.741 -5.483 -1.236 1.00 . A A . 6 GLU HB2 1 1 5 2933 1 1 6 GLU HB3 H -1.699 -4.905 0.038 1.00 . A A . 6 GLU HB3 1 1 5 2934 1 1 6 GLU HG2 H -3.944 -5.543 0.819 1.00 . A A . 6 GLU HG2 1 1 5 2935 1 1 6 GLU HG3 H -3.514 -3.877 1.185 1.00 . A A . 6 GLU HG3 1 1 5 2936 1 1 6 GLU N N -3.351 -2.990 -2.224 1.00 . A A . 6 GLU N 1 1 5 2937 1 1 6 GLU O O -1.116 -4.078 -3.351 1.00 . A A . 6 GLU O 1 1 5 2938 1 1 6 GLU OE1 O -5.440 -4.652 -1.311 1.00 . A A . 6 GLU OE1 1 1 5 2939 1 1 6 GLU OE2 O -5.681 -3.161 0.263 1.00 . A A . 6 GLU OE2 1 1 5 2940 1 1 7 CYS C C 1.509 -4.865 -2.935 1.00 . A A . 7 CYS C 1 1 5 2941 1 1 7 CYS CA C 1.411 -3.463 -2.330 1.00 . A A . 7 CYS CA 1 1 5 2942 1 1 7 CYS CB C 2.557 -3.212 -1.341 1.00 . A A . 7 CYS CB 1 1 5 2943 1 1 7 CYS H H 0.121 -2.928 -0.736 1.00 . A A . 7 CYS H 1 1 5 2944 1 1 7 CYS HA H 1.464 -2.734 -3.125 1.00 . A A . 7 CYS HA 1 1 5 2945 1 1 7 CYS HB2 H 2.754 -2.152 -1.296 1.00 . A A . 7 CYS HB2 1 1 5 2946 1 1 7 CYS HB3 H 2.251 -3.554 -0.362 1.00 . A A . 7 CYS HB3 1 1 5 2947 1 1 7 CYS N N 0.134 -3.294 -1.647 1.00 . A A . 7 CYS N 1 1 5 2948 1 1 7 CYS O O 1.335 -5.864 -2.234 1.00 . A A . 7 CYS O 1 1 5 2949 1 1 7 CYS SG S 4.133 -4.043 -1.743 1.00 . A A . 7 CYS SG 1 1 5 2950 1 1 8 PRO C C 2.885 -7.156 -4.342 1.00 . A A . 8 PRO C 1 1 5 2951 1 1 8 PRO CA C 1.851 -6.231 -4.968 1.00 . A A . 8 PRO CA 1 1 5 2952 1 1 8 PRO CB C 2.272 -5.835 -6.392 1.00 . A A . 8 PRO CB 1 1 5 2953 1 1 8 PRO CD C 1.938 -3.810 -5.161 1.00 . A A . 8 PRO CD 1 1 5 2954 1 1 8 PRO CG C 2.708 -4.409 -6.302 1.00 . A A . 8 PRO CG 1 1 5 2955 1 1 8 PRO HA H 0.895 -6.734 -4.999 1.00 . A A . 8 PRO HA 1 1 5 2956 1 1 8 PRO HB2 H 3.081 -6.472 -6.717 1.00 . A A . 8 PRO HB2 1 1 5 2957 1 1 8 PRO HB3 H 1.432 -5.947 -7.060 1.00 . A A . 8 PRO HB3 1 1 5 2958 1 1 8 PRO HD2 H 2.511 -3.026 -4.688 1.00 . A A . 8 PRO HD2 1 1 5 2959 1 1 8 PRO HD3 H 0.986 -3.433 -5.503 1.00 . A A . 8 PRO HD3 1 1 5 2960 1 1 8 PRO HG2 H 3.768 -4.361 -6.104 1.00 . A A . 8 PRO HG2 1 1 5 2961 1 1 8 PRO HG3 H 2.474 -3.895 -7.223 1.00 . A A . 8 PRO HG3 1 1 5 2962 1 1 8 PRO N N 1.757 -4.951 -4.256 1.00 . A A . 8 PRO N 1 1 5 2963 1 1 8 PRO O O 2.642 -8.345 -4.148 1.00 . A A . 8 PRO O 1 1 5 2964 1 1 9 THR C C 4.983 -7.260 -1.862 1.00 . A A . 9 THR C 1 1 5 2965 1 1 9 THR CA C 5.099 -7.345 -3.381 1.00 . A A . 9 THR CA 1 1 5 2966 1 1 9 THR CB C 6.477 -6.822 -3.839 1.00 . A A . 9 THR CB 1 1 5 2967 1 1 9 THR CG2 C 6.811 -7.326 -5.235 1.00 . A A . 9 THR CG2 1 1 5 2968 1 1 9 THR H H 4.155 -5.636 -4.169 1.00 . A A . 9 THR H 1 1 5 2969 1 1 9 THR HA H 5.005 -8.378 -3.686 1.00 . A A . 9 THR HA 1 1 5 2970 1 1 9 THR HB H 7.229 -7.184 -3.152 1.00 . A A . 9 THR HB 1 1 5 2971 1 1 9 THR HG1 H 6.048 -5.071 -3.023 1.00 . A A . 9 THR HG1 1 1 5 2972 1 1 9 THR HG21 H 6.007 -7.951 -5.595 1.00 . A A . 9 THR HG21 1 1 5 2973 1 1 9 THR HG22 H 7.725 -7.901 -5.202 1.00 . A A . 9 THR HG22 1 1 5 2974 1 1 9 THR HG23 H 6.939 -6.485 -5.900 1.00 . A A . 9 THR HG23 1 1 5 2975 1 1 9 THR N N 4.031 -6.592 -4.008 1.00 . A A . 9 THR N 1 1 5 2976 1 1 9 THR O O 5.955 -6.952 -1.173 1.00 . A A . 9 THR O 1 1 5 2977 1 1 9 THR OG1 O 6.487 -5.382 -3.830 1.00 . A A . 9 THR OG1 1 1 5 2978 1 1 10 TRP C C 2.679 -8.577 0.573 1.00 . A A . 10 TRP C 1 1 5 2979 1 1 10 TRP CA C 3.548 -7.427 0.085 1.00 . A A . 10 TRP CA 1 1 5 2980 1 1 10 TRP CB C 2.866 -6.110 0.438 1.00 . A A . 10 TRP CB 1 1 5 2981 1 1 10 TRP CD1 C 2.295 -5.994 2.920 1.00 . A A . 10 TRP CD1 1 1 5 2982 1 1 10 TRP CD2 C 4.157 -4.894 2.345 1.00 . A A . 10 TRP CD2 1 1 5 2983 1 1 10 TRP CE2 C 3.975 -4.757 3.732 1.00 . A A . 10 TRP CE2 1 1 5 2984 1 1 10 TRP CE3 C 5.262 -4.284 1.743 1.00 . A A . 10 TRP CE3 1 1 5 2985 1 1 10 TRP CG C 3.084 -5.698 1.852 1.00 . A A . 10 TRP CG 1 1 5 2986 1 1 10 TRP CH2 C 5.931 -3.443 3.909 1.00 . A A . 10 TRP CH2 1 1 5 2987 1 1 10 TRP CZ2 C 4.863 -4.029 4.527 1.00 . A A . 10 TRP CZ2 1 1 5 2988 1 1 10 TRP CZ3 C 6.135 -3.564 2.531 1.00 . A A . 10 TRP CZ3 1 1 5 2989 1 1 10 TRP H H 3.034 -7.724 -1.944 1.00 . A A . 10 TRP H 1 1 5 2990 1 1 10 TRP HA H 4.504 -7.472 0.583 1.00 . A A . 10 TRP HA 1 1 5 2991 1 1 10 TRP HB2 H 3.252 -5.329 -0.200 1.00 . A A . 10 TRP HB2 1 1 5 2992 1 1 10 TRP HB3 H 1.802 -6.207 0.277 1.00 . A A . 10 TRP HB3 1 1 5 2993 1 1 10 TRP HD1 H 1.390 -6.588 2.858 1.00 . A A . 10 TRP HD1 1 1 5 2994 1 1 10 TRP HE1 H 2.454 -5.529 4.967 1.00 . A A . 10 TRP HE1 1 1 5 2995 1 1 10 TRP HE3 H 5.435 -4.367 0.680 1.00 . A A . 10 TRP HE3 1 1 5 2996 1 1 10 TRP HH2 H 6.640 -2.869 4.487 1.00 . A A . 10 TRP HH2 1 1 5 2997 1 1 10 TRP HZ2 H 4.729 -3.923 5.591 1.00 . A A . 10 TRP HZ2 1 1 5 2998 1 1 10 TRP HZ3 H 6.990 -3.081 2.083 1.00 . A A . 10 TRP HZ3 1 1 5 2999 1 1 10 TRP N N 3.781 -7.504 -1.346 1.00 . A A . 10 TRP N 1 1 5 3000 1 1 10 TRP NE1 N 2.829 -5.443 4.063 1.00 . A A . 10 TRP NE1 1 1 5 3001 1 1 10 TRP O O 1.510 -8.704 0.194 1.00 . A A . 10 TRP O 1 1 5 3002 1 1 11 ASP C C 2.759 -10.576 3.504 1.00 . A A . 11 ASP C 1 1 5 3003 1 1 11 ASP CA C 2.558 -10.539 1.995 1.00 . A A . 11 ASP CA 1 1 5 3004 1 1 11 ASP CB C 3.074 -11.843 1.375 1.00 . A A . 11 ASP CB 1 1 5 3005 1 1 11 ASP CG C 4.570 -12.052 1.579 1.00 . A A . 11 ASP CG 1 1 5 3006 1 1 11 ASP H H 4.188 -9.240 1.686 1.00 . A A . 11 ASP H 1 1 5 3007 1 1 11 ASP HA H 1.505 -10.434 1.781 1.00 . A A . 11 ASP HA 1 1 5 3008 1 1 11 ASP HB2 H 2.552 -12.675 1.823 1.00 . A A . 11 ASP HB2 1 1 5 3009 1 1 11 ASP HB3 H 2.874 -11.830 0.314 1.00 . A A . 11 ASP HB3 1 1 5 3010 1 1 11 ASP N N 3.253 -9.398 1.426 1.00 . A A . 11 ASP N 1 1 5 3011 1 1 11 ASP O O 2.207 -11.431 4.196 1.00 . A A . 11 ASP O 1 1 5 3012 1 1 11 ASP OD1 O 5.251 -11.126 2.082 1.00 . A A . 11 ASP OD1 1 1 5 3013 1 1 11 ASP OD2 O 5.067 -13.137 1.218 1.00 . A A . 11 ASP OD2 1 1 5 3014 1 1 12 SER C C 3.060 -8.509 6.128 1.00 . A A . 12 SER C 1 1 5 3015 1 1 12 SER CA C 3.876 -9.592 5.417 1.00 . A A . 12 SER CA 1 1 5 3016 1 1 12 SER CB C 5.379 -9.349 5.603 1.00 . A A . 12 SER CB 1 1 5 3017 1 1 12 SER H H 3.986 -9.010 3.395 1.00 . A A . 12 SER H 1 1 5 3018 1 1 12 SER HA H 3.626 -10.549 5.848 1.00 . A A . 12 SER HA 1 1 5 3019 1 1 12 SER HB2 H 5.929 -9.980 4.921 1.00 . A A . 12 SER HB2 1 1 5 3020 1 1 12 SER HB3 H 5.602 -8.313 5.391 1.00 . A A . 12 SER HB3 1 1 5 3021 1 1 12 SER HG H 6.297 -10.463 6.928 1.00 . A A . 12 SER HG 1 1 5 3022 1 1 12 SER N N 3.571 -9.653 4.001 1.00 . A A . 12 SER N 1 1 5 3023 1 1 12 SER O O 2.116 -7.942 5.567 1.00 . A A . 12 SER O 1 1 5 3024 1 1 12 SER OG O 5.796 -9.642 6.929 1.00 . A A . 12 SER OG 1 1 5 3025 1 1 13 VAL C C 3.369 -5.856 7.998 1.00 . A A . 13 VAL C 1 1 5 3026 1 1 13 VAL CA C 2.768 -7.247 8.195 1.00 . A A . 13 VAL CA 1 1 5 3027 1 1 13 VAL CB C 2.861 -7.638 9.688 1.00 . A A . 13 VAL CB 1 1 5 3028 1 1 13 VAL CG1 C 2.190 -6.601 10.574 1.00 . A A . 13 VAL CG1 1 1 5 3029 1 1 13 VAL CG2 C 2.250 -9.013 9.918 1.00 . A A . 13 VAL CG2 1 1 5 3030 1 1 13 VAL H H 4.199 -8.732 7.746 1.00 . A A . 13 VAL H 1 1 5 3031 1 1 13 VAL HA H 1.726 -7.224 7.915 1.00 . A A . 13 VAL HA 1 1 5 3032 1 1 13 VAL HB H 3.905 -7.686 9.961 1.00 . A A . 13 VAL HB 1 1 5 3033 1 1 13 VAL HG11 H 2.809 -5.717 10.627 1.00 . A A . 13 VAL HG11 1 1 5 3034 1 1 13 VAL HG12 H 2.056 -7.006 11.566 1.00 . A A . 13 VAL HG12 1 1 5 3035 1 1 13 VAL HG13 H 1.227 -6.341 10.158 1.00 . A A . 13 VAL HG13 1 1 5 3036 1 1 13 VAL HG21 H 1.264 -9.046 9.478 1.00 . A A . 13 VAL HG21 1 1 5 3037 1 1 13 VAL HG22 H 2.178 -9.202 10.979 1.00 . A A . 13 VAL HG22 1 1 5 3038 1 1 13 VAL HG23 H 2.874 -9.765 9.459 1.00 . A A . 13 VAL HG23 1 1 5 3039 1 1 13 VAL N N 3.437 -8.238 7.369 1.00 . A A . 13 VAL N 1 1 5 3040 1 1 13 VAL O O 4.580 -5.666 8.110 1.00 . A A . 13 VAL O 1 1 5 3041 1 1 14 CYS C C 3.124 -2.849 8.900 1.00 . A A . 14 CYS C 1 1 5 3042 1 1 14 CYS CA C 2.947 -3.507 7.536 1.00 . A A . 14 CYS CA 1 1 5 3043 1 1 14 CYS CB C 1.914 -2.738 6.702 1.00 . A A . 14 CYS CB 1 1 5 3044 1 1 14 CYS H H 1.552 -5.093 7.661 1.00 . A A . 14 CYS H 1 1 5 3045 1 1 14 CYS HA H 3.894 -3.517 7.019 1.00 . A A . 14 CYS HA 1 1 5 3046 1 1 14 CYS HB2 H 1.694 -3.307 5.812 1.00 . A A . 14 CYS HB2 1 1 5 3047 1 1 14 CYS HB3 H 1.008 -2.632 7.282 1.00 . A A . 14 CYS HB3 1 1 5 3048 1 1 14 CYS N N 2.512 -4.883 7.723 1.00 . A A . 14 CYS N 1 1 5 3049 1 1 14 CYS O O 2.147 -2.495 9.562 1.00 . A A . 14 CYS O 1 1 5 3050 1 1 14 CYS SG S 2.427 -1.071 6.170 1.00 . A A . 14 CYS SG 1 1 5 3051 1 1 15 ILE C C 5.012 -0.642 10.480 1.00 . A A . 15 ILE C 1 1 5 3052 1 1 15 ILE CA C 4.642 -2.112 10.630 1.00 . A A . 15 ILE CA 1 1 5 3053 1 1 15 ILE CB C 5.781 -2.858 11.357 1.00 . A A . 15 ILE CB 1 1 5 3054 1 1 15 ILE CD1 C 6.554 -5.177 12.093 1.00 . A A . 15 ILE CD1 1 1 5 3055 1 1 15 ILE CG1 C 5.445 -4.348 11.478 1.00 . A A . 15 ILE CG1 1 1 5 3056 1 1 15 ILE CG2 C 6.023 -2.250 12.734 1.00 . A A . 15 ILE CG2 1 1 5 3057 1 1 15 ILE H H 5.105 -3.024 8.777 1.00 . A A . 15 ILE H 1 1 5 3058 1 1 15 ILE HA H 3.747 -2.188 11.231 1.00 . A A . 15 ILE HA 1 1 5 3059 1 1 15 ILE HB H 6.684 -2.745 10.777 1.00 . A A . 15 ILE HB 1 1 5 3060 1 1 15 ILE HD11 H 6.605 -4.979 13.153 1.00 . A A . 15 ILE HD11 1 1 5 3061 1 1 15 ILE HD12 H 7.495 -4.917 11.632 1.00 . A A . 15 ILE HD12 1 1 5 3062 1 1 15 ILE HD13 H 6.351 -6.225 11.932 1.00 . A A . 15 ILE HD13 1 1 5 3063 1 1 15 ILE HG12 H 4.567 -4.463 12.095 1.00 . A A . 15 ILE HG12 1 1 5 3064 1 1 15 ILE HG13 H 5.241 -4.745 10.494 1.00 . A A . 15 ILE HG13 1 1 5 3065 1 1 15 ILE HG21 H 6.810 -2.795 13.235 1.00 . A A . 15 ILE HG21 1 1 5 3066 1 1 15 ILE HG22 H 5.116 -2.309 13.318 1.00 . A A . 15 ILE HG22 1 1 5 3067 1 1 15 ILE HG23 H 6.315 -1.216 12.625 1.00 . A A . 15 ILE HG23 1 1 5 3068 1 1 15 ILE N N 4.364 -2.707 9.333 1.00 . A A . 15 ILE N 1 1 5 3069 1 1 15 ILE O O 4.409 0.228 11.107 1.00 . A A . 15 ILE O 1 1 5 3070 1 1 16 ASN C C 5.879 1.506 8.085 1.00 . A A . 16 ASN C 1 1 5 3071 1 1 16 ASN CA C 6.444 0.991 9.405 1.00 . A A . 16 ASN CA 1 1 5 3072 1 1 16 ASN CB C 7.976 1.060 9.407 1.00 . A A . 16 ASN CB 1 1 5 3073 1 1 16 ASN CG C 8.506 2.477 9.560 1.00 . A A . 16 ASN CG 1 1 5 3074 1 1 16 ASN H H 6.433 -1.106 9.162 1.00 . A A . 16 ASN H 1 1 5 3075 1 1 16 ASN HA H 6.063 1.605 10.208 1.00 . A A . 16 ASN HA 1 1 5 3076 1 1 16 ASN HB2 H 8.354 0.467 10.226 1.00 . A A . 16 ASN HB2 1 1 5 3077 1 1 16 ASN HB3 H 8.347 0.656 8.476 1.00 . A A . 16 ASN HB3 1 1 5 3078 1 1 16 ASN HD21 H 9.358 1.994 11.288 1.00 . A A . 16 ASN HD21 1 1 5 3079 1 1 16 ASN HD22 H 9.565 3.630 10.779 1.00 . A A . 16 ASN HD22 1 1 5 3080 1 1 16 ASN N N 5.999 -0.373 9.640 1.00 . A A . 16 ASN N 1 1 5 3081 1 1 16 ASN ND2 N 9.215 2.726 10.651 1.00 . A A . 16 ASN ND2 1 1 5 3082 1 1 16 ASN O O 5.730 0.747 7.126 1.00 . A A . 16 ASN O 1 1 5 3083 1 1 16 ASN OD1 O 8.283 3.339 8.711 1.00 . A A . 16 ASN OD1 1 1 5 3084 1 1 17 LYS C C 6.012 3.478 5.714 1.00 . A A . 17 LYS C 1 1 5 3085 1 1 17 LYS CA C 4.997 3.423 6.861 1.00 . A A . 17 LYS CA 1 1 5 3086 1 1 17 LYS CB C 4.507 4.837 7.206 1.00 . A A . 17 LYS CB 1 1 5 3087 1 1 17 LYS CD C 3.408 6.972 6.450 1.00 . A A . 17 LYS CD 1 1 5 3088 1 1 17 LYS CE C 3.040 7.837 5.250 1.00 . A A . 17 LYS CE 1 1 5 3089 1 1 17 LYS CG C 3.911 5.598 6.029 1.00 . A A . 17 LYS CG 1 1 5 3090 1 1 17 LYS H H 5.694 3.334 8.855 1.00 . A A . 17 LYS H 1 1 5 3091 1 1 17 LYS HA H 4.151 2.832 6.545 1.00 . A A . 17 LYS HA 1 1 5 3092 1 1 17 LYS HB2 H 3.752 4.764 7.975 1.00 . A A . 17 LYS HB2 1 1 5 3093 1 1 17 LYS HB3 H 5.341 5.407 7.589 1.00 . A A . 17 LYS HB3 1 1 5 3094 1 1 17 LYS HD2 H 2.533 6.847 7.070 1.00 . A A . 17 LYS HD2 1 1 5 3095 1 1 17 LYS HD3 H 4.183 7.468 7.016 1.00 . A A . 17 LYS HD3 1 1 5 3096 1 1 17 LYS HE2 H 2.737 8.810 5.606 1.00 . A A . 17 LYS HE2 1 1 5 3097 1 1 17 LYS HE3 H 3.912 7.942 4.622 1.00 . A A . 17 LYS HE3 1 1 5 3098 1 1 17 LYS HG2 H 4.670 5.721 5.271 1.00 . A A . 17 LYS HG2 1 1 5 3099 1 1 17 LYS HG3 H 3.086 5.030 5.626 1.00 . A A . 17 LYS HG3 1 1 5 3100 1 1 17 LYS HZ1 H 1.014 7.527 4.842 1.00 . A A . 17 LYS HZ1 1 1 5 3101 1 1 17 LYS HZ2 H 1.999 6.217 4.425 1.00 . A A . 17 LYS HZ2 1 1 5 3102 1 1 17 LYS HZ3 H 1.984 7.608 3.458 1.00 . A A . 17 LYS HZ3 1 1 5 3103 1 1 17 LYS N N 5.557 2.792 8.050 1.00 . A A . 17 LYS N 1 1 5 3104 1 1 17 LYS NZ N 1.933 7.255 4.446 1.00 . A A . 17 LYS NZ 1 1 5 3105 1 1 17 LYS O O 5.633 3.384 4.547 1.00 . A A . 17 LYS O 1 1 5 3106 1 1 18 LYS C C 8.320 2.544 4.050 1.00 . A A . 18 LYS C 1 1 5 3107 1 1 18 LYS CA C 8.356 3.723 5.038 1.00 . A A . 18 LYS CA 1 1 5 3108 1 1 18 LYS CB C 9.737 3.833 5.701 1.00 . A A . 18 LYS CB 1 1 5 3109 1 1 18 LYS CD C 9.820 6.349 5.669 1.00 . A A . 18 LYS CD 1 1 5 3110 1 1 18 LYS CE C 10.024 7.612 6.493 1.00 . A A . 18 LYS CE 1 1 5 3111 1 1 18 LYS CG C 9.923 5.098 6.527 1.00 . A A . 18 LYS CG 1 1 5 3112 1 1 18 LYS H H 7.532 3.710 7.001 1.00 . A A . 18 LYS H 1 1 5 3113 1 1 18 LYS HA H 8.180 4.628 4.476 1.00 . A A . 18 LYS HA 1 1 5 3114 1 1 18 LYS HB2 H 9.879 2.982 6.350 1.00 . A A . 18 LYS HB2 1 1 5 3115 1 1 18 LYS HB3 H 10.494 3.817 4.931 1.00 . A A . 18 LYS HB3 1 1 5 3116 1 1 18 LYS HD2 H 10.575 6.309 4.899 1.00 . A A . 18 LYS HD2 1 1 5 3117 1 1 18 LYS HD3 H 8.841 6.382 5.214 1.00 . A A . 18 LYS HD3 1 1 5 3118 1 1 18 LYS HE2 H 9.902 8.470 5.849 1.00 . A A . 18 LYS HE2 1 1 5 3119 1 1 18 LYS HE3 H 9.277 7.641 7.273 1.00 . A A . 18 LYS HE3 1 1 5 3120 1 1 18 LYS HG2 H 9.159 5.133 7.289 1.00 . A A . 18 LYS HG2 1 1 5 3121 1 1 18 LYS HG3 H 10.897 5.071 6.993 1.00 . A A . 18 LYS HG3 1 1 5 3122 1 1 18 LYS HZ1 H 11.294 7.689 8.151 1.00 . A A . 18 LYS HZ1 1 1 5 3123 1 1 18 LYS HZ2 H 11.884 8.514 6.798 1.00 . A A . 18 LYS HZ2 1 1 5 3124 1 1 18 LYS HZ3 H 11.927 6.824 6.841 1.00 . A A . 18 LYS HZ3 1 1 5 3125 1 1 18 LYS N N 7.294 3.639 6.050 1.00 . A A . 18 LYS N 1 1 5 3126 1 1 18 LYS NZ N 11.377 7.663 7.114 1.00 . A A . 18 LYS NZ 1 1 5 3127 1 1 18 LYS O O 8.209 2.772 2.845 1.00 . A A . 18 LYS O 1 1 5 3128 1 1 19 PRO C C 7.176 0.119 2.693 1.00 . A A . 19 PRO C 1 1 5 3129 1 1 19 PRO CA C 8.369 0.094 3.643 1.00 . A A . 19 PRO CA 1 1 5 3130 1 1 19 PRO CB C 8.215 -1.066 4.631 1.00 . A A . 19 PRO CB 1 1 5 3131 1 1 19 PRO CD C 8.555 0.881 5.941 1.00 . A A . 19 PRO CD 1 1 5 3132 1 1 19 PRO CG C 8.880 -0.583 5.865 1.00 . A A . 19 PRO CG 1 1 5 3133 1 1 19 PRO HA H 9.284 -0.020 3.081 1.00 . A A . 19 PRO HA 1 1 5 3134 1 1 19 PRO HB2 H 7.164 -1.257 4.799 1.00 . A A . 19 PRO HB2 1 1 5 3135 1 1 19 PRO HB3 H 8.688 -1.953 4.243 1.00 . A A . 19 PRO HB3 1 1 5 3136 1 1 19 PRO HD2 H 7.632 1.035 6.482 1.00 . A A . 19 PRO HD2 1 1 5 3137 1 1 19 PRO HD3 H 9.363 1.424 6.409 1.00 . A A . 19 PRO HD3 1 1 5 3138 1 1 19 PRO HG2 H 8.485 -1.103 6.726 1.00 . A A . 19 PRO HG2 1 1 5 3139 1 1 19 PRO HG3 H 9.947 -0.727 5.792 1.00 . A A . 19 PRO HG3 1 1 5 3140 1 1 19 PRO N N 8.407 1.276 4.525 1.00 . A A . 19 PRO N 1 1 5 3141 1 1 19 PRO O O 7.299 -0.171 1.498 1.00 . A A . 19 PRO O 1 1 5 3142 1 1 20 CYS C C 4.893 1.615 1.391 1.00 . A A . 20 CYS C 1 1 5 3143 1 1 20 CYS CA C 4.794 0.539 2.469 1.00 . A A . 20 CYS CA 1 1 5 3144 1 1 20 CYS CB C 3.613 0.821 3.402 1.00 . A A . 20 CYS CB 1 1 5 3145 1 1 20 CYS H H 5.998 0.692 4.196 1.00 . A A . 20 CYS H 1 1 5 3146 1 1 20 CYS HA H 4.651 -0.422 1.990 1.00 . A A . 20 CYS HA 1 1 5 3147 1 1 20 CYS HB2 H 3.631 0.113 4.216 1.00 . A A . 20 CYS HB2 1 1 5 3148 1 1 20 CYS HB3 H 3.711 1.821 3.801 1.00 . A A . 20 CYS HB3 1 1 5 3149 1 1 20 CYS N N 6.022 0.471 3.241 1.00 . A A . 20 CYS N 1 1 5 3150 1 1 20 CYS O O 4.664 1.342 0.213 1.00 . A A . 20 CYS O 1 1 5 3151 1 1 20 CYS SG S 1.982 0.701 2.605 1.00 . A A . 20 CYS SG 1 1 5 3152 1 1 21 VAL C C 6.416 3.589 -0.233 1.00 . A A . 21 VAL C 1 1 5 3153 1 1 21 VAL CA C 5.408 3.941 0.857 1.00 . A A . 21 VAL CA 1 1 5 3154 1 1 21 VAL CB C 5.842 5.243 1.569 1.00 . A A . 21 VAL CB 1 1 5 3155 1 1 21 VAL CG1 C 6.062 6.369 0.569 1.00 . A A . 21 VAL CG1 1 1 5 3156 1 1 21 VAL CG2 C 4.805 5.656 2.599 1.00 . A A . 21 VAL CG2 1 1 5 3157 1 1 21 VAL H H 5.451 2.983 2.749 1.00 . A A . 21 VAL H 1 1 5 3158 1 1 21 VAL HA H 4.445 4.112 0.396 1.00 . A A . 21 VAL HA 1 1 5 3159 1 1 21 VAL HB H 6.774 5.057 2.082 1.00 . A A . 21 VAL HB 1 1 5 3160 1 1 21 VAL HG11 H 6.363 5.954 -0.381 1.00 . A A . 21 VAL HG11 1 1 5 3161 1 1 21 VAL HG12 H 6.835 7.029 0.935 1.00 . A A . 21 VAL HG12 1 1 5 3162 1 1 21 VAL HG13 H 5.144 6.925 0.445 1.00 . A A . 21 VAL HG13 1 1 5 3163 1 1 21 VAL HG21 H 4.672 6.727 2.567 1.00 . A A . 21 VAL HG21 1 1 5 3164 1 1 21 VAL HG22 H 5.140 5.364 3.584 1.00 . A A . 21 VAL HG22 1 1 5 3165 1 1 21 VAL HG23 H 3.866 5.169 2.380 1.00 . A A . 21 VAL HG23 1 1 5 3166 1 1 21 VAL N N 5.262 2.831 1.795 1.00 . A A . 21 VAL N 1 1 5 3167 1 1 21 VAL O O 6.235 3.945 -1.399 1.00 . A A . 21 VAL O 1 1 5 3168 1 1 22 ALA C C 7.875 1.558 -1.872 1.00 . A A . 22 ALA C 1 1 5 3169 1 1 22 ALA CA C 8.489 2.447 -0.796 1.00 . A A . 22 ALA CA 1 1 5 3170 1 1 22 ALA CB C 9.613 1.718 -0.075 1.00 . A A . 22 ALA CB 1 1 5 3171 1 1 22 ALA H H 7.545 2.603 1.095 1.00 . A A . 22 ALA H 1 1 5 3172 1 1 22 ALA HA H 8.900 3.331 -1.262 1.00 . A A . 22 ALA HA 1 1 5 3173 1 1 22 ALA HB1 H 9.359 1.605 0.968 1.00 . A A . 22 ALA HB1 1 1 5 3174 1 1 22 ALA HB2 H 10.526 2.288 -0.164 1.00 . A A . 22 ALA HB2 1 1 5 3175 1 1 22 ALA HB3 H 9.753 0.743 -0.519 1.00 . A A . 22 ALA HB3 1 1 5 3176 1 1 22 ALA N N 7.466 2.870 0.149 1.00 . A A . 22 ALA N 1 1 5 3177 1 1 22 ALA O O 8.139 1.731 -3.067 1.00 . A A . 22 ALA O 1 1 5 3178 1 1 23 CYS C C 5.390 0.509 -3.244 1.00 . A A . 23 CYS C 1 1 5 3179 1 1 23 CYS CA C 6.378 -0.266 -2.398 1.00 . A A . 23 CYS CA 1 1 5 3180 1 1 23 CYS CB C 5.628 -1.390 -1.703 1.00 . A A . 23 CYS CB 1 1 5 3181 1 1 23 CYS H H 6.843 0.535 -0.491 1.00 . A A . 23 CYS H 1 1 5 3182 1 1 23 CYS HA H 7.135 -0.689 -3.041 1.00 . A A . 23 CYS HA 1 1 5 3183 1 1 23 CYS HB2 H 6.244 -1.812 -0.928 1.00 . A A . 23 CYS HB2 1 1 5 3184 1 1 23 CYS HB3 H 4.725 -0.994 -1.264 1.00 . A A . 23 CYS HB3 1 1 5 3185 1 1 23 CYS N N 7.035 0.620 -1.452 1.00 . A A . 23 CYS N 1 1 5 3186 1 1 23 CYS O O 5.299 0.324 -4.454 1.00 . A A . 23 CYS O 1 1 5 3187 1 1 23 CYS SG S 5.146 -2.707 -2.870 1.00 . A A . 23 CYS SG 1 1 5 3188 1 1 24 CYS C C 4.261 3.038 -4.348 1.00 . A A . 24 CYS C 1 1 5 3189 1 1 24 CYS CA C 3.636 2.158 -3.271 1.00 . A A . 24 CYS CA 1 1 5 3190 1 1 24 CYS CB C 2.860 2.992 -2.261 1.00 . A A . 24 CYS CB 1 1 5 3191 1 1 24 CYS H H 4.744 1.446 -1.615 1.00 . A A . 24 CYS H 1 1 5 3192 1 1 24 CYS HA H 2.951 1.473 -3.749 1.00 . A A . 24 CYS HA 1 1 5 3193 1 1 24 CYS HB2 H 3.546 3.632 -1.725 1.00 . A A . 24 CYS HB2 1 1 5 3194 1 1 24 CYS HB3 H 2.134 3.599 -2.781 1.00 . A A . 24 CYS HB3 1 1 5 3195 1 1 24 CYS N N 4.637 1.362 -2.592 1.00 . A A . 24 CYS N 1 1 5 3196 1 1 24 CYS O O 3.742 3.116 -5.456 1.00 . A A . 24 CYS O 1 1 5 3197 1 1 24 CYS SG S 1.969 1.978 -1.041 1.00 . A A . 24 CYS SG 1 1 5 3198 1 1 25 LYS C C 6.587 3.723 -6.190 1.00 . A A . 25 LYS C 1 1 5 3199 1 1 25 LYS CA C 6.035 4.542 -5.022 1.00 . A A . 25 LYS CA 1 1 5 3200 1 1 25 LYS CB C 7.131 5.409 -4.385 1.00 . A A . 25 LYS CB 1 1 5 3201 1 1 25 LYS CD C 9.304 5.561 -3.136 1.00 . A A . 25 LYS CD 1 1 5 3202 1 1 25 LYS CE C 8.669 6.337 -1.992 1.00 . A A . 25 LYS CE 1 1 5 3203 1 1 25 LYS CG C 8.301 4.634 -3.803 1.00 . A A . 25 LYS CG 1 1 5 3204 1 1 25 LYS H H 5.768 3.588 -3.142 1.00 . A A . 25 LYS H 1 1 5 3205 1 1 25 LYS HA H 5.273 5.201 -5.416 1.00 . A A . 25 LYS HA 1 1 5 3206 1 1 25 LYS HB2 H 7.519 6.080 -5.136 1.00 . A A . 25 LYS HB2 1 1 5 3207 1 1 25 LYS HB3 H 6.689 5.994 -3.592 1.00 . A A . 25 LYS HB3 1 1 5 3208 1 1 25 LYS HD2 H 10.121 4.973 -2.748 1.00 . A A . 25 LYS HD2 1 1 5 3209 1 1 25 LYS HD3 H 9.677 6.260 -3.870 1.00 . A A . 25 LYS HD3 1 1 5 3210 1 1 25 LYS HE2 H 7.830 6.897 -2.376 1.00 . A A . 25 LYS HE2 1 1 5 3211 1 1 25 LYS HE3 H 8.322 5.636 -1.248 1.00 . A A . 25 LYS HE3 1 1 5 3212 1 1 25 LYS HG2 H 7.928 3.935 -3.069 1.00 . A A . 25 LYS HG2 1 1 5 3213 1 1 25 LYS HG3 H 8.795 4.095 -4.599 1.00 . A A . 25 LYS HG3 1 1 5 3214 1 1 25 LYS HZ1 H 10.181 7.774 -2.089 1.00 . A A . 25 LYS HZ1 1 1 5 3215 1 1 25 LYS HZ2 H 10.281 6.764 -0.736 1.00 . A A . 25 LYS HZ2 1 1 5 3216 1 1 25 LYS HZ3 H 9.114 7.987 -0.793 1.00 . A A . 25 LYS HZ3 1 1 5 3217 1 1 25 LYS N N 5.379 3.687 -4.039 1.00 . A A . 25 LYS N 1 1 5 3218 1 1 25 LYS NZ N 9.629 7.281 -1.358 1.00 . A A . 25 LYS NZ 1 1 5 3219 1 1 25 LYS O O 6.498 4.155 -7.338 1.00 . A A . 25 LYS O 1 1 5 3220 1 1 26 LYS C C 6.511 1.159 -7.859 1.00 . A A . 26 LYS C 1 1 5 3221 1 1 26 LYS CA C 7.658 1.691 -6.995 1.00 . A A . 26 LYS CA 1 1 5 3222 1 1 26 LYS CB C 8.550 0.544 -6.463 1.00 . A A . 26 LYS CB 1 1 5 3223 1 1 26 LYS CD C 7.114 -1.540 -6.259 1.00 . A A . 26 LYS CD 1 1 5 3224 1 1 26 LYS CE C 7.966 -2.786 -6.441 1.00 . A A . 26 LYS CE 1 1 5 3225 1 1 26 LYS CG C 7.866 -0.438 -5.518 1.00 . A A . 26 LYS CG 1 1 5 3226 1 1 26 LYS H H 7.168 2.214 -4.987 1.00 . A A . 26 LYS H 1 1 5 3227 1 1 26 LYS HA H 8.267 2.332 -7.619 1.00 . A A . 26 LYS HA 1 1 5 3228 1 1 26 LYS HB2 H 8.924 -0.017 -7.306 1.00 . A A . 26 LYS HB2 1 1 5 3229 1 1 26 LYS HB3 H 9.390 0.980 -5.941 1.00 . A A . 26 LYS HB3 1 1 5 3230 1 1 26 LYS HD2 H 6.232 -1.801 -5.694 1.00 . A A . 26 LYS HD2 1 1 5 3231 1 1 26 LYS HD3 H 6.822 -1.169 -7.231 1.00 . A A . 26 LYS HD3 1 1 5 3232 1 1 26 LYS HE2 H 7.448 -3.468 -7.099 1.00 . A A . 26 LYS HE2 1 1 5 3233 1 1 26 LYS HE3 H 8.907 -2.501 -6.888 1.00 . A A . 26 LYS HE3 1 1 5 3234 1 1 26 LYS HG2 H 8.616 -0.895 -4.891 1.00 . A A . 26 LYS HG2 1 1 5 3235 1 1 26 LYS HG3 H 7.167 0.107 -4.900 1.00 . A A . 26 LYS HG3 1 1 5 3236 1 1 26 LYS HZ1 H 7.432 -4.098 -4.894 1.00 . A A . 26 LYS HZ1 1 1 5 3237 1 1 26 LYS HZ2 H 8.356 -2.772 -4.387 1.00 . A A . 26 LYS HZ2 1 1 5 3238 1 1 26 LYS HZ3 H 9.094 -4.048 -5.214 1.00 . A A . 26 LYS HZ3 1 1 5 3239 1 1 26 LYS N N 7.133 2.532 -5.915 1.00 . A A . 26 LYS N 1 1 5 3240 1 1 26 LYS NZ N 8.232 -3.473 -5.144 1.00 . A A . 26 LYS NZ 1 1 5 3241 1 1 26 LYS O O 6.708 0.800 -9.017 1.00 . A A . 26 LYS O 1 1 5 3242 1 1 27 ALA C C 3.344 1.846 -8.573 1.00 . A A . 27 ALA C 1 1 5 3243 1 1 27 ALA CA C 4.124 0.662 -7.999 1.00 . A A . 27 ALA CA 1 1 5 3244 1 1 27 ALA CB C 3.243 -0.167 -7.075 1.00 . A A . 27 ALA CB 1 1 5 3245 1 1 27 ALA H H 5.215 1.438 -6.359 1.00 . A A . 27 ALA H 1 1 5 3246 1 1 27 ALA HA H 4.451 0.030 -8.812 1.00 . A A . 27 ALA HA 1 1 5 3247 1 1 27 ALA HB1 H 3.680 -0.192 -6.088 1.00 . A A . 27 ALA HB1 1 1 5 3248 1 1 27 ALA HB2 H 3.163 -1.173 -7.460 1.00 . A A . 27 ALA HB2 1 1 5 3249 1 1 27 ALA HB3 H 2.259 0.277 -7.022 1.00 . A A . 27 ALA HB3 1 1 5 3250 1 1 27 ALA N N 5.309 1.127 -7.285 1.00 . A A . 27 ALA N 1 1 5 3251 1 1 27 ALA O O 2.224 1.693 -9.071 1.00 . A A . 27 ALA O 1 1 5 3252 1 1 28 LYS C C 2.119 4.677 -8.247 1.00 . A A . 28 LYS C 1 1 5 3253 1 1 28 LYS CA C 3.387 4.265 -9.012 1.00 . A A . 28 LYS CA 1 1 5 3254 1 1 28 LYS CB C 3.109 4.158 -10.519 1.00 . A A . 28 LYS CB 1 1 5 3255 1 1 28 LYS CD C 2.812 5.351 -12.717 1.00 . A A . 28 LYS CD 1 1 5 3256 1 1 28 LYS CE C 2.734 6.702 -13.410 1.00 . A A . 28 LYS CE 1 1 5 3257 1 1 28 LYS CG C 2.940 5.505 -11.209 1.00 . A A . 28 LYS CG 1 1 5 3258 1 1 28 LYS H H 4.857 3.054 -8.099 1.00 . A A . 28 LYS H 1 1 5 3259 1 1 28 LYS HA H 4.127 5.037 -8.861 1.00 . A A . 28 LYS HA 1 1 5 3260 1 1 28 LYS HB2 H 3.932 3.639 -10.988 1.00 . A A . 28 LYS HB2 1 1 5 3261 1 1 28 LYS HB3 H 2.204 3.586 -10.666 1.00 . A A . 28 LYS HB3 1 1 5 3262 1 1 28 LYS HD2 H 3.674 4.816 -13.088 1.00 . A A . 28 LYS HD2 1 1 5 3263 1 1 28 LYS HD3 H 1.916 4.790 -12.937 1.00 . A A . 28 LYS HD3 1 1 5 3264 1 1 28 LYS HE2 H 1.848 7.217 -13.068 1.00 . A A . 28 LYS HE2 1 1 5 3265 1 1 28 LYS HE3 H 3.608 7.279 -13.146 1.00 . A A . 28 LYS HE3 1 1 5 3266 1 1 28 LYS HG2 H 2.049 5.982 -10.830 1.00 . A A . 28 LYS HG2 1 1 5 3267 1 1 28 LYS HG3 H 3.801 6.120 -10.990 1.00 . A A . 28 LYS HG3 1 1 5 3268 1 1 28 LYS HZ1 H 2.215 5.669 -15.151 1.00 . A A . 28 LYS HZ1 1 1 5 3269 1 1 28 LYS HZ2 H 3.631 6.583 -15.293 1.00 . A A . 28 LYS HZ2 1 1 5 3270 1 1 28 LYS HZ3 H 2.124 7.352 -15.300 1.00 . A A . 28 LYS HZ3 1 1 5 3271 1 1 28 LYS N N 3.963 3.022 -8.504 1.00 . A A . 28 LYS N 1 1 5 3272 1 1 28 LYS NZ N 2.671 6.567 -14.892 1.00 . A A . 28 LYS NZ 1 1 5 3273 1 1 28 LYS O O 1.069 4.930 -8.846 1.00 . A A . 28 LYS O 1 1 5 3274 1 1 29 PHE C C 1.589 6.429 -5.276 1.00 . A A . 29 PHE C 1 1 5 3275 1 1 29 PHE CA C 1.140 5.203 -6.061 1.00 . A A . 29 PHE CA 1 1 5 3276 1 1 29 PHE CB C 0.685 4.103 -5.090 1.00 . A A . 29 PHE CB 1 1 5 3277 1 1 29 PHE CD1 C 0.444 2.065 -6.547 1.00 . A A . 29 PHE CD1 1 1 5 3278 1 1 29 PHE CD2 C -1.498 2.926 -5.469 1.00 . A A . 29 PHE CD2 1 1 5 3279 1 1 29 PHE CE1 C -0.315 1.057 -7.112 1.00 . A A . 29 PHE CE1 1 1 5 3280 1 1 29 PHE CE2 C -2.261 1.919 -6.028 1.00 . A A . 29 PHE CE2 1 1 5 3281 1 1 29 PHE CG C -0.138 3.012 -5.722 1.00 . A A . 29 PHE CG 1 1 5 3282 1 1 29 PHE CZ C -1.669 0.984 -6.851 1.00 . A A . 29 PHE CZ 1 1 5 3283 1 1 29 PHE H H 3.113 4.581 -6.517 1.00 . A A . 29 PHE H 1 1 5 3284 1 1 29 PHE HA H 0.311 5.483 -6.696 1.00 . A A . 29 PHE HA 1 1 5 3285 1 1 29 PHE HB2 H 1.553 3.644 -4.646 1.00 . A A . 29 PHE HB2 1 1 5 3286 1 1 29 PHE HB3 H 0.088 4.552 -4.308 1.00 . A A . 29 PHE HB3 1 1 5 3287 1 1 29 PHE HD1 H 1.503 2.120 -6.752 1.00 . A A . 29 PHE HD1 1 1 5 3288 1 1 29 PHE HD2 H -1.964 3.660 -4.828 1.00 . A A . 29 PHE HD2 1 1 5 3289 1 1 29 PHE HE1 H 0.152 0.326 -7.756 1.00 . A A . 29 PHE HE1 1 1 5 3290 1 1 29 PHE HE2 H -3.320 1.865 -5.821 1.00 . A A . 29 PHE HE2 1 1 5 3291 1 1 29 PHE HZ H -2.262 0.195 -7.290 1.00 . A A . 29 PHE HZ 1 1 5 3292 1 1 29 PHE N N 2.239 4.775 -6.927 1.00 . A A . 29 PHE N 1 1 5 3293 1 1 29 PHE O O 2.771 6.565 -4.964 1.00 . A A . 29 PHE O 1 1 5 3294 1 1 30 SER C C 1.448 8.331 -2.861 1.00 . A A . 30 SER C 1 1 5 3295 1 1 30 SER CA C 0.956 8.564 -4.291 1.00 . A A . 30 SER CA 1 1 5 3296 1 1 30 SER CB C -0.287 9.451 -4.291 1.00 . A A . 30 SER CB 1 1 5 3297 1 1 30 SER H H -0.259 7.169 -5.302 1.00 . A A . 30 SER H 1 1 5 3298 1 1 30 SER HA H 1.733 9.068 -4.837 1.00 . A A . 30 SER HA 1 1 5 3299 1 1 30 SER HB2 H -1.018 9.048 -3.605 1.00 . A A . 30 SER HB2 1 1 5 3300 1 1 30 SER HB3 H -0.017 10.452 -3.988 1.00 . A A . 30 SER HB3 1 1 5 3301 1 1 30 SER HG H -1.545 10.189 -5.626 1.00 . A A . 30 SER HG 1 1 5 3302 1 1 30 SER N N 0.657 7.325 -4.999 1.00 . A A . 30 SER N 1 1 5 3303 1 1 30 SER O O 2.425 8.948 -2.433 1.00 . A A . 30 SER O 1 1 5 3304 1 1 30 SER OG O -0.852 9.500 -5.591 1.00 . A A . 30 SER OG 1 1 5 3305 1 1 31 ASP C C 0.733 5.806 -0.278 1.00 . A A . 31 ASP C 1 1 5 3306 1 1 31 ASP CA C 1.174 7.190 -0.736 1.00 . A A . 31 ASP CA 1 1 5 3307 1 1 31 ASP CB C 0.592 8.252 0.206 1.00 . A A . 31 ASP CB 1 1 5 3308 1 1 31 ASP CG C 0.984 8.014 1.653 1.00 . A A . 31 ASP CG 1 1 5 3309 1 1 31 ASP H H 0.002 6.995 -2.502 1.00 . A A . 31 ASP H 1 1 5 3310 1 1 31 ASP HA H 2.251 7.241 -0.690 1.00 . A A . 31 ASP HA 1 1 5 3311 1 1 31 ASP HB2 H 0.953 9.225 -0.090 1.00 . A A . 31 ASP HB2 1 1 5 3312 1 1 31 ASP HB3 H -0.486 8.235 0.136 1.00 . A A . 31 ASP HB3 1 1 5 3313 1 1 31 ASP N N 0.778 7.458 -2.120 1.00 . A A . 31 ASP N 1 1 5 3314 1 1 31 ASP O O -0.251 5.257 -0.779 1.00 . A A . 31 ASP O 1 1 5 3315 1 1 31 ASP OD1 O 2.198 7.928 1.940 1.00 . A A . 31 ASP OD1 1 1 5 3316 1 1 31 ASP OD2 O 0.086 7.893 2.514 1.00 . A A . 31 ASP OD2 1 1 5 3317 1 1 32 GLY C C 0.864 4.015 2.707 1.00 . A A . 32 GLY C 1 1 5 3318 1 1 32 GLY CA C 1.157 3.954 1.225 1.00 . A A . 32 GLY CA 1 1 5 3319 1 1 32 GLY H H 2.229 5.764 1.042 1.00 . A A . 32 GLY H 1 1 5 3320 1 1 32 GLY HA2 H 0.293 3.557 0.711 1.00 . A A . 32 GLY HA2 1 1 5 3321 1 1 32 GLY HA3 H 1.998 3.296 1.060 1.00 . A A . 32 GLY HA3 1 1 5 3322 1 1 32 GLY N N 1.467 5.259 0.683 1.00 . A A . 32 GLY N 1 1 5 3323 1 1 32 GLY O O 1.496 4.776 3.445 1.00 . A A . 32 GLY O 1 1 5 3324 1 1 33 HIS C C -0.877 1.812 5.002 1.00 . A A . 33 HIS C 1 1 5 3325 1 1 33 HIS CA C -0.477 3.210 4.553 1.00 . A A . 33 HIS CA 1 1 5 3326 1 1 33 HIS CB C -1.628 4.195 4.798 1.00 . A A . 33 HIS CB 1 1 5 3327 1 1 33 HIS CD2 C -3.332 4.207 2.827 1.00 . A A . 33 HIS CD2 1 1 5 3328 1 1 33 HIS CE1 C -4.847 2.894 3.709 1.00 . A A . 33 HIS CE1 1 1 5 3329 1 1 33 HIS CG C -2.896 3.855 4.063 1.00 . A A . 33 HIS CG 1 1 5 3330 1 1 33 HIS H H -0.573 2.640 2.513 1.00 . A A . 33 HIS H 1 1 5 3331 1 1 33 HIS HA H 0.380 3.526 5.129 1.00 . A A . 33 HIS HA 1 1 5 3332 1 1 33 HIS HB2 H -1.855 4.212 5.853 1.00 . A A . 33 HIS HB2 1 1 5 3333 1 1 33 HIS HB3 H -1.315 5.178 4.490 1.00 . A A . 33 HIS HB3 1 1 5 3334 1 1 33 HIS HD1 H -3.846 2.604 5.468 1.00 . A A . 33 HIS HD1 1 1 5 3335 1 1 33 HIS HD2 H -2.811 4.825 2.115 1.00 . A A . 33 HIS HD2 1 1 5 3336 1 1 33 HIS HE1 H -5.732 2.291 3.838 1.00 . A A . 33 HIS HE1 1 1 5 3337 1 1 33 HIS N N -0.098 3.225 3.151 1.00 . A A . 33 HIS N 1 1 5 3338 1 1 33 HIS ND1 N -3.871 3.031 4.587 1.00 . A A . 33 HIS ND1 1 1 5 3339 1 1 33 HIS NE2 N -4.546 3.597 2.637 1.00 . A A . 33 HIS NE2 1 1 5 3340 1 1 33 HIS O O -1.592 1.101 4.299 1.00 . A A . 33 HIS O 1 1 5 3341 1 1 34 CYS C C -2.219 0.075 7.122 1.00 . A A . 34 CYS C 1 1 5 3342 1 1 34 CYS CA C -0.742 0.127 6.736 1.00 . A A . 34 CYS CA 1 1 5 3343 1 1 34 CYS CB C 0.126 -0.155 7.964 1.00 . A A . 34 CYS CB 1 1 5 3344 1 1 34 CYS H H 0.134 2.050 6.695 1.00 . A A . 34 CYS H 1 1 5 3345 1 1 34 CYS HA H -0.547 -0.619 5.980 1.00 . A A . 34 CYS HA 1 1 5 3346 1 1 34 CYS HB2 H -0.199 0.478 8.776 1.00 . A A . 34 CYS HB2 1 1 5 3347 1 1 34 CYS HB3 H 0.001 -1.189 8.251 1.00 . A A . 34 CYS HB3 1 1 5 3348 1 1 34 CYS N N -0.423 1.433 6.180 1.00 . A A . 34 CYS N 1 1 5 3349 1 1 34 CYS O O -2.751 1.035 7.683 1.00 . A A . 34 CYS O 1 1 5 3350 1 1 34 CYS SG S 1.912 0.139 7.720 1.00 . A A . 34 CYS SG 1 1 5 3351 1 1 35 SER C C -4.496 -1.615 8.580 1.00 . A A . 35 SER C 1 1 5 3352 1 1 35 SER CA C -4.297 -1.174 7.130 1.00 . A A . 35 SER CA 1 1 5 3353 1 1 35 SER CB C -4.966 -2.166 6.179 1.00 . A A . 35 SER CB 1 1 5 3354 1 1 35 SER H H -2.417 -1.760 6.352 1.00 . A A . 35 SER H 1 1 5 3355 1 1 35 SER HA H -4.758 -0.207 6.999 1.00 . A A . 35 SER HA 1 1 5 3356 1 1 35 SER HB2 H -5.946 -2.418 6.555 1.00 . A A . 35 SER HB2 1 1 5 3357 1 1 35 SER HB3 H -5.061 -1.715 5.202 1.00 . A A . 35 SER HB3 1 1 5 3358 1 1 35 SER HG H -3.494 -3.210 5.421 1.00 . A A . 35 SER HG 1 1 5 3359 1 1 35 SER N N -2.884 -1.028 6.811 1.00 . A A . 35 SER N 1 1 5 3360 1 1 35 SER O O -3.538 -1.949 9.278 1.00 . A A . 35 SER O 1 1 5 3361 1 1 35 SER OG O -4.206 -3.353 6.060 1.00 . A A . 35 SER OG 1 1 5 3362 1 1 36 LYS C C -6.367 -3.492 10.484 1.00 . A A . 36 LYS C 1 1 5 3363 1 1 36 LYS CA C -6.087 -1.992 10.385 1.00 . A A . 36 LYS CA 1 1 5 3364 1 1 36 LYS CB C -7.308 -1.196 10.862 1.00 . A A . 36 LYS CB 1 1 5 3365 1 1 36 LYS CD C -9.067 -0.842 12.637 1.00 . A A . 36 LYS CD 1 1 5 3366 1 1 36 LYS CE C -8.633 0.576 12.982 1.00 . A A . 36 LYS CE 1 1 5 3367 1 1 36 LYS CG C -7.893 -1.695 12.176 1.00 . A A . 36 LYS CG 1 1 5 3368 1 1 36 LYS H H -6.459 -1.320 8.418 1.00 . A A . 36 LYS H 1 1 5 3369 1 1 36 LYS HA H -5.246 -1.754 11.018 1.00 . A A . 36 LYS HA 1 1 5 3370 1 1 36 LYS HB2 H -7.020 -0.163 10.992 1.00 . A A . 36 LYS HB2 1 1 5 3371 1 1 36 LYS HB3 H -8.077 -1.253 10.106 1.00 . A A . 36 LYS HB3 1 1 5 3372 1 1 36 LYS HD2 H -9.800 -0.799 11.845 1.00 . A A . 36 LYS HD2 1 1 5 3373 1 1 36 LYS HD3 H -9.507 -1.297 13.512 1.00 . A A . 36 LYS HD3 1 1 5 3374 1 1 36 LYS HE2 H -7.871 0.529 13.745 1.00 . A A . 36 LYS HE2 1 1 5 3375 1 1 36 LYS HE3 H -8.224 1.039 12.095 1.00 . A A . 36 LYS HE3 1 1 5 3376 1 1 36 LYS HG2 H -8.233 -2.712 12.037 1.00 . A A . 36 LYS HG2 1 1 5 3377 1 1 36 LYS HG3 H -7.122 -1.672 12.932 1.00 . A A . 36 LYS HG3 1 1 5 3378 1 1 36 LYS HZ1 H -10.116 2.026 12.725 1.00 . A A . 36 LYS HZ1 1 1 5 3379 1 1 36 LYS HZ2 H -9.460 1.985 14.284 1.00 . A A . 36 LYS HZ2 1 1 5 3380 1 1 36 LYS HZ3 H -10.546 0.786 13.794 1.00 . A A . 36 LYS HZ3 1 1 5 3381 1 1 36 LYS N N -5.745 -1.603 9.023 1.00 . A A . 36 LYS N 1 1 5 3382 1 1 36 LYS NZ N -9.768 1.401 13.481 1.00 . A A . 36 LYS NZ 1 1 5 3383 1 1 36 LYS O O -6.140 -4.100 11.525 1.00 . A A . 36 LYS O 1 1 5 3384 1 1 37 ILE C C -6.004 -6.390 9.437 1.00 . A A . 37 ILE C 1 1 5 3385 1 1 37 ILE CA C -7.241 -5.487 9.373 1.00 . A A . 37 ILE CA 1 1 5 3386 1 1 37 ILE CB C -8.033 -5.844 8.097 1.00 . A A . 37 ILE CB 1 1 5 3387 1 1 37 ILE CD1 C -9.529 -4.880 6.286 1.00 . A A . 37 ILE CD1 1 1 5 3388 1 1 37 ILE CG1 C -8.958 -4.701 7.678 1.00 . A A . 37 ILE CG1 1 1 5 3389 1 1 37 ILE CG2 C -8.842 -7.118 8.318 1.00 . A A . 37 ILE CG2 1 1 5 3390 1 1 37 ILE H H -7.067 -3.518 8.618 1.00 . A A . 37 ILE H 1 1 5 3391 1 1 37 ILE HA H -7.864 -5.692 10.228 1.00 . A A . 37 ILE HA 1 1 5 3392 1 1 37 ILE HB H -7.324 -6.030 7.309 1.00 . A A . 37 ILE HB 1 1 5 3393 1 1 37 ILE HD11 H -8.864 -5.506 5.702 1.00 . A A . 37 ILE HD11 1 1 5 3394 1 1 37 ILE HD12 H -9.626 -3.916 5.809 1.00 . A A . 37 ILE HD12 1 1 5 3395 1 1 37 ILE HD13 H -10.499 -5.350 6.351 1.00 . A A . 37 ILE HD13 1 1 5 3396 1 1 37 ILE HG12 H -9.784 -4.639 8.371 1.00 . A A . 37 ILE HG12 1 1 5 3397 1 1 37 ILE HG13 H -8.406 -3.773 7.695 1.00 . A A . 37 ILE HG13 1 1 5 3398 1 1 37 ILE HG21 H -9.640 -7.167 7.593 1.00 . A A . 37 ILE HG21 1 1 5 3399 1 1 37 ILE HG22 H -9.260 -7.111 9.314 1.00 . A A . 37 ILE HG22 1 1 5 3400 1 1 37 ILE HG23 H -8.198 -7.977 8.203 1.00 . A A . 37 ILE HG23 1 1 5 3401 1 1 37 ILE N N -6.890 -4.066 9.405 1.00 . A A . 37 ILE N 1 1 5 3402 1 1 37 ILE O O -5.391 -6.555 10.485 1.00 . A A . 37 ILE O 1 1 5 3403 1 1 38 LEU C C -3.198 -7.132 8.267 1.00 . A A . 38 LEU C 1 1 5 3404 1 1 38 LEU CA C -4.515 -7.897 8.205 1.00 . A A . 38 LEU CA 1 1 5 3405 1 1 38 LEU CB C -4.585 -8.691 6.903 1.00 . A A . 38 LEU CB 1 1 5 3406 1 1 38 LEU CD1 C -3.939 -10.890 7.918 1.00 . A A . 38 LEU CD1 1 1 5 3407 1 1 38 LEU CD2 C -3.688 -10.531 5.457 1.00 . A A . 38 LEU CD2 1 1 5 3408 1 1 38 LEU CG C -3.627 -9.876 6.827 1.00 . A A . 38 LEU CG 1 1 5 3409 1 1 38 LEU H H -6.198 -6.830 7.497 1.00 . A A . 38 LEU H 1 1 5 3410 1 1 38 LEU HA H -4.564 -8.581 9.038 1.00 . A A . 38 LEU HA 1 1 5 3411 1 1 38 LEU HB2 H -5.591 -9.049 6.777 1.00 . A A . 38 LEU HB2 1 1 5 3412 1 1 38 LEU HB3 H -4.356 -8.022 6.087 1.00 . A A . 38 LEU HB3 1 1 5 3413 1 1 38 LEU HD11 H -3.031 -11.138 8.449 1.00 . A A . 38 LEU HD11 1 1 5 3414 1 1 38 LEU HD12 H -4.351 -11.783 7.473 1.00 . A A . 38 LEU HD12 1 1 5 3415 1 1 38 LEU HD13 H -4.655 -10.467 8.608 1.00 . A A . 38 LEU HD13 1 1 5 3416 1 1 38 LEU HD21 H -4.709 -10.804 5.235 1.00 . A A . 38 LEU HD21 1 1 5 3417 1 1 38 LEU HD22 H -3.069 -11.416 5.453 1.00 . A A . 38 LEU HD22 1 1 5 3418 1 1 38 LEU HD23 H -3.330 -9.838 4.711 1.00 . A A . 38 LEU HD23 1 1 5 3419 1 1 38 LEU HG H -2.621 -9.514 6.985 1.00 . A A . 38 LEU HG 1 1 5 3420 1 1 38 LEU N N -5.659 -6.990 8.296 1.00 . A A . 38 LEU N 1 1 5 3421 1 1 38 LEU O O -2.119 -7.707 8.131 1.00 . A A . 38 LEU O 1 1 5 3422 1 1 39 ARG C C -1.382 -4.937 7.250 1.00 . A A . 39 ARG C 1 1 5 3423 1 1 39 ARG CA C -2.167 -4.945 8.564 1.00 . A A . 39 ARG CA 1 1 5 3424 1 1 39 ARG CB C -1.274 -5.355 9.742 1.00 . A A . 39 ARG CB 1 1 5 3425 1 1 39 ARG CD C -1.053 -3.059 10.729 1.00 . A A . 39 ARG CD 1 1 5 3426 1 1 39 ARG CG C -0.315 -4.271 10.190 1.00 . A A . 39 ARG CG 1 1 5 3427 1 1 39 ARG CZ C -0.512 -0.782 11.515 1.00 . A A . 39 ARG CZ 1 1 5 3428 1 1 39 ARG H H -4.205 -5.459 8.571 1.00 . A A . 39 ARG H 1 1 5 3429 1 1 39 ARG HA H -2.542 -3.947 8.744 1.00 . A A . 39 ARG HA 1 1 5 3430 1 1 39 ARG HB2 H -1.903 -5.617 10.580 1.00 . A A . 39 ARG HB2 1 1 5 3431 1 1 39 ARG HB3 H -0.696 -6.221 9.454 1.00 . A A . 39 ARG HB3 1 1 5 3432 1 1 39 ARG HD2 H -1.789 -2.747 10.002 1.00 . A A . 39 ARG HD2 1 1 5 3433 1 1 39 ARG HD3 H -1.551 -3.334 11.648 1.00 . A A . 39 ARG HD3 1 1 5 3434 1 1 39 ARG HE H 0.812 -2.087 10.763 1.00 . A A . 39 ARG HE 1 1 5 3435 1 1 39 ARG HG2 H 0.322 -4.666 10.967 1.00 . A A . 39 ARG HG2 1 1 5 3436 1 1 39 ARG HG3 H 0.288 -3.968 9.346 1.00 . A A . 39 ARG HG3 1 1 5 3437 1 1 39 ARG HH11 H -2.474 -1.275 11.634 1.00 . A A . 39 ARG HH11 1 1 5 3438 1 1 39 ARG HH12 H -2.075 0.313 12.202 1.00 . A A . 39 ARG HH12 1 1 5 3439 1 1 39 ARG HH21 H 1.358 0.008 11.496 1.00 . A A . 39 ARG HH21 1 1 5 3440 1 1 39 ARG HH22 H 0.121 1.048 12.121 1.00 . A A . 39 ARG HH22 1 1 5 3441 1 1 39 ARG N N -3.312 -5.832 8.472 1.00 . A A . 39 ARG N 1 1 5 3442 1 1 39 ARG NE N -0.140 -1.948 10.994 1.00 . A A . 39 ARG NE 1 1 5 3443 1 1 39 ARG NH1 N -1.790 -0.561 11.807 1.00 . A A . 39 ARG NH1 1 1 5 3444 1 1 39 ARG NH2 N 0.393 0.169 11.728 1.00 . A A . 39 ARG NH2 1 1 5 3445 1 1 39 ARG O O -0.167 -4.771 7.233 1.00 . A A . 39 ARG O 1 1 5 3446 1 1 40 ARG C C -1.130 -3.664 4.405 1.00 . A A . 40 ARG C 1 1 5 3447 1 1 40 ARG CA C -1.482 -5.087 4.822 1.00 . A A . 40 ARG CA 1 1 5 3448 1 1 40 ARG CB C -2.420 -5.692 3.779 1.00 . A A . 40 ARG CB 1 1 5 3449 1 1 40 ARG CD C -3.309 -7.736 2.639 1.00 . A A . 40 ARG CD 1 1 5 3450 1 1 40 ARG CG C -2.424 -7.206 3.757 1.00 . A A . 40 ARG CG 1 1 5 3451 1 1 40 ARG CZ C -2.063 -9.745 1.916 1.00 . A A . 40 ARG CZ 1 1 5 3452 1 1 40 ARG H H -3.071 -5.217 6.222 1.00 . A A . 40 ARG H 1 1 5 3453 1 1 40 ARG HA H -0.578 -5.674 4.868 1.00 . A A . 40 ARG HA 1 1 5 3454 1 1 40 ARG HB2 H -3.426 -5.356 3.981 1.00 . A A . 40 ARG HB2 1 1 5 3455 1 1 40 ARG HB3 H -2.124 -5.341 2.801 1.00 . A A . 40 ARG HB3 1 1 5 3456 1 1 40 ARG HD2 H -4.340 -7.526 2.883 1.00 . A A . 40 ARG HD2 1 1 5 3457 1 1 40 ARG HD3 H -3.048 -7.232 1.720 1.00 . A A . 40 ARG HD3 1 1 5 3458 1 1 40 ARG HE H -3.879 -9.749 2.781 1.00 . A A . 40 ARG HE 1 1 5 3459 1 1 40 ARG HG2 H -1.415 -7.559 3.603 1.00 . A A . 40 ARG HG2 1 1 5 3460 1 1 40 ARG HG3 H -2.796 -7.570 4.703 1.00 . A A . 40 ARG HG3 1 1 5 3461 1 1 40 ARG HH11 H -1.185 -7.992 1.397 1.00 . A A . 40 ARG HH11 1 1 5 3462 1 1 40 ARG HH12 H -0.280 -9.411 0.986 1.00 . A A . 40 ARG HH12 1 1 5 3463 1 1 40 ARG HH21 H -2.686 -11.648 2.242 1.00 . A A . 40 ARG HH21 1 1 5 3464 1 1 40 ARG HH22 H -1.140 -11.497 1.474 1.00 . A A . 40 ARG HH22 1 1 5 3465 1 1 40 ARG N N -2.097 -5.100 6.145 1.00 . A A . 40 ARG N 1 1 5 3466 1 1 40 ARG NE N -3.150 -9.176 2.454 1.00 . A A . 40 ARG NE 1 1 5 3467 1 1 40 ARG NH1 N -1.100 -8.989 1.392 1.00 . A A . 40 ARG NH1 1 1 5 3468 1 1 40 ARG NH2 N -1.956 -11.070 1.873 1.00 . A A . 40 ARG NH2 1 1 5 3469 1 1 40 ARG O O -1.769 -2.707 4.846 1.00 . A A . 40 ARG O 1 1 5 3470 1 1 41 CYS C C -0.678 -1.763 1.959 1.00 . A A . 41 CYS C 1 1 5 3471 1 1 41 CYS CA C 0.284 -2.232 3.042 1.00 . A A . 41 CYS CA 1 1 5 3472 1 1 41 CYS CB C 1.704 -2.314 2.479 1.00 . A A . 41 CYS CB 1 1 5 3473 1 1 41 CYS H H 0.324 -4.335 3.218 1.00 . A A . 41 CYS H 1 1 5 3474 1 1 41 CYS HA H 0.264 -1.531 3.863 1.00 . A A . 41 CYS HA 1 1 5 3475 1 1 41 CYS HB2 H 2.406 -2.343 3.299 1.00 . A A . 41 CYS HB2 1 1 5 3476 1 1 41 CYS HB3 H 1.800 -3.221 1.900 1.00 . A A . 41 CYS HB3 1 1 5 3477 1 1 41 CYS N N -0.132 -3.534 3.544 1.00 . A A . 41 CYS N 1 1 5 3478 1 1 41 CYS O O -0.676 -2.297 0.853 1.00 . A A . 41 CYS O 1 1 5 3479 1 1 41 CYS SG S 2.172 -0.920 1.405 1.00 . A A . 41 CYS SG 1 1 5 3480 1 1 42 LEU C C -1.907 0.964 0.605 1.00 . A A . 42 LEU C 1 1 5 3481 1 1 42 LEU CA C -2.466 -0.245 1.331 1.00 . A A . 42 LEU CA 1 1 5 3482 1 1 42 LEU CB C -3.761 0.153 2.046 1.00 . A A . 42 LEU CB 1 1 5 3483 1 1 42 LEU CD1 C -4.295 -2.148 2.899 1.00 . A A . 42 LEU CD1 1 1 5 3484 1 1 42 LEU CD2 C -6.074 -0.400 2.835 1.00 . A A . 42 LEU CD2 1 1 5 3485 1 1 42 LEU CG C -4.828 -0.939 2.151 1.00 . A A . 42 LEU CG 1 1 5 3486 1 1 42 LEU H H -1.457 -0.389 3.185 1.00 . A A . 42 LEU H 1 1 5 3487 1 1 42 LEU HA H -2.682 -1.019 0.609 1.00 . A A . 42 LEU HA 1 1 5 3488 1 1 42 LEU HB2 H -3.505 0.466 3.048 1.00 . A A . 42 LEU HB2 1 1 5 3489 1 1 42 LEU HB3 H -4.191 1.002 1.526 1.00 . A A . 42 LEU HB3 1 1 5 3490 1 1 42 LEU HD11 H -4.660 -2.132 3.915 1.00 . A A . 42 LEU HD11 1 1 5 3491 1 1 42 LEU HD12 H -3.215 -2.121 2.903 1.00 . A A . 42 LEU HD12 1 1 5 3492 1 1 42 LEU HD13 H -4.631 -3.050 2.410 1.00 . A A . 42 LEU HD13 1 1 5 3493 1 1 42 LEU HD21 H -6.814 -0.150 2.089 1.00 . A A . 42 LEU HD21 1 1 5 3494 1 1 42 LEU HD22 H -5.820 0.483 3.401 1.00 . A A . 42 LEU HD22 1 1 5 3495 1 1 42 LEU HD23 H -6.473 -1.152 3.500 1.00 . A A . 42 LEU HD23 1 1 5 3496 1 1 42 LEU HG H -5.104 -1.259 1.157 1.00 . A A . 42 LEU HG 1 1 5 3497 1 1 42 LEU N N -1.499 -0.776 2.281 1.00 . A A . 42 LEU N 1 1 5 3498 1 1 42 LEU O O -1.574 1.972 1.230 1.00 . A A . 42 LEU O 1 1 5 3499 1 1 43 CYS C C -2.542 2.781 -2.016 1.00 . A A . 43 CYS C 1 1 5 3500 1 1 43 CYS CA C -1.357 1.979 -1.511 1.00 . A A . 43 CYS CA 1 1 5 3501 1 1 43 CYS CB C -0.512 1.472 -2.677 1.00 . A A . 43 CYS CB 1 1 5 3502 1 1 43 CYS H H -2.146 0.058 -1.158 1.00 . A A . 43 CYS H 1 1 5 3503 1 1 43 CYS HA H -0.750 2.610 -0.879 1.00 . A A . 43 CYS HA 1 1 5 3504 1 1 43 CYS HB2 H -1.100 0.795 -3.275 1.00 . A A . 43 CYS HB2 1 1 5 3505 1 1 43 CYS HB3 H -0.215 2.313 -3.287 1.00 . A A . 43 CYS HB3 1 1 5 3506 1 1 43 CYS N N -1.839 0.877 -0.708 1.00 . A A . 43 CYS N 1 1 5 3507 1 1 43 CYS O O -3.539 2.213 -2.471 1.00 . A A . 43 CYS O 1 1 5 3508 1 1 43 CYS SG S 1.001 0.598 -2.169 1.00 . A A . 43 CYS SG 1 1 5 3509 1 1 44 THR C C -3.030 6.057 -3.267 1.00 . A A . 44 THR C 1 1 5 3510 1 1 44 THR CA C -3.527 4.962 -2.337 1.00 . A A . 44 THR CA 1 1 5 3511 1 1 44 THR CB C -4.231 5.598 -1.124 1.00 . A A . 44 THR CB 1 1 5 3512 1 1 44 THR CG2 C -5.358 4.710 -0.621 1.00 . A A . 44 THR CG2 1 1 5 3513 1 1 44 THR H H -1.634 4.489 -1.524 1.00 . A A . 44 THR H 1 1 5 3514 1 1 44 THR HA H -4.250 4.358 -2.866 1.00 . A A . 44 THR HA 1 1 5 3515 1 1 44 THR HB H -4.649 6.547 -1.429 1.00 . A A . 44 THR HB 1 1 5 3516 1 1 44 THR HG1 H -2.489 6.229 -0.435 1.00 . A A . 44 THR HG1 1 1 5 3517 1 1 44 THR HG21 H -5.675 4.048 -1.413 1.00 . A A . 44 THR HG21 1 1 5 3518 1 1 44 THR HG22 H -6.190 5.326 -0.312 1.00 . A A . 44 THR HG22 1 1 5 3519 1 1 44 THR HG23 H -5.010 4.127 0.218 1.00 . A A . 44 THR HG23 1 1 5 3520 1 1 44 THR N N -2.449 4.092 -1.913 1.00 . A A . 44 THR N 1 1 5 3521 1 1 44 THR O O -1.942 6.604 -3.078 1.00 . A A . 44 THR O 1 1 5 3522 1 1 44 THR OG1 O -3.283 5.823 -0.070 1.00 . A A . 44 THR OG1 1 1 5 3523 1 1 45 LYS C C -4.781 7.853 -5.941 1.00 . A A . 45 LYS C 1 1 5 3524 1 1 45 LYS CA C -3.517 7.400 -5.236 1.00 . A A . 45 LYS CA 1 1 5 3525 1 1 45 LYS CB C -2.494 6.902 -6.262 1.00 . A A . 45 LYS CB 1 1 5 3526 1 1 45 LYS CD C -1.895 5.328 -8.106 1.00 . A A . 45 LYS CD 1 1 5 3527 1 1 45 LYS CE C -2.298 4.110 -8.917 1.00 . A A . 45 LYS CE 1 1 5 3528 1 1 45 LYS CG C -2.978 5.753 -7.132 1.00 . A A . 45 LYS CG 1 1 5 3529 1 1 45 LYS H H -4.696 5.886 -4.352 1.00 . A A . 45 LYS H 1 1 5 3530 1 1 45 LYS HA H -3.098 8.239 -4.699 1.00 . A A . 45 LYS HA 1 1 5 3531 1 1 45 LYS HB2 H -2.229 7.723 -6.911 1.00 . A A . 45 LYS HB2 1 1 5 3532 1 1 45 LYS HB3 H -1.608 6.576 -5.736 1.00 . A A . 45 LYS HB3 1 1 5 3533 1 1 45 LYS HD2 H -1.696 6.145 -8.784 1.00 . A A . 45 LYS HD2 1 1 5 3534 1 1 45 LYS HD3 H -0.998 5.097 -7.550 1.00 . A A . 45 LYS HD3 1 1 5 3535 1 1 45 LYS HE2 H -2.658 3.346 -8.243 1.00 . A A . 45 LYS HE2 1 1 5 3536 1 1 45 LYS HE3 H -3.088 4.390 -9.599 1.00 . A A . 45 LYS HE3 1 1 5 3537 1 1 45 LYS HG2 H -3.235 4.915 -6.500 1.00 . A A . 45 LYS HG2 1 1 5 3538 1 1 45 LYS HG3 H -3.848 6.073 -7.687 1.00 . A A . 45 LYS HG3 1 1 5 3539 1 1 45 LYS HZ1 H -0.990 2.571 -9.453 1.00 . A A . 45 LYS HZ1 1 1 5 3540 1 1 45 LYS HZ2 H -0.283 4.109 -9.477 1.00 . A A . 45 LYS HZ2 1 1 5 3541 1 1 45 LYS HZ3 H -1.342 3.642 -10.714 1.00 . A A . 45 LYS HZ3 1 1 5 3542 1 1 45 LYS N N -3.840 6.367 -4.266 1.00 . A A . 45 LYS N 1 1 5 3543 1 1 45 LYS NZ N -1.151 3.569 -9.696 1.00 . A A . 45 LYS NZ 1 1 5 3544 1 1 45 LYS O O -5.769 7.121 -5.979 1.00 . A A . 45 LYS O 1 1 5 3545 1 1 46 GLU C C -6.014 8.991 -8.578 1.00 . A A . 46 GLU C 1 1 5 3546 1 1 46 GLU CA C -5.897 9.598 -7.182 1.00 . A A . 46 GLU CA 1 1 5 3547 1 1 46 GLU CB C -5.810 11.130 -7.263 1.00 . A A . 46 GLU CB 1 1 5 3548 1 1 46 GLU CD C -3.451 11.893 -6.675 1.00 . A A . 46 GLU CD 1 1 5 3549 1 1 46 GLU CG C -4.477 11.669 -7.777 1.00 . A A . 46 GLU CG 1 1 5 3550 1 1 46 GLU H H -3.929 9.597 -6.411 1.00 . A A . 46 GLU H 1 1 5 3551 1 1 46 GLU HA H -6.780 9.330 -6.619 1.00 . A A . 46 GLU HA 1 1 5 3552 1 1 46 GLU HB2 H -6.589 11.484 -7.921 1.00 . A A . 46 GLU HB2 1 1 5 3553 1 1 46 GLU HB3 H -5.978 11.536 -6.276 1.00 . A A . 46 GLU HB3 1 1 5 3554 1 1 46 GLU HG2 H -4.069 10.962 -8.484 1.00 . A A . 46 GLU HG2 1 1 5 3555 1 1 46 GLU HG3 H -4.656 12.609 -8.277 1.00 . A A . 46 GLU HG3 1 1 5 3556 1 1 46 GLU N N -4.752 9.051 -6.484 1.00 . A A . 46 GLU N 1 1 5 3557 1 1 46 GLU O O -5.009 8.665 -9.216 1.00 . A A . 46 GLU O 1 1 5 3558 1 1 46 GLU OE1 O -3.014 10.904 -6.045 1.00 . A A . 46 GLU OE1 1 1 5 3559 1 1 46 GLU OE2 O -3.083 13.060 -6.439 1.00 . A A . 46 GLU OE2 1 1 5 3560 1 1 47 CYS C C -8.971 8.568 -10.717 1.00 . A A . 47 CYS C 1 1 5 3561 1 1 47 CYS CA C -7.530 8.259 -10.338 1.00 . A A . 47 CYS CA 1 1 5 3562 1 1 47 CYS CB C -7.301 6.745 -10.333 1.00 . A A . 47 CYS CB 1 1 5 3563 1 1 47 CYS H H -7.998 9.102 -8.471 1.00 . A A . 47 CYS H 1 1 5 3564 1 1 47 CYS HA H -6.866 8.716 -11.054 1.00 . A A . 47 CYS HA 1 1 5 3565 1 1 47 CYS HB2 H -7.501 6.356 -11.320 1.00 . A A . 47 CYS HB2 1 1 5 3566 1 1 47 CYS HB3 H -6.271 6.546 -10.076 1.00 . A A . 47 CYS HB3 1 1 5 3567 1 1 47 CYS N N -7.246 8.830 -9.032 1.00 . A A . 47 CYS N 1 1 5 3568 1 1 47 CYS O O -9.736 8.968 -9.810 1.00 . A A . 47 CYS O 1 1 5 3569 1 1 47 CYS OXT O -9.327 8.419 -11.900 1.00 . A A . 47 CYS OXT 1 1 5 3570 1 1 47 CYS SG S -8.353 5.830 -9.157 1.00 . A A . 47 CYS SG 1 1 6 3571 1 1 1 ALA C C -8.284 10.617 -7.834 1.00 . A A . 1 ALA C 1 1 6 3572 1 1 1 ALA CA C -9.292 11.304 -8.752 1.00 . A A . 1 ALA CA 1 1 6 3573 1 1 1 ALA CB C -9.001 12.795 -8.848 1.00 . A A . 1 ALA CB 1 1 6 3574 1 1 1 ALA H1 H -11.120 10.320 -8.812 1.00 . A A . 1 ALA H1 1 1 6 3575 1 1 1 ALA H2 H -11.230 11.950 -8.376 1.00 . A A . 1 ALA H2 1 1 6 3576 1 1 1 ALA H3 H -10.654 10.815 -7.262 1.00 . A A . 1 ALA H3 1 1 6 3577 1 1 1 ALA HA H -9.215 10.881 -9.742 1.00 . A A . 1 ALA HA 1 1 6 3578 1 1 1 ALA HB1 H -7.937 12.960 -8.761 1.00 . A A . 1 ALA HB1 1 1 6 3579 1 1 1 ALA HB2 H -9.511 13.314 -8.049 1.00 . A A . 1 ALA HB2 1 1 6 3580 1 1 1 ALA HB3 H -9.347 13.170 -9.800 1.00 . A A . 1 ALA HB3 1 1 6 3581 1 1 1 ALA N N -10.671 11.082 -8.266 1.00 . A A . 1 ALA N 1 1 6 3582 1 1 1 ALA O O -7.226 11.167 -7.527 1.00 . A A . 1 ALA O 1 1 6 3583 1 1 2 THR C C -8.015 7.156 -6.718 1.00 . A A . 2 THR C 1 1 6 3584 1 1 2 THR CA C -7.756 8.643 -6.511 1.00 . A A . 2 THR CA 1 1 6 3585 1 1 2 THR CB C -7.998 9.006 -5.031 1.00 . A A . 2 THR CB 1 1 6 3586 1 1 2 THR CG2 C -6.911 8.419 -4.141 1.00 . A A . 2 THR CG2 1 1 6 3587 1 1 2 THR H H -9.472 9.019 -7.668 1.00 . A A . 2 THR H 1 1 6 3588 1 1 2 THR HA H -6.729 8.867 -6.761 1.00 . A A . 2 THR HA 1 1 6 3589 1 1 2 THR HB H -8.952 8.600 -4.726 1.00 . A A . 2 THR HB 1 1 6 3590 1 1 2 THR HG1 H -7.338 10.825 -5.429 1.00 . A A . 2 THR HG1 1 1 6 3591 1 1 2 THR HG21 H -7.302 7.561 -3.614 1.00 . A A . 2 THR HG21 1 1 6 3592 1 1 2 THR HG22 H -6.589 9.164 -3.427 1.00 . A A . 2 THR HG22 1 1 6 3593 1 1 2 THR HG23 H -6.072 8.117 -4.750 1.00 . A A . 2 THR HG23 1 1 6 3594 1 1 2 THR N N -8.622 9.412 -7.391 1.00 . A A . 2 THR N 1 1 6 3595 1 1 2 THR O O -9.157 6.707 -6.626 1.00 . A A . 2 THR O 1 1 6 3596 1 1 2 THR OG1 O -8.025 10.432 -4.877 1.00 . A A . 2 THR OG1 1 1 6 3597 1 1 3 CYS C C -6.352 4.152 -6.229 1.00 . A A . 3 CYS C 1 1 6 3598 1 1 3 CYS CA C -7.114 4.977 -7.257 1.00 . A A . 3 CYS CA 1 1 6 3599 1 1 3 CYS CB C -6.650 4.631 -8.673 1.00 . A A . 3 CYS CB 1 1 6 3600 1 1 3 CYS H H -6.082 6.821 -7.098 1.00 . A A . 3 CYS H 1 1 6 3601 1 1 3 CYS HA H -8.164 4.739 -7.173 1.00 . A A . 3 CYS HA 1 1 6 3602 1 1 3 CYS HB2 H -5.745 5.181 -8.893 1.00 . A A . 3 CYS HB2 1 1 6 3603 1 1 3 CYS HB3 H -6.449 3.572 -8.733 1.00 . A A . 3 CYS HB3 1 1 6 3604 1 1 3 CYS N N -6.971 6.404 -7.017 1.00 . A A . 3 CYS N 1 1 6 3605 1 1 3 CYS O O -5.187 4.423 -5.935 1.00 . A A . 3 CYS O 1 1 6 3606 1 1 3 CYS SG S -7.868 5.045 -9.960 1.00 . A A . 3 CYS SG 1 1 6 3607 1 1 4 LYS C C -6.295 0.855 -5.292 1.00 . A A . 4 LYS C 1 1 6 3608 1 1 4 LYS CA C -6.440 2.250 -4.703 1.00 . A A . 4 LYS CA 1 1 6 3609 1 1 4 LYS CB C -7.330 2.203 -3.445 1.00 . A A . 4 LYS CB 1 1 6 3610 1 1 4 LYS CD C -6.529 0.030 -2.370 1.00 . A A . 4 LYS CD 1 1 6 3611 1 1 4 LYS CE C -7.862 -0.676 -2.577 1.00 . A A . 4 LYS CE 1 1 6 3612 1 1 4 LYS CG C -6.694 1.541 -2.217 1.00 . A A . 4 LYS CG 1 1 6 3613 1 1 4 LYS H H -7.949 2.982 -5.982 1.00 . A A . 4 LYS H 1 1 6 3614 1 1 4 LYS HA H -5.459 2.625 -4.437 1.00 . A A . 4 LYS HA 1 1 6 3615 1 1 4 LYS HB2 H -7.596 3.213 -3.176 1.00 . A A . 4 LYS HB2 1 1 6 3616 1 1 4 LYS HB3 H -8.233 1.661 -3.686 1.00 . A A . 4 LYS HB3 1 1 6 3617 1 1 4 LYS HD2 H -5.897 -0.167 -3.223 1.00 . A A . 4 LYS HD2 1 1 6 3618 1 1 4 LYS HD3 H -6.061 -0.361 -1.478 1.00 . A A . 4 LYS HD3 1 1 6 3619 1 1 4 LYS HE2 H -8.432 -0.617 -1.661 1.00 . A A . 4 LYS HE2 1 1 6 3620 1 1 4 LYS HE3 H -8.401 -0.175 -3.368 1.00 . A A . 4 LYS HE3 1 1 6 3621 1 1 4 LYS HG2 H -5.721 1.978 -2.054 1.00 . A A . 4 LYS HG2 1 1 6 3622 1 1 4 LYS HG3 H -7.321 1.737 -1.358 1.00 . A A . 4 LYS HG3 1 1 6 3623 1 1 4 LYS HZ1 H -7.089 -2.193 -3.794 1.00 . A A . 4 LYS HZ1 1 1 6 3624 1 1 4 LYS HZ2 H -8.601 -2.550 -3.134 1.00 . A A . 4 LYS HZ2 1 1 6 3625 1 1 4 LYS HZ3 H -7.216 -2.631 -2.163 1.00 . A A . 4 LYS HZ3 1 1 6 3626 1 1 4 LYS N N -7.026 3.140 -5.694 1.00 . A A . 4 LYS N 1 1 6 3627 1 1 4 LYS NZ N -7.683 -2.109 -2.943 1.00 . A A . 4 LYS NZ 1 1 6 3628 1 1 4 LYS O O -7.257 0.282 -5.801 1.00 . A A . 4 LYS O 1 1 6 3629 1 1 5 ALA C C -3.575 -1.541 -4.955 1.00 . A A . 5 ALA C 1 1 6 3630 1 1 5 ALA CA C -4.805 -1.021 -5.670 1.00 . A A . 5 ALA CA 1 1 6 3631 1 1 5 ALA CB C -4.585 -1.012 -7.177 1.00 . A A . 5 ALA CB 1 1 6 3632 1 1 5 ALA H H -4.382 0.825 -4.744 1.00 . A A . 5 ALA H 1 1 6 3633 1 1 5 ALA HA H -5.647 -1.660 -5.447 1.00 . A A . 5 ALA HA 1 1 6 3634 1 1 5 ALA HB1 H -3.643 -0.532 -7.401 1.00 . A A . 5 ALA HB1 1 1 6 3635 1 1 5 ALA HB2 H -5.387 -0.470 -7.655 1.00 . A A . 5 ALA HB2 1 1 6 3636 1 1 5 ALA HB3 H -4.567 -2.027 -7.545 1.00 . A A . 5 ALA HB3 1 1 6 3637 1 1 5 ALA N N -5.100 0.313 -5.186 1.00 . A A . 5 ALA N 1 1 6 3638 1 1 5 ALA O O -2.542 -0.878 -4.943 1.00 . A A . 5 ALA O 1 1 6 3639 1 1 6 GLU C C -1.455 -3.590 -4.596 1.00 . A A . 6 GLU C 1 1 6 3640 1 1 6 GLU CA C -2.584 -3.300 -3.627 1.00 . A A . 6 GLU CA 1 1 6 3641 1 1 6 GLU CB C -3.005 -4.582 -2.889 1.00 . A A . 6 GLU CB 1 1 6 3642 1 1 6 GLU CD C -5.459 -4.083 -2.273 1.00 . A A . 6 GLU CD 1 1 6 3643 1 1 6 GLU CG C -4.040 -4.364 -1.785 1.00 . A A . 6 GLU CG 1 1 6 3644 1 1 6 GLU H H -4.546 -3.192 -4.379 1.00 . A A . 6 GLU H 1 1 6 3645 1 1 6 GLU HA H -2.240 -2.575 -2.904 1.00 . A A . 6 GLU HA 1 1 6 3646 1 1 6 GLU HB2 H -3.403 -5.287 -3.597 1.00 . A A . 6 GLU HB2 1 1 6 3647 1 1 6 GLU HB3 H -2.126 -5.014 -2.435 1.00 . A A . 6 GLU HB3 1 1 6 3648 1 1 6 GLU HG2 H -4.070 -5.250 -1.169 1.00 . A A . 6 GLU HG2 1 1 6 3649 1 1 6 GLU HG3 H -3.718 -3.528 -1.180 1.00 . A A . 6 GLU HG3 1 1 6 3650 1 1 6 GLU N N -3.691 -2.710 -4.347 1.00 . A A . 6 GLU N 1 1 6 3651 1 1 6 GLU O O -1.701 -3.944 -5.752 1.00 . A A . 6 GLU O 1 1 6 3652 1 1 6 GLU OE1 O -5.703 -4.068 -3.495 1.00 . A A . 6 GLU OE1 1 1 6 3653 1 1 6 GLU OE2 O -6.350 -3.866 -1.420 1.00 . A A . 6 GLU OE2 1 1 6 3654 1 1 7 CYS C C 0.886 -5.005 -5.627 1.00 . A A . 7 CYS C 1 1 6 3655 1 1 7 CYS CA C 0.944 -3.624 -4.976 1.00 . A A . 7 CYS CA 1 1 6 3656 1 1 7 CYS CB C 2.236 -3.478 -4.165 1.00 . A A . 7 CYS CB 1 1 6 3657 1 1 7 CYS H H -0.115 -3.096 -3.209 1.00 . A A . 7 CYS H 1 1 6 3658 1 1 7 CYS HA H 0.933 -2.875 -5.755 1.00 . A A . 7 CYS HA 1 1 6 3659 1 1 7 CYS HB2 H 2.210 -2.543 -3.625 1.00 . A A . 7 CYS HB2 1 1 6 3660 1 1 7 CYS HB3 H 2.305 -4.294 -3.461 1.00 . A A . 7 CYS HB3 1 1 6 3661 1 1 7 CYS N N -0.229 -3.405 -4.133 1.00 . A A . 7 CYS N 1 1 6 3662 1 1 7 CYS O O 0.680 -6.009 -4.946 1.00 . A A . 7 CYS O 1 1 6 3663 1 1 7 CYS SG S 3.753 -3.490 -5.183 1.00 . A A . 7 CYS SG 1 1 6 3664 1 1 8 PRO C C 1.929 -7.378 -7.162 1.00 . A A . 8 PRO C 1 1 6 3665 1 1 8 PRO CA C 0.992 -6.318 -7.725 1.00 . A A . 8 PRO CA 1 1 6 3666 1 1 8 PRO CB C 1.434 -5.902 -9.129 1.00 . A A . 8 PRO CB 1 1 6 3667 1 1 8 PRO CD C 1.265 -3.897 -7.841 1.00 . A A . 8 PRO CD 1 1 6 3668 1 1 8 PRO CG C 1.082 -4.459 -9.224 1.00 . A A . 8 PRO CG 1 1 6 3669 1 1 8 PRO HA H -0.013 -6.713 -7.763 1.00 . A A . 8 PRO HA 1 1 6 3670 1 1 8 PRO HB2 H 2.498 -6.058 -9.235 1.00 . A A . 8 PRO HB2 1 1 6 3671 1 1 8 PRO HB3 H 0.903 -6.487 -9.865 1.00 . A A . 8 PRO HB3 1 1 6 3672 1 1 8 PRO HD2 H 2.266 -3.508 -7.721 1.00 . A A . 8 PRO HD2 1 1 6 3673 1 1 8 PRO HD3 H 0.534 -3.126 -7.647 1.00 . A A . 8 PRO HD3 1 1 6 3674 1 1 8 PRO HG2 H 1.743 -3.964 -9.920 1.00 . A A . 8 PRO HG2 1 1 6 3675 1 1 8 PRO HG3 H 0.055 -4.351 -9.538 1.00 . A A . 8 PRO HG3 1 1 6 3676 1 1 8 PRO N N 1.046 -5.062 -6.965 1.00 . A A . 8 PRO N 1 1 6 3677 1 1 8 PRO O O 1.565 -8.544 -7.040 1.00 . A A . 8 PRO O 1 1 6 3678 1 1 9 THR C C 4.004 -7.867 -4.713 1.00 . A A . 9 THR C 1 1 6 3679 1 1 9 THR CA C 4.109 -7.870 -6.233 1.00 . A A . 9 THR CA 1 1 6 3680 1 1 9 THR CB C 5.542 -7.489 -6.654 1.00 . A A . 9 THR CB 1 1 6 3681 1 1 9 THR CG2 C 5.748 -7.713 -8.145 1.00 . A A . 9 THR CG2 1 1 6 3682 1 1 9 THR H H 3.361 -6.016 -6.908 1.00 . A A . 9 THR H 1 1 6 3683 1 1 9 THR HA H 3.897 -8.864 -6.600 1.00 . A A . 9 THR HA 1 1 6 3684 1 1 9 THR HB H 6.238 -8.114 -6.112 1.00 . A A . 9 THR HB 1 1 6 3685 1 1 9 THR HG1 H 5.287 -5.870 -5.546 1.00 . A A . 9 THR HG1 1 1 6 3686 1 1 9 THR HG21 H 4.900 -8.247 -8.549 1.00 . A A . 9 THR HG21 1 1 6 3687 1 1 9 THR HG22 H 6.645 -8.293 -8.301 1.00 . A A . 9 THR HG22 1 1 6 3688 1 1 9 THR HG23 H 5.844 -6.759 -8.642 1.00 . A A . 9 THR HG23 1 1 6 3689 1 1 9 THR N N 3.132 -6.961 -6.803 1.00 . A A . 9 THR N 1 1 6 3690 1 1 9 THR O O 5.004 -7.702 -4.012 1.00 . A A . 9 THR O 1 1 6 3691 1 1 9 THR OG1 O 5.801 -6.114 -6.333 1.00 . A A . 9 THR OG1 1 1 6 3692 1 1 10 TRP C C 1.296 -8.824 -2.449 1.00 . A A . 10 TRP C 1 1 6 3693 1 1 10 TRP CA C 2.551 -8.028 -2.781 1.00 . A A . 10 TRP CA 1 1 6 3694 1 1 10 TRP CB C 2.403 -6.596 -2.262 1.00 . A A . 10 TRP CB 1 1 6 3695 1 1 10 TRP CD1 C 1.733 -6.893 0.188 1.00 . A A . 10 TRP CD1 1 1 6 3696 1 1 10 TRP CD2 C 3.725 -5.917 -0.114 1.00 . A A . 10 TRP CD2 1 1 6 3697 1 1 10 TRP CE2 C 3.491 -6.028 1.269 1.00 . A A . 10 TRP CE2 1 1 6 3698 1 1 10 TRP CE3 C 4.915 -5.331 -0.552 1.00 . A A . 10 TRP CE3 1 1 6 3699 1 1 10 TRP CG C 2.597 -6.486 -0.784 1.00 . A A . 10 TRP CG 1 1 6 3700 1 1 10 TRP CH2 C 5.562 -5.000 1.755 1.00 . A A . 10 TRP CH2 1 1 6 3701 1 1 10 TRP CZ2 C 4.409 -5.570 2.216 1.00 . A A . 10 TRP CZ2 1 1 6 3702 1 1 10 TRP CZ3 C 5.819 -4.878 0.386 1.00 . A A . 10 TRP CZ3 1 1 6 3703 1 1 10 TRP H H 2.024 -8.142 -4.821 1.00 . A A . 10 TRP H 1 1 6 3704 1 1 10 TRP HA H 3.399 -8.492 -2.301 1.00 . A A . 10 TRP HA 1 1 6 3705 1 1 10 TRP HB2 H 3.137 -5.967 -2.744 1.00 . A A . 10 TRP HB2 1 1 6 3706 1 1 10 TRP HB3 H 1.413 -6.234 -2.499 1.00 . A A . 10 TRP HB3 1 1 6 3707 1 1 10 TRP HD1 H 0.775 -7.364 -0.008 1.00 . A A . 10 TRP HD1 1 1 6 3708 1 1 10 TRP HE1 H 1.842 -6.849 2.290 1.00 . A A . 10 TRP HE1 1 1 6 3709 1 1 10 TRP HE3 H 5.131 -5.229 -1.605 1.00 . A A . 10 TRP HE3 1 1 6 3710 1 1 10 TRP HH2 H 6.298 -4.629 2.453 1.00 . A A . 10 TRP HH2 1 1 6 3711 1 1 10 TRP HZ2 H 4.232 -5.654 3.277 1.00 . A A . 10 TRP HZ2 1 1 6 3712 1 1 10 TRP HZ3 H 6.741 -4.418 0.065 1.00 . A A . 10 TRP HZ3 1 1 6 3713 1 1 10 TRP N N 2.788 -8.028 -4.211 1.00 . A A . 10 TRP N 1 1 6 3714 1 1 10 TRP NE1 N 2.267 -6.633 1.430 1.00 . A A . 10 TRP NE1 1 1 6 3715 1 1 10 TRP O O 0.269 -8.696 -3.113 1.00 . A A . 10 TRP O 1 1 6 3716 1 1 11 ASP C C 0.371 -10.720 0.528 1.00 . A A . 11 ASP C 1 1 6 3717 1 1 11 ASP CA C 0.288 -10.477 -0.973 1.00 . A A . 11 ASP CA 1 1 6 3718 1 1 11 ASP CB C 0.300 -11.821 -1.719 1.00 . A A . 11 ASP CB 1 1 6 3719 1 1 11 ASP CG C 1.633 -12.555 -1.611 1.00 . A A . 11 ASP CG 1 1 6 3720 1 1 11 ASP H H 2.247 -9.694 -0.939 1.00 . A A . 11 ASP H 1 1 6 3721 1 1 11 ASP HA H -0.632 -9.957 -1.195 1.00 . A A . 11 ASP HA 1 1 6 3722 1 1 11 ASP HB2 H -0.470 -12.457 -1.309 1.00 . A A . 11 ASP HB2 1 1 6 3723 1 1 11 ASP HB3 H 0.093 -11.644 -2.764 1.00 . A A . 11 ASP HB3 1 1 6 3724 1 1 11 ASP N N 1.397 -9.642 -1.416 1.00 . A A . 11 ASP N 1 1 6 3725 1 1 11 ASP O O -0.641 -10.928 1.199 1.00 . A A . 11 ASP O 1 1 6 3726 1 1 11 ASP OD1 O 2.038 -12.915 -0.481 1.00 . A A . 11 ASP OD1 1 1 6 3727 1 1 11 ASP OD2 O 2.280 -12.762 -2.656 1.00 . A A . 11 ASP OD2 1 1 6 3728 1 1 12 SER C C 1.448 -9.831 3.348 1.00 . A A . 12 SER C 1 1 6 3729 1 1 12 SER CA C 1.866 -10.984 2.432 1.00 . A A . 12 SER CA 1 1 6 3730 1 1 12 SER CB C 3.352 -11.284 2.601 1.00 . A A . 12 SER CB 1 1 6 3731 1 1 12 SER H H 2.347 -10.578 0.428 1.00 . A A . 12 SER H 1 1 6 3732 1 1 12 SER HA H 1.307 -11.863 2.714 1.00 . A A . 12 SER HA 1 1 6 3733 1 1 12 SER HB2 H 3.925 -10.394 2.384 1.00 . A A . 12 SER HB2 1 1 6 3734 1 1 12 SER HB3 H 3.542 -11.596 3.618 1.00 . A A . 12 SER HB3 1 1 6 3735 1 1 12 SER HG H 3.062 -12.498 1.067 1.00 . A A . 12 SER HG 1 1 6 3736 1 1 12 SER N N 1.594 -10.724 1.031 1.00 . A A . 12 SER N 1 1 6 3737 1 1 12 SER O O 1.034 -8.758 2.895 1.00 . A A . 12 SER O 1 1 6 3738 1 1 12 SER OG O 3.764 -12.319 1.721 1.00 . A A . 12 SER OG 1 1 6 3739 1 1 13 VAL C C 2.312 -8.047 5.815 1.00 . A A . 13 VAL C 1 1 6 3740 1 1 13 VAL CA C 1.218 -9.105 5.668 1.00 . A A . 13 VAL CA 1 1 6 3741 1 1 13 VAL CB C 0.998 -9.817 7.024 1.00 . A A . 13 VAL CB 1 1 6 3742 1 1 13 VAL CG1 C 0.785 -8.820 8.151 1.00 . A A . 13 VAL CG1 1 1 6 3743 1 1 13 VAL CG2 C -0.177 -10.779 6.933 1.00 . A A . 13 VAL CG2 1 1 6 3744 1 1 13 VAL H H 1.907 -10.951 4.927 1.00 . A A . 13 VAL H 1 1 6 3745 1 1 13 VAL HA H 0.294 -8.625 5.377 1.00 . A A . 13 VAL HA 1 1 6 3746 1 1 13 VAL HB H 1.884 -10.392 7.250 1.00 . A A . 13 VAL HB 1 1 6 3747 1 1 13 VAL HG11 H 0.512 -9.349 9.052 1.00 . A A . 13 VAL HG11 1 1 6 3748 1 1 13 VAL HG12 H -0.006 -8.136 7.882 1.00 . A A . 13 VAL HG12 1 1 6 3749 1 1 13 VAL HG13 H 1.697 -8.267 8.320 1.00 . A A . 13 VAL HG13 1 1 6 3750 1 1 13 VAL HG21 H -0.826 -10.479 6.124 1.00 . A A . 13 VAL HG21 1 1 6 3751 1 1 13 VAL HG22 H -0.727 -10.763 7.862 1.00 . A A . 13 VAL HG22 1 1 6 3752 1 1 13 VAL HG23 H 0.190 -11.778 6.749 1.00 . A A . 13 VAL HG23 1 1 6 3753 1 1 13 VAL N N 1.570 -10.077 4.645 1.00 . A A . 13 VAL N 1 1 6 3754 1 1 13 VAL O O 3.492 -8.370 5.939 1.00 . A A . 13 VAL O 1 1 6 3755 1 1 14 CYS C C 3.122 -5.351 7.384 1.00 . A A . 14 CYS C 1 1 6 3756 1 1 14 CYS CA C 2.830 -5.672 5.922 1.00 . A A . 14 CYS CA 1 1 6 3757 1 1 14 CYS CB C 2.264 -4.428 5.238 1.00 . A A . 14 CYS CB 1 1 6 3758 1 1 14 CYS H H 0.945 -6.599 5.688 1.00 . A A . 14 CYS H 1 1 6 3759 1 1 14 CYS HA H 3.753 -5.949 5.436 1.00 . A A . 14 CYS HA 1 1 6 3760 1 1 14 CYS HB2 H 2.499 -4.466 4.184 1.00 . A A . 14 CYS HB2 1 1 6 3761 1 1 14 CYS HB3 H 1.192 -4.411 5.364 1.00 . A A . 14 CYS HB3 1 1 6 3762 1 1 14 CYS N N 1.905 -6.787 5.793 1.00 . A A . 14 CYS N 1 1 6 3763 1 1 14 CYS O O 2.213 -5.281 8.213 1.00 . A A . 14 CYS O 1 1 6 3764 1 1 14 CYS SG S 2.930 -2.867 5.902 1.00 . A A . 14 CYS SG 1 1 6 3765 1 1 15 ILE C C 5.010 -3.279 9.160 1.00 . A A . 15 ILE C 1 1 6 3766 1 1 15 ILE CA C 4.798 -4.790 9.040 1.00 . A A . 15 ILE CA 1 1 6 3767 1 1 15 ILE CB C 6.100 -5.524 9.461 1.00 . A A . 15 ILE CB 1 1 6 3768 1 1 15 ILE CD1 C 6.085 -7.663 8.054 1.00 . A A . 15 ILE CD1 1 1 6 3769 1 1 15 ILE CG1 C 5.917 -7.048 9.429 1.00 . A A . 15 ILE CG1 1 1 6 3770 1 1 15 ILE CG2 C 6.540 -5.082 10.851 1.00 . A A . 15 ILE CG2 1 1 6 3771 1 1 15 ILE H H 5.066 -5.184 6.984 1.00 . A A . 15 ILE H 1 1 6 3772 1 1 15 ILE HA H 4.006 -5.087 9.712 1.00 . A A . 15 ILE HA 1 1 6 3773 1 1 15 ILE HB H 6.878 -5.249 8.764 1.00 . A A . 15 ILE HB 1 1 6 3774 1 1 15 ILE HD11 H 5.356 -8.449 7.921 1.00 . A A . 15 ILE HD11 1 1 6 3775 1 1 15 ILE HD12 H 7.079 -8.074 7.963 1.00 . A A . 15 ILE HD12 1 1 6 3776 1 1 15 ILE HD13 H 5.938 -6.905 7.300 1.00 . A A . 15 ILE HD13 1 1 6 3777 1 1 15 ILE HG12 H 6.645 -7.503 10.083 1.00 . A A . 15 ILE HG12 1 1 6 3778 1 1 15 ILE HG13 H 4.925 -7.290 9.782 1.00 . A A . 15 ILE HG13 1 1 6 3779 1 1 15 ILE HG21 H 6.076 -5.714 11.593 1.00 . A A . 15 ILE HG21 1 1 6 3780 1 1 15 ILE HG22 H 6.242 -4.057 11.014 1.00 . A A . 15 ILE HG22 1 1 6 3781 1 1 15 ILE HG23 H 7.614 -5.162 10.930 1.00 . A A . 15 ILE HG23 1 1 6 3782 1 1 15 ILE N N 4.390 -5.130 7.688 1.00 . A A . 15 ILE N 1 1 6 3783 1 1 15 ILE O O 4.476 -2.634 10.062 1.00 . A A . 15 ILE O 1 1 6 3784 1 1 16 ASN C C 5.680 -0.651 6.909 1.00 . A A . 16 ASN C 1 1 6 3785 1 1 16 ASN CA C 6.095 -1.298 8.234 1.00 . A A . 16 ASN CA 1 1 6 3786 1 1 16 ASN CB C 7.593 -1.098 8.512 1.00 . A A . 16 ASN CB 1 1 6 3787 1 1 16 ASN CG C 8.051 0.347 8.417 1.00 . A A . 16 ASN CG 1 1 6 3788 1 1 16 ASN H H 6.182 -3.294 7.546 1.00 . A A . 16 ASN H 1 1 6 3789 1 1 16 ASN HA H 5.529 -0.841 9.032 1.00 . A A . 16 ASN HA 1 1 6 3790 1 1 16 ASN HB2 H 7.813 -1.453 9.507 1.00 . A A . 16 ASN HB2 1 1 6 3791 1 1 16 ASN HB3 H 8.160 -1.680 7.799 1.00 . A A . 16 ASN HB3 1 1 6 3792 1 1 16 ASN HD21 H 9.773 -0.237 7.622 1.00 . A A . 16 ASN HD21 1 1 6 3793 1 1 16 ASN HD22 H 9.588 1.463 7.853 1.00 . A A . 16 ASN HD22 1 1 6 3794 1 1 16 ASN N N 5.793 -2.727 8.239 1.00 . A A . 16 ASN N 1 1 6 3795 1 1 16 ASN ND2 N 9.256 0.546 7.906 1.00 . A A . 16 ASN ND2 1 1 6 3796 1 1 16 ASN O O 5.646 -1.311 5.871 1.00 . A A . 16 ASN O 1 1 6 3797 1 1 16 ASN OD1 O 7.348 1.273 8.819 1.00 . A A . 16 ASN OD1 1 1 6 3798 1 1 17 LYS C C 5.979 1.515 4.716 1.00 . A A . 17 LYS C 1 1 6 3799 1 1 17 LYS CA C 4.897 1.398 5.799 1.00 . A A . 17 LYS CA 1 1 6 3800 1 1 17 LYS CB C 4.438 2.797 6.238 1.00 . A A . 17 LYS CB 1 1 6 3801 1 1 17 LYS CD C 3.585 5.082 5.601 1.00 . A A . 17 LYS CD 1 1 6 3802 1 1 17 LYS CE C 3.488 6.112 4.479 1.00 . A A . 17 LYS CE 1 1 6 3803 1 1 17 LYS CG C 4.030 3.717 5.091 1.00 . A A . 17 LYS CG 1 1 6 3804 1 1 17 LYS H H 5.379 1.088 7.839 1.00 . A A . 17 LYS H 1 1 6 3805 1 1 17 LYS HA H 4.050 0.878 5.377 1.00 . A A . 17 LYS HA 1 1 6 3806 1 1 17 LYS HB2 H 3.591 2.691 6.899 1.00 . A A . 17 LYS HB2 1 1 6 3807 1 1 17 LYS HB3 H 5.244 3.271 6.779 1.00 . A A . 17 LYS HB3 1 1 6 3808 1 1 17 LYS HD2 H 2.615 4.981 6.064 1.00 . A A . 17 LYS HD2 1 1 6 3809 1 1 17 LYS HD3 H 4.298 5.429 6.334 1.00 . A A . 17 LYS HD3 1 1 6 3810 1 1 17 LYS HE2 H 3.257 7.073 4.913 1.00 . A A . 17 LYS HE2 1 1 6 3811 1 1 17 LYS HE3 H 4.444 6.168 3.980 1.00 . A A . 17 LYS HE3 1 1 6 3812 1 1 17 LYS HG2 H 4.874 3.849 4.430 1.00 . A A . 17 LYS HG2 1 1 6 3813 1 1 17 LYS HG3 H 3.214 3.261 4.550 1.00 . A A . 17 LYS HG3 1 1 6 3814 1 1 17 LYS HZ1 H 2.407 4.749 3.310 1.00 . A A . 17 LYS HZ1 1 1 6 3815 1 1 17 LYS HZ2 H 2.644 6.253 2.567 1.00 . A A . 17 LYS HZ2 1 1 6 3816 1 1 17 LYS HZ3 H 1.508 6.093 3.807 1.00 . A A . 17 LYS HZ3 1 1 6 3817 1 1 17 LYS N N 5.342 0.635 6.968 1.00 . A A . 17 LYS N 1 1 6 3818 1 1 17 LYS NZ N 2.440 5.775 3.478 1.00 . A A . 17 LYS NZ 1 1 6 3819 1 1 17 LYS O O 5.658 1.549 3.530 1.00 . A A . 17 LYS O 1 1 6 3820 1 1 18 LYS C C 8.295 0.679 3.037 1.00 . A A . 18 LYS C 1 1 6 3821 1 1 18 LYS CA C 8.359 1.731 4.160 1.00 . A A . 18 LYS CA 1 1 6 3822 1 1 18 LYS CB C 9.719 1.687 4.868 1.00 . A A . 18 LYS CB 1 1 6 3823 1 1 18 LYS CD C 10.249 4.135 4.616 1.00 . A A . 18 LYS CD 1 1 6 3824 1 1 18 LYS CE C 10.849 5.363 5.289 1.00 . A A . 18 LYS CE 1 1 6 3825 1 1 18 LYS CG C 10.083 2.977 5.591 1.00 . A A . 18 LYS CG 1 1 6 3826 1 1 18 LYS H H 7.446 1.573 6.081 1.00 . A A . 18 LYS H 1 1 6 3827 1 1 18 LYS HA H 8.252 2.703 3.702 1.00 . A A . 18 LYS HA 1 1 6 3828 1 1 18 LYS HB2 H 9.706 0.887 5.594 1.00 . A A . 18 LYS HB2 1 1 6 3829 1 1 18 LYS HB3 H 10.485 1.482 4.135 1.00 . A A . 18 LYS HB3 1 1 6 3830 1 1 18 LYS HD2 H 10.901 3.825 3.813 1.00 . A A . 18 LYS HD2 1 1 6 3831 1 1 18 LYS HD3 H 9.280 4.393 4.214 1.00 . A A . 18 LYS HD3 1 1 6 3832 1 1 18 LYS HE2 H 11.801 5.091 5.718 1.00 . A A . 18 LYS HE2 1 1 6 3833 1 1 18 LYS HE3 H 10.999 6.128 4.541 1.00 . A A . 18 LYS HE3 1 1 6 3834 1 1 18 LYS HG2 H 9.299 3.220 6.292 1.00 . A A . 18 LYS HG2 1 1 6 3835 1 1 18 LYS HG3 H 11.012 2.830 6.123 1.00 . A A . 18 LYS HG3 1 1 6 3836 1 1 18 LYS HZ1 H 9.287 5.185 6.666 1.00 . A A . 18 LYS HZ1 1 1 6 3837 1 1 18 LYS HZ2 H 9.456 6.738 6.020 1.00 . A A . 18 LYS HZ2 1 1 6 3838 1 1 18 LYS HZ3 H 10.548 6.185 7.186 1.00 . A A . 18 LYS HZ3 1 1 6 3839 1 1 18 LYS N N 7.251 1.595 5.122 1.00 . A A . 18 LYS N 1 1 6 3840 1 1 18 LYS NZ N 9.973 5.905 6.365 1.00 . A A . 18 LYS NZ 1 1 6 3841 1 1 18 LYS O O 8.234 1.053 1.866 1.00 . A A . 18 LYS O 1 1 6 3842 1 1 19 PRO C C 7.062 -1.487 1.369 1.00 . A A . 19 PRO C 1 1 6 3843 1 1 19 PRO CA C 8.222 -1.702 2.338 1.00 . A A . 19 PRO CA 1 1 6 3844 1 1 19 PRO CB C 7.972 -2.963 3.170 1.00 . A A . 19 PRO CB 1 1 6 3845 1 1 19 PRO CD C 8.377 -1.210 4.720 1.00 . A A . 19 PRO CD 1 1 6 3846 1 1 19 PRO CG C 8.617 -2.672 4.475 1.00 . A A . 19 PRO CG 1 1 6 3847 1 1 19 PRO HA H 9.146 -1.800 1.788 1.00 . A A . 19 PRO HA 1 1 6 3848 1 1 19 PRO HB2 H 6.908 -3.115 3.282 1.00 . A A . 19 PRO HB2 1 1 6 3849 1 1 19 PRO HB3 H 8.413 -3.821 2.688 1.00 . A A . 19 PRO HB3 1 1 6 3850 1 1 19 PRO HD2 H 7.449 -1.064 5.253 1.00 . A A . 19 PRO HD2 1 1 6 3851 1 1 19 PRO HD3 H 9.200 -0.779 5.269 1.00 . A A . 19 PRO HD3 1 1 6 3852 1 1 19 PRO HG2 H 8.160 -3.266 5.253 1.00 . A A . 19 PRO HG2 1 1 6 3853 1 1 19 PRO HG3 H 9.676 -2.874 4.416 1.00 . A A . 19 PRO HG3 1 1 6 3854 1 1 19 PRO N N 8.298 -0.640 3.358 1.00 . A A . 19 PRO N 1 1 6 3855 1 1 19 PRO O O 7.199 -1.667 0.155 1.00 . A A . 19 PRO O 1 1 6 3856 1 1 20 CYS C C 4.948 0.302 0.162 1.00 . A A . 20 CYS C 1 1 6 3857 1 1 20 CYS CA C 4.725 -0.847 1.142 1.00 . A A . 20 CYS CA 1 1 6 3858 1 1 20 CYS CB C 3.553 -0.528 2.074 1.00 . A A . 20 CYS CB 1 1 6 3859 1 1 20 CYS H H 5.890 -0.968 2.896 1.00 . A A . 20 CYS H 1 1 6 3860 1 1 20 CYS HA H 4.500 -1.744 0.584 1.00 . A A . 20 CYS HA 1 1 6 3861 1 1 20 CYS HB2 H 3.443 -1.332 2.787 1.00 . A A . 20 CYS HB2 1 1 6 3862 1 1 20 CYS HB3 H 3.767 0.388 2.606 1.00 . A A . 20 CYS HB3 1 1 6 3863 1 1 20 CYS N N 5.923 -1.096 1.926 1.00 . A A . 20 CYS N 1 1 6 3864 1 1 20 CYS O O 4.714 0.159 -1.038 1.00 . A A . 20 CYS O 1 1 6 3865 1 1 20 CYS SG S 1.954 -0.318 1.232 1.00 . A A . 20 CYS SG 1 1 6 3866 1 1 21 VAL C C 6.653 2.264 -1.277 1.00 . A A . 21 VAL C 1 1 6 3867 1 1 21 VAL CA C 5.685 2.605 -0.151 1.00 . A A . 21 VAL CA 1 1 6 3868 1 1 21 VAL CB C 6.252 3.777 0.681 1.00 . A A . 21 VAL CB 1 1 6 3869 1 1 21 VAL CG1 C 6.572 4.974 -0.204 1.00 . A A . 21 VAL CG1 1 1 6 3870 1 1 21 VAL CG2 C 5.275 4.177 1.772 1.00 . A A . 21 VAL CG2 1 1 6 3871 1 1 21 VAL H H 5.601 1.480 1.643 1.00 . A A . 21 VAL H 1 1 6 3872 1 1 21 VAL HA H 4.745 2.921 -0.588 1.00 . A A . 21 VAL HA 1 1 6 3873 1 1 21 VAL HB H 7.168 3.450 1.150 1.00 . A A . 21 VAL HB 1 1 6 3874 1 1 21 VAL HG11 H 6.584 4.664 -1.239 1.00 . A A . 21 VAL HG11 1 1 6 3875 1 1 21 VAL HG12 H 7.540 5.371 0.063 1.00 . A A . 21 VAL HG12 1 1 6 3876 1 1 21 VAL HG13 H 5.820 5.736 -0.065 1.00 . A A . 21 VAL HG13 1 1 6 3877 1 1 21 VAL HG21 H 5.452 3.575 2.652 1.00 . A A . 21 VAL HG21 1 1 6 3878 1 1 21 VAL HG22 H 4.264 4.020 1.425 1.00 . A A . 21 VAL HG22 1 1 6 3879 1 1 21 VAL HG23 H 5.414 5.220 2.016 1.00 . A A . 21 VAL HG23 1 1 6 3880 1 1 21 VAL N N 5.420 1.434 0.678 1.00 . A A . 21 VAL N 1 1 6 3881 1 1 21 VAL O O 6.463 2.694 -2.411 1.00 . A A . 21 VAL O 1 1 6 3882 1 1 22 ALA C C 7.993 0.289 -3.085 1.00 . A A . 22 ALA C 1 1 6 3883 1 1 22 ALA CA C 8.663 1.075 -1.960 1.00 . A A . 22 ALA CA 1 1 6 3884 1 1 22 ALA CB C 9.763 0.247 -1.312 1.00 . A A . 22 ALA CB 1 1 6 3885 1 1 22 ALA H H 7.771 1.159 -0.038 1.00 . A A . 22 ALA H 1 1 6 3886 1 1 22 ALA HA H 9.109 1.968 -2.373 1.00 . A A . 22 ALA HA 1 1 6 3887 1 1 22 ALA HB1 H 10.702 0.449 -1.805 1.00 . A A . 22 ALA HB1 1 1 6 3888 1 1 22 ALA HB2 H 9.525 -0.802 -1.404 1.00 . A A . 22 ALA HB2 1 1 6 3889 1 1 22 ALA HB3 H 9.841 0.508 -0.267 1.00 . A A . 22 ALA HB3 1 1 6 3890 1 1 22 ALA N N 7.679 1.481 -0.963 1.00 . A A . 22 ALA N 1 1 6 3891 1 1 22 ALA O O 8.247 0.532 -4.270 1.00 . A A . 22 ALA O 1 1 6 3892 1 1 23 CYS C C 5.487 -0.564 -4.518 1.00 . A A . 23 CYS C 1 1 6 3893 1 1 23 CYS CA C 6.392 -1.454 -3.667 1.00 . A A . 23 CYS CA 1 1 6 3894 1 1 23 CYS CB C 5.558 -2.510 -2.930 1.00 . A A . 23 CYS CB 1 1 6 3895 1 1 23 CYS H H 6.953 -0.770 -1.743 1.00 . A A . 23 CYS H 1 1 6 3896 1 1 23 CYS HA H 7.110 -1.946 -4.307 1.00 . A A . 23 CYS HA 1 1 6 3897 1 1 23 CYS HB2 H 6.080 -2.803 -2.032 1.00 . A A . 23 CYS HB2 1 1 6 3898 1 1 23 CYS HB3 H 4.607 -2.076 -2.659 1.00 . A A . 23 CYS HB3 1 1 6 3899 1 1 23 CYS N N 7.121 -0.639 -2.704 1.00 . A A . 23 CYS N 1 1 6 3900 1 1 23 CYS O O 5.421 -0.694 -5.744 1.00 . A A . 23 CYS O 1 1 6 3901 1 1 23 CYS SG S 5.223 -4.026 -3.891 1.00 . A A . 23 CYS SG 1 1 6 3902 1 1 24 CYS C C 4.641 2.227 -5.440 1.00 . A A . 24 CYS C 1 1 6 3903 1 1 24 CYS CA C 3.894 1.268 -4.513 1.00 . A A . 24 CYS CA 1 1 6 3904 1 1 24 CYS CB C 3.108 2.045 -3.462 1.00 . A A . 24 CYS CB 1 1 6 3905 1 1 24 CYS H H 4.899 0.396 -2.874 1.00 . A A . 24 CYS H 1 1 6 3906 1 1 24 CYS HA H 3.203 0.686 -5.103 1.00 . A A . 24 CYS HA 1 1 6 3907 1 1 24 CYS HB2 H 3.799 2.586 -2.834 1.00 . A A . 24 CYS HB2 1 1 6 3908 1 1 24 CYS HB3 H 2.451 2.746 -3.951 1.00 . A A . 24 CYS HB3 1 1 6 3909 1 1 24 CYS N N 4.799 0.344 -3.852 1.00 . A A . 24 CYS N 1 1 6 3910 1 1 24 CYS O O 4.166 2.539 -6.528 1.00 . A A . 24 CYS O 1 1 6 3911 1 1 24 CYS SG S 2.093 0.986 -2.384 1.00 . A A . 24 CYS SG 1 1 6 3912 1 1 25 LYS C C 7.079 2.976 -7.099 1.00 . A A . 25 LYS C 1 1 6 3913 1 1 25 LYS CA C 6.592 3.627 -5.813 1.00 . A A . 25 LYS CA 1 1 6 3914 1 1 25 LYS CB C 7.767 4.191 -5.011 1.00 . A A . 25 LYS CB 1 1 6 3915 1 1 25 LYS CD C 6.635 6.396 -4.624 1.00 . A A . 25 LYS CD 1 1 6 3916 1 1 25 LYS CE C 5.800 7.180 -3.624 1.00 . A A . 25 LYS CE 1 1 6 3917 1 1 25 LYS CG C 7.337 5.215 -3.972 1.00 . A A . 25 LYS CG 1 1 6 3918 1 1 25 LYS H H 6.140 2.422 -4.125 1.00 . A A . 25 LYS H 1 1 6 3919 1 1 25 LYS HA H 5.939 4.446 -6.080 1.00 . A A . 25 LYS HA 1 1 6 3920 1 1 25 LYS HB2 H 8.268 3.379 -4.504 1.00 . A A . 25 LYS HB2 1 1 6 3921 1 1 25 LYS HB3 H 8.460 4.666 -5.690 1.00 . A A . 25 LYS HB3 1 1 6 3922 1 1 25 LYS HD2 H 7.379 7.054 -5.047 1.00 . A A . 25 LYS HD2 1 1 6 3923 1 1 25 LYS HD3 H 5.990 6.029 -5.408 1.00 . A A . 25 LYS HD3 1 1 6 3924 1 1 25 LYS HE2 H 5.277 7.965 -4.151 1.00 . A A . 25 LYS HE2 1 1 6 3925 1 1 25 LYS HE3 H 5.080 6.511 -3.177 1.00 . A A . 25 LYS HE3 1 1 6 3926 1 1 25 LYS HG2 H 6.660 4.744 -3.274 1.00 . A A . 25 LYS HG2 1 1 6 3927 1 1 25 LYS HG3 H 8.211 5.570 -3.446 1.00 . A A . 25 LYS HG3 1 1 6 3928 1 1 25 LYS HZ1 H 7.389 8.360 -2.963 1.00 . A A . 25 LYS HZ1 1 1 6 3929 1 1 25 LYS HZ2 H 7.039 7.052 -1.950 1.00 . A A . 25 LYS HZ2 1 1 6 3930 1 1 25 LYS HZ3 H 6.030 8.410 -1.955 1.00 . A A . 25 LYS HZ3 1 1 6 3931 1 1 25 LYS N N 5.805 2.699 -5.008 1.00 . A A . 25 LYS N 1 1 6 3932 1 1 25 LYS NZ N 6.623 7.793 -2.548 1.00 . A A . 25 LYS NZ 1 1 6 3933 1 1 25 LYS O O 6.991 3.579 -8.167 1.00 . A A . 25 LYS O 1 1 6 3934 1 1 26 LYS C C 6.875 0.746 -9.136 1.00 . A A . 26 LYS C 1 1 6 3935 1 1 26 LYS CA C 8.047 1.042 -8.197 1.00 . A A . 26 LYS CA 1 1 6 3936 1 1 26 LYS CB C 8.785 -0.254 -7.833 1.00 . A A . 26 LYS CB 1 1 6 3937 1 1 26 LYS CD C 8.619 -2.612 -6.964 1.00 . A A . 26 LYS CD 1 1 6 3938 1 1 26 LYS CE C 7.706 -3.614 -6.280 1.00 . A A . 26 LYS CE 1 1 6 3939 1 1 26 LYS CG C 7.910 -1.283 -7.146 1.00 . A A . 26 LYS CG 1 1 6 3940 1 1 26 LYS H H 7.611 1.299 -6.133 1.00 . A A . 26 LYS H 1 1 6 3941 1 1 26 LYS HA H 8.734 1.701 -8.709 1.00 . A A . 26 LYS HA 1 1 6 3942 1 1 26 LYS HB2 H 9.180 -0.696 -8.736 1.00 . A A . 26 LYS HB2 1 1 6 3943 1 1 26 LYS HB3 H 9.606 -0.013 -7.173 1.00 . A A . 26 LYS HB3 1 1 6 3944 1 1 26 LYS HD2 H 8.904 -2.996 -7.932 1.00 . A A . 26 LYS HD2 1 1 6 3945 1 1 26 LYS HD3 H 9.499 -2.463 -6.355 1.00 . A A . 26 LYS HD3 1 1 6 3946 1 1 26 LYS HE2 H 7.503 -3.268 -5.278 1.00 . A A . 26 LYS HE2 1 1 6 3947 1 1 26 LYS HE3 H 6.779 -3.669 -6.833 1.00 . A A . 26 LYS HE3 1 1 6 3948 1 1 26 LYS HG2 H 7.626 -0.906 -6.176 1.00 . A A . 26 LYS HG2 1 1 6 3949 1 1 26 LYS HG3 H 7.024 -1.439 -7.744 1.00 . A A . 26 LYS HG3 1 1 6 3950 1 1 26 LYS HZ1 H 8.799 -5.097 -5.301 1.00 . A A . 26 LYS HZ1 1 1 6 3951 1 1 26 LYS HZ2 H 8.982 -5.107 -6.983 1.00 . A A . 26 LYS HZ2 1 1 6 3952 1 1 26 LYS HZ3 H 7.554 -5.693 -6.284 1.00 . A A . 26 LYS HZ3 1 1 6 3953 1 1 26 LYS N N 7.574 1.744 -7.007 1.00 . A A . 26 LYS N 1 1 6 3954 1 1 26 LYS NZ N 8.306 -4.971 -6.207 1.00 . A A . 26 LYS NZ 1 1 6 3955 1 1 26 LYS O O 7.037 0.717 -10.354 1.00 . A A . 26 LYS O 1 1 6 3956 1 1 27 ALA C C 3.823 1.550 -9.819 1.00 . A A . 27 ALA C 1 1 6 3957 1 1 27 ALA CA C 4.493 0.254 -9.345 1.00 . A A . 27 ALA CA 1 1 6 3958 1 1 27 ALA CB C 3.520 -0.589 -8.535 1.00 . A A . 27 ALA CB 1 1 6 3959 1 1 27 ALA H H 5.622 0.576 -7.579 1.00 . A A . 27 ALA H 1 1 6 3960 1 1 27 ALA HA H 4.793 -0.319 -10.211 1.00 . A A . 27 ALA HA 1 1 6 3961 1 1 27 ALA HB1 H 3.918 -0.746 -7.543 1.00 . A A . 27 ALA HB1 1 1 6 3962 1 1 27 ALA HB2 H 3.380 -1.543 -9.021 1.00 . A A . 27 ALA HB2 1 1 6 3963 1 1 27 ALA HB3 H 2.572 -0.078 -8.465 1.00 . A A . 27 ALA HB3 1 1 6 3964 1 1 27 ALA N N 5.691 0.535 -8.558 1.00 . A A . 27 ALA N 1 1 6 3965 1 1 27 ALA O O 2.745 1.523 -10.424 1.00 . A A . 27 ALA O 1 1 6 3966 1 1 28 LYS C C 2.716 4.360 -9.155 1.00 . A A . 28 LYS C 1 1 6 3967 1 1 28 LYS CA C 3.996 4.002 -9.904 1.00 . A A . 28 LYS CA 1 1 6 3968 1 1 28 LYS CB C 3.799 4.139 -11.427 1.00 . A A . 28 LYS CB 1 1 6 3969 1 1 28 LYS CD C 2.766 6.461 -11.496 1.00 . A A . 28 LYS CD 1 1 6 3970 1 1 28 LYS CE C 3.014 7.932 -11.791 1.00 . A A . 28 LYS CE 1 1 6 3971 1 1 28 LYS CG C 3.925 5.577 -11.945 1.00 . A A . 28 LYS CG 1 1 6 3972 1 1 28 LYS H H 5.322 2.611 -9.043 1.00 . A A . 28 LYS H 1 1 6 3973 1 1 28 LYS HA H 4.760 4.704 -9.600 1.00 . A A . 28 LYS HA 1 1 6 3974 1 1 28 LYS HB2 H 4.539 3.534 -11.928 1.00 . A A . 28 LYS HB2 1 1 6 3975 1 1 28 LYS HB3 H 2.815 3.773 -11.683 1.00 . A A . 28 LYS HB3 1 1 6 3976 1 1 28 LYS HD2 H 1.871 6.150 -12.013 1.00 . A A . 28 LYS HD2 1 1 6 3977 1 1 28 LYS HD3 H 2.627 6.336 -10.432 1.00 . A A . 28 LYS HD3 1 1 6 3978 1 1 28 LYS HE2 H 3.926 8.237 -11.299 1.00 . A A . 28 LYS HE2 1 1 6 3979 1 1 28 LYS HE3 H 3.120 8.060 -12.858 1.00 . A A . 28 LYS HE3 1 1 6 3980 1 1 28 LYS HG2 H 4.846 6.000 -11.575 1.00 . A A . 28 LYS HG2 1 1 6 3981 1 1 28 LYS HG3 H 3.950 5.555 -13.025 1.00 . A A . 28 LYS HG3 1 1 6 3982 1 1 28 LYS HZ1 H 1.264 9.036 -12.095 1.00 . A A . 28 LYS HZ1 1 1 6 3983 1 1 28 LYS HZ2 H 2.258 9.667 -10.887 1.00 . A A . 28 LYS HZ2 1 1 6 3984 1 1 28 LYS HZ3 H 1.336 8.285 -10.583 1.00 . A A . 28 LYS HZ3 1 1 6 3985 1 1 28 LYS N N 4.476 2.676 -9.533 1.00 . A A . 28 LYS N 1 1 6 3986 1 1 28 LYS NZ N 1.894 8.787 -11.308 1.00 . A A . 28 LYS NZ 1 1 6 3987 1 1 28 LYS O O 1.632 4.438 -9.737 1.00 . A A . 28 LYS O 1 1 6 3988 1 1 29 PHE C C 2.203 6.167 -6.137 1.00 . A A . 29 PHE C 1 1 6 3989 1 1 29 PHE CA C 1.754 4.999 -7.008 1.00 . A A . 29 PHE CA 1 1 6 3990 1 1 29 PHE CB C 1.244 3.849 -6.133 1.00 . A A . 29 PHE CB 1 1 6 3991 1 1 29 PHE CD1 C 1.055 1.815 -7.603 1.00 . A A . 29 PHE CD1 1 1 6 3992 1 1 29 PHE CD2 C -0.950 2.833 -6.816 1.00 . A A . 29 PHE CD2 1 1 6 3993 1 1 29 PHE CE1 C 0.310 0.858 -8.266 1.00 . A A . 29 PHE CE1 1 1 6 3994 1 1 29 PHE CE2 C -1.699 1.877 -7.474 1.00 . A A . 29 PHE CE2 1 1 6 3995 1 1 29 PHE CG C 0.436 2.815 -6.873 1.00 . A A . 29 PHE CG 1 1 6 3996 1 1 29 PHE CZ C -1.068 0.889 -8.201 1.00 . A A . 29 PHE CZ 1 1 6 3997 1 1 29 PHE H H 3.765 4.526 -7.475 1.00 . A A . 29 PHE H 1 1 6 3998 1 1 29 PHE HA H 0.952 5.338 -7.650 1.00 . A A . 29 PHE HA 1 1 6 3999 1 1 29 PHE HB2 H 2.088 3.348 -5.685 1.00 . A A . 29 PHE HB2 1 1 6 4000 1 1 29 PHE HB3 H 0.620 4.255 -5.349 1.00 . A A . 29 PHE HB3 1 1 6 4001 1 1 29 PHE HD1 H 2.134 1.788 -7.655 1.00 . A A . 29 PHE HD1 1 1 6 4002 1 1 29 PHE HD2 H -1.447 3.609 -6.251 1.00 . A A . 29 PHE HD2 1 1 6 4003 1 1 29 PHE HE1 H 0.807 0.085 -8.834 1.00 . A A . 29 PHE HE1 1 1 6 4004 1 1 29 PHE HE2 H -2.777 1.904 -7.421 1.00 . A A . 29 PHE HE2 1 1 6 4005 1 1 29 PHE HZ H -1.651 0.140 -8.717 1.00 . A A . 29 PHE HZ 1 1 6 4006 1 1 29 PHE N N 2.865 4.600 -7.865 1.00 . A A . 29 PHE N 1 1 6 4007 1 1 29 PHE O O 3.376 6.251 -5.766 1.00 . A A . 29 PHE O 1 1 6 4008 1 1 30 SER C C 2.100 7.892 -3.654 1.00 . A A . 30 SER C 1 1 6 4009 1 1 30 SER CA C 1.580 8.259 -5.043 1.00 . A A . 30 SER CA 1 1 6 4010 1 1 30 SER CB C 0.330 9.129 -4.924 1.00 . A A . 30 SER CB 1 1 6 4011 1 1 30 SER H H 0.372 6.956 -6.186 1.00 . A A . 30 SER H 1 1 6 4012 1 1 30 SER HA H 2.344 8.818 -5.558 1.00 . A A . 30 SER HA 1 1 6 4013 1 1 30 SER HB2 H -0.380 8.649 -4.267 1.00 . A A . 30 SER HB2 1 1 6 4014 1 1 30 SER HB3 H 0.600 10.094 -4.519 1.00 . A A . 30 SER HB3 1 1 6 4015 1 1 30 SER HG H 0.325 9.796 -6.772 1.00 . A A . 30 SER HG 1 1 6 4016 1 1 30 SER N N 1.282 7.074 -5.842 1.00 . A A . 30 SER N 1 1 6 4017 1 1 30 SER O O 3.100 8.444 -3.190 1.00 . A A . 30 SER O 1 1 6 4018 1 1 30 SER OG O -0.277 9.319 -6.192 1.00 . A A . 30 SER OG 1 1 6 4019 1 1 31 ASP C C 1.243 5.153 -1.348 1.00 . A A . 31 ASP C 1 1 6 4020 1 1 31 ASP CA C 1.827 6.519 -1.667 1.00 . A A . 31 ASP CA 1 1 6 4021 1 1 31 ASP CB C 1.392 7.528 -0.598 1.00 . A A . 31 ASP CB 1 1 6 4022 1 1 31 ASP CG C 1.761 7.071 0.802 1.00 . A A . 31 ASP CG 1 1 6 4023 1 1 31 ASP H H 0.640 6.548 -3.424 1.00 . A A . 31 ASP H 1 1 6 4024 1 1 31 ASP HA H 2.904 6.444 -1.657 1.00 . A A . 31 ASP HA 1 1 6 4025 1 1 31 ASP HB2 H 1.875 8.475 -0.787 1.00 . A A . 31 ASP HB2 1 1 6 4026 1 1 31 ASP HB3 H 0.321 7.657 -0.646 1.00 . A A . 31 ASP HB3 1 1 6 4027 1 1 31 ASP N N 1.427 6.957 -3.000 1.00 . A A . 31 ASP N 1 1 6 4028 1 1 31 ASP O O 0.157 4.802 -1.819 1.00 . A A . 31 ASP O 1 1 6 4029 1 1 31 ASP OD1 O 2.959 6.801 1.052 1.00 . A A . 31 ASP OD1 1 1 6 4030 1 1 31 ASP OD2 O 0.860 6.957 1.657 1.00 . A A . 31 ASP OD2 1 1 6 4031 1 1 32 GLY C C 1.100 3.029 1.289 1.00 . A A . 32 GLY C 1 1 6 4032 1 1 32 GLY CA C 1.526 3.076 -0.158 1.00 . A A . 32 GLY CA 1 1 6 4033 1 1 32 GLY H H 2.820 4.738 -0.201 1.00 . A A . 32 GLY H 1 1 6 4034 1 1 32 GLY HA2 H 0.690 2.791 -0.780 1.00 . A A . 32 GLY HA2 1 1 6 4035 1 1 32 GLY HA3 H 2.332 2.374 -0.309 1.00 . A A . 32 GLY HA3 1 1 6 4036 1 1 32 GLY N N 1.971 4.392 -0.546 1.00 . A A . 32 GLY N 1 1 6 4037 1 1 32 GLY O O 1.799 3.538 2.169 1.00 . A A . 32 GLY O 1 1 6 4038 1 1 33 HIS C C -1.022 0.891 3.176 1.00 . A A . 33 HIS C 1 1 6 4039 1 1 33 HIS CA C -0.543 2.301 2.897 1.00 . A A . 33 HIS CA 1 1 6 4040 1 1 33 HIS CB C -1.666 3.311 3.149 1.00 . A A . 33 HIS CB 1 1 6 4041 1 1 33 HIS CD2 C -3.152 3.490 1.015 1.00 . A A . 33 HIS CD2 1 1 6 4042 1 1 33 HIS CE1 C -4.908 2.417 1.763 1.00 . A A . 33 HIS CE1 1 1 6 4043 1 1 33 HIS CG C -2.888 3.118 2.292 1.00 . A A . 33 HIS CG 1 1 6 4044 1 1 33 HIS H H -0.547 2.013 0.801 1.00 . A A . 33 HIS H 1 1 6 4045 1 1 33 HIS HA H 0.275 2.521 3.567 1.00 . A A . 33 HIS HA 1 1 6 4046 1 1 33 HIS HB2 H -1.976 3.233 4.181 1.00 . A A . 33 HIS HB2 1 1 6 4047 1 1 33 HIS HB3 H -1.284 4.300 2.973 1.00 . A A . 33 HIS HB3 1 1 6 4048 1 1 33 HIS HD1 H -4.130 2.046 3.616 1.00 . A A . 33 HIS HD1 1 1 6 4049 1 1 33 HIS HD2 H -2.485 4.012 0.348 1.00 . A A . 33 HIS HD2 1 1 6 4050 1 1 33 HIS HE1 H -5.878 1.946 1.815 1.00 . A A . 33 HIS HE1 1 1 6 4051 1 1 33 HIS N N -0.037 2.413 1.545 1.00 . A A . 33 HIS N 1 1 6 4052 1 1 33 HIS ND1 N -4.012 2.447 2.730 1.00 . A A . 33 HIS ND1 1 1 6 4053 1 1 33 HIS NE2 N -4.414 3.042 0.714 1.00 . A A . 33 HIS NE2 1 1 6 4054 1 1 33 HIS O O -1.850 0.337 2.458 1.00 . A A . 33 HIS O 1 1 6 4055 1 1 34 CYS C C -2.235 -1.032 5.248 1.00 . A A . 34 CYS C 1 1 6 4056 1 1 34 CYS CA C -0.847 -1.024 4.625 1.00 . A A . 34 CYS CA 1 1 6 4057 1 1 34 CYS CB C 0.203 -1.556 5.591 1.00 . A A . 34 CYS CB 1 1 6 4058 1 1 34 CYS H H 0.161 0.825 4.754 1.00 . A A . 34 CYS H 1 1 6 4059 1 1 34 CYS HA H -0.858 -1.641 3.739 1.00 . A A . 34 CYS HA 1 1 6 4060 1 1 34 CYS HB2 H 0.161 -0.989 6.510 1.00 . A A . 34 CYS HB2 1 1 6 4061 1 1 34 CYS HB3 H 0.005 -2.596 5.799 1.00 . A A . 34 CYS HB3 1 1 6 4062 1 1 34 CYS N N -0.491 0.323 4.226 1.00 . A A . 34 CYS N 1 1 6 4063 1 1 34 CYS O O -2.588 -0.125 6.002 1.00 . A A . 34 CYS O 1 1 6 4064 1 1 34 CYS SG S 1.894 -1.428 4.926 1.00 . A A . 34 CYS SG 1 1 6 4065 1 1 35 SER C C -4.416 -2.570 6.883 1.00 . A A . 35 SER C 1 1 6 4066 1 1 35 SER CA C -4.390 -2.134 5.414 1.00 . A A . 35 SER CA 1 1 6 4067 1 1 35 SER CB C -5.208 -3.096 4.548 1.00 . A A . 35 SER CB 1 1 6 4068 1 1 35 SER H H -2.702 -2.716 4.278 1.00 . A A . 35 SER H 1 1 6 4069 1 1 35 SER HA H -4.828 -1.153 5.340 1.00 . A A . 35 SER HA 1 1 6 4070 1 1 35 SER HB2 H -6.109 -3.373 5.075 1.00 . A A . 35 SER HB2 1 1 6 4071 1 1 35 SER HB3 H -5.470 -2.607 3.621 1.00 . A A . 35 SER HB3 1 1 6 4072 1 1 35 SER HG H -3.810 -4.072 3.580 1.00 . A A . 35 SER HG 1 1 6 4073 1 1 35 SER N N -3.031 -2.036 4.904 1.00 . A A . 35 SER N 1 1 6 4074 1 1 35 SER O O -3.426 -2.432 7.606 1.00 . A A . 35 SER O 1 1 6 4075 1 1 35 SER OG O -4.475 -4.271 4.253 1.00 . A A . 35 SER OG 1 1 6 4076 1 1 36 LYS C C -6.168 -4.983 8.774 1.00 . A A . 36 LYS C 1 1 6 4077 1 1 36 LYS CA C -5.704 -3.531 8.700 1.00 . A A . 36 LYS CA 1 1 6 4078 1 1 36 LYS CB C -6.697 -2.624 9.438 1.00 . A A . 36 LYS CB 1 1 6 4079 1 1 36 LYS CD C -7.884 -2.065 11.592 1.00 . A A . 36 LYS CD 1 1 6 4080 1 1 36 LYS CE C -7.412 -0.618 11.625 1.00 . A A . 36 LYS CE 1 1 6 4081 1 1 36 LYS CG C -6.871 -2.974 10.910 1.00 . A A . 36 LYS CG 1 1 6 4082 1 1 36 LYS H H -6.308 -3.170 6.706 1.00 . A A . 36 LYS H 1 1 6 4083 1 1 36 LYS HA H -4.739 -3.451 9.178 1.00 . A A . 36 LYS HA 1 1 6 4084 1 1 36 LYS HB2 H -6.350 -1.603 9.373 1.00 . A A . 36 LYS HB2 1 1 6 4085 1 1 36 LYS HB3 H -7.660 -2.699 8.956 1.00 . A A . 36 LYS HB3 1 1 6 4086 1 1 36 LYS HD2 H -8.817 -2.114 11.052 1.00 . A A . 36 LYS HD2 1 1 6 4087 1 1 36 LYS HD3 H -8.034 -2.408 12.605 1.00 . A A . 36 LYS HD3 1 1 6 4088 1 1 36 LYS HE2 H -6.468 -0.572 12.147 1.00 . A A . 36 LYS HE2 1 1 6 4089 1 1 36 LYS HE3 H -7.278 -0.274 10.610 1.00 . A A . 36 LYS HE3 1 1 6 4090 1 1 36 LYS HG2 H -7.213 -3.996 10.987 1.00 . A A . 36 LYS HG2 1 1 6 4091 1 1 36 LYS HG3 H -5.918 -2.874 11.408 1.00 . A A . 36 LYS HG3 1 1 6 4092 1 1 36 LYS HZ1 H -8.658 -0.139 13.232 1.00 . A A . 36 LYS HZ1 1 1 6 4093 1 1 36 LYS HZ2 H -9.245 0.379 11.733 1.00 . A A . 36 LYS HZ2 1 1 6 4094 1 1 36 LYS HZ3 H -7.970 1.208 12.473 1.00 . A A . 36 LYS HZ3 1 1 6 4095 1 1 36 LYS N N -5.554 -3.089 7.321 1.00 . A A . 36 LYS N 1 1 6 4096 1 1 36 LYS NZ N -8.390 0.270 12.314 1.00 . A A . 36 LYS NZ 1 1 6 4097 1 1 36 LYS O O -5.627 -5.765 9.546 1.00 . A A . 36 LYS O 1 1 6 4098 1 1 37 ILE C C -6.696 -7.686 7.449 1.00 . A A . 37 ILE C 1 1 6 4099 1 1 37 ILE CA C -7.720 -6.688 7.986 1.00 . A A . 37 ILE CA 1 1 6 4100 1 1 37 ILE CB C -9.028 -6.801 7.159 1.00 . A A . 37 ILE CB 1 1 6 4101 1 1 37 ILE CD1 C -9.970 -4.419 7.166 1.00 . A A . 37 ILE CD1 1 1 6 4102 1 1 37 ILE CG1 C -10.104 -5.839 7.681 1.00 . A A . 37 ILE CG1 1 1 6 4103 1 1 37 ILE CG2 C -9.553 -8.231 7.183 1.00 . A A . 37 ILE CG2 1 1 6 4104 1 1 37 ILE H H -7.582 -4.659 7.399 1.00 . A A . 37 ILE H 1 1 6 4105 1 1 37 ILE HA H -7.945 -6.946 9.010 1.00 . A A . 37 ILE HA 1 1 6 4106 1 1 37 ILE HB H -8.799 -6.549 6.134 1.00 . A A . 37 ILE HB 1 1 6 4107 1 1 37 ILE HD11 H -10.920 -4.087 6.775 1.00 . A A . 37 ILE HD11 1 1 6 4108 1 1 37 ILE HD12 H -9.228 -4.389 6.382 1.00 . A A . 37 ILE HD12 1 1 6 4109 1 1 37 ILE HD13 H -9.667 -3.770 7.975 1.00 . A A . 37 ILE HD13 1 1 6 4110 1 1 37 ILE HG12 H -11.076 -6.204 7.386 1.00 . A A . 37 ILE HG12 1 1 6 4111 1 1 37 ILE HG13 H -10.052 -5.806 8.760 1.00 . A A . 37 ILE HG13 1 1 6 4112 1 1 37 ILE HG21 H -8.808 -8.895 6.771 1.00 . A A . 37 ILE HG21 1 1 6 4113 1 1 37 ILE HG22 H -10.456 -8.293 6.593 1.00 . A A . 37 ILE HG22 1 1 6 4114 1 1 37 ILE HG23 H -9.768 -8.518 8.201 1.00 . A A . 37 ILE HG23 1 1 6 4115 1 1 37 ILE N N -7.180 -5.329 7.982 1.00 . A A . 37 ILE N 1 1 6 4116 1 1 37 ILE O O -6.158 -8.496 8.197 1.00 . A A . 37 ILE O 1 1 6 4117 1 1 38 LEU C C -4.042 -7.986 5.795 1.00 . A A . 38 LEU C 1 1 6 4118 1 1 38 LEU CA C -5.448 -8.516 5.541 1.00 . A A . 38 LEU CA 1 1 6 4119 1 1 38 LEU CB C -5.708 -8.668 4.039 1.00 . A A . 38 LEU CB 1 1 6 4120 1 1 38 LEU CD1 C -5.231 -11.133 4.110 1.00 . A A . 38 LEU CD1 1 1 6 4121 1 1 38 LEU CD2 C -5.387 -9.962 1.914 1.00 . A A . 38 LEU CD2 1 1 6 4122 1 1 38 LEU CG C -4.968 -9.830 3.369 1.00 . A A . 38 LEU CG 1 1 6 4123 1 1 38 LEU H H -6.872 -6.951 5.598 1.00 . A A . 38 LEU H 1 1 6 4124 1 1 38 LEU HA H -5.546 -9.481 6.018 1.00 . A A . 38 LEU HA 1 1 6 4125 1 1 38 LEU HB2 H -6.769 -8.806 3.888 1.00 . A A . 38 LEU HB2 1 1 6 4126 1 1 38 LEU HB3 H -5.410 -7.753 3.550 1.00 . A A . 38 LEU HB3 1 1 6 4127 1 1 38 LEU HD11 H -4.870 -11.050 5.125 1.00 . A A . 38 LEU HD11 1 1 6 4128 1 1 38 LEU HD12 H -4.719 -11.942 3.611 1.00 . A A . 38 LEU HD12 1 1 6 4129 1 1 38 LEU HD13 H -6.293 -11.333 4.122 1.00 . A A . 38 LEU HD13 1 1 6 4130 1 1 38 LEU HD21 H -4.547 -9.735 1.275 1.00 . A A . 38 LEU HD21 1 1 6 4131 1 1 38 LEU HD22 H -6.193 -9.273 1.708 1.00 . A A . 38 LEU HD22 1 1 6 4132 1 1 38 LEU HD23 H -5.721 -10.972 1.726 1.00 . A A . 38 LEU HD23 1 1 6 4133 1 1 38 LEU HG H -3.905 -9.637 3.398 1.00 . A A . 38 LEU HG 1 1 6 4134 1 1 38 LEU N N -6.420 -7.617 6.151 1.00 . A A . 38 LEU N 1 1 6 4135 1 1 38 LEU O O -3.057 -8.717 5.714 1.00 . A A . 38 LEU O 1 1 6 4136 1 1 39 ARG C C -1.790 -6.001 5.200 1.00 . A A . 39 ARG C 1 1 6 4137 1 1 39 ARG CA C -2.733 -6.001 6.411 1.00 . A A . 39 ARG CA 1 1 6 4138 1 1 39 ARG CB C -2.075 -6.633 7.649 1.00 . A A . 39 ARG CB 1 1 6 4139 1 1 39 ARG CD C -1.192 -4.436 8.514 1.00 . A A . 39 ARG CD 1 1 6 4140 1 1 39 ARG CG C -0.866 -5.879 8.179 1.00 . A A . 39 ARG CG 1 1 6 4141 1 1 39 ARG CZ C 0.024 -2.401 9.213 1.00 . A A . 39 ARG CZ 1 1 6 4142 1 1 39 ARG H H -4.817 -6.191 6.165 1.00 . A A . 39 ARG H 1 1 6 4143 1 1 39 ARG HA H -2.983 -4.976 6.642 1.00 . A A . 39 ARG HA 1 1 6 4144 1 1 39 ARG HB2 H -2.807 -6.686 8.440 1.00 . A A . 39 ARG HB2 1 1 6 4145 1 1 39 ARG HB3 H -1.762 -7.636 7.398 1.00 . A A . 39 ARG HB3 1 1 6 4146 1 1 39 ARG HD2 H -1.614 -3.962 7.640 1.00 . A A . 39 ARG HD2 1 1 6 4147 1 1 39 ARG HD3 H -1.913 -4.419 9.318 1.00 . A A . 39 ARG HD3 1 1 6 4148 1 1 39 ARG HE H 0.842 -4.220 9.005 1.00 . A A . 39 ARG HE 1 1 6 4149 1 1 39 ARG HG2 H -0.514 -6.371 9.073 1.00 . A A . 39 ARG HG2 1 1 6 4150 1 1 39 ARG HG3 H -0.088 -5.897 7.429 1.00 . A A . 39 ARG HG3 1 1 6 4151 1 1 39 ARG HH11 H -1.926 -2.093 8.729 1.00 . A A . 39 ARG HH11 1 1 6 4152 1 1 39 ARG HH12 H -1.066 -0.691 9.280 1.00 . A A . 39 ARG HH12 1 1 6 4153 1 1 39 ARG HH21 H 1.992 -2.375 9.720 1.00 . A A . 39 ARG HH21 1 1 6 4154 1 1 39 ARG HH22 H 1.174 -0.853 9.846 1.00 . A A . 39 ARG HH22 1 1 6 4155 1 1 39 ARG N N -3.983 -6.694 6.114 1.00 . A A . 39 ARG N 1 1 6 4156 1 1 39 ARG NE N 0.004 -3.701 8.927 1.00 . A A . 39 ARG NE 1 1 6 4157 1 1 39 ARG NH1 N -1.076 -1.667 9.062 1.00 . A A . 39 ARG NH1 1 1 6 4158 1 1 39 ARG NH2 N 1.154 -1.828 9.625 1.00 . A A . 39 ARG NH2 1 1 6 4159 1 1 39 ARG O O -0.580 -5.835 5.330 1.00 . A A . 39 ARG O 1 1 6 4160 1 1 40 ARG C C -1.301 -4.680 2.373 1.00 . A A . 40 ARG C 1 1 6 4161 1 1 40 ARG CA C -1.566 -6.125 2.791 1.00 . A A . 40 ARG CA 1 1 6 4162 1 1 40 ARG CB C -2.245 -6.911 1.666 1.00 . A A . 40 ARG CB 1 1 6 4163 1 1 40 ARG CD C -4.222 -7.240 0.169 1.00 . A A . 40 ARG CD 1 1 6 4164 1 1 40 ARG CG C -3.652 -6.448 1.334 1.00 . A A . 40 ARG CG 1 1 6 4165 1 1 40 ARG CZ C -6.270 -7.320 -1.207 1.00 . A A . 40 ARG CZ 1 1 6 4166 1 1 40 ARG H H -3.330 -6.246 3.955 1.00 . A A . 40 ARG H 1 1 6 4167 1 1 40 ARG HA H -0.617 -6.591 3.016 1.00 . A A . 40 ARG HA 1 1 6 4168 1 1 40 ARG HB2 H -1.645 -6.823 0.772 1.00 . A A . 40 ARG HB2 1 1 6 4169 1 1 40 ARG HB3 H -2.292 -7.951 1.952 1.00 . A A . 40 ARG HB3 1 1 6 4170 1 1 40 ARG HD2 H -3.577 -7.109 -0.686 1.00 . A A . 40 ARG HD2 1 1 6 4171 1 1 40 ARG HD3 H -4.249 -8.285 0.442 1.00 . A A . 40 ARG HD3 1 1 6 4172 1 1 40 ARG HE H -5.976 -6.091 0.347 1.00 . A A . 40 ARG HE 1 1 6 4173 1 1 40 ARG HG2 H -4.281 -6.591 2.201 1.00 . A A . 40 ARG HG2 1 1 6 4174 1 1 40 ARG HG3 H -3.625 -5.401 1.071 1.00 . A A . 40 ARG HG3 1 1 6 4175 1 1 40 ARG HH11 H -4.828 -8.637 -1.752 1.00 . A A . 40 ARG HH11 1 1 6 4176 1 1 40 ARG HH12 H -6.261 -8.670 -2.722 1.00 . A A . 40 ARG HH12 1 1 6 4177 1 1 40 ARG HH21 H -7.873 -6.112 -0.934 1.00 . A A . 40 ARG HH21 1 1 6 4178 1 1 40 ARG HH22 H -8.006 -7.230 -2.250 1.00 . A A . 40 ARG HH22 1 1 6 4179 1 1 40 ARG N N -2.358 -6.147 4.011 1.00 . A A . 40 ARG N 1 1 6 4180 1 1 40 ARG NE N -5.574 -6.809 -0.190 1.00 . A A . 40 ARG NE 1 1 6 4181 1 1 40 ARG NH1 N -5.747 -8.289 -1.953 1.00 . A A . 40 ARG NH1 1 1 6 4182 1 1 40 ARG NH2 N -7.481 -6.852 -1.485 1.00 . A A . 40 ARG NH2 1 1 6 4183 1 1 40 ARG O O -1.970 -3.757 2.850 1.00 . A A . 40 ARG O 1 1 6 4184 1 1 41 CYS C C -0.880 -2.590 0.014 1.00 . A A . 41 CYS C 1 1 6 4185 1 1 41 CYS CA C 0.077 -3.159 1.061 1.00 . A A . 41 CYS CA 1 1 6 4186 1 1 41 CYS CB C 1.490 -3.210 0.482 1.00 . A A . 41 CYS CB 1 1 6 4187 1 1 41 CYS H H 0.199 -5.264 1.198 1.00 . A A . 41 CYS H 1 1 6 4188 1 1 41 CYS HA H 0.080 -2.504 1.918 1.00 . A A . 41 CYS HA 1 1 6 4189 1 1 41 CYS HB2 H 2.186 -3.447 1.273 1.00 . A A . 41 CYS HB2 1 1 6 4190 1 1 41 CYS HB3 H 1.534 -3.983 -0.271 1.00 . A A . 41 CYS HB3 1 1 6 4191 1 1 41 CYS N N -0.308 -4.490 1.519 1.00 . A A . 41 CYS N 1 1 6 4192 1 1 41 CYS O O -0.861 -3.001 -1.149 1.00 . A A . 41 CYS O 1 1 6 4193 1 1 41 CYS SG S 2.041 -1.657 -0.286 1.00 . A A . 41 CYS SG 1 1 6 4194 1 1 42 LEU C C -1.929 0.282 -1.072 1.00 . A A . 42 LEU C 1 1 6 4195 1 1 42 LEU CA C -2.609 -0.941 -0.477 1.00 . A A . 42 LEU CA 1 1 6 4196 1 1 42 LEU CB C -3.877 -0.501 0.267 1.00 . A A . 42 LEU CB 1 1 6 4197 1 1 42 LEU CD1 C -4.505 -2.745 1.213 1.00 . A A . 42 LEU CD1 1 1 6 4198 1 1 42 LEU CD2 C -6.217 -0.941 1.050 1.00 . A A . 42 LEU CD2 1 1 6 4199 1 1 42 LEU CG C -4.983 -1.552 0.405 1.00 . A A . 42 LEU CG 1 1 6 4200 1 1 42 LEU H H -1.624 -1.303 1.360 1.00 . A A . 42 LEU H 1 1 6 4201 1 1 42 LEU HA H -2.869 -1.629 -1.271 1.00 . A A . 42 LEU HA 1 1 6 4202 1 1 42 LEU HB2 H -3.586 -0.195 1.262 1.00 . A A . 42 LEU HB2 1 1 6 4203 1 1 42 LEU HB3 H -4.287 0.363 -0.243 1.00 . A A . 42 LEU HB3 1 1 6 4204 1 1 42 LEU HD11 H -4.740 -3.656 0.684 1.00 . A A . 42 LEU HD11 1 1 6 4205 1 1 42 LEU HD12 H -4.998 -2.749 2.174 1.00 . A A . 42 LEU HD12 1 1 6 4206 1 1 42 LEU HD13 H -3.437 -2.677 1.357 1.00 . A A . 42 LEU HD13 1 1 6 4207 1 1 42 LEU HD21 H -6.435 -1.459 1.972 1.00 . A A . 42 LEU HD21 1 1 6 4208 1 1 42 LEU HD22 H -7.058 -1.034 0.378 1.00 . A A . 42 LEU HD22 1 1 6 4209 1 1 42 LEU HD23 H -6.035 0.103 1.257 1.00 . A A . 42 LEU HD23 1 1 6 4210 1 1 42 LEU HG H -5.260 -1.905 -0.578 1.00 . A A . 42 LEU HG 1 1 6 4211 1 1 42 LEU N N -1.681 -1.611 0.426 1.00 . A A . 42 LEU N 1 1 6 4212 1 1 42 LEU O O -1.460 1.149 -0.338 1.00 . A A . 42 LEU O 1 1 6 4213 1 1 43 CYS C C -2.285 2.467 -3.553 1.00 . A A . 43 CYS C 1 1 6 4214 1 1 43 CYS CA C -1.240 1.497 -3.029 1.00 . A A . 43 CYS CA 1 1 6 4215 1 1 43 CYS CB C -0.339 1.031 -4.170 1.00 . A A . 43 CYS CB 1 1 6 4216 1 1 43 CYS H H -2.265 -0.345 -2.939 1.00 . A A . 43 CYS H 1 1 6 4217 1 1 43 CYS HA H -0.636 2.002 -2.290 1.00 . A A . 43 CYS HA 1 1 6 4218 1 1 43 CYS HB2 H -0.940 0.535 -4.914 1.00 . A A . 43 CYS HB2 1 1 6 4219 1 1 43 CYS HB3 H 0.132 1.894 -4.618 1.00 . A A . 43 CYS HB3 1 1 6 4220 1 1 43 CYS N N -1.873 0.364 -2.385 1.00 . A A . 43 CYS N 1 1 6 4221 1 1 43 CYS O O -3.285 2.060 -4.144 1.00 . A A . 43 CYS O 1 1 6 4222 1 1 43 CYS SG S 0.981 -0.117 -3.670 1.00 . A A . 43 CYS SG 1 1 6 4223 1 1 44 THR C C -2.232 5.748 -4.715 1.00 . A A . 44 THR C 1 1 6 4224 1 1 44 THR CA C -2.960 4.777 -3.799 1.00 . A A . 44 THR CA 1 1 6 4225 1 1 44 THR CB C -3.587 5.544 -2.622 1.00 . A A . 44 THR CB 1 1 6 4226 1 1 44 THR CG2 C -4.920 4.931 -2.222 1.00 . A A . 44 THR CG2 1 1 6 4227 1 1 44 THR H H -1.230 4.012 -2.863 1.00 . A A . 44 THR H 1 1 6 4228 1 1 44 THR HA H -3.753 4.298 -4.356 1.00 . A A . 44 THR HA 1 1 6 4229 1 1 44 THR HB H -3.757 6.565 -2.934 1.00 . A A . 44 THR HB 1 1 6 4230 1 1 44 THR HG1 H -1.800 5.749 -1.795 1.00 . A A . 44 THR HG1 1 1 6 4231 1 1 44 THR HG21 H -4.810 4.416 -1.278 1.00 . A A . 44 THR HG21 1 1 6 4232 1 1 44 THR HG22 H -5.236 4.230 -2.980 1.00 . A A . 44 THR HG22 1 1 6 4233 1 1 44 THR HG23 H -5.659 5.711 -2.122 1.00 . A A . 44 THR HG23 1 1 6 4234 1 1 44 THR N N -2.050 3.747 -3.340 1.00 . A A . 44 THR N 1 1 6 4235 1 1 44 THR O O -1.071 6.082 -4.471 1.00 . A A . 44 THR O 1 1 6 4236 1 1 44 THR OG1 O -2.694 5.538 -1.498 1.00 . A A . 44 THR OG1 1 1 6 4237 1 1 45 LYS C C -3.345 7.943 -7.434 1.00 . A A . 45 LYS C 1 1 6 4238 1 1 45 LYS CA C -2.300 7.116 -6.715 1.00 . A A . 45 LYS CA 1 1 6 4239 1 1 45 LYS CB C -1.435 6.377 -7.737 1.00 . A A . 45 LYS CB 1 1 6 4240 1 1 45 LYS CD C -1.262 4.884 -9.719 1.00 . A A . 45 LYS CD 1 1 6 4241 1 1 45 LYS CE C -1.888 3.750 -10.506 1.00 . A A . 45 LYS CE 1 1 6 4242 1 1 45 LYS CG C -2.200 5.455 -8.672 1.00 . A A . 45 LYS CG 1 1 6 4243 1 1 45 LYS H H -3.827 5.881 -5.912 1.00 . A A . 45 LYS H 1 1 6 4244 1 1 45 LYS HA H -1.667 7.790 -6.159 1.00 . A A . 45 LYS HA 1 1 6 4245 1 1 45 LYS HB2 H -0.915 7.106 -8.339 1.00 . A A . 45 LYS HB2 1 1 6 4246 1 1 45 LYS HB3 H -0.705 5.784 -7.204 1.00 . A A . 45 LYS HB3 1 1 6 4247 1 1 45 LYS HD2 H -0.990 5.671 -10.405 1.00 . A A . 45 LYS HD2 1 1 6 4248 1 1 45 LYS HD3 H -0.374 4.518 -9.224 1.00 . A A . 45 LYS HD3 1 1 6 4249 1 1 45 LYS HE2 H -2.361 3.065 -9.817 1.00 . A A . 45 LYS HE2 1 1 6 4250 1 1 45 LYS HE3 H -2.628 4.157 -11.179 1.00 . A A . 45 LYS HE3 1 1 6 4251 1 1 45 LYS HG2 H -2.630 4.646 -8.101 1.00 . A A . 45 LYS HG2 1 1 6 4252 1 1 45 LYS HG3 H -2.981 6.016 -9.164 1.00 . A A . 45 LYS HG3 1 1 6 4253 1 1 45 LYS HZ1 H 0.095 3.281 -10.973 1.00 . A A . 45 LYS HZ1 1 1 6 4254 1 1 45 LYS HZ2 H -0.950 3.249 -12.305 1.00 . A A . 45 LYS HZ2 1 1 6 4255 1 1 45 LYS HZ3 H -0.982 1.990 -11.177 1.00 . A A . 45 LYS HZ3 1 1 6 4256 1 1 45 LYS N N -2.904 6.188 -5.767 1.00 . A A . 45 LYS N 1 1 6 4257 1 1 45 LYS NZ N -0.861 3.016 -11.297 1.00 . A A . 45 LYS NZ 1 1 6 4258 1 1 45 LYS O O -4.547 7.817 -7.180 1.00 . A A . 45 LYS O 1 1 6 4259 1 1 46 GLU C C -4.337 8.930 -10.279 1.00 . A A . 46 GLU C 1 1 6 4260 1 1 46 GLU CA C -3.697 9.669 -9.106 1.00 . A A . 46 GLU CA 1 1 6 4261 1 1 46 GLU CB C -2.875 10.862 -9.614 1.00 . A A . 46 GLU CB 1 1 6 4262 1 1 46 GLU CD C -0.493 10.011 -10.024 1.00 . A A . 46 GLU CD 1 1 6 4263 1 1 46 GLU CG C -1.797 10.502 -10.633 1.00 . A A . 46 GLU CG 1 1 6 4264 1 1 46 GLU H H -1.883 8.822 -8.465 1.00 . A A . 46 GLU H 1 1 6 4265 1 1 46 GLU HA H -4.480 10.036 -8.460 1.00 . A A . 46 GLU HA 1 1 6 4266 1 1 46 GLU HB2 H -3.546 11.572 -10.074 1.00 . A A . 46 GLU HB2 1 1 6 4267 1 1 46 GLU HB3 H -2.395 11.334 -8.769 1.00 . A A . 46 GLU HB3 1 1 6 4268 1 1 46 GLU HG2 H -2.181 9.718 -11.265 1.00 . A A . 46 GLU HG2 1 1 6 4269 1 1 46 GLU HG3 H -1.589 11.374 -11.234 1.00 . A A . 46 GLU HG3 1 1 6 4270 1 1 46 GLU N N -2.860 8.788 -8.325 1.00 . A A . 46 GLU N 1 1 6 4271 1 1 46 GLU O O -3.757 7.991 -10.836 1.00 . A A . 46 GLU O 1 1 6 4272 1 1 46 GLU OE1 O -0.460 8.888 -9.479 1.00 . A A . 46 GLU OE1 1 1 6 4273 1 1 46 GLU OE2 O 0.522 10.730 -10.128 1.00 . A A . 46 GLU OE2 1 1 6 4274 1 1 47 CYS C C -7.557 9.630 -11.934 1.00 . A A . 47 CYS C 1 1 6 4275 1 1 47 CYS CA C -6.288 8.813 -11.746 1.00 . A A . 47 CYS CA 1 1 6 4276 1 1 47 CYS CB C -6.641 7.345 -11.494 1.00 . A A . 47 CYS CB 1 1 6 4277 1 1 47 CYS H H -5.915 10.131 -10.155 1.00 . A A . 47 CYS H 1 1 6 4278 1 1 47 CYS HA H -5.685 8.886 -12.637 1.00 . A A . 47 CYS HA 1 1 6 4279 1 1 47 CYS HB2 H -7.118 6.943 -12.375 1.00 . A A . 47 CYS HB2 1 1 6 4280 1 1 47 CYS HB3 H -5.732 6.794 -11.302 1.00 . A A . 47 CYS HB3 1 1 6 4281 1 1 47 CYS N N -5.528 9.377 -10.642 1.00 . A A . 47 CYS N 1 1 6 4282 1 1 47 CYS O O -8.252 9.440 -12.949 1.00 . A A . 47 CYS O 1 1 6 4283 1 1 47 CYS OXT O -7.845 10.466 -11.046 1.00 . A A . 47 CYS OXT 1 1 6 4284 1 1 47 CYS SG S -7.764 7.067 -10.087 1.00 . A A . 47 CYS SG 1 1 7 4285 1 1 1 ALA C C -10.300 10.536 -8.063 1.00 . A A . 1 ALA C 1 1 7 4286 1 1 1 ALA CA C -11.260 11.132 -9.089 1.00 . A A . 1 ALA CA 1 1 7 4287 1 1 1 ALA CB C -11.169 12.652 -9.087 1.00 . A A . 1 ALA CB 1 1 7 4288 1 1 1 ALA H1 H -12.733 10.393 -7.825 1.00 . A A . 1 ALA H1 1 1 7 4289 1 1 1 ALA H2 H -12.903 9.914 -9.440 1.00 . A A . 1 ALA H2 1 1 7 4290 1 1 1 ALA H3 H -13.302 11.491 -8.980 1.00 . A A . 1 ALA H3 1 1 7 4291 1 1 1 ALA HA H -10.988 10.780 -10.072 1.00 . A A . 1 ALA HA 1 1 7 4292 1 1 1 ALA HB1 H -12.097 13.068 -8.725 1.00 . A A . 1 ALA HB1 1 1 7 4293 1 1 1 ALA HB2 H -10.984 13.003 -10.091 1.00 . A A . 1 ALA HB2 1 1 7 4294 1 1 1 ALA HB3 H -10.359 12.963 -8.442 1.00 . A A . 1 ALA HB3 1 1 7 4295 1 1 1 ALA N N -12.647 10.703 -8.814 1.00 . A A . 1 ALA N 1 1 7 4296 1 1 1 ALA O O -9.375 11.201 -7.596 1.00 . A A . 1 ALA O 1 1 7 4297 1 1 2 THR C C -9.708 7.088 -7.010 1.00 . A A . 2 THR C 1 1 7 4298 1 1 2 THR CA C -9.687 8.589 -6.741 1.00 . A A . 2 THR CA 1 1 7 4299 1 1 2 THR CB C -10.160 8.860 -5.297 1.00 . A A . 2 THR CB 1 1 7 4300 1 1 2 THR CG2 C -9.135 8.365 -4.285 1.00 . A A . 2 THR CG2 1 1 7 4301 1 1 2 THR H H -11.272 8.790 -8.111 1.00 . A A . 2 THR H 1 1 7 4302 1 1 2 THR HA H -8.676 8.956 -6.848 1.00 . A A . 2 THR HA 1 1 7 4303 1 1 2 THR HB H -11.090 8.334 -5.132 1.00 . A A . 2 THR HB 1 1 7 4304 1 1 2 THR HG1 H -9.717 10.759 -5.614 1.00 . A A . 2 THR HG1 1 1 7 4305 1 1 2 THR HG21 H -8.193 8.189 -4.784 1.00 . A A . 2 THR HG21 1 1 7 4306 1 1 2 THR HG22 H -9.483 7.445 -3.840 1.00 . A A . 2 THR HG22 1 1 7 4307 1 1 2 THR HG23 H -9.000 9.110 -3.515 1.00 . A A . 2 THR HG23 1 1 7 4308 1 1 2 THR N N -10.527 9.277 -7.708 1.00 . A A . 2 THR N 1 1 7 4309 1 1 2 THR O O -10.778 6.485 -7.082 1.00 . A A . 2 THR O 1 1 7 4310 1 1 2 THR OG1 O -10.376 10.265 -5.110 1.00 . A A . 2 THR OG1 1 1 7 4311 1 1 3 CYS C C -7.748 4.343 -6.293 1.00 . A A . 3 CYS C 1 1 7 4312 1 1 3 CYS CA C -8.434 5.073 -7.442 1.00 . A A . 3 CYS CA 1 1 7 4313 1 1 3 CYS CB C -7.693 4.836 -8.761 1.00 . A A . 3 CYS CB 1 1 7 4314 1 1 3 CYS H H -7.713 7.034 -7.112 1.00 . A A . 3 CYS H 1 1 7 4315 1 1 3 CYS HA H -9.439 4.689 -7.537 1.00 . A A . 3 CYS HA 1 1 7 4316 1 1 3 CYS HB2 H -6.861 5.525 -8.830 1.00 . A A . 3 CYS HB2 1 1 7 4317 1 1 3 CYS HB3 H -7.322 3.822 -8.785 1.00 . A A . 3 CYS HB3 1 1 7 4318 1 1 3 CYS N N -8.536 6.497 -7.170 1.00 . A A . 3 CYS N 1 1 7 4319 1 1 3 CYS O O -6.762 4.829 -5.735 1.00 . A A . 3 CYS O 1 1 7 4320 1 1 3 CYS SG S -8.729 5.089 -10.237 1.00 . A A . 3 CYS SG 1 1 7 4321 1 1 4 LYS C C -7.642 0.920 -5.302 1.00 . A A . 4 LYS C 1 1 7 4322 1 1 4 LYS CA C -7.753 2.371 -4.855 1.00 . A A . 4 LYS CA 1 1 7 4323 1 1 4 LYS CB C -8.673 2.481 -3.622 1.00 . A A . 4 LYS CB 1 1 7 4324 1 1 4 LYS CD C -8.017 0.382 -2.326 1.00 . A A . 4 LYS CD 1 1 7 4325 1 1 4 LYS CE C -9.383 -0.270 -2.505 1.00 . A A . 4 LYS CE 1 1 7 4326 1 1 4 LYS CG C -8.101 1.908 -2.321 1.00 . A A . 4 LYS CG 1 1 7 4327 1 1 4 LYS H H -9.076 2.859 -6.426 1.00 . A A . 4 LYS H 1 1 7 4328 1 1 4 LYS HA H -6.767 2.738 -4.601 1.00 . A A . 4 LYS HA 1 1 7 4329 1 1 4 LYS HB2 H -8.895 3.524 -3.454 1.00 . A A . 4 LYS HB2 1 1 7 4330 1 1 4 LYS HB3 H -9.597 1.963 -3.838 1.00 . A A . 4 LYS HB3 1 1 7 4331 1 1 4 LYS HD2 H -7.376 0.072 -3.136 1.00 . A A . 4 LYS HD2 1 1 7 4332 1 1 4 LYS HD3 H -7.593 0.055 -1.388 1.00 . A A . 4 LYS HD3 1 1 7 4333 1 1 4 LYS HE2 H -9.966 -0.106 -1.611 1.00 . A A . 4 LYS HE2 1 1 7 4334 1 1 4 LYS HE3 H -9.880 0.190 -3.346 1.00 . A A . 4 LYS HE3 1 1 7 4335 1 1 4 LYS HG2 H -7.108 2.305 -2.176 1.00 . A A . 4 LYS HG2 1 1 7 4336 1 1 4 LYS HG3 H -8.732 2.219 -1.502 1.00 . A A . 4 LYS HG3 1 1 7 4337 1 1 4 LYS HZ1 H -8.452 -2.129 -2.224 1.00 . A A . 4 LYS HZ1 1 1 7 4338 1 1 4 LYS HZ2 H -9.135 -1.923 -3.760 1.00 . A A . 4 LYS HZ2 1 1 7 4339 1 1 4 LYS HZ3 H -10.131 -2.222 -2.431 1.00 . A A . 4 LYS HZ3 1 1 7 4340 1 1 4 LYS N N -8.287 3.181 -5.941 1.00 . A A . 4 LYS N 1 1 7 4341 1 1 4 LYS NZ N -9.272 -1.735 -2.748 1.00 . A A . 4 LYS NZ 1 1 7 4342 1 1 4 LYS O O -8.605 0.339 -5.802 1.00 . A A . 4 LYS O 1 1 7 4343 1 1 5 ALA C C -5.022 -1.541 -4.651 1.00 . A A . 5 ALA C 1 1 7 4344 1 1 5 ALA CA C -6.217 -1.042 -5.441 1.00 . A A . 5 ALA CA 1 1 7 4345 1 1 5 ALA CB C -5.967 -1.184 -6.936 1.00 . A A . 5 ALA CB 1 1 7 4346 1 1 5 ALA H H -5.754 0.866 -4.669 1.00 . A A . 5 ALA H 1 1 7 4347 1 1 5 ALA HA H -7.088 -1.626 -5.179 1.00 . A A . 5 ALA HA 1 1 7 4348 1 1 5 ALA HB1 H -6.712 -1.837 -7.366 1.00 . A A . 5 ALA HB1 1 1 7 4349 1 1 5 ALA HB2 H -4.985 -1.603 -7.099 1.00 . A A . 5 ALA HB2 1 1 7 4350 1 1 5 ALA HB3 H -6.026 -0.213 -7.405 1.00 . A A . 5 ALA HB3 1 1 7 4351 1 1 5 ALA N N -6.474 0.343 -5.092 1.00 . A A . 5 ALA N 1 1 7 4352 1 1 5 ALA O O -4.022 -0.834 -4.536 1.00 . A A . 5 ALA O 1 1 7 4353 1 1 6 GLU C C -2.855 -3.543 -4.225 1.00 . A A . 6 GLU C 1 1 7 4354 1 1 6 GLU CA C -4.045 -3.306 -3.315 1.00 . A A . 6 GLU CA 1 1 7 4355 1 1 6 GLU CB C -4.457 -4.623 -2.634 1.00 . A A . 6 GLU CB 1 1 7 4356 1 1 6 GLU CD C -6.840 -3.833 -2.151 1.00 . A A . 6 GLU CD 1 1 7 4357 1 1 6 GLU CG C -5.586 -4.498 -1.609 1.00 . A A . 6 GLU CG 1 1 7 4358 1 1 6 GLU H H -5.955 -3.254 -4.210 1.00 . A A . 6 GLU H 1 1 7 4359 1 1 6 GLU HA H -3.767 -2.585 -2.559 1.00 . A A . 6 GLU HA 1 1 7 4360 1 1 6 GLU HB2 H -4.760 -5.327 -3.387 1.00 . A A . 6 GLU HB2 1 1 7 4361 1 1 6 GLU HB3 H -3.592 -5.022 -2.124 1.00 . A A . 6 GLU HB3 1 1 7 4362 1 1 6 GLU HG2 H -5.850 -5.487 -1.266 1.00 . A A . 6 GLU HG2 1 1 7 4363 1 1 6 GLU HG3 H -5.225 -3.918 -0.771 1.00 . A A . 6 GLU HG3 1 1 7 4364 1 1 6 GLU N N -5.128 -2.738 -4.096 1.00 . A A . 6 GLU N 1 1 7 4365 1 1 6 GLU O O -3.023 -3.973 -5.368 1.00 . A A . 6 GLU O 1 1 7 4366 1 1 6 GLU OE1 O -7.363 -4.276 -3.191 1.00 . A A . 6 GLU OE1 1 1 7 4367 1 1 6 GLU OE2 O -7.304 -2.852 -1.543 1.00 . A A . 6 GLU OE2 1 1 7 4368 1 1 7 CYS C C -0.360 -4.811 -5.083 1.00 . A A . 7 CYS C 1 1 7 4369 1 1 7 CYS CA C -0.449 -3.396 -4.515 1.00 . A A . 7 CYS CA 1 1 7 4370 1 1 7 CYS CB C 0.795 -3.094 -3.672 1.00 . A A . 7 CYS CB 1 1 7 4371 1 1 7 CYS H H -1.621 -2.871 -2.817 1.00 . A A . 7 CYS H 1 1 7 4372 1 1 7 CYS HA H -0.493 -2.697 -5.337 1.00 . A A . 7 CYS HA 1 1 7 4373 1 1 7 CYS HB2 H 0.679 -2.127 -3.205 1.00 . A A . 7 CYS HB2 1 1 7 4374 1 1 7 CYS HB3 H 0.894 -3.849 -2.906 1.00 . A A . 7 CYS HB3 1 1 7 4375 1 1 7 CYS N N -1.670 -3.234 -3.729 1.00 . A A . 7 CYS N 1 1 7 4376 1 1 7 CYS O O -0.471 -5.792 -4.346 1.00 . A A . 7 CYS O 1 1 7 4377 1 1 7 CYS SG S 2.347 -3.066 -4.636 1.00 . A A . 7 CYS SG 1 1 7 4378 1 1 8 PRO C C 0.978 -7.125 -6.494 1.00 . A A . 8 PRO C 1 1 7 4379 1 1 8 PRO CA C -0.091 -6.224 -7.097 1.00 . A A . 8 PRO CA 1 1 7 4380 1 1 8 PRO CB C 0.277 -5.846 -8.534 1.00 . A A . 8 PRO CB 1 1 7 4381 1 1 8 PRO CD C -0.065 -3.799 -7.354 1.00 . A A . 8 PRO CD 1 1 7 4382 1 1 8 PRO CG C -0.220 -4.452 -8.698 1.00 . A A . 8 PRO CG 1 1 7 4383 1 1 8 PRO HA H -1.041 -6.739 -7.089 1.00 . A A . 8 PRO HA 1 1 7 4384 1 1 8 PRO HB2 H 1.349 -5.901 -8.660 1.00 . A A . 8 PRO HB2 1 1 7 4385 1 1 8 PRO HB3 H -0.208 -6.521 -9.223 1.00 . A A . 8 PRO HB3 1 1 7 4386 1 1 8 PRO HD2 H 0.902 -3.325 -7.274 1.00 . A A . 8 PRO HD2 1 1 7 4387 1 1 8 PRO HD3 H -0.855 -3.081 -7.189 1.00 . A A . 8 PRO HD3 1 1 7 4388 1 1 8 PRO HG2 H 0.373 -3.934 -9.438 1.00 . A A . 8 PRO HG2 1 1 7 4389 1 1 8 PRO HG3 H -1.260 -4.465 -8.991 1.00 . A A . 8 PRO HG3 1 1 7 4390 1 1 8 PRO N N -0.178 -4.928 -6.412 1.00 . A A . 8 PRO N 1 1 7 4391 1 1 8 PRO O O 0.764 -8.320 -6.298 1.00 . A A . 8 PRO O 1 1 7 4392 1 1 9 THR C C 3.126 -7.254 -4.069 1.00 . A A . 9 THR C 1 1 7 4393 1 1 9 THR CA C 3.216 -7.293 -5.590 1.00 . A A . 9 THR CA 1 1 7 4394 1 1 9 THR CB C 4.585 -6.750 -6.046 1.00 . A A . 9 THR CB 1 1 7 4395 1 1 9 THR CG2 C 4.848 -7.101 -7.503 1.00 . A A . 9 THR CG2 1 1 7 4396 1 1 9 THR H H 2.236 -5.586 -6.349 1.00 . A A . 9 THR H 1 1 7 4397 1 1 9 THR HA H 3.132 -8.319 -5.919 1.00 . A A . 9 THR HA 1 1 7 4398 1 1 9 THR HB H 5.355 -7.203 -5.439 1.00 . A A . 9 THR HB 1 1 7 4399 1 1 9 THR HG1 H 4.162 -5.079 -5.067 1.00 . A A . 9 THR HG1 1 1 7 4400 1 1 9 THR HG21 H 5.285 -6.251 -8.005 1.00 . A A . 9 THR HG21 1 1 7 4401 1 1 9 THR HG22 H 3.917 -7.363 -7.983 1.00 . A A . 9 THR HG22 1 1 7 4402 1 1 9 THR HG23 H 5.528 -7.939 -7.554 1.00 . A A . 9 THR HG23 1 1 7 4403 1 1 9 THR N N 2.126 -6.544 -6.186 1.00 . A A . 9 THR N 1 1 7 4404 1 1 9 THR O O 4.120 -7.012 -3.386 1.00 . A A . 9 THR O 1 1 7 4405 1 1 9 THR OG1 O 4.639 -5.323 -5.878 1.00 . A A . 9 THR OG1 1 1 7 4406 1 1 10 TRP C C 0.678 -8.505 -1.713 1.00 . A A . 10 TRP C 1 1 7 4407 1 1 10 TRP CA C 1.715 -7.464 -2.112 1.00 . A A . 10 TRP CA 1 1 7 4408 1 1 10 TRP CB C 1.242 -6.080 -1.662 1.00 . A A . 10 TRP CB 1 1 7 4409 1 1 10 TRP CD1 C 0.359 -6.201 0.737 1.00 . A A . 10 TRP CD1 1 1 7 4410 1 1 10 TRP CD2 C 2.404 -5.310 0.545 1.00 . A A . 10 TRP CD2 1 1 7 4411 1 1 10 TRP CE2 C 2.055 -5.327 1.907 1.00 . A A . 10 TRP CE2 1 1 7 4412 1 1 10 TRP CE3 C 3.645 -4.789 0.173 1.00 . A A . 10 TRP CE3 1 1 7 4413 1 1 10 TRP CG C 1.317 -5.886 -0.182 1.00 . A A . 10 TRP CG 1 1 7 4414 1 1 10 TRP CH2 C 4.114 -4.333 2.501 1.00 . A A . 10 TRP CH2 1 1 7 4415 1 1 10 TRP CZ2 C 2.909 -4.838 2.898 1.00 . A A . 10 TRP CZ2 1 1 7 4416 1 1 10 TRP CZ3 C 4.485 -4.304 1.154 1.00 . A A . 10 TRP CZ3 1 1 7 4417 1 1 10 TRP H H 1.168 -7.665 -4.141 1.00 . A A . 10 TRP H 1 1 7 4418 1 1 10 TRP HA H 2.651 -7.694 -1.628 1.00 . A A . 10 TRP HA 1 1 7 4419 1 1 10 TRP HB2 H 1.859 -5.326 -2.129 1.00 . A A . 10 TRP HB2 1 1 7 4420 1 1 10 TRP HB3 H 0.216 -5.941 -1.967 1.00 . A A . 10 TRP HB3 1 1 7 4421 1 1 10 TRP HD1 H -0.598 -6.648 0.491 1.00 . A A . 10 TRP HD1 1 1 7 4422 1 1 10 TRP HE1 H 0.302 -6.026 2.837 1.00 . A A . 10 TRP HE1 1 1 7 4423 1 1 10 TRP HE3 H 3.950 -4.759 -0.863 1.00 . A A . 10 TRP HE3 1 1 7 4424 1 1 10 TRP HH2 H 4.803 -3.940 3.234 1.00 . A A . 10 TRP HH2 1 1 7 4425 1 1 10 TRP HZ2 H 2.645 -4.850 3.944 1.00 . A A . 10 TRP HZ2 1 1 7 4426 1 1 10 TRP HZ3 H 5.443 -3.890 0.883 1.00 . A A . 10 TRP HZ3 1 1 7 4427 1 1 10 TRP N N 1.930 -7.483 -3.546 1.00 . A A . 10 TRP N 1 1 7 4428 1 1 10 TRP NE1 N 0.801 -5.881 2.002 1.00 . A A . 10 TRP NE1 1 1 7 4429 1 1 10 TRP O O -0.477 -8.442 -2.137 1.00 . A A . 10 TRP O 1 1 7 4430 1 1 11 ASP C C 0.650 -10.934 0.977 1.00 . A A . 11 ASP C 1 1 7 4431 1 1 11 ASP CA C 0.205 -10.495 -0.408 1.00 . A A . 11 ASP CA 1 1 7 4432 1 1 11 ASP CB C 0.199 -11.682 -1.376 1.00 . A A . 11 ASP CB 1 1 7 4433 1 1 11 ASP CG C -1.033 -12.550 -1.210 1.00 . A A . 11 ASP CG 1 1 7 4434 1 1 11 ASP H H 2.022 -9.431 -0.571 1.00 . A A . 11 ASP H 1 1 7 4435 1 1 11 ASP HA H -0.792 -10.084 -0.342 1.00 . A A . 11 ASP HA 1 1 7 4436 1 1 11 ASP HB2 H 0.224 -11.313 -2.391 1.00 . A A . 11 ASP HB2 1 1 7 4437 1 1 11 ASP HB3 H 1.074 -12.290 -1.197 1.00 . A A . 11 ASP HB3 1 1 7 4438 1 1 11 ASP N N 1.093 -9.445 -0.883 1.00 . A A . 11 ASP N 1 1 7 4439 1 1 11 ASP O O 0.896 -12.109 1.235 1.00 . A A . 11 ASP O 1 1 7 4440 1 1 11 ASP OD1 O -2.154 -12.018 -1.367 1.00 . A A . 11 ASP OD1 1 1 7 4441 1 1 11 ASP OD2 O -0.890 -13.754 -0.928 1.00 . A A . 11 ASP OD2 1 1 7 4442 1 1 12 SER C C 0.670 -9.177 4.178 1.00 . A A . 12 SER C 1 1 7 4443 1 1 12 SER CA C 1.226 -10.222 3.219 1.00 . A A . 12 SER CA 1 1 7 4444 1 1 12 SER CB C 2.756 -10.232 3.266 1.00 . A A . 12 SER CB 1 1 7 4445 1 1 12 SER H H 0.596 -9.040 1.595 1.00 . A A . 12 SER H 1 1 7 4446 1 1 12 SER HA H 0.858 -11.194 3.509 1.00 . A A . 12 SER HA 1 1 7 4447 1 1 12 SER HB2 H 3.083 -10.230 4.295 1.00 . A A . 12 SER HB2 1 1 7 4448 1 1 12 SER HB3 H 3.124 -11.120 2.773 1.00 . A A . 12 SER HB3 1 1 7 4449 1 1 12 SER HG H 3.845 -8.600 3.229 1.00 . A A . 12 SER HG 1 1 7 4450 1 1 12 SER N N 0.783 -9.962 1.864 1.00 . A A . 12 SER N 1 1 7 4451 1 1 12 SER O O 0.077 -8.178 3.754 1.00 . A A . 12 SER O 1 1 7 4452 1 1 12 SER OG O 3.294 -9.091 2.614 1.00 . A A . 12 SER OG 1 1 7 4453 1 1 13 VAL C C 1.323 -7.304 6.616 1.00 . A A . 13 VAL C 1 1 7 4454 1 1 13 VAL CA C 0.386 -8.502 6.495 1.00 . A A . 13 VAL CA 1 1 7 4455 1 1 13 VAL CB C 0.276 -9.215 7.863 1.00 . A A . 13 VAL CB 1 1 7 4456 1 1 13 VAL CG1 C -0.232 -8.266 8.939 1.00 . A A . 13 VAL CG1 1 1 7 4457 1 1 13 VAL CG2 C -0.626 -10.435 7.757 1.00 . A A . 13 VAL CG2 1 1 7 4458 1 1 13 VAL H H 1.339 -10.223 5.738 1.00 . A A . 13 VAL H 1 1 7 4459 1 1 13 VAL HA H -0.596 -8.155 6.209 1.00 . A A . 13 VAL HA 1 1 7 4460 1 1 13 VAL HB H 1.262 -9.550 8.150 1.00 . A A . 13 VAL HB 1 1 7 4461 1 1 13 VAL HG11 H -1.290 -8.096 8.798 1.00 . A A . 13 VAL HG11 1 1 7 4462 1 1 13 VAL HG12 H 0.295 -7.326 8.869 1.00 . A A . 13 VAL HG12 1 1 7 4463 1 1 13 VAL HG13 H -0.064 -8.702 9.912 1.00 . A A . 13 VAL HG13 1 1 7 4464 1 1 13 VAL HG21 H -0.597 -10.818 6.747 1.00 . A A . 13 VAL HG21 1 1 7 4465 1 1 13 VAL HG22 H -1.639 -10.157 8.007 1.00 . A A . 13 VAL HG22 1 1 7 4466 1 1 13 VAL HG23 H -0.282 -11.198 8.440 1.00 . A A . 13 VAL HG23 1 1 7 4467 1 1 13 VAL N N 0.862 -9.413 5.468 1.00 . A A . 13 VAL N 1 1 7 4468 1 1 13 VAL O O 2.543 -7.462 6.675 1.00 . A A . 13 VAL O 1 1 7 4469 1 1 14 CYS C C 2.269 -4.788 8.054 1.00 . A A . 14 CYS C 1 1 7 4470 1 1 14 CYS CA C 1.504 -4.879 6.742 1.00 . A A . 14 CYS CA 1 1 7 4471 1 1 14 CYS CB C 0.577 -3.675 6.640 1.00 . A A . 14 CYS CB 1 1 7 4472 1 1 14 CYS H H -0.235 -6.064 6.573 1.00 . A A . 14 CYS H 1 1 7 4473 1 1 14 CYS HA H 2.207 -4.849 5.924 1.00 . A A . 14 CYS HA 1 1 7 4474 1 1 14 CYS HB2 H -0.424 -3.982 6.903 1.00 . A A . 14 CYS HB2 1 1 7 4475 1 1 14 CYS HB3 H 0.907 -2.920 7.339 1.00 . A A . 14 CYS HB3 1 1 7 4476 1 1 14 CYS N N 0.741 -6.114 6.637 1.00 . A A . 14 CYS N 1 1 7 4477 1 1 14 CYS O O 1.705 -4.979 9.131 1.00 . A A . 14 CYS O 1 1 7 4478 1 1 14 CYS SG S 0.496 -2.906 4.996 1.00 . A A . 14 CYS SG 1 1 7 4479 1 1 15 ILE C C 4.537 -2.824 9.446 1.00 . A A . 15 ILE C 1 1 7 4480 1 1 15 ILE CA C 4.402 -4.311 9.115 1.00 . A A . 15 ILE CA 1 1 7 4481 1 1 15 ILE CB C 5.804 -4.921 8.869 1.00 . A A . 15 ILE CB 1 1 7 4482 1 1 15 ILE CD1 C 4.990 -7.279 9.435 1.00 . A A . 15 ILE CD1 1 1 7 4483 1 1 15 ILE CG1 C 5.682 -6.385 8.426 1.00 . A A . 15 ILE CG1 1 1 7 4484 1 1 15 ILE CG2 C 6.672 -4.814 10.117 1.00 . A A . 15 ILE CG2 1 1 7 4485 1 1 15 ILE H H 3.925 -4.312 7.061 1.00 . A A . 15 ILE H 1 1 7 4486 1 1 15 ILE HA H 3.940 -4.822 9.948 1.00 . A A . 15 ILE HA 1 1 7 4487 1 1 15 ILE HB H 6.282 -4.356 8.083 1.00 . A A . 15 ILE HB 1 1 7 4488 1 1 15 ILE HD11 H 5.548 -7.279 10.359 1.00 . A A . 15 ILE HD11 1 1 7 4489 1 1 15 ILE HD12 H 4.935 -8.286 9.047 1.00 . A A . 15 ILE HD12 1 1 7 4490 1 1 15 ILE HD13 H 3.991 -6.909 9.618 1.00 . A A . 15 ILE HD13 1 1 7 4491 1 1 15 ILE HG12 H 5.118 -6.428 7.507 1.00 . A A . 15 ILE HG12 1 1 7 4492 1 1 15 ILE HG13 H 6.671 -6.784 8.253 1.00 . A A . 15 ILE HG13 1 1 7 4493 1 1 15 ILE HG21 H 7.577 -4.275 9.881 1.00 . A A . 15 ILE HG21 1 1 7 4494 1 1 15 ILE HG22 H 6.924 -5.805 10.467 1.00 . A A . 15 ILE HG22 1 1 7 4495 1 1 15 ILE HG23 H 6.130 -4.287 10.888 1.00 . A A . 15 ILE HG23 1 1 7 4496 1 1 15 ILE N N 3.547 -4.466 7.949 1.00 . A A . 15 ILE N 1 1 7 4497 1 1 15 ILE O O 4.752 -2.436 10.594 1.00 . A A . 15 ILE O 1 1 7 4498 1 1 16 ASN C C 3.985 0.098 7.260 1.00 . A A . 16 ASN C 1 1 7 4499 1 1 16 ASN CA C 4.506 -0.551 8.542 1.00 . A A . 16 ASN CA 1 1 7 4500 1 1 16 ASN CB C 5.971 -0.155 8.809 1.00 . A A . 16 ASN CB 1 1 7 4501 1 1 16 ASN CG C 6.155 1.311 9.165 1.00 . A A . 16 ASN CG 1 1 7 4502 1 1 16 ASN H H 4.229 -2.377 7.527 1.00 . A A . 16 ASN H 1 1 7 4503 1 1 16 ASN HA H 3.891 -0.241 9.374 1.00 . A A . 16 ASN HA 1 1 7 4504 1 1 16 ASN HB2 H 6.349 -0.748 9.627 1.00 . A A . 16 ASN HB2 1 1 7 4505 1 1 16 ASN HB3 H 6.556 -0.366 7.924 1.00 . A A . 16 ASN HB3 1 1 7 4506 1 1 16 ASN HD21 H 6.548 0.826 11.050 1.00 . A A . 16 ASN HD21 1 1 7 4507 1 1 16 ASN HD22 H 6.588 2.515 10.682 1.00 . A A . 16 ASN HD22 1 1 7 4508 1 1 16 ASN N N 4.404 -1.999 8.412 1.00 . A A . 16 ASN N 1 1 7 4509 1 1 16 ASN ND2 N 6.460 1.578 10.425 1.00 . A A . 16 ASN ND2 1 1 7 4510 1 1 16 ASN O O 3.875 -0.573 6.232 1.00 . A A . 16 ASN O 1 1 7 4511 1 1 16 ASN OD1 O 6.025 2.195 8.319 1.00 . A A . 16 ASN OD1 1 1 7 4512 1 1 17 LYS C C 4.233 2.239 5.079 1.00 . A A . 17 LYS C 1 1 7 4513 1 1 17 LYS CA C 3.148 2.099 6.150 1.00 . A A . 17 LYS CA 1 1 7 4514 1 1 17 LYS CB C 2.626 3.486 6.549 1.00 . A A . 17 LYS CB 1 1 7 4515 1 1 17 LYS CD C 1.423 5.592 5.850 1.00 . A A . 17 LYS CD 1 1 7 4516 1 1 17 LYS CE C 0.425 6.207 4.873 1.00 . A A . 17 LYS CE 1 1 7 4517 1 1 17 LYS CG C 1.800 4.167 5.462 1.00 . A A . 17 LYS CG 1 1 7 4518 1 1 17 LYS H H 3.762 1.866 8.164 1.00 . A A . 17 LYS H 1 1 7 4519 1 1 17 LYS HA H 2.330 1.523 5.742 1.00 . A A . 17 LYS HA 1 1 7 4520 1 1 17 LYS HB2 H 2.009 3.386 7.429 1.00 . A A . 17 LYS HB2 1 1 7 4521 1 1 17 LYS HB3 H 3.469 4.121 6.780 1.00 . A A . 17 LYS HB3 1 1 7 4522 1 1 17 LYS HD2 H 0.983 5.580 6.836 1.00 . A A . 17 LYS HD2 1 1 7 4523 1 1 17 LYS HD3 H 2.318 6.196 5.863 1.00 . A A . 17 LYS HD3 1 1 7 4524 1 1 17 LYS HE2 H -0.478 5.615 4.882 1.00 . A A . 17 LYS HE2 1 1 7 4525 1 1 17 LYS HE3 H 0.196 7.211 5.200 1.00 . A A . 17 LYS HE3 1 1 7 4526 1 1 17 LYS HG2 H 2.376 4.195 4.550 1.00 . A A . 17 LYS HG2 1 1 7 4527 1 1 17 LYS HG3 H 0.896 3.597 5.301 1.00 . A A . 17 LYS HG3 1 1 7 4528 1 1 17 LYS HZ1 H 1.848 6.776 3.448 1.00 . A A . 17 LYS HZ1 1 1 7 4529 1 1 17 LYS HZ2 H 0.264 6.747 2.851 1.00 . A A . 17 LYS HZ2 1 1 7 4530 1 1 17 LYS HZ3 H 1.096 5.297 3.115 1.00 . A A . 17 LYS HZ3 1 1 7 4531 1 1 17 LYS N N 3.657 1.384 7.317 1.00 . A A . 17 LYS N 1 1 7 4532 1 1 17 LYS NZ N 0.948 6.260 3.481 1.00 . A A . 17 LYS NZ 1 1 7 4533 1 1 17 LYS O O 3.934 2.216 3.887 1.00 . A A . 17 LYS O 1 1 7 4534 1 1 18 LYS C C 6.636 1.430 3.532 1.00 . A A . 18 LYS C 1 1 7 4535 1 1 18 LYS CA C 6.621 2.547 4.592 1.00 . A A . 18 LYS CA 1 1 7 4536 1 1 18 LYS CB C 7.949 2.589 5.367 1.00 . A A . 18 LYS CB 1 1 7 4537 1 1 18 LYS CD C 9.507 3.019 3.410 1.00 . A A . 18 LYS CD 1 1 7 4538 1 1 18 LYS CE C 10.287 1.720 3.539 1.00 . A A . 18 LYS CE 1 1 7 4539 1 1 18 LYS CG C 9.001 3.514 4.759 1.00 . A A . 18 LYS CG 1 1 7 4540 1 1 18 LYS H H 5.658 2.406 6.485 1.00 . A A . 18 LYS H 1 1 7 4541 1 1 18 LYS HA H 6.490 3.491 4.083 1.00 . A A . 18 LYS HA 1 1 7 4542 1 1 18 LYS HB2 H 7.752 2.922 6.375 1.00 . A A . 18 LYS HB2 1 1 7 4543 1 1 18 LYS HB3 H 8.360 1.591 5.403 1.00 . A A . 18 LYS HB3 1 1 7 4544 1 1 18 LYS HD2 H 8.661 2.855 2.760 1.00 . A A . 18 LYS HD2 1 1 7 4545 1 1 18 LYS HD3 H 10.150 3.774 2.981 1.00 . A A . 18 LYS HD3 1 1 7 4546 1 1 18 LYS HE2 H 11.121 1.879 4.205 1.00 . A A . 18 LYS HE2 1 1 7 4547 1 1 18 LYS HE3 H 9.636 0.964 3.953 1.00 . A A . 18 LYS HE3 1 1 7 4548 1 1 18 LYS HG2 H 8.567 4.493 4.627 1.00 . A A . 18 LYS HG2 1 1 7 4549 1 1 18 LYS HG3 H 9.837 3.583 5.442 1.00 . A A . 18 LYS HG3 1 1 7 4550 1 1 18 LYS HZ1 H 11.785 0.926 2.318 1.00 . A A . 18 LYS HZ1 1 1 7 4551 1 1 18 LYS HZ2 H 10.768 2.023 1.529 1.00 . A A . 18 LYS HZ2 1 1 7 4552 1 1 18 LYS HZ3 H 10.220 0.461 1.873 1.00 . A A . 18 LYS HZ3 1 1 7 4553 1 1 18 LYS N N 5.489 2.391 5.515 1.00 . A A . 18 LYS N 1 1 7 4554 1 1 18 LYS NZ N 10.801 1.249 2.223 1.00 . A A . 18 LYS NZ 1 1 7 4555 1 1 18 LYS O O 6.611 1.727 2.337 1.00 . A A . 18 LYS O 1 1 7 4556 1 1 19 PRO C C 5.533 -0.869 1.965 1.00 . A A . 19 PRO C 1 1 7 4557 1 1 19 PRO CA C 6.663 -0.993 2.983 1.00 . A A . 19 PRO CA 1 1 7 4558 1 1 19 PRO CB C 6.413 -2.205 3.885 1.00 . A A . 19 PRO CB 1 1 7 4559 1 1 19 PRO CD C 6.718 -0.351 5.332 1.00 . A A . 19 PRO CD 1 1 7 4560 1 1 19 PRO CG C 7.011 -1.817 5.185 1.00 . A A . 19 PRO CG 1 1 7 4561 1 1 19 PRO HA H 7.609 -1.098 2.474 1.00 . A A . 19 PRO HA 1 1 7 4562 1 1 19 PRO HB2 H 5.349 -2.373 3.974 1.00 . A A . 19 PRO HB2 1 1 7 4563 1 1 19 PRO HB3 H 6.886 -3.082 3.471 1.00 . A A . 19 PRO HB3 1 1 7 4564 1 1 19 PRO HD2 H 5.767 -0.204 5.824 1.00 . A A . 19 PRO HD2 1 1 7 4565 1 1 19 PRO HD3 H 7.508 0.139 5.881 1.00 . A A . 19 PRO HD3 1 1 7 4566 1 1 19 PRO HG2 H 6.551 -2.377 5.986 1.00 . A A . 19 PRO HG2 1 1 7 4567 1 1 19 PRO HG3 H 8.077 -1.987 5.168 1.00 . A A . 19 PRO HG3 1 1 7 4568 1 1 19 PRO N N 6.669 0.132 3.935 1.00 . A A . 19 PRO N 1 1 7 4569 1 1 19 PRO O O 5.732 -1.073 0.765 1.00 . A A . 19 PRO O 1 1 7 4570 1 1 20 CYS C C 3.380 0.762 0.608 1.00 . A A . 20 CYS C 1 1 7 4571 1 1 20 CYS CA C 3.173 -0.358 1.629 1.00 . A A . 20 CYS CA 1 1 7 4572 1 1 20 CYS CB C 1.956 -0.059 2.512 1.00 . A A . 20 CYS CB 1 1 7 4573 1 1 20 CYS H H 4.275 -0.368 3.429 1.00 . A A . 20 CYS H 1 1 7 4574 1 1 20 CYS HA H 3.009 -1.288 1.103 1.00 . A A . 20 CYS HA 1 1 7 4575 1 1 20 CYS HB2 H 1.810 -0.880 3.197 1.00 . A A . 20 CYS HB2 1 1 7 4576 1 1 20 CYS HB3 H 2.147 0.842 3.077 1.00 . A A . 20 CYS HB3 1 1 7 4577 1 1 20 CYS N N 4.353 -0.522 2.464 1.00 . A A . 20 CYS N 1 1 7 4578 1 1 20 CYS O O 3.186 0.564 -0.592 1.00 . A A . 20 CYS O 1 1 7 4579 1 1 20 CYS SG S 0.397 0.179 1.602 1.00 . A A . 20 CYS SG 1 1 7 4580 1 1 21 VAL C C 5.066 2.730 -0.855 1.00 . A A . 21 VAL C 1 1 7 4581 1 1 21 VAL CA C 4.039 3.079 0.216 1.00 . A A . 21 VAL CA 1 1 7 4582 1 1 21 VAL CB C 4.526 4.312 1.013 1.00 . A A . 21 VAL CB 1 1 7 4583 1 1 21 VAL CG1 C 4.811 5.485 0.086 1.00 . A A . 21 VAL CG1 1 1 7 4584 1 1 21 VAL CG2 C 3.502 4.708 2.063 1.00 . A A . 21 VAL CG2 1 1 7 4585 1 1 21 VAL H H 3.946 2.027 2.056 1.00 . A A . 21 VAL H 1 1 7 4586 1 1 21 VAL HA H 3.105 3.334 -0.270 1.00 . A A . 21 VAL HA 1 1 7 4587 1 1 21 VAL HB H 5.444 4.050 1.518 1.00 . A A . 21 VAL HB 1 1 7 4588 1 1 21 VAL HG11 H 3.886 5.830 -0.353 1.00 . A A . 21 VAL HG11 1 1 7 4589 1 1 21 VAL HG12 H 5.486 5.171 -0.696 1.00 . A A . 21 VAL HG12 1 1 7 4590 1 1 21 VAL HG13 H 5.262 6.288 0.650 1.00 . A A . 21 VAL HG13 1 1 7 4591 1 1 21 VAL HG21 H 2.593 5.027 1.576 1.00 . A A . 21 VAL HG21 1 1 7 4592 1 1 21 VAL HG22 H 3.894 5.517 2.660 1.00 . A A . 21 VAL HG22 1 1 7 4593 1 1 21 VAL HG23 H 3.292 3.860 2.698 1.00 . A A . 21 VAL HG23 1 1 7 4594 1 1 21 VAL N N 3.794 1.934 1.088 1.00 . A A . 21 VAL N 1 1 7 4595 1 1 21 VAL O O 4.921 3.123 -2.008 1.00 . A A . 21 VAL O 1 1 7 4596 1 1 22 ALA C C 6.532 0.708 -2.520 1.00 . A A . 22 ALA C 1 1 7 4597 1 1 22 ALA CA C 7.129 1.563 -1.406 1.00 . A A . 22 ALA CA 1 1 7 4598 1 1 22 ALA CB C 8.229 0.804 -0.678 1.00 . A A . 22 ALA CB 1 1 7 4599 1 1 22 ALA H H 6.142 1.684 0.468 1.00 . A A . 22 ALA H 1 1 7 4600 1 1 22 ALA HA H 7.562 2.453 -1.840 1.00 . A A . 22 ALA HA 1 1 7 4601 1 1 22 ALA HB1 H 8.366 1.225 0.307 1.00 . A A . 22 ALA HB1 1 1 7 4602 1 1 22 ALA HB2 H 9.151 0.884 -1.235 1.00 . A A . 22 ALA HB2 1 1 7 4603 1 1 22 ALA HB3 H 7.950 -0.236 -0.589 1.00 . A A . 22 ALA HB3 1 1 7 4604 1 1 22 ALA N N 6.091 1.978 -0.469 1.00 . A A . 22 ALA N 1 1 7 4605 1 1 22 ALA O O 6.836 0.902 -3.700 1.00 . A A . 22 ALA O 1 1 7 4606 1 1 23 CYS C C 4.124 -0.260 -4.018 1.00 . A A . 23 CYS C 1 1 7 4607 1 1 23 CYS CA C 4.998 -1.096 -3.091 1.00 . A A . 23 CYS CA 1 1 7 4608 1 1 23 CYS CB C 4.141 -2.129 -2.353 1.00 . A A . 23 CYS CB 1 1 7 4609 1 1 23 CYS H H 5.452 -0.312 -1.179 1.00 . A A . 23 CYS H 1 1 7 4610 1 1 23 CYS HA H 5.754 -1.603 -3.673 1.00 . A A . 23 CYS HA 1 1 7 4611 1 1 23 CYS HB2 H 4.653 -2.428 -1.452 1.00 . A A . 23 CYS HB2 1 1 7 4612 1 1 23 CYS HB3 H 3.198 -1.674 -2.087 1.00 . A A . 23 CYS HB3 1 1 7 4613 1 1 23 CYS N N 5.663 -0.222 -2.135 1.00 . A A . 23 CYS N 1 1 7 4614 1 1 23 CYS O O 4.119 -0.440 -5.234 1.00 . A A . 23 CYS O 1 1 7 4615 1 1 23 CYS SG S 3.777 -3.639 -3.313 1.00 . A A . 23 CYS SG 1 1 7 4616 1 1 24 CYS C C 3.307 2.453 -5.113 1.00 . A A . 24 CYS C 1 1 7 4617 1 1 24 CYS CA C 2.516 1.542 -4.178 1.00 . A A . 24 CYS CA 1 1 7 4618 1 1 24 CYS CB C 1.663 2.360 -3.216 1.00 . A A . 24 CYS CB 1 1 7 4619 1 1 24 CYS H H 3.445 0.759 -2.448 1.00 . A A . 24 CYS H 1 1 7 4620 1 1 24 CYS HA H 1.865 0.920 -4.775 1.00 . A A . 24 CYS HA 1 1 7 4621 1 1 24 CYS HB2 H 2.309 2.916 -2.553 1.00 . A A . 24 CYS HB2 1 1 7 4622 1 1 24 CYS HB3 H 1.052 3.049 -3.775 1.00 . A A . 24 CYS HB3 1 1 7 4623 1 1 24 CYS N N 3.394 0.664 -3.427 1.00 . A A . 24 CYS N 1 1 7 4624 1 1 24 CYS O O 2.874 2.729 -6.226 1.00 . A A . 24 CYS O 1 1 7 4625 1 1 24 CYS SG S 0.561 1.338 -2.192 1.00 . A A . 24 CYS SG 1 1 7 4626 1 1 25 LYS C C 5.812 3.060 -6.720 1.00 . A A . 25 LYS C 1 1 7 4627 1 1 25 LYS CA C 5.305 3.786 -5.482 1.00 . A A . 25 LYS CA 1 1 7 4628 1 1 25 LYS CB C 6.467 4.359 -4.666 1.00 . A A . 25 LYS CB 1 1 7 4629 1 1 25 LYS CD C 5.464 6.651 -4.511 1.00 . A A . 25 LYS CD 1 1 7 4630 1 1 25 LYS CE C 4.464 7.449 -3.689 1.00 . A A . 25 LYS CE 1 1 7 4631 1 1 25 LYS CG C 6.032 5.476 -3.731 1.00 . A A . 25 LYS CG 1 1 7 4632 1 1 25 LYS H H 4.775 2.658 -3.765 1.00 . A A . 25 LYS H 1 1 7 4633 1 1 25 LYS HA H 4.681 4.606 -5.808 1.00 . A A . 25 LYS HA 1 1 7 4634 1 1 25 LYS HB2 H 6.905 3.568 -4.075 1.00 . A A . 25 LYS HB2 1 1 7 4635 1 1 25 LYS HB3 H 7.212 4.751 -5.342 1.00 . A A . 25 LYS HB3 1 1 7 4636 1 1 25 LYS HD2 H 6.274 7.303 -4.801 1.00 . A A . 25 LYS HD2 1 1 7 4637 1 1 25 LYS HD3 H 4.970 6.276 -5.396 1.00 . A A . 25 LYS HD3 1 1 7 4638 1 1 25 LYS HE2 H 4.059 8.235 -4.308 1.00 . A A . 25 LYS HE2 1 1 7 4639 1 1 25 LYS HE3 H 3.665 6.789 -3.383 1.00 . A A . 25 LYS HE3 1 1 7 4640 1 1 25 LYS HG2 H 5.274 5.099 -3.060 1.00 . A A . 25 LYS HG2 1 1 7 4641 1 1 25 LYS HG3 H 6.887 5.811 -3.162 1.00 . A A . 25 LYS HG3 1 1 7 4642 1 1 25 LYS HZ1 H 5.468 7.320 -1.863 1.00 . A A . 25 LYS HZ1 1 1 7 4643 1 1 25 LYS HZ2 H 4.353 8.589 -1.946 1.00 . A A . 25 LYS HZ2 1 1 7 4644 1 1 25 LYS HZ3 H 5.836 8.713 -2.751 1.00 . A A . 25 LYS HZ3 1 1 7 4645 1 1 25 LYS N N 4.470 2.914 -4.664 1.00 . A A . 25 LYS N 1 1 7 4646 1 1 25 LYS NZ N 5.075 8.060 -2.478 1.00 . A A . 25 LYS NZ 1 1 7 4647 1 1 25 LYS O O 5.773 3.609 -7.818 1.00 . A A . 25 LYS O 1 1 7 4648 1 1 26 LYS C C 5.561 0.697 -8.613 1.00 . A A . 26 LYS C 1 1 7 4649 1 1 26 LYS CA C 6.736 1.041 -7.695 1.00 . A A . 26 LYS CA 1 1 7 4650 1 1 26 LYS CB C 7.500 -0.223 -7.246 1.00 . A A . 26 LYS CB 1 1 7 4651 1 1 26 LYS CD C 5.851 -2.143 -7.223 1.00 . A A . 26 LYS CD 1 1 7 4652 1 1 26 LYS CE C 6.668 -3.308 -7.752 1.00 . A A . 26 LYS CE 1 1 7 4653 1 1 26 LYS CG C 6.699 -1.193 -6.386 1.00 . A A . 26 LYS CG 1 1 7 4654 1 1 26 LYS H H 6.251 1.413 -5.659 1.00 . A A . 26 LYS H 1 1 7 4655 1 1 26 LYS HA H 7.415 1.676 -8.247 1.00 . A A . 26 LYS HA 1 1 7 4656 1 1 26 LYS HB2 H 7.829 -0.755 -8.125 1.00 . A A . 26 LYS HB2 1 1 7 4657 1 1 26 LYS HB3 H 8.369 0.085 -6.683 1.00 . A A . 26 LYS HB3 1 1 7 4658 1 1 26 LYS HD2 H 5.050 -2.528 -6.611 1.00 . A A . 26 LYS HD2 1 1 7 4659 1 1 26 LYS HD3 H 5.437 -1.596 -8.058 1.00 . A A . 26 LYS HD3 1 1 7 4660 1 1 26 LYS HE2 H 6.081 -3.841 -8.485 1.00 . A A . 26 LYS HE2 1 1 7 4661 1 1 26 LYS HE3 H 7.563 -2.922 -8.218 1.00 . A A . 26 LYS HE3 1 1 7 4662 1 1 26 LYS HG2 H 7.384 -1.775 -5.789 1.00 . A A . 26 LYS HG2 1 1 7 4663 1 1 26 LYS HG3 H 6.049 -0.625 -5.735 1.00 . A A . 26 LYS HG3 1 1 7 4664 1 1 26 LYS HZ1 H 7.487 -3.723 -5.877 1.00 . A A . 26 LYS HZ1 1 1 7 4665 1 1 26 LYS HZ2 H 7.732 -4.947 -7.017 1.00 . A A . 26 LYS HZ2 1 1 7 4666 1 1 26 LYS HZ3 H 6.206 -4.746 -6.308 1.00 . A A . 26 LYS HZ3 1 1 7 4667 1 1 26 LYS N N 6.259 1.817 -6.554 1.00 . A A . 26 LYS N 1 1 7 4668 1 1 26 LYS NZ N 7.053 -4.246 -6.663 1.00 . A A . 26 LYS NZ 1 1 7 4669 1 1 26 LYS O O 5.734 0.491 -9.813 1.00 . A A . 26 LYS O 1 1 7 4670 1 1 27 ALA C C 2.592 1.612 -9.446 1.00 . A A . 27 ALA C 1 1 7 4671 1 1 27 ALA CA C 3.148 0.351 -8.781 1.00 . A A . 27 ALA CA 1 1 7 4672 1 1 27 ALA CB C 2.106 -0.278 -7.869 1.00 . A A . 27 ALA CB 1 1 7 4673 1 1 27 ALA H H 4.294 0.832 -7.069 1.00 . A A . 27 ALA H 1 1 7 4674 1 1 27 ALA HA H 3.400 -0.366 -9.549 1.00 . A A . 27 ALA HA 1 1 7 4675 1 1 27 ALA HB1 H 1.968 -1.314 -8.141 1.00 . A A . 27 ALA HB1 1 1 7 4676 1 1 27 ALA HB2 H 1.170 0.250 -7.974 1.00 . A A . 27 ALA HB2 1 1 7 4677 1 1 27 ALA HB3 H 2.441 -0.216 -6.844 1.00 . A A . 27 ALA HB3 1 1 7 4678 1 1 27 ALA N N 4.363 0.650 -8.031 1.00 . A A . 27 ALA N 1 1 7 4679 1 1 27 ALA O O 1.591 1.554 -10.163 1.00 . A A . 27 ALA O 1 1 7 4680 1 1 28 LYS C C 1.623 4.606 -9.108 1.00 . A A . 28 LYS C 1 1 7 4681 1 1 28 LYS CA C 2.892 4.041 -9.764 1.00 . A A . 28 LYS CA 1 1 7 4682 1 1 28 LYS CB C 2.722 3.940 -11.287 1.00 . A A . 28 LYS CB 1 1 7 4683 1 1 28 LYS CD C 2.591 5.096 -13.512 1.00 . A A . 28 LYS CD 1 1 7 4684 1 1 28 LYS CE C 3.681 4.209 -14.095 1.00 . A A . 28 LYS CE 1 1 7 4685 1 1 28 LYS CG C 2.763 5.277 -12.012 1.00 . A A . 28 LYS CG 1 1 7 4686 1 1 28 LYS H H 4.057 2.693 -8.626 1.00 . A A . 28 LYS H 1 1 7 4687 1 1 28 LYS HA H 3.706 4.721 -9.558 1.00 . A A . 28 LYS HA 1 1 7 4688 1 1 28 LYS HB2 H 3.512 3.320 -11.683 1.00 . A A . 28 LYS HB2 1 1 7 4689 1 1 28 LYS HB3 H 1.772 3.471 -11.498 1.00 . A A . 28 LYS HB3 1 1 7 4690 1 1 28 LYS HD2 H 1.630 4.641 -13.703 1.00 . A A . 28 LYS HD2 1 1 7 4691 1 1 28 LYS HD3 H 2.634 6.065 -13.988 1.00 . A A . 28 LYS HD3 1 1 7 4692 1 1 28 LYS HE2 H 4.634 4.699 -13.963 1.00 . A A . 28 LYS HE2 1 1 7 4693 1 1 28 LYS HE3 H 3.684 3.269 -13.563 1.00 . A A . 28 LYS HE3 1 1 7 4694 1 1 28 LYS HG2 H 1.965 5.902 -11.640 1.00 . A A . 28 LYS HG2 1 1 7 4695 1 1 28 LYS HG3 H 3.714 5.751 -11.821 1.00 . A A . 28 LYS HG3 1 1 7 4696 1 1 28 LYS HZ1 H 2.554 3.473 -15.690 1.00 . A A . 28 LYS HZ1 1 1 7 4697 1 1 28 LYS HZ2 H 4.225 3.332 -15.910 1.00 . A A . 28 LYS HZ2 1 1 7 4698 1 1 28 LYS HZ3 H 3.476 4.839 -16.075 1.00 . A A . 28 LYS HZ3 1 1 7 4699 1 1 28 LYS N N 3.265 2.740 -9.203 1.00 . A A . 28 LYS N 1 1 7 4700 1 1 28 LYS NZ N 3.469 3.945 -15.544 1.00 . A A . 28 LYS NZ 1 1 7 4701 1 1 28 LYS O O 0.727 5.114 -9.785 1.00 . A A . 28 LYS O 1 1 7 4702 1 1 29 PHE C C 0.893 6.236 -6.158 1.00 . A A . 29 PHE C 1 1 7 4703 1 1 29 PHE CA C 0.435 5.069 -7.029 1.00 . A A . 29 PHE CA 1 1 7 4704 1 1 29 PHE CB C -0.229 3.985 -6.171 1.00 . A A . 29 PHE CB 1 1 7 4705 1 1 29 PHE CD1 C -0.563 2.125 -7.830 1.00 . A A . 29 PHE CD1 1 1 7 4706 1 1 29 PHE CD2 C -2.485 3.077 -6.794 1.00 . A A . 29 PHE CD2 1 1 7 4707 1 1 29 PHE CE1 C -1.372 1.258 -8.539 1.00 . A A . 29 PHE CE1 1 1 7 4708 1 1 29 PHE CE2 C -3.300 2.212 -7.499 1.00 . A A . 29 PHE CE2 1 1 7 4709 1 1 29 PHE CG C -1.108 3.045 -6.951 1.00 . A A . 29 PHE CG 1 1 7 4710 1 1 29 PHE CZ C -2.742 1.301 -8.374 1.00 . A A . 29 PHE CZ 1 1 7 4711 1 1 29 PHE H H 2.320 4.139 -7.295 1.00 . A A . 29 PHE H 1 1 7 4712 1 1 29 PHE HA H -0.286 5.440 -7.744 1.00 . A A . 29 PHE HA 1 1 7 4713 1 1 29 PHE HB2 H 0.538 3.399 -5.692 1.00 . A A . 29 PHE HB2 1 1 7 4714 1 1 29 PHE HB3 H -0.839 4.455 -5.411 1.00 . A A . 29 PHE HB3 1 1 7 4715 1 1 29 PHE HD1 H 0.508 2.089 -7.961 1.00 . A A . 29 PHE HD1 1 1 7 4716 1 1 29 PHE HD2 H -2.923 3.791 -6.111 1.00 . A A . 29 PHE HD2 1 1 7 4717 1 1 29 PHE HE1 H -0.933 0.547 -9.223 1.00 . A A . 29 PHE HE1 1 1 7 4718 1 1 29 PHE HE2 H -4.371 2.248 -7.366 1.00 . A A . 29 PHE HE2 1 1 7 4719 1 1 29 PHE HZ H -3.376 0.624 -8.926 1.00 . A A . 29 PHE HZ 1 1 7 4720 1 1 29 PHE N N 1.567 4.540 -7.784 1.00 . A A . 29 PHE N 1 1 7 4721 1 1 29 PHE O O 2.042 6.270 -5.710 1.00 . A A . 29 PHE O 1 1 7 4722 1 1 30 SER C C 0.757 8.066 -3.746 1.00 . A A . 30 SER C 1 1 7 4723 1 1 30 SER CA C 0.298 8.396 -5.170 1.00 . A A . 30 SER CA 1 1 7 4724 1 1 30 SER CB C -0.939 9.294 -5.132 1.00 . A A . 30 SER CB 1 1 7 4725 1 1 30 SER H H -0.886 7.114 -6.357 1.00 . A A . 30 SER H 1 1 7 4726 1 1 30 SER HA H 1.091 8.923 -5.671 1.00 . A A . 30 SER HA 1 1 7 4727 1 1 30 SER HB2 H -1.624 8.931 -4.380 1.00 . A A . 30 SER HB2 1 1 7 4728 1 1 30 SER HB3 H -0.642 10.305 -4.893 1.00 . A A . 30 SER HB3 1 1 7 4729 1 1 30 SER HG H -1.288 10.047 -6.927 1.00 . A A . 30 SER HG 1 1 7 4730 1 1 30 SER N N 0.001 7.197 -5.951 1.00 . A A . 30 SER N 1 1 7 4731 1 1 30 SER O O 1.763 8.602 -3.273 1.00 . A A . 30 SER O 1 1 7 4732 1 1 30 SER OG O -1.597 9.295 -6.391 1.00 . A A . 30 SER OG 1 1 7 4733 1 1 31 ASP C C -0.350 5.522 -1.293 1.00 . A A . 31 ASP C 1 1 7 4734 1 1 31 ASP CA C 0.379 6.795 -1.699 1.00 . A A . 31 ASP CA 1 1 7 4735 1 1 31 ASP CB C 0.068 7.924 -0.705 1.00 . A A . 31 ASP CB 1 1 7 4736 1 1 31 ASP CG C 0.378 7.536 0.732 1.00 . A A . 31 ASP CG 1 1 7 4737 1 1 31 ASP H H -0.759 6.786 -3.496 1.00 . A A . 31 ASP H 1 1 7 4738 1 1 31 ASP HA H 1.441 6.600 -1.679 1.00 . A A . 31 ASP HA 1 1 7 4739 1 1 31 ASP HB2 H 0.660 8.791 -0.959 1.00 . A A . 31 ASP HB2 1 1 7 4740 1 1 31 ASP HB3 H -0.980 8.177 -0.774 1.00 . A A . 31 ASP HB3 1 1 7 4741 1 1 31 ASP N N 0.030 7.186 -3.068 1.00 . A A . 31 ASP N 1 1 7 4742 1 1 31 ASP O O -1.491 5.288 -1.699 1.00 . A A . 31 ASP O 1 1 7 4743 1 1 31 ASP OD1 O -0.502 6.956 1.405 1.00 . A A . 31 ASP OD1 1 1 7 4744 1 1 31 ASP OD2 O 1.518 7.772 1.186 1.00 . A A . 31 ASP OD2 1 1 7 4745 1 1 32 GLY C C -0.633 3.467 1.408 1.00 . A A . 32 GLY C 1 1 7 4746 1 1 32 GLY CA C -0.257 3.451 -0.056 1.00 . A A . 32 GLY CA 1 1 7 4747 1 1 32 GLY H H 1.226 4.939 -0.219 1.00 . A A . 32 GLY H 1 1 7 4748 1 1 32 GLY HA2 H -1.144 3.252 -0.640 1.00 . A A . 32 GLY HA2 1 1 7 4749 1 1 32 GLY HA3 H 0.455 2.657 -0.224 1.00 . A A . 32 GLY HA3 1 1 7 4750 1 1 32 GLY N N 0.323 4.697 -0.502 1.00 . A A . 32 GLY N 1 1 7 4751 1 1 32 GLY O O 0.094 4.008 2.245 1.00 . A A . 32 GLY O 1 1 7 4752 1 1 33 HIS C C -2.688 1.353 3.400 1.00 . A A . 33 HIS C 1 1 7 4753 1 1 33 HIS CA C -2.244 2.771 3.087 1.00 . A A . 33 HIS CA 1 1 7 4754 1 1 33 HIS CB C -3.405 3.746 3.330 1.00 . A A . 33 HIS CB 1 1 7 4755 1 1 33 HIS CD2 C -5.783 2.985 2.607 1.00 . A A . 33 HIS CD2 1 1 7 4756 1 1 33 HIS CE1 C -5.715 3.638 0.519 1.00 . A A . 33 HIS CE1 1 1 7 4757 1 1 33 HIS CG C -4.574 3.561 2.402 1.00 . A A . 33 HIS CG 1 1 7 4758 1 1 33 HIS H H -2.284 2.421 1.002 1.00 . A A . 33 HIS H 1 1 7 4759 1 1 33 HIS HA H -1.424 3.030 3.742 1.00 . A A . 33 HIS HA 1 1 7 4760 1 1 33 HIS HB2 H -3.765 3.615 4.340 1.00 . A A . 33 HIS HB2 1 1 7 4761 1 1 33 HIS HB3 H -3.042 4.753 3.216 1.00 . A A . 33 HIS HB3 1 1 7 4762 1 1 33 HIS HD1 H -3.828 4.420 0.621 1.00 . A A . 33 HIS HD1 1 1 7 4763 1 1 33 HIS HD2 H -6.135 2.544 3.526 1.00 . A A . 33 HIS HD2 1 1 7 4764 1 1 33 HIS HE1 H -5.986 3.815 -0.511 1.00 . A A . 33 HIS HE1 1 1 7 4765 1 1 33 HIS N N -1.762 2.854 1.720 1.00 . A A . 33 HIS N 1 1 7 4766 1 1 33 HIS ND1 N -4.566 3.960 1.081 1.00 . A A . 33 HIS ND1 1 1 7 4767 1 1 33 HIS NE2 N -6.471 3.048 1.423 1.00 . A A . 33 HIS NE2 1 1 7 4768 1 1 33 HIS O O -3.432 0.741 2.641 1.00 . A A . 33 HIS O 1 1 7 4769 1 1 34 CYS C C -4.012 -0.553 5.453 1.00 . A A . 34 CYS C 1 1 7 4770 1 1 34 CYS CA C -2.579 -0.504 4.937 1.00 . A A . 34 CYS CA 1 1 7 4771 1 1 34 CYS CB C -1.601 -0.979 6.003 1.00 . A A . 34 CYS CB 1 1 7 4772 1 1 34 CYS H H -1.643 1.383 5.081 1.00 . A A . 34 CYS H 1 1 7 4773 1 1 34 CYS HA H -2.498 -1.150 4.074 1.00 . A A . 34 CYS HA 1 1 7 4774 1 1 34 CYS HB2 H -1.679 -0.337 6.868 1.00 . A A . 34 CYS HB2 1 1 7 4775 1 1 34 CYS HB3 H -1.849 -1.992 6.286 1.00 . A A . 34 CYS HB3 1 1 7 4776 1 1 34 CYS N N -2.230 0.842 4.517 1.00 . A A . 34 CYS N 1 1 7 4777 1 1 34 CYS O O -4.472 0.377 6.116 1.00 . A A . 34 CYS O 1 1 7 4778 1 1 34 CYS SG S 0.135 -0.963 5.449 1.00 . A A . 34 CYS SG 1 1 7 4779 1 1 35 SER C C -6.206 -2.212 7.015 1.00 . A A . 35 SER C 1 1 7 4780 1 1 35 SER CA C -6.106 -1.780 5.547 1.00 . A A . 35 SER CA 1 1 7 4781 1 1 35 SER CB C -6.817 -2.791 4.645 1.00 . A A . 35 SER CB 1 1 7 4782 1 1 35 SER H H -4.305 -2.326 4.580 1.00 . A A . 35 SER H 1 1 7 4783 1 1 35 SER HA H -6.585 -0.820 5.434 1.00 . A A . 35 SER HA 1 1 7 4784 1 1 35 SER HB2 H -7.762 -3.064 5.090 1.00 . A A . 35 SER HB2 1 1 7 4785 1 1 35 SER HB3 H -6.990 -2.345 3.677 1.00 . A A . 35 SER HB3 1 1 7 4786 1 1 35 SER HG H -5.353 -3.794 3.814 1.00 . A A . 35 SER HG 1 1 7 4787 1 1 35 SER N N -4.721 -1.626 5.127 1.00 . A A . 35 SER N 1 1 7 4788 1 1 35 SER O O -5.234 -2.130 7.769 1.00 . A A . 35 SER O 1 1 7 4789 1 1 35 SER OG O -6.037 -3.962 4.477 1.00 . A A . 35 SER OG 1 1 7 4790 1 1 36 LYS C C -7.946 -4.596 8.869 1.00 . A A . 36 LYS C 1 1 7 4791 1 1 36 LYS CA C -7.601 -3.110 8.793 1.00 . A A . 36 LYS CA 1 1 7 4792 1 1 36 LYS CB C -8.707 -2.282 9.460 1.00 . A A . 36 LYS CB 1 1 7 4793 1 1 36 LYS CD C -11.152 -1.735 9.630 1.00 . A A . 36 LYS CD 1 1 7 4794 1 1 36 LYS CE C -12.530 -1.870 8.996 1.00 . A A . 36 LYS CE 1 1 7 4795 1 1 36 LYS CG C -10.072 -2.420 8.803 1.00 . A A . 36 LYS CG 1 1 7 4796 1 1 36 LYS H H -8.124 -2.718 6.780 1.00 . A A . 36 LYS H 1 1 7 4797 1 1 36 LYS HA H -6.679 -2.947 9.331 1.00 . A A . 36 LYS HA 1 1 7 4798 1 1 36 LYS HB2 H -8.797 -2.591 10.490 1.00 . A A . 36 LYS HB2 1 1 7 4799 1 1 36 LYS HB3 H -8.423 -1.240 9.432 1.00 . A A . 36 LYS HB3 1 1 7 4800 1 1 36 LYS HD2 H -11.176 -2.183 10.611 1.00 . A A . 36 LYS HD2 1 1 7 4801 1 1 36 LYS HD3 H -10.909 -0.686 9.719 1.00 . A A . 36 LYS HD3 1 1 7 4802 1 1 36 LYS HE2 H -12.705 -2.911 8.768 1.00 . A A . 36 LYS HE2 1 1 7 4803 1 1 36 LYS HE3 H -13.271 -1.528 9.703 1.00 . A A . 36 LYS HE3 1 1 7 4804 1 1 36 LYS HG2 H -10.037 -1.967 7.824 1.00 . A A . 36 LYS HG2 1 1 7 4805 1 1 36 LYS HG3 H -10.311 -3.469 8.710 1.00 . A A . 36 LYS HG3 1 1 7 4806 1 1 36 LYS HZ1 H -12.929 -1.693 6.952 1.00 . A A . 36 LYS HZ1 1 1 7 4807 1 1 36 LYS HZ2 H -11.746 -0.621 7.514 1.00 . A A . 36 LYS HZ2 1 1 7 4808 1 1 36 LYS HZ3 H -13.377 -0.336 7.858 1.00 . A A . 36 LYS HZ3 1 1 7 4809 1 1 36 LYS N N -7.386 -2.675 7.418 1.00 . A A . 36 LYS N 1 1 7 4810 1 1 36 LYS NZ N -12.653 -1.075 7.742 1.00 . A A . 36 LYS NZ 1 1 7 4811 1 1 36 LYS O O -7.831 -5.205 9.927 1.00 . A A . 36 LYS O 1 1 7 4812 1 1 37 ILE C C -7.498 -7.459 7.641 1.00 . A A . 37 ILE C 1 1 7 4813 1 1 37 ILE CA C -8.749 -6.581 7.709 1.00 . A A . 37 ILE CA 1 1 7 4814 1 1 37 ILE CB C -9.667 -6.893 6.504 1.00 . A A . 37 ILE CB 1 1 7 4815 1 1 37 ILE CD1 C -11.614 -5.983 5.133 1.00 . A A . 37 ILE CD1 1 1 7 4816 1 1 37 ILE CG1 C -10.757 -5.825 6.371 1.00 . A A . 37 ILE CG1 1 1 7 4817 1 1 37 ILE CG2 C -10.299 -8.272 6.662 1.00 . A A . 37 ILE CG2 1 1 7 4818 1 1 37 ILE H H -8.459 -4.632 6.940 1.00 . A A . 37 ILE H 1 1 7 4819 1 1 37 ILE HA H -9.288 -6.810 8.617 1.00 . A A . 37 ILE HA 1 1 7 4820 1 1 37 ILE HB H -9.064 -6.899 5.609 1.00 . A A . 37 ILE HB 1 1 7 4821 1 1 37 ILE HD11 H -12.463 -6.610 5.360 1.00 . A A . 37 ILE HD11 1 1 7 4822 1 1 37 ILE HD12 H -11.030 -6.439 4.347 1.00 . A A . 37 ILE HD12 1 1 7 4823 1 1 37 ILE HD13 H -11.960 -5.013 4.808 1.00 . A A . 37 ILE HD13 1 1 7 4824 1 1 37 ILE HG12 H -11.407 -5.874 7.231 1.00 . A A . 37 ILE HG12 1 1 7 4825 1 1 37 ILE HG13 H -10.293 -4.850 6.332 1.00 . A A . 37 ILE HG13 1 1 7 4826 1 1 37 ILE HG21 H -9.545 -9.032 6.523 1.00 . A A . 37 ILE HG21 1 1 7 4827 1 1 37 ILE HG22 H -11.078 -8.399 5.925 1.00 . A A . 37 ILE HG22 1 1 7 4828 1 1 37 ILE HG23 H -10.723 -8.363 7.652 1.00 . A A . 37 ILE HG23 1 1 7 4829 1 1 37 ILE N N -8.381 -5.168 7.750 1.00 . A A . 37 ILE N 1 1 7 4830 1 1 37 ILE O O -6.833 -7.686 8.649 1.00 . A A . 37 ILE O 1 1 7 4831 1 1 38 LEU C C -4.726 -7.945 6.318 1.00 . A A . 38 LEU C 1 1 7 4832 1 1 38 LEU CA C -5.999 -8.781 6.237 1.00 . A A . 38 LEU CA 1 1 7 4833 1 1 38 LEU CB C -6.077 -9.477 4.879 1.00 . A A . 38 LEU CB 1 1 7 4834 1 1 38 LEU CD1 C -5.194 -11.677 5.702 1.00 . A A . 38 LEU CD1 1 1 7 4835 1 1 38 LEU CD2 C -5.153 -11.153 3.259 1.00 . A A . 38 LEU CD2 1 1 7 4836 1 1 38 LEU CG C -5.039 -10.578 4.661 1.00 . A A . 38 LEU CG 1 1 7 4837 1 1 38 LEU H H -7.738 -7.716 5.674 1.00 . A A . 38 LEU H 1 1 7 4838 1 1 38 LEU HA H -5.981 -9.527 7.018 1.00 . A A . 38 LEU HA 1 1 7 4839 1 1 38 LEU HB2 H -7.060 -9.903 4.771 1.00 . A A . 38 LEU HB2 1 1 7 4840 1 1 38 LEU HB3 H -5.942 -8.732 4.109 1.00 . A A . 38 LEU HB3 1 1 7 4841 1 1 38 LEU HD11 H -5.785 -11.309 6.528 1.00 . A A . 38 LEU HD11 1 1 7 4842 1 1 38 LEU HD12 H -4.219 -11.973 6.061 1.00 . A A . 38 LEU HD12 1 1 7 4843 1 1 38 LEU HD13 H -5.688 -12.528 5.257 1.00 . A A . 38 LEU HD13 1 1 7 4844 1 1 38 LEU HD21 H -4.962 -10.375 2.535 1.00 . A A . 38 LEU HD21 1 1 7 4845 1 1 38 LEU HD22 H -6.147 -11.547 3.112 1.00 . A A . 38 LEU HD22 1 1 7 4846 1 1 38 LEU HD23 H -4.429 -11.945 3.135 1.00 . A A . 38 LEU HD23 1 1 7 4847 1 1 38 LEU HG H -4.053 -10.150 4.771 1.00 . A A . 38 LEU HG 1 1 7 4848 1 1 38 LEU N N -7.175 -7.938 6.442 1.00 . A A . 38 LEU N 1 1 7 4849 1 1 38 LEU O O -3.613 -8.462 6.219 1.00 . A A . 38 LEU O 1 1 7 4850 1 1 39 ARG C C -3.100 -5.560 5.268 1.00 . A A . 39 ARG C 1 1 7 4851 1 1 39 ARG CA C -3.840 -5.681 6.599 1.00 . A A . 39 ARG CA 1 1 7 4852 1 1 39 ARG CB C -2.882 -6.076 7.729 1.00 . A A . 39 ARG CB 1 1 7 4853 1 1 39 ARG CD C -3.169 -4.022 9.142 1.00 . A A . 39 ARG CD 1 1 7 4854 1 1 39 ARG CG C -2.184 -4.900 8.389 1.00 . A A . 39 ARG CG 1 1 7 4855 1 1 39 ARG CZ C -4.817 -4.233 10.971 1.00 . A A . 39 ARG CZ 1 1 7 4856 1 1 39 ARG H H -5.842 -6.326 6.560 1.00 . A A . 39 ARG H 1 1 7 4857 1 1 39 ARG HA H -4.279 -4.723 6.834 1.00 . A A . 39 ARG HA 1 1 7 4858 1 1 39 ARG HB2 H -3.444 -6.601 8.488 1.00 . A A . 39 ARG HB2 1 1 7 4859 1 1 39 ARG HB3 H -2.128 -6.739 7.331 1.00 . A A . 39 ARG HB3 1 1 7 4860 1 1 39 ARG HD2 H -2.624 -3.227 9.629 1.00 . A A . 39 ARG HD2 1 1 7 4861 1 1 39 ARG HD3 H -3.868 -3.599 8.435 1.00 . A A . 39 ARG HD3 1 1 7 4862 1 1 39 ARG HE H -3.732 -5.739 10.217 1.00 . A A . 39 ARG HE 1 1 7 4863 1 1 39 ARG HG2 H -1.446 -5.274 9.082 1.00 . A A . 39 ARG HG2 1 1 7 4864 1 1 39 ARG HG3 H -1.698 -4.309 7.626 1.00 . A A . 39 ARG HG3 1 1 7 4865 1 1 39 ARG HH11 H -4.614 -2.356 10.228 1.00 . A A . 39 ARG HH11 1 1 7 4866 1 1 39 ARG HH12 H -5.760 -2.522 11.517 1.00 . A A . 39 ARG HH12 1 1 7 4867 1 1 39 ARG HH21 H -5.262 -5.978 11.900 1.00 . A A . 39 ARG HH21 1 1 7 4868 1 1 39 ARG HH22 H -6.143 -4.598 12.461 1.00 . A A . 39 ARG HH22 1 1 7 4869 1 1 39 ARG N N -4.923 -6.646 6.494 1.00 . A A . 39 ARG N 1 1 7 4870 1 1 39 ARG NE N -3.914 -4.774 10.152 1.00 . A A . 39 ARG NE 1 1 7 4871 1 1 39 ARG NH1 N -5.087 -2.933 10.900 1.00 . A A . 39 ARG NH1 1 1 7 4872 1 1 39 ARG NH2 N -5.457 -4.996 11.850 1.00 . A A . 39 ARG NH2 1 1 7 4873 1 1 39 ARG O O -1.901 -5.290 5.229 1.00 . A A . 39 ARG O 1 1 7 4874 1 1 40 ARG C C -2.925 -4.172 2.539 1.00 . A A . 40 ARG C 1 1 7 4875 1 1 40 ARG CA C -3.286 -5.621 2.834 1.00 . A A . 40 ARG CA 1 1 7 4876 1 1 40 ARG CB C -4.276 -6.116 1.775 1.00 . A A . 40 ARG CB 1 1 7 4877 1 1 40 ARG CD C -5.302 -8.032 0.524 1.00 . A A . 40 ARG CD 1 1 7 4878 1 1 40 ARG CG C -4.352 -7.626 1.644 1.00 . A A . 40 ARG CG 1 1 7 4879 1 1 40 ARG CZ C -4.364 -10.198 -0.232 1.00 . A A . 40 ARG CZ 1 1 7 4880 1 1 40 ARG H H -4.800 -5.934 4.283 1.00 . A A . 40 ARG H 1 1 7 4881 1 1 40 ARG HA H -2.390 -6.222 2.791 1.00 . A A . 40 ARG HA 1 1 7 4882 1 1 40 ARG HB2 H -5.261 -5.751 2.026 1.00 . A A . 40 ARG HB2 1 1 7 4883 1 1 40 ARG HB3 H -3.988 -5.708 0.817 1.00 . A A . 40 ARG HB3 1 1 7 4884 1 1 40 ARG HD2 H -6.294 -7.683 0.768 1.00 . A A . 40 ARG HD2 1 1 7 4885 1 1 40 ARG HD3 H -4.974 -7.565 -0.393 1.00 . A A . 40 ARG HD3 1 1 7 4886 1 1 40 ARG HE H -6.139 -9.952 0.664 1.00 . A A . 40 ARG HE 1 1 7 4887 1 1 40 ARG HG2 H -3.367 -8.011 1.426 1.00 . A A . 40 ARG HG2 1 1 7 4888 1 1 40 ARG HG3 H -4.707 -8.043 2.575 1.00 . A A . 40 ARG HG3 1 1 7 4889 1 1 40 ARG HH11 H -3.228 -8.606 -0.766 1.00 . A A . 40 ARG HH11 1 1 7 4890 1 1 40 ARG HH12 H -2.577 -10.162 -1.192 1.00 . A A . 40 ARG HH12 1 1 7 4891 1 1 40 ARG HH21 H -5.242 -11.996 0.083 1.00 . A A . 40 ARG HH21 1 1 7 4892 1 1 40 ARG HH22 H -3.690 -12.052 -0.712 1.00 . A A . 40 ARG HH22 1 1 7 4893 1 1 40 ARG N N -3.844 -5.738 4.177 1.00 . A A . 40 ARG N 1 1 7 4894 1 1 40 ARG NE N -5.346 -9.482 0.330 1.00 . A A . 40 ARG NE 1 1 7 4895 1 1 40 ARG NH1 N -3.308 -9.600 -0.769 1.00 . A A . 40 ARG NH1 1 1 7 4896 1 1 40 ARG NH2 N -4.450 -11.518 -0.289 1.00 . A A . 40 ARG NH2 1 1 7 4897 1 1 40 ARG O O -3.532 -3.251 3.093 1.00 . A A . 40 ARG O 1 1 7 4898 1 1 41 CYS C C -2.415 -2.063 0.216 1.00 . A A . 41 CYS C 1 1 7 4899 1 1 41 CYS CA C -1.508 -2.646 1.293 1.00 . A A . 41 CYS CA 1 1 7 4900 1 1 41 CYS CB C -0.066 -2.697 0.788 1.00 . A A . 41 CYS CB 1 1 7 4901 1 1 41 CYS H H -1.509 -4.754 1.265 1.00 . A A . 41 CYS H 1 1 7 4902 1 1 41 CYS HA H -1.553 -2.017 2.169 1.00 . A A . 41 CYS HA 1 1 7 4903 1 1 41 CYS HB2 H 0.586 -2.949 1.611 1.00 . A A . 41 CYS HB2 1 1 7 4904 1 1 41 CYS HB3 H 0.013 -3.461 0.028 1.00 . A A . 41 CYS HB3 1 1 7 4905 1 1 41 CYS N N -1.947 -3.979 1.671 1.00 . A A . 41 CYS N 1 1 7 4906 1 1 41 CYS O O -2.327 -2.441 -0.954 1.00 . A A . 41 CYS O 1 1 7 4907 1 1 41 CYS SG S 0.533 -1.139 0.070 1.00 . A A . 41 CYS SG 1 1 7 4908 1 1 42 LEU C C -3.499 0.714 -0.951 1.00 . A A . 42 LEU C 1 1 7 4909 1 1 42 LEU CA C -4.185 -0.486 -0.318 1.00 . A A . 42 LEU CA 1 1 7 4910 1 1 42 LEU CB C -5.456 -0.019 0.409 1.00 . A A . 42 LEU CB 1 1 7 4911 1 1 42 LEU CD1 C -6.035 -2.268 1.385 1.00 . A A . 42 LEU CD1 1 1 7 4912 1 1 42 LEU CD2 C -7.748 -0.455 1.320 1.00 . A A . 42 LEU CD2 1 1 7 4913 1 1 42 LEU CG C -6.552 -1.070 0.608 1.00 . A A . 42 LEU CG 1 1 7 4914 1 1 42 LEU H H -3.292 -0.869 1.560 1.00 . A A . 42 LEU H 1 1 7 4915 1 1 42 LEU HA H -4.445 -1.197 -1.090 1.00 . A A . 42 LEU HA 1 1 7 4916 1 1 42 LEU HB2 H -5.164 0.344 1.383 1.00 . A A . 42 LEU HB2 1 1 7 4917 1 1 42 LEU HB3 H -5.878 0.808 -0.146 1.00 . A A . 42 LEU HB3 1 1 7 4918 1 1 42 LEU HD11 H -6.768 -2.563 2.121 1.00 . A A . 42 LEU HD11 1 1 7 4919 1 1 42 LEU HD12 H -5.113 -2.005 1.881 1.00 . A A . 42 LEU HD12 1 1 7 4920 1 1 42 LEU HD13 H -5.858 -3.088 0.705 1.00 . A A . 42 LEU HD13 1 1 7 4921 1 1 42 LEU HD21 H -7.919 0.541 0.941 1.00 . A A . 42 LEU HD21 1 1 7 4922 1 1 42 LEU HD22 H -7.550 -0.408 2.381 1.00 . A A . 42 LEU HD22 1 1 7 4923 1 1 42 LEU HD23 H -8.623 -1.063 1.144 1.00 . A A . 42 LEU HD23 1 1 7 4924 1 1 42 LEU HG H -6.885 -1.419 -0.358 1.00 . A A . 42 LEU HG 1 1 7 4925 1 1 42 LEU N N -3.275 -1.136 0.613 1.00 . A A . 42 LEU N 1 1 7 4926 1 1 42 LEU O O -3.142 1.666 -0.257 1.00 . A A . 42 LEU O 1 1 7 4927 1 1 43 CYS C C -3.717 2.755 -3.474 1.00 . A A . 43 CYS C 1 1 7 4928 1 1 43 CYS CA C -2.681 1.787 -2.939 1.00 . A A . 43 CYS CA 1 1 7 4929 1 1 43 CYS CB C -1.794 1.283 -4.076 1.00 . A A . 43 CYS CB 1 1 7 4930 1 1 43 CYS H H -3.631 -0.090 -2.776 1.00 . A A . 43 CYS H 1 1 7 4931 1 1 43 CYS HA H -2.064 2.305 -2.219 1.00 . A A . 43 CYS HA 1 1 7 4932 1 1 43 CYS HB2 H -2.397 0.736 -4.782 1.00 . A A . 43 CYS HB2 1 1 7 4933 1 1 43 CYS HB3 H -1.351 2.133 -4.576 1.00 . A A . 43 CYS HB3 1 1 7 4934 1 1 43 CYS N N -3.321 0.684 -2.255 1.00 . A A . 43 CYS N 1 1 7 4935 1 1 43 CYS O O -4.687 2.353 -4.119 1.00 . A A . 43 CYS O 1 1 7 4936 1 1 43 CYS SG S -0.440 0.196 -3.536 1.00 . A A . 43 CYS SG 1 1 7 4937 1 1 44 THR C C -3.685 5.962 -4.659 1.00 . A A . 44 THR C 1 1 7 4938 1 1 44 THR CA C -4.402 5.062 -3.671 1.00 . A A . 44 THR CA 1 1 7 4939 1 1 44 THR CB C -4.948 5.906 -2.508 1.00 . A A . 44 THR CB 1 1 7 4940 1 1 44 THR CG2 C -6.412 5.585 -2.246 1.00 . A A . 44 THR CG2 1 1 7 4941 1 1 44 THR H H -2.706 4.284 -2.694 1.00 . A A . 44 THR H 1 1 7 4942 1 1 44 THR HA H -5.234 4.586 -4.170 1.00 . A A . 44 THR HA 1 1 7 4943 1 1 44 THR HB H -4.867 6.949 -2.779 1.00 . A A . 44 THR HB 1 1 7 4944 1 1 44 THR HG1 H -3.247 5.887 -1.493 1.00 . A A . 44 THR HG1 1 1 7 4945 1 1 44 THR HG21 H -6.610 5.648 -1.186 1.00 . A A . 44 THR HG21 1 1 7 4946 1 1 44 THR HG22 H -6.629 4.586 -2.595 1.00 . A A . 44 THR HG22 1 1 7 4947 1 1 44 THR HG23 H -7.035 6.294 -2.772 1.00 . A A . 44 THR HG23 1 1 7 4948 1 1 44 THR N N -3.504 4.027 -3.209 1.00 . A A . 44 THR N 1 1 7 4949 1 1 44 THR O O -2.486 6.218 -4.519 1.00 . A A . 44 THR O 1 1 7 4950 1 1 44 THR OG1 O -4.174 5.666 -1.321 1.00 . A A . 44 THR OG1 1 1 7 4951 1 1 45 LYS C C -4.915 8.120 -7.339 1.00 . A A . 45 LYS C 1 1 7 4952 1 1 45 LYS CA C -3.835 7.295 -6.666 1.00 . A A . 45 LYS CA 1 1 7 4953 1 1 45 LYS CB C -3.074 6.481 -7.719 1.00 . A A . 45 LYS CB 1 1 7 4954 1 1 45 LYS CD C -3.156 5.176 -9.877 1.00 . A A . 45 LYS CD 1 1 7 4955 1 1 45 LYS CE C -2.105 6.113 -10.461 1.00 . A A . 45 LYS CE 1 1 7 4956 1 1 45 LYS CG C -3.968 5.847 -8.777 1.00 . A A . 45 LYS CG 1 1 7 4957 1 1 45 LYS H H -5.360 6.186 -5.714 1.00 . A A . 45 LYS H 1 1 7 4958 1 1 45 LYS HA H -3.144 7.965 -6.176 1.00 . A A . 45 LYS HA 1 1 7 4959 1 1 45 LYS HB2 H -2.370 7.130 -8.218 1.00 . A A . 45 LYS HB2 1 1 7 4960 1 1 45 LYS HB3 H -2.530 5.692 -7.221 1.00 . A A . 45 LYS HB3 1 1 7 4961 1 1 45 LYS HD2 H -2.660 4.311 -9.464 1.00 . A A . 45 LYS HD2 1 1 7 4962 1 1 45 LYS HD3 H -3.827 4.866 -10.665 1.00 . A A . 45 LYS HD3 1 1 7 4963 1 1 45 LYS HE2 H -1.376 6.333 -9.697 1.00 . A A . 45 LYS HE2 1 1 7 4964 1 1 45 LYS HE3 H -1.618 5.612 -11.286 1.00 . A A . 45 LYS HE3 1 1 7 4965 1 1 45 LYS HG2 H -4.596 5.106 -8.305 1.00 . A A . 45 LYS HG2 1 1 7 4966 1 1 45 LYS HG3 H -4.587 6.616 -9.217 1.00 . A A . 45 LYS HG3 1 1 7 4967 1 1 45 LYS HZ1 H -2.350 8.189 -10.357 1.00 . A A . 45 LYS HZ1 1 1 7 4968 1 1 45 LYS HZ2 H -3.728 7.364 -10.899 1.00 . A A . 45 LYS HZ2 1 1 7 4969 1 1 45 LYS HZ3 H -2.405 7.565 -11.931 1.00 . A A . 45 LYS HZ3 1 1 7 4970 1 1 45 LYS N N -4.410 6.430 -5.655 1.00 . A A . 45 LYS N 1 1 7 4971 1 1 45 LYS NZ N -2.688 7.392 -10.950 1.00 . A A . 45 LYS NZ 1 1 7 4972 1 1 45 LYS O O -6.107 7.821 -7.224 1.00 . A A . 45 LYS O 1 1 7 4973 1 1 46 GLU C C -5.810 9.394 -10.080 1.00 . A A . 46 GLU C 1 1 7 4974 1 1 46 GLU CA C -5.376 10.028 -8.760 1.00 . A A . 46 GLU CA 1 1 7 4975 1 1 46 GLU CB C -4.712 11.396 -8.998 1.00 . A A . 46 GLU CB 1 1 7 4976 1 1 46 GLU CD C -2.286 10.609 -9.190 1.00 . A A . 46 GLU CD 1 1 7 4977 1 1 46 GLU CG C -3.430 11.374 -9.837 1.00 . A A . 46 GLU CG 1 1 7 4978 1 1 46 GLU H H -3.511 9.309 -8.093 1.00 . A A . 46 GLU H 1 1 7 4979 1 1 46 GLU HA H -6.253 10.170 -8.145 1.00 . A A . 46 GLU HA 1 1 7 4980 1 1 46 GLU HB2 H -5.422 12.037 -9.499 1.00 . A A . 46 GLU HB2 1 1 7 4981 1 1 46 GLU HB3 H -4.475 11.832 -8.038 1.00 . A A . 46 GLU HB3 1 1 7 4982 1 1 46 GLU HG2 H -3.649 10.912 -10.786 1.00 . A A . 46 GLU HG2 1 1 7 4983 1 1 46 GLU HG3 H -3.111 12.393 -10.002 1.00 . A A . 46 GLU HG3 1 1 7 4984 1 1 46 GLU N N -4.482 9.144 -8.042 1.00 . A A . 46 GLU N 1 1 7 4985 1 1 46 GLU O O -5.041 8.668 -10.721 1.00 . A A . 46 GLU O 1 1 7 4986 1 1 46 GLU OE1 O -2.197 9.379 -9.401 1.00 . A A . 46 GLU OE1 1 1 7 4987 1 1 46 GLU OE2 O -1.500 11.220 -8.445 1.00 . A A . 46 GLU OE2 1 1 7 4988 1 1 47 CYS C C -8.929 9.836 -11.981 1.00 . A A . 47 CYS C 1 1 7 4989 1 1 47 CYS CA C -7.606 9.140 -11.704 1.00 . A A . 47 CYS CA 1 1 7 4990 1 1 47 CYS CB C -7.818 7.626 -11.617 1.00 . A A . 47 CYS CB 1 1 7 4991 1 1 47 CYS H H -7.601 10.246 -9.915 1.00 . A A . 47 CYS H 1 1 7 4992 1 1 47 CYS HA H -6.916 9.355 -12.503 1.00 . A A . 47 CYS HA 1 1 7 4993 1 1 47 CYS HB2 H -8.206 7.272 -12.560 1.00 . A A . 47 CYS HB2 1 1 7 4994 1 1 47 CYS HB3 H -6.869 7.149 -11.424 1.00 . A A . 47 CYS HB3 1 1 7 4995 1 1 47 CYS N N -7.042 9.666 -10.471 1.00 . A A . 47 CYS N 1 1 7 4996 1 1 47 CYS O O -9.376 10.597 -11.094 1.00 . A A . 47 CYS O 1 1 7 4997 1 1 47 CYS OXT O -9.508 9.623 -13.060 1.00 . A A . 47 CYS OXT 1 1 7 4998 1 1 47 CYS SG S -8.979 7.101 -10.315 1.00 . A A . 47 CYS SG 1 1 8 4999 1 1 1 ALA C C -10.505 9.152 -8.938 1.00 . A A . 1 ALA C 1 1 8 5000 1 1 1 ALA CA C -11.333 9.603 -10.138 1.00 . A A . 1 ALA CA 1 1 8 5001 1 1 1 ALA CB C -11.463 11.120 -10.158 1.00 . A A . 1 ALA CB 1 1 8 5002 1 1 1 ALA H1 H -12.694 8.163 -10.760 1.00 . A A . 1 ALA H1 1 1 8 5003 1 1 1 ALA H2 H -13.391 9.663 -10.410 1.00 . A A . 1 ALA H2 1 1 8 5004 1 1 1 ALA H3 H -12.893 8.651 -9.151 1.00 . A A . 1 ALA H3 1 1 8 5005 1 1 1 ALA HA H -10.835 9.296 -11.044 1.00 . A A . 1 ALA HA 1 1 8 5006 1 1 1 ALA HB1 H -12.508 11.392 -10.168 1.00 . A A . 1 ALA HB1 1 1 8 5007 1 1 1 ALA HB2 H -10.982 11.511 -11.042 1.00 . A A . 1 ALA HB2 1 1 8 5008 1 1 1 ALA HB3 H -10.992 11.534 -9.279 1.00 . A A . 1 ALA HB3 1 1 8 5009 1 1 1 ALA N N -12.673 8.976 -10.113 1.00 . A A . 1 ALA N 1 1 8 5010 1 1 1 ALA O O -9.782 9.943 -8.333 1.00 . A A . 1 ALA O 1 1 8 5011 1 1 2 THR C C -9.638 5.831 -7.678 1.00 . A A . 2 THR C 1 1 8 5012 1 1 2 THR CA C -9.878 7.322 -7.467 1.00 . A A . 2 THR CA 1 1 8 5013 1 1 2 THR CB C -10.637 7.537 -6.140 1.00 . A A . 2 THR CB 1 1 8 5014 1 1 2 THR CG2 C -9.743 7.228 -4.947 1.00 . A A . 2 THR CG2 1 1 8 5015 1 1 2 THR H H -11.201 7.285 -9.106 1.00 . A A . 2 THR H 1 1 8 5016 1 1 2 THR HA H -8.926 7.829 -7.405 1.00 . A A . 2 THR HA 1 1 8 5017 1 1 2 THR HB H -11.489 6.874 -6.116 1.00 . A A . 2 THR HB 1 1 8 5018 1 1 2 THR HG1 H -10.422 9.482 -6.421 1.00 . A A . 2 THR HG1 1 1 8 5019 1 1 2 THR HG21 H -10.120 6.359 -4.430 1.00 . A A . 2 THR HG21 1 1 8 5020 1 1 2 THR HG22 H -9.736 8.073 -4.274 1.00 . A A . 2 THR HG22 1 1 8 5021 1 1 2 THR HG23 H -8.738 7.034 -5.292 1.00 . A A . 2 THR HG23 1 1 8 5022 1 1 2 THR N N -10.617 7.876 -8.591 1.00 . A A . 2 THR N 1 1 8 5023 1 1 2 THR O O -10.586 5.065 -7.851 1.00 . A A . 2 THR O 1 1 8 5024 1 1 2 THR OG1 O -11.095 8.894 -6.055 1.00 . A A . 2 THR OG1 1 1 8 5025 1 1 3 CYS C C -7.390 3.457 -6.604 1.00 . A A . 3 CYS C 1 1 8 5026 1 1 3 CYS CA C -8.026 4.028 -7.862 1.00 . A A . 3 CYS CA 1 1 8 5027 1 1 3 CYS CB C -7.092 3.875 -9.065 1.00 . A A . 3 CYS CB 1 1 8 5028 1 1 3 CYS H H -7.661 6.085 -7.531 1.00 . A A . 3 CYS H 1 1 8 5029 1 1 3 CYS HA H -8.939 3.487 -8.060 1.00 . A A . 3 CYS HA 1 1 8 5030 1 1 3 CYS HB2 H -6.363 4.674 -9.052 1.00 . A A . 3 CYS HB2 1 1 8 5031 1 1 3 CYS HB3 H -6.584 2.924 -9.002 1.00 . A A . 3 CYS HB3 1 1 8 5032 1 1 3 CYS N N -8.379 5.426 -7.669 1.00 . A A . 3 CYS N 1 1 8 5033 1 1 3 CYS O O -6.591 4.123 -5.943 1.00 . A A . 3 CYS O 1 1 8 5034 1 1 3 CYS SG S -7.950 3.945 -10.669 1.00 . A A . 3 CYS SG 1 1 8 5035 1 1 4 LYS C C -7.212 0.058 -5.249 1.00 . A A . 4 LYS C 1 1 8 5036 1 1 4 LYS CA C -7.245 1.573 -5.073 1.00 . A A . 4 LYS CA 1 1 8 5037 1 1 4 LYS CB C -8.115 1.934 -3.868 1.00 . A A . 4 LYS CB 1 1 8 5038 1 1 4 LYS CD C -8.895 1.265 -1.575 1.00 . A A . 4 LYS CD 1 1 8 5039 1 1 4 LYS CE C -10.257 0.879 -2.143 1.00 . A A . 4 LYS CE 1 1 8 5040 1 1 4 LYS CG C -7.796 1.132 -2.617 1.00 . A A . 4 LYS CG 1 1 8 5041 1 1 4 LYS H H -8.413 1.756 -6.825 1.00 . A A . 4 LYS H 1 1 8 5042 1 1 4 LYS HA H -6.239 1.927 -4.902 1.00 . A A . 4 LYS HA 1 1 8 5043 1 1 4 LYS HB2 H -7.977 2.981 -3.642 1.00 . A A . 4 LYS HB2 1 1 8 5044 1 1 4 LYS HB3 H -9.151 1.765 -4.123 1.00 . A A . 4 LYS HB3 1 1 8 5045 1 1 4 LYS HD2 H -8.666 0.616 -0.743 1.00 . A A . 4 LYS HD2 1 1 8 5046 1 1 4 LYS HD3 H -8.932 2.290 -1.236 1.00 . A A . 4 LYS HD3 1 1 8 5047 1 1 4 LYS HE2 H -10.976 0.867 -1.338 1.00 . A A . 4 LYS HE2 1 1 8 5048 1 1 4 LYS HE3 H -10.550 1.621 -2.872 1.00 . A A . 4 LYS HE3 1 1 8 5049 1 1 4 LYS HG2 H -7.692 0.092 -2.885 1.00 . A A . 4 LYS HG2 1 1 8 5050 1 1 4 LYS HG3 H -6.869 1.494 -2.197 1.00 . A A . 4 LYS HG3 1 1 8 5051 1 1 4 LYS HZ1 H -9.951 -1.191 -2.113 1.00 . A A . 4 LYS HZ1 1 1 8 5052 1 1 4 LYS HZ2 H -9.571 -0.466 -3.595 1.00 . A A . 4 LYS HZ2 1 1 8 5053 1 1 4 LYS HZ3 H -11.188 -0.696 -3.155 1.00 . A A . 4 LYS HZ3 1 1 8 5054 1 1 4 LYS N N -7.763 2.229 -6.264 1.00 . A A . 4 LYS N 1 1 8 5055 1 1 4 LYS NZ N -10.240 -0.463 -2.796 1.00 . A A . 4 LYS NZ 1 1 8 5056 1 1 4 LYS O O -8.249 -0.574 -5.468 1.00 . A A . 4 LYS O 1 1 8 5057 1 1 5 ALA C C -4.493 -2.313 -4.592 1.00 . A A . 5 ALA C 1 1 8 5058 1 1 5 ALA CA C -5.811 -1.943 -5.247 1.00 . A A . 5 ALA CA 1 1 8 5059 1 1 5 ALA CB C -5.814 -2.368 -6.709 1.00 . A A . 5 ALA CB 1 1 8 5060 1 1 5 ALA H H -5.244 0.066 -4.928 1.00 . A A . 5 ALA H 1 1 8 5061 1 1 5 ALA HA H -6.616 -2.453 -4.737 1.00 . A A . 5 ALA HA 1 1 8 5062 1 1 5 ALA HB1 H -5.342 -3.334 -6.804 1.00 . A A . 5 ALA HB1 1 1 8 5063 1 1 5 ALA HB2 H -5.271 -1.642 -7.296 1.00 . A A . 5 ALA HB2 1 1 8 5064 1 1 5 ALA HB3 H -6.832 -2.429 -7.064 1.00 . A A . 5 ALA HB3 1 1 8 5065 1 1 5 ALA N N -6.022 -0.507 -5.123 1.00 . A A . 5 ALA N 1 1 8 5066 1 1 5 ALA O O -3.592 -1.478 -4.511 1.00 . A A . 5 ALA O 1 1 8 5067 1 1 6 GLU C C -2.003 -4.015 -4.439 1.00 . A A . 6 GLU C 1 1 8 5068 1 1 6 GLU CA C -3.160 -3.979 -3.454 1.00 . A A . 6 GLU CA 1 1 8 5069 1 1 6 GLU CB C -3.334 -5.341 -2.774 1.00 . A A . 6 GLU CB 1 1 8 5070 1 1 6 GLU CD C -4.241 -6.444 -0.682 1.00 . A A . 6 GLU CD 1 1 8 5071 1 1 6 GLU CG C -4.403 -5.329 -1.694 1.00 . A A . 6 GLU CG 1 1 8 5072 1 1 6 GLU H H -5.130 -4.161 -4.188 1.00 . A A . 6 GLU H 1 1 8 5073 1 1 6 GLU HA H -2.928 -3.246 -2.695 1.00 . A A . 6 GLU HA 1 1 8 5074 1 1 6 GLU HB2 H -3.599 -6.078 -3.515 1.00 . A A . 6 GLU HB2 1 1 8 5075 1 1 6 GLU HB3 H -2.397 -5.623 -2.318 1.00 . A A . 6 GLU HB3 1 1 8 5076 1 1 6 GLU HG2 H -4.356 -4.385 -1.172 1.00 . A A . 6 GLU HG2 1 1 8 5077 1 1 6 GLU HG3 H -5.370 -5.429 -2.165 1.00 . A A . 6 GLU HG3 1 1 8 5078 1 1 6 GLU N N -4.381 -3.542 -4.108 1.00 . A A . 6 GLU N 1 1 8 5079 1 1 6 GLU O O -2.179 -4.367 -5.607 1.00 . A A . 6 GLU O 1 1 8 5080 1 1 6 GLU OE1 O -4.359 -7.621 -1.071 1.00 . A A . 6 GLU OE1 1 1 8 5081 1 1 6 GLU OE2 O -3.989 -6.142 0.511 1.00 . A A . 6 GLU OE2 1 1 8 5082 1 1 7 CYS C C 0.623 -4.908 -5.455 1.00 . A A . 7 CYS C 1 1 8 5083 1 1 7 CYS CA C 0.375 -3.570 -4.764 1.00 . A A . 7 CYS CA 1 1 8 5084 1 1 7 CYS CB C 1.580 -3.197 -3.893 1.00 . A A . 7 CYS CB 1 1 8 5085 1 1 7 CYS H H -0.792 -3.336 -3.014 1.00 . A A . 7 CYS H 1 1 8 5086 1 1 7 CYS HA H 0.239 -2.808 -5.517 1.00 . A A . 7 CYS HA 1 1 8 5087 1 1 7 CYS HB2 H 1.354 -2.294 -3.347 1.00 . A A . 7 CYS HB2 1 1 8 5088 1 1 7 CYS HB3 H 1.768 -3.997 -3.192 1.00 . A A . 7 CYS HB3 1 1 8 5089 1 1 7 CYS N N -0.835 -3.619 -3.953 1.00 . A A . 7 CYS N 1 1 8 5090 1 1 7 CYS O O 0.657 -5.955 -4.808 1.00 . A A . 7 CYS O 1 1 8 5091 1 1 7 CYS SG S 3.121 -2.906 -4.830 1.00 . A A . 7 CYS SG 1 1 8 5092 1 1 8 PRO C C 2.244 -6.864 -7.127 1.00 . A A . 8 PRO C 1 1 8 5093 1 1 8 PRO CA C 1.014 -6.092 -7.587 1.00 . A A . 8 PRO CA 1 1 8 5094 1 1 8 PRO CB C 1.224 -5.555 -9.007 1.00 . A A . 8 PRO CB 1 1 8 5095 1 1 8 PRO CD C 0.732 -3.672 -7.626 1.00 . A A . 8 PRO CD 1 1 8 5096 1 1 8 PRO CG C 0.566 -4.219 -9.014 1.00 . A A . 8 PRO CG 1 1 8 5097 1 1 8 PRO HA H 0.154 -6.745 -7.569 1.00 . A A . 8 PRO HA 1 1 8 5098 1 1 8 PRO HB2 H 2.283 -5.474 -9.210 1.00 . A A . 8 PRO HB2 1 1 8 5099 1 1 8 PRO HB3 H 0.766 -6.224 -9.719 1.00 . A A . 8 PRO HB3 1 1 8 5100 1 1 8 PRO HD2 H 1.651 -3.109 -7.549 1.00 . A A . 8 PRO HD2 1 1 8 5101 1 1 8 PRO HD3 H -0.114 -3.055 -7.358 1.00 . A A . 8 PRO HD3 1 1 8 5102 1 1 8 PRO HG2 H 1.051 -3.575 -9.732 1.00 . A A . 8 PRO HG2 1 1 8 5103 1 1 8 PRO HG3 H -0.482 -4.327 -9.251 1.00 . A A . 8 PRO HG3 1 1 8 5104 1 1 8 PRO N N 0.783 -4.883 -6.789 1.00 . A A . 8 PRO N 1 1 8 5105 1 1 8 PRO O O 2.229 -8.090 -7.046 1.00 . A A . 8 PRO O 1 1 8 5106 1 1 9 THR C C 4.561 -6.874 -4.842 1.00 . A A . 9 THR C 1 1 8 5107 1 1 9 THR CA C 4.540 -6.757 -6.361 1.00 . A A . 9 THR CA 1 1 8 5108 1 1 9 THR CB C 5.771 -5.961 -6.830 1.00 . A A . 9 THR CB 1 1 8 5109 1 1 9 THR CG2 C 5.937 -6.060 -8.339 1.00 . A A . 9 THR CG2 1 1 8 5110 1 1 9 THR H H 3.260 -5.164 -6.894 1.00 . A A . 9 THR H 1 1 8 5111 1 1 9 THR HA H 4.594 -7.748 -6.788 1.00 . A A . 9 THR HA 1 1 8 5112 1 1 9 THR HB H 6.649 -6.378 -6.359 1.00 . A A . 9 THR HB 1 1 8 5113 1 1 9 THR HG1 H 5.105 -4.523 -5.640 1.00 . A A . 9 THR HG1 1 1 8 5114 1 1 9 THR HG21 H 5.070 -5.638 -8.825 1.00 . A A . 9 THR HG21 1 1 8 5115 1 1 9 THR HG22 H 6.039 -7.097 -8.623 1.00 . A A . 9 THR HG22 1 1 8 5116 1 1 9 THR HG23 H 6.820 -5.515 -8.641 1.00 . A A . 9 THR HG23 1 1 8 5117 1 1 9 THR N N 3.309 -6.138 -6.819 1.00 . A A . 9 THR N 1 1 8 5118 1 1 9 THR O O 5.574 -6.585 -4.203 1.00 . A A . 9 THR O 1 1 8 5119 1 1 9 THR OG1 O 5.645 -4.582 -6.446 1.00 . A A . 9 THR OG1 1 1 8 5120 1 1 10 TRP C C 2.431 -8.601 -2.476 1.00 . A A . 10 TRP C 1 1 8 5121 1 1 10 TRP CA C 3.341 -7.436 -2.830 1.00 . A A . 10 TRP CA 1 1 8 5122 1 1 10 TRP CB C 2.794 -6.152 -2.198 1.00 . A A . 10 TRP CB 1 1 8 5123 1 1 10 TRP CD1 C 1.843 -6.829 0.081 1.00 . A A . 10 TRP CD1 1 1 8 5124 1 1 10 TRP CD2 C 3.674 -5.551 0.195 1.00 . A A . 10 TRP CD2 1 1 8 5125 1 1 10 TRP CE2 C 3.263 -5.864 1.505 1.00 . A A . 10 TRP CE2 1 1 8 5126 1 1 10 TRP CE3 C 4.802 -4.750 0.018 1.00 . A A . 10 TRP CE3 1 1 8 5127 1 1 10 TRP CG C 2.762 -6.193 -0.701 1.00 . A A . 10 TRP CG 1 1 8 5128 1 1 10 TRP CH2 C 5.039 -4.617 2.424 1.00 . A A . 10 TRP CH2 1 1 8 5129 1 1 10 TRP CZ2 C 3.941 -5.402 2.629 1.00 . A A . 10 TRP CZ2 1 1 8 5130 1 1 10 TRP CZ3 C 5.471 -4.290 1.134 1.00 . A A . 10 TRP CZ3 1 1 8 5131 1 1 10 TRP H H 2.664 -7.505 -4.828 1.00 . A A . 10 TRP H 1 1 8 5132 1 1 10 TRP HA H 4.329 -7.629 -2.441 1.00 . A A . 10 TRP HA 1 1 8 5133 1 1 10 TRP HB2 H 3.414 -5.319 -2.496 1.00 . A A . 10 TRP HB2 1 1 8 5134 1 1 10 TRP HB3 H 1.786 -5.987 -2.550 1.00 . A A . 10 TRP HB3 1 1 8 5135 1 1 10 TRP HD1 H 1.011 -7.404 -0.305 1.00 . A A . 10 TRP HD1 1 1 8 5136 1 1 10 TRP HE1 H 1.645 -7.027 2.166 1.00 . A A . 10 TRP HE1 1 1 8 5137 1 1 10 TRP HE3 H 5.151 -4.486 -0.969 1.00 . A A . 10 TRP HE3 1 1 8 5138 1 1 10 TRP HH2 H 5.594 -4.233 3.267 1.00 . A A . 10 TRP HH2 1 1 8 5139 1 1 10 TRP HZ2 H 3.622 -5.645 3.632 1.00 . A A . 10 TRP HZ2 1 1 8 5140 1 1 10 TRP HZ3 H 6.340 -3.661 1.017 1.00 . A A . 10 TRP HZ3 1 1 8 5141 1 1 10 TRP N N 3.444 -7.291 -4.268 1.00 . A A . 10 TRP N 1 1 8 5142 1 1 10 TRP NE1 N 2.150 -6.654 1.407 1.00 . A A . 10 TRP NE1 1 1 8 5143 1 1 10 TRP O O 1.268 -8.637 -2.876 1.00 . A A . 10 TRP O 1 1 8 5144 1 1 11 ASP C C 2.745 -11.160 0.074 1.00 . A A . 11 ASP C 1 1 8 5145 1 1 11 ASP CA C 2.202 -10.691 -1.267 1.00 . A A . 11 ASP CA 1 1 8 5146 1 1 11 ASP CB C 2.254 -11.815 -2.302 1.00 . A A . 11 ASP CB 1 1 8 5147 1 1 11 ASP CG C 1.072 -12.755 -2.172 1.00 . A A . 11 ASP CG 1 1 8 5148 1 1 11 ASP H H 3.889 -9.435 -1.409 1.00 . A A . 11 ASP H 1 1 8 5149 1 1 11 ASP HA H 1.175 -10.379 -1.133 1.00 . A A . 11 ASP HA 1 1 8 5150 1 1 11 ASP HB2 H 2.246 -11.387 -3.293 1.00 . A A . 11 ASP HB2 1 1 8 5151 1 1 11 ASP HB3 H 3.162 -12.383 -2.164 1.00 . A A . 11 ASP HB3 1 1 8 5152 1 1 11 ASP N N 2.962 -9.533 -1.706 1.00 . A A . 11 ASP N 1 1 8 5153 1 1 11 ASP O O 3.228 -12.279 0.219 1.00 . A A . 11 ASP O 1 1 8 5154 1 1 11 ASP OD1 O -0.079 -12.266 -2.229 1.00 . A A . 11 ASP OD1 1 1 8 5155 1 1 11 ASP OD2 O 1.286 -13.973 -2.028 1.00 . A A . 11 ASP OD2 1 1 8 5156 1 1 12 SER C C 2.320 -9.821 3.407 1.00 . A A . 12 SER C 1 1 8 5157 1 1 12 SER CA C 3.179 -10.551 2.382 1.00 . A A . 12 SER CA 1 1 8 5158 1 1 12 SER CB C 4.648 -10.124 2.504 1.00 . A A . 12 SER CB 1 1 8 5159 1 1 12 SER H H 2.304 -9.386 0.862 1.00 . A A . 12 SER H 1 1 8 5160 1 1 12 SER HA H 3.102 -11.615 2.551 1.00 . A A . 12 SER HA 1 1 8 5161 1 1 12 SER HB2 H 5.215 -10.561 1.695 1.00 . A A . 12 SER HB2 1 1 8 5162 1 1 12 SER HB3 H 4.713 -9.047 2.446 1.00 . A A . 12 SER HB3 1 1 8 5163 1 1 12 SER HG H 5.884 -9.919 4.014 1.00 . A A . 12 SER HG 1 1 8 5164 1 1 12 SER N N 2.685 -10.268 1.048 1.00 . A A . 12 SER N 1 1 8 5165 1 1 12 SER O O 1.482 -8.992 3.043 1.00 . A A . 12 SER O 1 1 8 5166 1 1 12 SER OG O 5.213 -10.548 3.735 1.00 . A A . 12 SER OG 1 1 8 5167 1 1 13 VAL C C 2.280 -8.109 6.044 1.00 . A A . 13 VAL C 1 1 8 5168 1 1 13 VAL CA C 1.764 -9.513 5.748 1.00 . A A . 13 VAL CA 1 1 8 5169 1 1 13 VAL CB C 1.819 -10.359 7.040 1.00 . A A . 13 VAL CB 1 1 8 5170 1 1 13 VAL CG1 C 0.982 -9.729 8.144 1.00 . A A . 13 VAL CG1 1 1 8 5171 1 1 13 VAL CG2 C 1.359 -11.783 6.766 1.00 . A A . 13 VAL CG2 1 1 8 5172 1 1 13 VAL H H 3.209 -10.799 4.899 1.00 . A A . 13 VAL H 1 1 8 5173 1 1 13 VAL HA H 0.734 -9.447 5.429 1.00 . A A . 13 VAL HA 1 1 8 5174 1 1 13 VAL HB H 2.845 -10.396 7.376 1.00 . A A . 13 VAL HB 1 1 8 5175 1 1 13 VAL HG11 H 1.423 -9.956 9.104 1.00 . A A . 13 VAL HG11 1 1 8 5176 1 1 13 VAL HG12 H -0.022 -10.126 8.106 1.00 . A A . 13 VAL HG12 1 1 8 5177 1 1 13 VAL HG13 H 0.951 -8.658 8.006 1.00 . A A . 13 VAL HG13 1 1 8 5178 1 1 13 VAL HG21 H 0.887 -11.829 5.796 1.00 . A A . 13 VAL HG21 1 1 8 5179 1 1 13 VAL HG22 H 0.651 -12.084 7.525 1.00 . A A . 13 VAL HG22 1 1 8 5180 1 1 13 VAL HG23 H 2.210 -12.447 6.785 1.00 . A A . 13 VAL HG23 1 1 8 5181 1 1 13 VAL N N 2.526 -10.132 4.677 1.00 . A A . 13 VAL N 1 1 8 5182 1 1 13 VAL O O 3.475 -7.903 6.263 1.00 . A A . 13 VAL O 1 1 8 5183 1 1 14 CYS C C 2.135 -5.581 7.750 1.00 . A A . 14 CYS C 1 1 8 5184 1 1 14 CYS CA C 1.684 -5.765 6.307 1.00 . A A . 14 CYS CA 1 1 8 5185 1 1 14 CYS CB C 0.462 -4.887 6.018 1.00 . A A . 14 CYS CB 1 1 8 5186 1 1 14 CYS H H 0.430 -7.399 5.850 1.00 . A A . 14 CYS H 1 1 8 5187 1 1 14 CYS HA H 2.489 -5.476 5.648 1.00 . A A . 14 CYS HA 1 1 8 5188 1 1 14 CYS HB2 H 0.356 -4.775 4.950 1.00 . A A . 14 CYS HB2 1 1 8 5189 1 1 14 CYS HB3 H -0.419 -5.373 6.412 1.00 . A A . 14 CYS HB3 1 1 8 5190 1 1 14 CYS N N 1.363 -7.155 6.041 1.00 . A A . 14 CYS N 1 1 8 5191 1 1 14 CYS O O 1.392 -5.869 8.691 1.00 . A A . 14 CYS O 1 1 8 5192 1 1 14 CYS SG S 0.544 -3.215 6.741 1.00 . A A . 14 CYS SG 1 1 8 5193 1 1 15 ILE C C 3.812 -3.403 9.608 1.00 . A A . 15 ILE C 1 1 8 5194 1 1 15 ILE CA C 3.927 -4.877 9.230 1.00 . A A . 15 ILE CA 1 1 8 5195 1 1 15 ILE CB C 5.411 -5.310 9.280 1.00 . A A . 15 ILE CB 1 1 8 5196 1 1 15 ILE CD1 C 4.793 -7.752 9.733 1.00 . A A . 15 ILE CD1 1 1 8 5197 1 1 15 ILE CG1 C 5.558 -6.778 8.858 1.00 . A A . 15 ILE CG1 1 1 8 5198 1 1 15 ILE CG2 C 5.996 -5.096 10.671 1.00 . A A . 15 ILE CG2 1 1 8 5199 1 1 15 ILE H H 3.896 -4.903 7.121 1.00 . A A . 15 ILE H 1 1 8 5200 1 1 15 ILE HA H 3.371 -5.469 9.944 1.00 . A A . 15 ILE HA 1 1 8 5201 1 1 15 ILE HB H 5.963 -4.691 8.589 1.00 . A A . 15 ILE HB 1 1 8 5202 1 1 15 ILE HD11 H 4.627 -7.309 10.704 1.00 . A A . 15 ILE HD11 1 1 8 5203 1 1 15 ILE HD12 H 5.366 -8.661 9.846 1.00 . A A . 15 ILE HD12 1 1 8 5204 1 1 15 ILE HD13 H 3.843 -7.981 9.274 1.00 . A A . 15 ILE HD13 1 1 8 5205 1 1 15 ILE HG12 H 5.196 -6.891 7.847 1.00 . A A . 15 ILE HG12 1 1 8 5206 1 1 15 ILE HG13 H 6.603 -7.051 8.892 1.00 . A A . 15 ILE HG13 1 1 8 5207 1 1 15 ILE HG21 H 5.550 -4.219 11.117 1.00 . A A . 15 ILE HG21 1 1 8 5208 1 1 15 ILE HG22 H 7.064 -4.957 10.595 1.00 . A A . 15 ILE HG22 1 1 8 5209 1 1 15 ILE HG23 H 5.788 -5.959 11.286 1.00 . A A . 15 ILE HG23 1 1 8 5210 1 1 15 ILE N N 3.358 -5.103 7.912 1.00 . A A . 15 ILE N 1 1 8 5211 1 1 15 ILE O O 3.614 -3.056 10.773 1.00 . A A . 15 ILE O 1 1 8 5212 1 1 16 ASN C C 3.501 -0.393 7.526 1.00 . A A . 16 ASN C 1 1 8 5213 1 1 16 ASN CA C 3.841 -1.101 8.834 1.00 . A A . 16 ASN CA 1 1 8 5214 1 1 16 ASN CB C 5.159 -0.578 9.419 1.00 . A A . 16 ASN CB 1 1 8 5215 1 1 16 ASN CG C 4.990 0.722 10.184 1.00 . A A . 16 ASN CG 1 1 8 5216 1 1 16 ASN H H 4.079 -2.868 7.701 1.00 . A A . 16 ASN H 1 1 8 5217 1 1 16 ASN HA H 3.046 -0.925 9.543 1.00 . A A . 16 ASN HA 1 1 8 5218 1 1 16 ASN HB2 H 5.564 -1.318 10.093 1.00 . A A . 16 ASN HB2 1 1 8 5219 1 1 16 ASN HB3 H 5.860 -0.411 8.614 1.00 . A A . 16 ASN HB3 1 1 8 5220 1 1 16 ASN HD21 H 4.728 -0.292 11.873 1.00 . A A . 16 ASN HD21 1 1 8 5221 1 1 16 ASN HD22 H 4.636 1.431 12.006 1.00 . A A . 16 ASN HD22 1 1 8 5222 1 1 16 ASN N N 3.931 -2.535 8.610 1.00 . A A . 16 ASN N 1 1 8 5223 1 1 16 ASN ND2 N 4.769 0.613 11.484 1.00 . A A . 16 ASN ND2 1 1 8 5224 1 1 16 ASN O O 3.569 -0.997 6.455 1.00 . A A . 16 ASN O 1 1 8 5225 1 1 16 ASN OD1 O 5.049 1.813 9.613 1.00 . A A . 16 ASN OD1 1 1 8 5226 1 1 17 LYS C C 3.887 1.857 5.474 1.00 . A A . 17 LYS C 1 1 8 5227 1 1 17 LYS CA C 2.720 1.649 6.444 1.00 . A A . 17 LYS CA 1 1 8 5228 1 1 17 LYS CB C 2.153 3.011 6.866 1.00 . A A . 17 LYS CB 1 1 8 5229 1 1 17 LYS CD C 0.989 5.144 6.179 1.00 . A A . 17 LYS CD 1 1 8 5230 1 1 17 LYS CE C 0.110 5.819 5.130 1.00 . A A . 17 LYS CE 1 1 8 5231 1 1 17 LYS CG C 1.430 3.752 5.744 1.00 . A A . 17 LYS CG 1 1 8 5232 1 1 17 LYS H H 3.049 1.287 8.504 1.00 . A A . 17 LYS H 1 1 8 5233 1 1 17 LYS HA H 1.945 1.099 5.932 1.00 . A A . 17 LYS HA 1 1 8 5234 1 1 17 LYS HB2 H 1.455 2.863 7.677 1.00 . A A . 17 LYS HB2 1 1 8 5235 1 1 17 LYS HB3 H 2.965 3.633 7.211 1.00 . A A . 17 LYS HB3 1 1 8 5236 1 1 17 LYS HD2 H 0.430 5.061 7.099 1.00 . A A . 17 LYS HD2 1 1 8 5237 1 1 17 LYS HD3 H 1.867 5.752 6.344 1.00 . A A . 17 LYS HD3 1 1 8 5238 1 1 17 LYS HE2 H -0.795 5.241 5.012 1.00 . A A . 17 LYS HE2 1 1 8 5239 1 1 17 LYS HE3 H -0.142 6.810 5.478 1.00 . A A . 17 LYS HE3 1 1 8 5240 1 1 17 LYS HG2 H 2.099 3.847 4.901 1.00 . A A . 17 LYS HG2 1 1 8 5241 1 1 17 LYS HG3 H 0.560 3.182 5.452 1.00 . A A . 17 LYS HG3 1 1 8 5242 1 1 17 LYS HZ1 H 0.481 6.802 3.312 1.00 . A A . 17 LYS HZ1 1 1 8 5243 1 1 17 LYS HZ2 H 0.540 5.110 3.210 1.00 . A A . 17 LYS HZ2 1 1 8 5244 1 1 17 LYS HZ3 H 1.815 5.957 3.929 1.00 . A A . 17 LYS HZ3 1 1 8 5245 1 1 17 LYS N N 3.105 0.871 7.618 1.00 . A A . 17 LYS N 1 1 8 5246 1 1 17 LYS NZ N 0.785 5.928 3.808 1.00 . A A . 17 LYS NZ 1 1 8 5247 1 1 17 LYS O O 3.697 1.779 4.266 1.00 . A A . 17 LYS O 1 1 8 5248 1 1 18 LYS C C 6.498 1.329 4.088 1.00 . A A . 18 LYS C 1 1 8 5249 1 1 18 LYS CA C 6.263 2.405 5.167 1.00 . A A . 18 LYS CA 1 1 8 5250 1 1 18 LYS CB C 7.531 2.611 6.016 1.00 . A A . 18 LYS CB 1 1 8 5251 1 1 18 LYS CD C 8.683 2.454 8.244 1.00 . A A . 18 LYS CD 1 1 8 5252 1 1 18 LYS CE C 8.525 2.149 9.726 1.00 . A A . 18 LYS CE 1 1 8 5253 1 1 18 LYS CG C 7.386 2.229 7.482 1.00 . A A . 18 LYS CG 1 1 8 5254 1 1 18 LYS H H 5.158 2.214 6.978 1.00 . A A . 18 LYS H 1 1 8 5255 1 1 18 LYS HA H 6.065 3.331 4.648 1.00 . A A . 18 LYS HA 1 1 8 5256 1 1 18 LYS HB2 H 8.328 2.017 5.594 1.00 . A A . 18 LYS HB2 1 1 8 5257 1 1 18 LYS HB3 H 7.813 3.653 5.966 1.00 . A A . 18 LYS HB3 1 1 8 5258 1 1 18 LYS HD2 H 9.446 1.809 7.835 1.00 . A A . 18 LYS HD2 1 1 8 5259 1 1 18 LYS HD3 H 8.983 3.486 8.128 1.00 . A A . 18 LYS HD3 1 1 8 5260 1 1 18 LYS HE2 H 8.204 1.124 9.837 1.00 . A A . 18 LYS HE2 1 1 8 5261 1 1 18 LYS HE3 H 9.481 2.280 10.211 1.00 . A A . 18 LYS HE3 1 1 8 5262 1 1 18 LYS HG2 H 6.609 2.832 7.927 1.00 . A A . 18 LYS HG2 1 1 8 5263 1 1 18 LYS HG3 H 7.116 1.185 7.547 1.00 . A A . 18 LYS HG3 1 1 8 5264 1 1 18 LYS HZ1 H 7.632 3.008 11.410 1.00 . A A . 18 LYS HZ1 1 1 8 5265 1 1 18 LYS HZ2 H 6.559 2.736 10.127 1.00 . A A . 18 LYS HZ2 1 1 8 5266 1 1 18 LYS HZ3 H 7.659 4.022 10.055 1.00 . A A . 18 LYS HZ3 1 1 8 5267 1 1 18 LYS N N 5.078 2.148 6.007 1.00 . A A . 18 LYS N 1 1 8 5268 1 1 18 LYS NZ N 7.525 3.041 10.375 1.00 . A A . 18 LYS NZ 1 1 8 5269 1 1 18 LYS O O 6.577 1.673 2.911 1.00 . A A . 18 LYS O 1 1 8 5270 1 1 19 PRO C C 5.763 -1.000 2.338 1.00 . A A . 19 PRO C 1 1 8 5271 1 1 19 PRO CA C 6.824 -1.035 3.438 1.00 . A A . 19 PRO CA 1 1 8 5272 1 1 19 PRO CB C 6.696 -2.326 4.253 1.00 . A A . 19 PRO CB 1 1 8 5273 1 1 19 PRO CD C 6.540 -0.529 5.805 1.00 . A A . 19 PRO CD 1 1 8 5274 1 1 19 PRO CG C 7.055 -1.929 5.640 1.00 . A A . 19 PRO CG 1 1 8 5275 1 1 19 PRO HA H 7.807 -0.975 2.996 1.00 . A A . 19 PRO HA 1 1 8 5276 1 1 19 PRO HB2 H 5.680 -2.689 4.197 1.00 . A A . 19 PRO HB2 1 1 8 5277 1 1 19 PRO HB3 H 7.372 -3.072 3.867 1.00 . A A . 19 PRO HB3 1 1 8 5278 1 1 19 PRO HD2 H 5.521 -0.542 6.164 1.00 . A A . 19 PRO HD2 1 1 8 5279 1 1 19 PRO HD3 H 7.172 0.029 6.479 1.00 . A A . 19 PRO HD3 1 1 8 5280 1 1 19 PRO HG2 H 6.579 -2.592 6.347 1.00 . A A . 19 PRO HG2 1 1 8 5281 1 1 19 PRO HG3 H 8.128 -1.952 5.764 1.00 . A A . 19 PRO HG3 1 1 8 5282 1 1 19 PRO N N 6.608 0.024 4.440 1.00 . A A . 19 PRO N 1 1 8 5283 1 1 19 PRO O O 6.071 -1.089 1.143 1.00 . A A . 19 PRO O 1 1 8 5284 1 1 20 CYS C C 3.548 0.433 0.919 1.00 . A A . 20 CYS C 1 1 8 5285 1 1 20 CYS CA C 3.390 -0.774 1.841 1.00 . A A . 20 CYS CA 1 1 8 5286 1 1 20 CYS CB C 2.084 -0.686 2.641 1.00 . A A . 20 CYS CB 1 1 8 5287 1 1 20 CYS H H 4.349 -0.761 3.721 1.00 . A A . 20 CYS H 1 1 8 5288 1 1 20 CYS HA H 3.387 -1.677 1.245 1.00 . A A . 20 CYS HA 1 1 8 5289 1 1 20 CYS HB2 H 1.983 -1.578 3.240 1.00 . A A . 20 CYS HB2 1 1 8 5290 1 1 20 CYS HB3 H 2.135 0.172 3.297 1.00 . A A . 20 CYS HB3 1 1 8 5291 1 1 20 CYS N N 4.515 -0.846 2.760 1.00 . A A . 20 CYS N 1 1 8 5292 1 1 20 CYS O O 3.423 0.320 -0.300 1.00 . A A . 20 CYS O 1 1 8 5293 1 1 20 CYS SG S 0.567 -0.527 1.644 1.00 . A A . 20 CYS SG 1 1 8 5294 1 1 21 VAL C C 5.160 2.622 -0.284 1.00 . A A . 21 VAL C 1 1 8 5295 1 1 21 VAL CA C 4.074 2.811 0.766 1.00 . A A . 21 VAL CA 1 1 8 5296 1 1 21 VAL CB C 4.466 3.975 1.704 1.00 . A A . 21 VAL CB 1 1 8 5297 1 1 21 VAL CG1 C 4.880 5.207 0.914 1.00 . A A . 21 VAL CG1 1 1 8 5298 1 1 21 VAL CG2 C 3.318 4.311 2.638 1.00 . A A . 21 VAL CG2 1 1 8 5299 1 1 21 VAL H H 3.976 1.592 2.492 1.00 . A A . 21 VAL H 1 1 8 5300 1 1 21 VAL HA H 3.146 3.067 0.268 1.00 . A A . 21 VAL HA 1 1 8 5301 1 1 21 VAL HB H 5.307 3.661 2.304 1.00 . A A . 21 VAL HB 1 1 8 5302 1 1 21 VAL HG11 H 4.735 5.024 -0.140 1.00 . A A . 21 VAL HG11 1 1 8 5303 1 1 21 VAL HG12 H 5.921 5.423 1.103 1.00 . A A . 21 VAL HG12 1 1 8 5304 1 1 21 VAL HG13 H 4.276 6.049 1.219 1.00 . A A . 21 VAL HG13 1 1 8 5305 1 1 21 VAL HG21 H 3.149 5.378 2.632 1.00 . A A . 21 VAL HG21 1 1 8 5306 1 1 21 VAL HG22 H 3.564 3.991 3.640 1.00 . A A . 21 VAL HG22 1 1 8 5307 1 1 21 VAL HG23 H 2.425 3.803 2.307 1.00 . A A . 21 VAL HG23 1 1 8 5308 1 1 21 VAL N N 3.863 1.580 1.515 1.00 . A A . 21 VAL N 1 1 8 5309 1 1 21 VAL O O 5.007 3.061 -1.420 1.00 . A A . 21 VAL O 1 1 8 5310 1 1 22 ALA C C 6.874 0.943 -2.042 1.00 . A A . 22 ALA C 1 1 8 5311 1 1 22 ALA CA C 7.353 1.706 -0.811 1.00 . A A . 22 ALA CA 1 1 8 5312 1 1 22 ALA CB C 8.459 0.937 -0.102 1.00 . A A . 22 ALA CB 1 1 8 5313 1 1 22 ALA H H 6.301 1.629 1.026 1.00 . A A . 22 ALA H 1 1 8 5314 1 1 22 ALA HA H 7.753 2.659 -1.124 1.00 . A A . 22 ALA HA 1 1 8 5315 1 1 22 ALA HB1 H 8.474 1.209 0.943 1.00 . A A . 22 ALA HB1 1 1 8 5316 1 1 22 ALA HB2 H 9.411 1.179 -0.552 1.00 . A A . 22 ALA HB2 1 1 8 5317 1 1 22 ALA HB3 H 8.277 -0.124 -0.195 1.00 . A A . 22 ALA HB3 1 1 8 5318 1 1 22 ALA N N 6.246 1.961 0.101 1.00 . A A . 22 ALA N 1 1 8 5319 1 1 22 ALA O O 7.212 1.298 -3.177 1.00 . A A . 22 ALA O 1 1 8 5320 1 1 23 CYS C C 4.624 -0.015 -3.781 1.00 . A A . 23 CYS C 1 1 8 5321 1 1 23 CYS CA C 5.527 -0.882 -2.911 1.00 . A A . 23 CYS CA 1 1 8 5322 1 1 23 CYS CB C 4.735 -2.075 -2.375 1.00 . A A . 23 CYS CB 1 1 8 5323 1 1 23 CYS H H 5.818 -0.311 -0.889 1.00 . A A . 23 CYS H 1 1 8 5324 1 1 23 CYS HA H 6.353 -1.240 -3.507 1.00 . A A . 23 CYS HA 1 1 8 5325 1 1 23 CYS HB2 H 5.214 -2.442 -1.482 1.00 . A A . 23 CYS HB2 1 1 8 5326 1 1 23 CYS HB3 H 3.734 -1.750 -2.130 1.00 . A A . 23 CYS HB3 1 1 8 5327 1 1 23 CYS N N 6.067 -0.088 -1.815 1.00 . A A . 23 CYS N 1 1 8 5328 1 1 23 CYS O O 4.690 -0.050 -5.008 1.00 . A A . 23 CYS O 1 1 8 5329 1 1 23 CYS SG S 4.594 -3.466 -3.549 1.00 . A A . 23 CYS SG 1 1 8 5330 1 1 24 CYS C C 3.608 2.715 -4.628 1.00 . A A . 24 CYS C 1 1 8 5331 1 1 24 CYS CA C 2.863 1.651 -3.824 1.00 . A A . 24 CYS CA 1 1 8 5332 1 1 24 CYS CB C 1.915 2.299 -2.820 1.00 . A A . 24 CYS CB 1 1 8 5333 1 1 24 CYS H H 3.781 0.747 -2.145 1.00 . A A . 24 CYS H 1 1 8 5334 1 1 24 CYS HA H 2.285 1.048 -4.507 1.00 . A A . 24 CYS HA 1 1 8 5335 1 1 24 CYS HB2 H 2.483 2.895 -2.125 1.00 . A A . 24 CYS HB2 1 1 8 5336 1 1 24 CYS HB3 H 1.220 2.935 -3.343 1.00 . A A . 24 CYS HB3 1 1 8 5337 1 1 24 CYS N N 3.785 0.767 -3.130 1.00 . A A . 24 CYS N 1 1 8 5338 1 1 24 CYS O O 3.190 3.074 -5.726 1.00 . A A . 24 CYS O 1 1 8 5339 1 1 24 CYS SG S 0.950 1.091 -1.863 1.00 . A A . 24 CYS SG 1 1 8 5340 1 1 25 LYS C C 6.121 3.682 -6.046 1.00 . A A . 25 LYS C 1 1 8 5341 1 1 25 LYS CA C 5.499 4.235 -4.769 1.00 . A A . 25 LYS CA 1 1 8 5342 1 1 25 LYS CB C 6.582 4.814 -3.850 1.00 . A A . 25 LYS CB 1 1 8 5343 1 1 25 LYS CD C 5.019 6.667 -3.187 1.00 . A A . 25 LYS CD 1 1 8 5344 1 1 25 LYS CE C 3.664 6.495 -2.515 1.00 . A A . 25 LYS CE 1 1 8 5345 1 1 25 LYS CG C 6.023 5.637 -2.695 1.00 . A A . 25 LYS CG 1 1 8 5346 1 1 25 LYS H H 5.006 2.892 -3.202 1.00 . A A . 25 LYS H 1 1 8 5347 1 1 25 LYS HA H 4.821 5.030 -5.043 1.00 . A A . 25 LYS HA 1 1 8 5348 1 1 25 LYS HB2 H 7.162 4.002 -3.439 1.00 . A A . 25 LYS HB2 1 1 8 5349 1 1 25 LYS HB3 H 7.231 5.449 -4.435 1.00 . A A . 25 LYS HB3 1 1 8 5350 1 1 25 LYS HD2 H 5.395 7.655 -2.968 1.00 . A A . 25 LYS HD2 1 1 8 5351 1 1 25 LYS HD3 H 4.898 6.555 -4.255 1.00 . A A . 25 LYS HD3 1 1 8 5352 1 1 25 LYS HE2 H 2.893 6.784 -3.213 1.00 . A A . 25 LYS HE2 1 1 8 5353 1 1 25 LYS HE3 H 3.538 5.454 -2.254 1.00 . A A . 25 LYS HE3 1 1 8 5354 1 1 25 LYS HG2 H 5.533 4.974 -1.997 1.00 . A A . 25 LYS HG2 1 1 8 5355 1 1 25 LYS HG3 H 6.838 6.146 -2.201 1.00 . A A . 25 LYS HG3 1 1 8 5356 1 1 25 LYS HZ1 H 4.468 7.569 -0.910 1.00 . A A . 25 LYS HZ1 1 1 8 5357 1 1 25 LYS HZ2 H 3.002 6.798 -0.546 1.00 . A A . 25 LYS HZ2 1 1 8 5358 1 1 25 LYS HZ3 H 3.012 8.200 -1.500 1.00 . A A . 25 LYS HZ3 1 1 8 5359 1 1 25 LYS N N 4.713 3.216 -4.084 1.00 . A A . 25 LYS N 1 1 8 5360 1 1 25 LYS NZ N 3.531 7.322 -1.282 1.00 . A A . 25 LYS NZ 1 1 8 5361 1 1 25 LYS O O 6.060 4.323 -7.093 1.00 . A A . 25 LYS O 1 1 8 5362 1 1 26 LYS C C 6.238 1.510 -8.175 1.00 . A A . 26 LYS C 1 1 8 5363 1 1 26 LYS CA C 7.312 1.874 -7.147 1.00 . A A . 26 LYS CA 1 1 8 5364 1 1 26 LYS CB C 8.172 0.650 -6.767 1.00 . A A . 26 LYS CB 1 1 8 5365 1 1 26 LYS CD C 6.698 -1.387 -7.045 1.00 . A A . 26 LYS CD 1 1 8 5366 1 1 26 LYS CE C 7.652 -2.352 -7.726 1.00 . A A . 26 LYS CE 1 1 8 5367 1 1 26 LYS CG C 7.423 -0.476 -6.063 1.00 . A A . 26 LYS CG 1 1 8 5368 1 1 26 LYS H H 6.715 2.008 -5.110 1.00 . A A . 26 LYS H 1 1 8 5369 1 1 26 LYS HA H 7.957 2.619 -7.591 1.00 . A A . 26 LYS HA 1 1 8 5370 1 1 26 LYS HB2 H 8.608 0.244 -7.667 1.00 . A A . 26 LYS HB2 1 1 8 5371 1 1 26 LYS HB3 H 8.969 0.980 -6.116 1.00 . A A . 26 LYS HB3 1 1 8 5372 1 1 26 LYS HD2 H 5.952 -1.955 -6.511 1.00 . A A . 26 LYS HD2 1 1 8 5373 1 1 26 LYS HD3 H 6.219 -0.778 -7.798 1.00 . A A . 26 LYS HD3 1 1 8 5374 1 1 26 LYS HE2 H 7.139 -2.827 -8.548 1.00 . A A . 26 LYS HE2 1 1 8 5375 1 1 26 LYS HE3 H 8.500 -1.797 -8.100 1.00 . A A . 26 LYS HE3 1 1 8 5376 1 1 26 LYS HG2 H 8.131 -1.066 -5.501 1.00 . A A . 26 LYS HG2 1 1 8 5377 1 1 26 LYS HG3 H 6.699 -0.043 -5.387 1.00 . A A . 26 LYS HG3 1 1 8 5378 1 1 26 LYS HZ1 H 7.327 -3.979 -6.459 1.00 . A A . 26 LYS HZ1 1 1 8 5379 1 1 26 LYS HZ2 H 8.581 -2.956 -5.956 1.00 . A A . 26 LYS HZ2 1 1 8 5380 1 1 26 LYS HZ3 H 8.824 -4.013 -7.253 1.00 . A A . 26 LYS HZ3 1 1 8 5381 1 1 26 LYS N N 6.703 2.486 -5.967 1.00 . A A . 26 LYS N 1 1 8 5382 1 1 26 LYS NZ N 8.133 -3.397 -6.783 1.00 . A A . 26 LYS NZ 1 1 8 5383 1 1 26 LYS O O 6.506 1.450 -9.373 1.00 . A A . 26 LYS O 1 1 8 5384 1 1 27 ALA C C 3.287 2.182 -9.184 1.00 . A A . 27 ALA C 1 1 8 5385 1 1 27 ALA CA C 3.895 0.929 -8.552 1.00 . A A . 27 ALA CA 1 1 8 5386 1 1 27 ALA CB C 2.846 0.159 -7.765 1.00 . A A . 27 ALA CB 1 1 8 5387 1 1 27 ALA H H 4.871 1.344 -6.722 1.00 . A A . 27 ALA H 1 1 8 5388 1 1 27 ALA HA H 4.265 0.286 -9.338 1.00 . A A . 27 ALA HA 1 1 8 5389 1 1 27 ALA HB1 H 1.898 0.213 -8.279 1.00 . A A . 27 ALA HB1 1 1 8 5390 1 1 27 ALA HB2 H 2.746 0.593 -6.780 1.00 . A A . 27 ALA HB2 1 1 8 5391 1 1 27 ALA HB3 H 3.150 -0.873 -7.675 1.00 . A A . 27 ALA HB3 1 1 8 5392 1 1 27 ALA N N 5.019 1.275 -7.689 1.00 . A A . 27 ALA N 1 1 8 5393 1 1 27 ALA O O 2.347 2.098 -9.978 1.00 . A A . 27 ALA O 1 1 8 5394 1 1 28 LYS C C 2.047 5.037 -8.764 1.00 . A A . 28 LYS C 1 1 8 5395 1 1 28 LYS CA C 3.414 4.636 -9.334 1.00 . A A . 28 LYS CA 1 1 8 5396 1 1 28 LYS CB C 3.401 4.629 -10.871 1.00 . A A . 28 LYS CB 1 1 8 5397 1 1 28 LYS CD C 3.792 5.919 -12.991 1.00 . A A . 28 LYS CD 1 1 8 5398 1 1 28 LYS CE C 5.140 5.253 -13.235 1.00 . A A . 28 LYS CE 1 1 8 5399 1 1 28 LYS CG C 3.478 6.011 -11.504 1.00 . A A . 28 LYS CG 1 1 8 5400 1 1 28 LYS H H 4.600 3.312 -8.192 1.00 . A A . 28 LYS H 1 1 8 5401 1 1 28 LYS HA H 4.141 5.364 -9.004 1.00 . A A . 28 LYS HA 1 1 8 5402 1 1 28 LYS HB2 H 4.243 4.052 -11.221 1.00 . A A . 28 LYS HB2 1 1 8 5403 1 1 28 LYS HB3 H 2.489 4.156 -11.206 1.00 . A A . 28 LYS HB3 1 1 8 5404 1 1 28 LYS HD2 H 3.022 5.339 -13.477 1.00 . A A . 28 LYS HD2 1 1 8 5405 1 1 28 LYS HD3 H 3.812 6.916 -13.407 1.00 . A A . 28 LYS HD3 1 1 8 5406 1 1 28 LYS HE2 H 5.912 5.855 -12.779 1.00 . A A . 28 LYS HE2 1 1 8 5407 1 1 28 LYS HE3 H 5.131 4.275 -12.776 1.00 . A A . 28 LYS HE3 1 1 8 5408 1 1 28 LYS HG2 H 2.529 6.508 -11.376 1.00 . A A . 28 LYS HG2 1 1 8 5409 1 1 28 LYS HG3 H 4.255 6.579 -11.014 1.00 . A A . 28 LYS HG3 1 1 8 5410 1 1 28 LYS HZ1 H 6.468 5.051 -14.835 1.00 . A A . 28 LYS HZ1 1 1 8 5411 1 1 28 LYS HZ2 H 5.066 5.917 -15.215 1.00 . A A . 28 LYS HZ2 1 1 8 5412 1 1 28 LYS HZ3 H 5.003 4.235 -15.054 1.00 . A A . 28 LYS HZ3 1 1 8 5413 1 1 28 LYS N N 3.849 3.337 -8.825 1.00 . A A . 28 LYS N 1 1 8 5414 1 1 28 LYS NZ N 5.439 5.104 -14.686 1.00 . A A . 28 LYS NZ 1 1 8 5415 1 1 28 LYS O O 1.180 5.553 -9.478 1.00 . A A . 28 LYS O 1 1 8 5416 1 1 29 PHE C C 0.950 6.376 -5.846 1.00 . A A . 29 PHE C 1 1 8 5417 1 1 29 PHE CA C 0.655 5.185 -6.755 1.00 . A A . 29 PHE CA 1 1 8 5418 1 1 29 PHE CB C 0.112 4.003 -5.935 1.00 . A A . 29 PHE CB 1 1 8 5419 1 1 29 PHE CD1 C 0.061 2.260 -7.751 1.00 . A A . 29 PHE CD1 1 1 8 5420 1 1 29 PHE CD2 C -1.939 2.681 -6.530 1.00 . A A . 29 PHE CD2 1 1 8 5421 1 1 29 PHE CE1 C -0.596 1.304 -8.502 1.00 . A A . 29 PHE CE1 1 1 8 5422 1 1 29 PHE CE2 C -2.602 1.726 -7.278 1.00 . A A . 29 PHE CE2 1 1 8 5423 1 1 29 PHE CG C -0.601 2.959 -6.757 1.00 . A A . 29 PHE CG 1 1 8 5424 1 1 29 PHE CZ C -1.929 1.036 -8.265 1.00 . A A . 29 PHE CZ 1 1 8 5425 1 1 29 PHE H H 2.622 4.427 -6.950 1.00 . A A . 29 PHE H 1 1 8 5426 1 1 29 PHE HA H -0.080 5.479 -7.491 1.00 . A A . 29 PHE HA 1 1 8 5427 1 1 29 PHE HB2 H 0.935 3.519 -5.435 1.00 . A A . 29 PHE HB2 1 1 8 5428 1 1 29 PHE HB3 H -0.580 4.369 -5.191 1.00 . A A . 29 PHE HB3 1 1 8 5429 1 1 29 PHE HD1 H 1.104 2.466 -7.938 1.00 . A A . 29 PHE HD1 1 1 8 5430 1 1 29 PHE HD2 H -2.468 3.220 -5.758 1.00 . A A . 29 PHE HD2 1 1 8 5431 1 1 29 PHE HE1 H -0.066 0.766 -9.275 1.00 . A A . 29 PHE HE1 1 1 8 5432 1 1 29 PHE HE2 H -3.645 1.519 -7.089 1.00 . A A . 29 PHE HE2 1 1 8 5433 1 1 29 PHE HZ H -2.444 0.289 -8.851 1.00 . A A . 29 PHE HZ 1 1 8 5434 1 1 29 PHE N N 1.881 4.823 -7.463 1.00 . A A . 29 PHE N 1 1 8 5435 1 1 29 PHE O O 2.083 6.532 -5.388 1.00 . A A . 29 PHE O 1 1 8 5436 1 1 30 SER C C 0.585 8.005 -3.347 1.00 . A A . 30 SER C 1 1 8 5437 1 1 30 SER CA C 0.143 8.401 -4.752 1.00 . A A . 30 SER CA 1 1 8 5438 1 1 30 SER CB C -1.132 9.250 -4.708 1.00 . A A . 30 SER CB 1 1 8 5439 1 1 30 SER H H -0.930 7.054 -5.990 1.00 . A A . 30 SER H 1 1 8 5440 1 1 30 SER HA H 0.930 8.987 -5.199 1.00 . A A . 30 SER HA 1 1 8 5441 1 1 30 SER HB2 H -1.058 9.963 -3.902 1.00 . A A . 30 SER HB2 1 1 8 5442 1 1 30 SER HB3 H -1.243 9.776 -5.645 1.00 . A A . 30 SER HB3 1 1 8 5443 1 1 30 SER HG H -2.694 8.693 -3.666 1.00 . A A . 30 SER HG 1 1 8 5444 1 1 30 SER N N -0.049 7.221 -5.597 1.00 . A A . 30 SER N 1 1 8 5445 1 1 30 SER O O 1.507 8.603 -2.784 1.00 . A A . 30 SER O 1 1 8 5446 1 1 30 SER OG O -2.277 8.446 -4.498 1.00 . A A . 30 SER OG 1 1 8 5447 1 1 31 ASP C C -0.394 5.156 -1.196 1.00 . A A . 31 ASP C 1 1 8 5448 1 1 31 ASP CA C 0.300 6.478 -1.472 1.00 . A A . 31 ASP CA 1 1 8 5449 1 1 31 ASP CB C -0.048 7.473 -0.363 1.00 . A A . 31 ASP CB 1 1 8 5450 1 1 31 ASP CG C 0.794 7.220 0.873 1.00 . A A . 31 ASP CG 1 1 8 5451 1 1 31 ASP H H -0.761 6.526 -3.307 1.00 . A A . 31 ASP H 1 1 8 5452 1 1 31 ASP HA H 1.367 6.308 -1.460 1.00 . A A . 31 ASP HA 1 1 8 5453 1 1 31 ASP HB2 H 0.136 8.479 -0.711 1.00 . A A . 31 ASP HB2 1 1 8 5454 1 1 31 ASP HB3 H -1.089 7.366 -0.099 1.00 . A A . 31 ASP HB3 1 1 8 5455 1 1 31 ASP N N -0.050 6.977 -2.798 1.00 . A A . 31 ASP N 1 1 8 5456 1 1 31 ASP O O -1.394 4.825 -1.829 1.00 . A A . 31 ASP O 1 1 8 5457 1 1 31 ASP OD1 O 1.825 6.514 0.750 1.00 . A A . 31 ASP OD1 1 1 8 5458 1 1 31 ASP OD2 O 0.446 7.720 1.961 1.00 . A A . 31 ASP OD2 1 1 8 5459 1 1 32 GLY C C -0.812 3.056 1.559 1.00 . A A . 32 GLY C 1 1 8 5460 1 1 32 GLY CA C -0.420 3.125 0.102 1.00 . A A . 32 GLY CA 1 1 8 5461 1 1 32 GLY H H 0.947 4.734 0.215 1.00 . A A . 32 GLY H 1 1 8 5462 1 1 32 GLY HA2 H -1.298 2.951 -0.504 1.00 . A A . 32 GLY HA2 1 1 8 5463 1 1 32 GLY HA3 H 0.305 2.352 -0.102 1.00 . A A . 32 GLY HA3 1 1 8 5464 1 1 32 GLY N N 0.148 4.407 -0.252 1.00 . A A . 32 GLY N 1 1 8 5465 1 1 32 GLY O O -0.296 3.814 2.387 1.00 . A A . 32 GLY O 1 1 8 5466 1 1 33 HIS C C -2.350 0.516 3.586 1.00 . A A . 33 HIS C 1 1 8 5467 1 1 33 HIS CA C -2.188 1.991 3.244 1.00 . A A . 33 HIS CA 1 1 8 5468 1 1 33 HIS CB C -3.511 2.742 3.462 1.00 . A A . 33 HIS CB 1 1 8 5469 1 1 33 HIS CD2 C -5.278 2.604 1.560 1.00 . A A . 33 HIS CD2 1 1 8 5470 1 1 33 HIS CE1 C -6.327 0.800 2.224 1.00 . A A . 33 HIS CE1 1 1 8 5471 1 1 33 HIS CG C -4.680 2.183 2.701 1.00 . A A . 33 HIS CG 1 1 8 5472 1 1 33 HIS H H -2.095 1.573 1.169 1.00 . A A . 33 HIS H 1 1 8 5473 1 1 33 HIS HA H -1.437 2.414 3.895 1.00 . A A . 33 HIS HA 1 1 8 5474 1 1 33 HIS HB2 H -3.761 2.710 4.512 1.00 . A A . 33 HIS HB2 1 1 8 5475 1 1 33 HIS HB3 H -3.382 3.771 3.164 1.00 . A A . 33 HIS HB3 1 1 8 5476 1 1 33 HIS HD1 H -5.166 0.498 3.884 1.00 . A A . 33 HIS HD1 1 1 8 5477 1 1 33 HIS HD2 H -4.994 3.460 0.965 1.00 . A A . 33 HIS HD2 1 1 8 5478 1 1 33 HIS HE1 H -7.008 -0.036 2.258 1.00 . A A . 33 HIS HE1 1 1 8 5479 1 1 33 HIS N N -1.724 2.153 1.877 1.00 . A A . 33 HIS N 1 1 8 5480 1 1 33 HIS ND1 N -5.365 1.048 3.091 1.00 . A A . 33 HIS ND1 1 1 8 5481 1 1 33 HIS NE2 N -6.298 1.728 1.288 1.00 . A A . 33 HIS NE2 1 1 8 5482 1 1 33 HIS O O -2.732 -0.293 2.739 1.00 . A A . 33 HIS O 1 1 8 5483 1 1 34 CYS C C -3.610 -1.683 5.163 1.00 . A A . 34 CYS C 1 1 8 5484 1 1 34 CYS CA C -2.175 -1.182 5.323 1.00 . A A . 34 CYS CA 1 1 8 5485 1 1 34 CYS CB C -1.755 -1.232 6.795 1.00 . A A . 34 CYS CB 1 1 8 5486 1 1 34 CYS H H -1.772 0.884 5.452 1.00 . A A . 34 CYS H 1 1 8 5487 1 1 34 CYS HA H -1.513 -1.806 4.740 1.00 . A A . 34 CYS HA 1 1 8 5488 1 1 34 CYS HB2 H -0.883 -0.610 6.932 1.00 . A A . 34 CYS HB2 1 1 8 5489 1 1 34 CYS HB3 H -2.562 -0.846 7.400 1.00 . A A . 34 CYS HB3 1 1 8 5490 1 1 34 CYS N N -2.063 0.185 4.834 1.00 . A A . 34 CYS N 1 1 8 5491 1 1 34 CYS O O -4.564 -0.911 5.313 1.00 . A A . 34 CYS O 1 1 8 5492 1 1 34 CYS SG S -1.345 -2.895 7.418 1.00 . A A . 34 CYS SG 1 1 8 5493 1 1 35 SER C C -5.525 -4.302 5.905 1.00 . A A . 35 SER C 1 1 8 5494 1 1 35 SER CA C -5.081 -3.541 4.658 1.00 . A A . 35 SER CA 1 1 8 5495 1 1 35 SER CB C -5.081 -4.455 3.434 1.00 . A A . 35 SER CB 1 1 8 5496 1 1 35 SER H H -2.972 -3.525 4.719 1.00 . A A . 35 SER H 1 1 8 5497 1 1 35 SER HA H -5.777 -2.735 4.487 1.00 . A A . 35 SER HA 1 1 8 5498 1 1 35 SER HB2 H -5.899 -5.156 3.512 1.00 . A A . 35 SER HB2 1 1 8 5499 1 1 35 SER HB3 H -5.207 -3.856 2.544 1.00 . A A . 35 SER HB3 1 1 8 5500 1 1 35 SER HG H -3.725 -5.417 2.397 1.00 . A A . 35 SER HG 1 1 8 5501 1 1 35 SER N N -3.763 -2.959 4.841 1.00 . A A . 35 SER N 1 1 8 5502 1 1 35 SER O O -5.040 -4.044 7.006 1.00 . A A . 35 SER O 1 1 8 5503 1 1 35 SER OG O -3.872 -5.180 3.328 1.00 . A A . 35 SER OG 1 1 8 5504 1 1 36 LYS C C -7.389 -7.418 6.373 1.00 . A A . 36 LYS C 1 1 8 5505 1 1 36 LYS CA C -6.958 -6.030 6.834 1.00 . A A . 36 LYS CA 1 1 8 5506 1 1 36 LYS CB C -8.136 -5.314 7.505 1.00 . A A . 36 LYS CB 1 1 8 5507 1 1 36 LYS CD C -9.856 -5.330 9.351 1.00 . A A . 36 LYS CD 1 1 8 5508 1 1 36 LYS CE C -11.021 -4.955 8.447 1.00 . A A . 36 LYS CE 1 1 8 5509 1 1 36 LYS CG C -8.795 -6.129 8.607 1.00 . A A . 36 LYS CG 1 1 8 5510 1 1 36 LYS H H -6.792 -5.394 4.825 1.00 . A A . 36 LYS H 1 1 8 5511 1 1 36 LYS HA H -6.161 -6.138 7.555 1.00 . A A . 36 LYS HA 1 1 8 5512 1 1 36 LYS HB2 H -7.783 -4.387 7.933 1.00 . A A . 36 LYS HB2 1 1 8 5513 1 1 36 LYS HB3 H -8.882 -5.093 6.755 1.00 . A A . 36 LYS HB3 1 1 8 5514 1 1 36 LYS HD2 H -10.230 -5.924 10.171 1.00 . A A . 36 LYS HD2 1 1 8 5515 1 1 36 LYS HD3 H -9.406 -4.426 9.736 1.00 . A A . 36 LYS HD3 1 1 8 5516 1 1 36 LYS HE2 H -10.649 -4.351 7.633 1.00 . A A . 36 LYS HE2 1 1 8 5517 1 1 36 LYS HE3 H -11.460 -5.859 8.052 1.00 . A A . 36 LYS HE3 1 1 8 5518 1 1 36 LYS HG2 H -9.260 -6.998 8.163 1.00 . A A . 36 LYS HG2 1 1 8 5519 1 1 36 LYS HG3 H -8.037 -6.445 9.309 1.00 . A A . 36 LYS HG3 1 1 8 5520 1 1 36 LYS HZ1 H -12.208 -4.595 10.128 1.00 . A A . 36 LYS HZ1 1 1 8 5521 1 1 36 LYS HZ2 H -12.967 -4.224 8.662 1.00 . A A . 36 LYS HZ2 1 1 8 5522 1 1 36 LYS HZ3 H -11.776 -3.195 9.282 1.00 . A A . 36 LYS HZ3 1 1 8 5523 1 1 36 LYS N N -6.447 -5.237 5.724 1.00 . A A . 36 LYS N 1 1 8 5524 1 1 36 LYS NZ N -12.066 -4.188 9.181 1.00 . A A . 36 LYS NZ 1 1 8 5525 1 1 36 LYS O O -7.174 -8.396 7.079 1.00 . A A . 36 LYS O 1 1 8 5526 1 1 37 ILE C C -7.361 -9.779 4.555 1.00 . A A . 37 ILE C 1 1 8 5527 1 1 37 ILE CA C -8.492 -8.756 4.644 1.00 . A A . 37 ILE CA 1 1 8 5528 1 1 37 ILE CB C -9.085 -8.554 3.236 1.00 . A A . 37 ILE CB 1 1 8 5529 1 1 37 ILE CD1 C -10.453 -6.938 1.826 1.00 . A A . 37 ILE CD1 1 1 8 5530 1 1 37 ILE CG1 C -10.062 -7.376 3.222 1.00 . A A . 37 ILE CG1 1 1 8 5531 1 1 37 ILE CG2 C -9.778 -9.826 2.763 1.00 . A A . 37 ILE CG2 1 1 8 5532 1 1 37 ILE H H -8.163 -6.666 4.691 1.00 . A A . 37 ILE H 1 1 8 5533 1 1 37 ILE HA H -9.265 -9.135 5.294 1.00 . A A . 37 ILE HA 1 1 8 5534 1 1 37 ILE HB H -8.272 -8.344 2.560 1.00 . A A . 37 ILE HB 1 1 8 5535 1 1 37 ILE HD11 H -10.749 -5.900 1.843 1.00 . A A . 37 ILE HD11 1 1 8 5536 1 1 37 ILE HD12 H -11.276 -7.542 1.476 1.00 . A A . 37 ILE HD12 1 1 8 5537 1 1 37 ILE HD13 H -9.608 -7.060 1.161 1.00 . A A . 37 ILE HD13 1 1 8 5538 1 1 37 ILE HG12 H -10.964 -7.657 3.746 1.00 . A A . 37 ILE HG12 1 1 8 5539 1 1 37 ILE HG13 H -9.608 -6.533 3.721 1.00 . A A . 37 ILE HG13 1 1 8 5540 1 1 37 ILE HG21 H -9.581 -10.625 3.464 1.00 . A A . 37 ILE HG21 1 1 8 5541 1 1 37 ILE HG22 H -9.401 -10.101 1.789 1.00 . A A . 37 ILE HG22 1 1 8 5542 1 1 37 ILE HG23 H -10.842 -9.655 2.703 1.00 . A A . 37 ILE HG23 1 1 8 5543 1 1 37 ILE N N -8.011 -7.487 5.196 1.00 . A A . 37 ILE N 1 1 8 5544 1 1 37 ILE O O -7.258 -10.680 5.383 1.00 . A A . 37 ILE O 1 1 8 5545 1 1 38 LEU C C -4.176 -9.936 4.116 1.00 . A A . 38 LEU C 1 1 8 5546 1 1 38 LEU CA C -5.372 -10.516 3.378 1.00 . A A . 38 LEU CA 1 1 8 5547 1 1 38 LEU CB C -5.059 -10.701 1.893 1.00 . A A . 38 LEU CB 1 1 8 5548 1 1 38 LEU CD1 C -4.599 -13.146 2.222 1.00 . A A . 38 LEU CD1 1 1 8 5549 1 1 38 LEU CD2 C -3.983 -12.042 0.072 1.00 . A A . 38 LEU CD2 1 1 8 5550 1 1 38 LEU CG C -4.111 -11.857 1.575 1.00 . A A . 38 LEU CG 1 1 8 5551 1 1 38 LEU H H -6.631 -8.880 2.930 1.00 . A A . 38 LEU H 1 1 8 5552 1 1 38 LEU HA H -5.628 -11.472 3.814 1.00 . A A . 38 LEU HA 1 1 8 5553 1 1 38 LEU HB2 H -5.986 -10.861 1.367 1.00 . A A . 38 LEU HB2 1 1 8 5554 1 1 38 LEU HB3 H -4.611 -9.789 1.527 1.00 . A A . 38 LEU HB3 1 1 8 5555 1 1 38 LEU HD11 H -4.067 -13.985 1.799 1.00 . A A . 38 LEU HD11 1 1 8 5556 1 1 38 LEU HD12 H -5.657 -13.262 2.040 1.00 . A A . 38 LEU HD12 1 1 8 5557 1 1 38 LEU HD13 H -4.419 -13.105 3.286 1.00 . A A . 38 LEU HD13 1 1 8 5558 1 1 38 LEU HD21 H -4.807 -11.550 -0.423 1.00 . A A . 38 LEU HD21 1 1 8 5559 1 1 38 LEU HD22 H -4.000 -13.096 -0.164 1.00 . A A . 38 LEU HD22 1 1 8 5560 1 1 38 LEU HD23 H -3.052 -11.612 -0.266 1.00 . A A . 38 LEU HD23 1 1 8 5561 1 1 38 LEU HG H -3.135 -11.628 1.974 1.00 . A A . 38 LEU HG 1 1 8 5562 1 1 38 LEU N N -6.506 -9.621 3.555 1.00 . A A . 38 LEU N 1 1 8 5563 1 1 38 LEU O O -3.155 -10.593 4.315 1.00 . A A . 38 LEU O 1 1 8 5564 1 1 39 ARG C C -2.092 -7.704 4.413 1.00 . A A . 39 ARG C 1 1 8 5565 1 1 39 ARG CA C -3.347 -7.925 5.255 1.00 . A A . 39 ARG CA 1 1 8 5566 1 1 39 ARG CB C -3.003 -8.627 6.580 1.00 . A A . 39 ARG CB 1 1 8 5567 1 1 39 ARG CD C -3.039 -6.555 8.007 1.00 . A A . 39 ARG CD 1 1 8 5568 1 1 39 ARG CG C -2.223 -7.757 7.554 1.00 . A A . 39 ARG CG 1 1 8 5569 1 1 39 ARG CZ C -1.717 -5.818 9.974 1.00 . A A . 39 ARG CZ 1 1 8 5570 1 1 39 ARG H H -5.199 -8.254 4.316 1.00 . A A . 39 ARG H 1 1 8 5571 1 1 39 ARG HA H -3.777 -6.960 5.481 1.00 . A A . 39 ARG HA 1 1 8 5572 1 1 39 ARG HB2 H -3.921 -8.932 7.060 1.00 . A A . 39 ARG HB2 1 1 8 5573 1 1 39 ARG HB3 H -2.413 -9.506 6.363 1.00 . A A . 39 ARG HB3 1 1 8 5574 1 1 39 ARG HD2 H -3.445 -6.064 7.135 1.00 . A A . 39 ARG HD2 1 1 8 5575 1 1 39 ARG HD3 H -3.849 -6.902 8.632 1.00 . A A . 39 ARG HD3 1 1 8 5576 1 1 39 ARG HE H -2.047 -4.729 8.325 1.00 . A A . 39 ARG HE 1 1 8 5577 1 1 39 ARG HG2 H -1.960 -8.348 8.419 1.00 . A A . 39 ARG HG2 1 1 8 5578 1 1 39 ARG HG3 H -1.323 -7.408 7.067 1.00 . A A . 39 ARG HG3 1 1 8 5579 1 1 39 ARG HH11 H -2.574 -7.642 10.201 1.00 . A A . 39 ARG HH11 1 1 8 5580 1 1 39 ARG HH12 H -1.593 -7.117 11.527 1.00 . A A . 39 ARG HH12 1 1 8 5581 1 1 39 ARG HH21 H -0.755 -4.037 10.065 1.00 . A A . 39 ARG HH21 1 1 8 5582 1 1 39 ARG HH22 H -0.551 -5.058 11.450 1.00 . A A . 39 ARG HH22 1 1 8 5583 1 1 39 ARG N N -4.349 -8.683 4.519 1.00 . A A . 39 ARG N 1 1 8 5584 1 1 39 ARG NE N -2.233 -5.593 8.762 1.00 . A A . 39 ARG NE 1 1 8 5585 1 1 39 ARG NH1 N -1.983 -6.950 10.621 1.00 . A A . 39 ARG NH1 1 1 8 5586 1 1 39 ARG NH2 N -0.948 -4.897 10.545 1.00 . A A . 39 ARG NH2 1 1 8 5587 1 1 39 ARG O O -0.981 -7.688 4.932 1.00 . A A . 39 ARG O 1 1 8 5588 1 1 40 ARG C C -0.792 -5.785 2.178 1.00 . A A . 40 ARG C 1 1 8 5589 1 1 40 ARG CA C -1.136 -7.275 2.239 1.00 . A A . 40 ARG CA 1 1 8 5590 1 1 40 ARG CB C -1.375 -7.843 0.841 1.00 . A A . 40 ARG CB 1 1 8 5591 1 1 40 ARG CD C -1.338 -9.893 -0.610 1.00 . A A . 40 ARG CD 1 1 8 5592 1 1 40 ARG CG C -1.406 -9.362 0.810 1.00 . A A . 40 ARG CG 1 1 8 5593 1 1 40 ARG CZ C -2.606 -9.713 -2.714 1.00 . A A . 40 ARG CZ 1 1 8 5594 1 1 40 ARG H H -3.178 -7.523 2.740 1.00 . A A . 40 ARG H 1 1 8 5595 1 1 40 ARG HA H -0.292 -7.789 2.673 1.00 . A A . 40 ARG HA 1 1 8 5596 1 1 40 ARG HB2 H -2.320 -7.475 0.470 1.00 . A A . 40 ARG HB2 1 1 8 5597 1 1 40 ARG HB3 H -0.584 -7.507 0.187 1.00 . A A . 40 ARG HB3 1 1 8 5598 1 1 40 ARG HD2 H -0.397 -9.595 -1.048 1.00 . A A . 40 ARG HD2 1 1 8 5599 1 1 40 ARG HD3 H -1.394 -10.971 -0.581 1.00 . A A . 40 ARG HD3 1 1 8 5600 1 1 40 ARG HE H -3.058 -8.737 -1.023 1.00 . A A . 40 ARG HE 1 1 8 5601 1 1 40 ARG HG2 H -0.563 -9.742 1.366 1.00 . A A . 40 ARG HG2 1 1 8 5602 1 1 40 ARG HG3 H -2.324 -9.702 1.268 1.00 . A A . 40 ARG HG3 1 1 8 5603 1 1 40 ARG HH11 H -1.098 -11.090 -2.759 1.00 . A A . 40 ARG HH11 1 1 8 5604 1 1 40 ARG HH12 H -1.962 -10.865 -4.251 1.00 . A A . 40 ARG HH12 1 1 8 5605 1 1 40 ARG HH21 H -4.189 -8.473 -2.940 1.00 . A A . 40 ARG HH21 1 1 8 5606 1 1 40 ARG HH22 H -3.736 -9.370 -4.357 1.00 . A A . 40 ARG HH22 1 1 8 5607 1 1 40 ARG N N -2.271 -7.515 3.113 1.00 . A A . 40 ARG N 1 1 8 5608 1 1 40 ARG NE N -2.426 -9.385 -1.440 1.00 . A A . 40 ARG NE 1 1 8 5609 1 1 40 ARG NH1 N -1.833 -10.627 -3.292 1.00 . A A . 40 ARG NH1 1 1 8 5610 1 1 40 ARG NH2 N -3.590 -9.144 -3.396 1.00 . A A . 40 ARG NH2 1 1 8 5611 1 1 40 ARG O O -0.002 -5.305 2.990 1.00 . A A . 40 ARG O 1 1 8 5612 1 1 41 CYS C C -1.925 -2.985 -0.026 1.00 . A A . 41 CYS C 1 1 8 5613 1 1 41 CYS CA C -1.082 -3.626 1.077 1.00 . A A . 41 CYS CA 1 1 8 5614 1 1 41 CYS CB C 0.410 -3.436 0.760 1.00 . A A . 41 CYS CB 1 1 8 5615 1 1 41 CYS H H -1.989 -5.491 0.593 1.00 . A A . 41 CYS H 1 1 8 5616 1 1 41 CYS HA H -1.305 -3.143 2.015 1.00 . A A . 41 CYS HA 1 1 8 5617 1 1 41 CYS HB2 H 0.979 -3.584 1.664 1.00 . A A . 41 CYS HB2 1 1 8 5618 1 1 41 CYS HB3 H 0.708 -4.179 0.033 1.00 . A A . 41 CYS HB3 1 1 8 5619 1 1 41 CYS N N -1.368 -5.057 1.221 1.00 . A A . 41 CYS N 1 1 8 5620 1 1 41 CYS O O -1.654 -3.182 -1.207 1.00 . A A . 41 CYS O 1 1 8 5621 1 1 41 CYS SG S 0.861 -1.800 0.094 1.00 . A A . 41 CYS SG 1 1 8 5622 1 1 42 LEU C C -3.165 -0.159 -1.001 1.00 . A A . 42 LEU C 1 1 8 5623 1 1 42 LEU CA C -3.771 -1.497 -0.607 1.00 . A A . 42 LEU CA 1 1 8 5624 1 1 42 LEU CB C -5.187 -1.258 -0.059 1.00 . A A . 42 LEU CB 1 1 8 5625 1 1 42 LEU CD1 C -6.057 -3.540 0.515 1.00 . A A . 42 LEU CD1 1 1 8 5626 1 1 42 LEU CD2 C -7.633 -1.772 -0.241 1.00 . A A . 42 LEU CD2 1 1 8 5627 1 1 42 LEU CG C -6.228 -2.334 -0.380 1.00 . A A . 42 LEU CG 1 1 8 5628 1 1 42 LEU H H -3.071 -2.043 1.319 1.00 . A A . 42 LEU H 1 1 8 5629 1 1 42 LEU HA H -3.838 -2.118 -1.488 1.00 . A A . 42 LEU HA 1 1 8 5630 1 1 42 LEU HB2 H -5.114 -1.179 1.016 1.00 . A A . 42 LEU HB2 1 1 8 5631 1 1 42 LEU HB3 H -5.547 -0.312 -0.440 1.00 . A A . 42 LEU HB3 1 1 8 5632 1 1 42 LEU HD11 H -6.820 -3.532 1.279 1.00 . A A . 42 LEU HD11 1 1 8 5633 1 1 42 LEU HD12 H -5.082 -3.508 0.979 1.00 . A A . 42 LEU HD12 1 1 8 5634 1 1 42 LEU HD13 H -6.147 -4.441 -0.074 1.00 . A A . 42 LEU HD13 1 1 8 5635 1 1 42 LEU HD21 H -8.346 -2.583 -0.232 1.00 . A A . 42 LEU HD21 1 1 8 5636 1 1 42 LEU HD22 H -7.843 -1.118 -1.074 1.00 . A A . 42 LEU HD22 1 1 8 5637 1 1 42 LEU HD23 H -7.709 -1.216 0.681 1.00 . A A . 42 LEU HD23 1 1 8 5638 1 1 42 LEU HG H -6.098 -2.656 -1.402 1.00 . A A . 42 LEU HG 1 1 8 5639 1 1 42 LEU N N -2.923 -2.190 0.363 1.00 . A A . 42 LEU N 1 1 8 5640 1 1 42 LEU O O -2.956 0.712 -0.153 1.00 . A A . 42 LEU O 1 1 8 5641 1 1 43 CYS C C -3.456 2.120 -3.373 1.00 . A A . 43 CYS C 1 1 8 5642 1 1 43 CYS CA C -2.355 1.248 -2.794 1.00 . A A . 43 CYS CA 1 1 8 5643 1 1 43 CYS CB C -1.297 0.970 -3.859 1.00 . A A . 43 CYS CB 1 1 8 5644 1 1 43 CYS H H -3.119 -0.712 -2.919 1.00 . A A . 43 CYS H 1 1 8 5645 1 1 43 CYS HA H -1.893 1.770 -1.968 1.00 . A A . 43 CYS HA 1 1 8 5646 1 1 43 CYS HB2 H -1.757 0.475 -4.698 1.00 . A A . 43 CYS HB2 1 1 8 5647 1 1 43 CYS HB3 H -0.882 1.910 -4.192 1.00 . A A . 43 CYS HB3 1 1 8 5648 1 1 43 CYS N N -2.911 0.010 -2.286 1.00 . A A . 43 CYS N 1 1 8 5649 1 1 43 CYS O O -4.377 1.625 -4.027 1.00 . A A . 43 CYS O 1 1 8 5650 1 1 43 CYS SG S 0.081 -0.065 -3.283 1.00 . A A . 43 CYS SG 1 1 8 5651 1 1 44 THR C C -3.654 5.356 -4.568 1.00 . A A . 44 THR C 1 1 8 5652 1 1 44 THR CA C -4.328 4.366 -3.629 1.00 . A A . 44 THR CA 1 1 8 5653 1 1 44 THR CB C -5.005 5.123 -2.468 1.00 . A A . 44 THR CB 1 1 8 5654 1 1 44 THR CG2 C -6.197 4.347 -1.930 1.00 . A A . 44 THR CG2 1 1 8 5655 1 1 44 THR H H -2.592 3.743 -2.608 1.00 . A A . 44 THR H 1 1 8 5656 1 1 44 THR HA H -5.087 3.822 -4.174 1.00 . A A . 44 THR HA 1 1 8 5657 1 1 44 THR HB H -5.355 6.077 -2.837 1.00 . A A . 44 THR HB 1 1 8 5658 1 1 44 THR HG1 H -3.175 5.418 -1.780 1.00 . A A . 44 THR HG1 1 1 8 5659 1 1 44 THR HG21 H -6.786 4.989 -1.292 1.00 . A A . 44 THR HG21 1 1 8 5660 1 1 44 THR HG22 H -5.846 3.499 -1.361 1.00 . A A . 44 THR HG22 1 1 8 5661 1 1 44 THR HG23 H -6.804 4.002 -2.753 1.00 . A A . 44 THR HG23 1 1 8 5662 1 1 44 THR N N -3.356 3.412 -3.133 1.00 . A A . 44 THR N 1 1 8 5663 1 1 44 THR O O -2.498 5.726 -4.353 1.00 . A A . 44 THR O 1 1 8 5664 1 1 44 THR OG1 O -4.063 5.349 -1.410 1.00 . A A . 44 THR OG1 1 1 8 5665 1 1 45 LYS C C -4.898 7.389 -7.383 1.00 . A A . 45 LYS C 1 1 8 5666 1 1 45 LYS CA C -3.803 6.714 -6.573 1.00 . A A . 45 LYS CA 1 1 8 5667 1 1 45 LYS CB C -2.828 6.022 -7.528 1.00 . A A . 45 LYS CB 1 1 8 5668 1 1 45 LYS CD C -2.516 4.629 -9.593 1.00 . A A . 45 LYS CD 1 1 8 5669 1 1 45 LYS CE C -1.987 5.802 -10.402 1.00 . A A . 45 LYS CE 1 1 8 5670 1 1 45 LYS CG C -3.497 5.089 -8.528 1.00 . A A . 45 LYS CG 1 1 8 5671 1 1 45 LYS H H -5.276 5.433 -5.745 1.00 . A A . 45 LYS H 1 1 8 5672 1 1 45 LYS HA H -3.269 7.470 -6.018 1.00 . A A . 45 LYS HA 1 1 8 5673 1 1 45 LYS HB2 H -2.290 6.778 -8.082 1.00 . A A . 45 LYS HB2 1 1 8 5674 1 1 45 LYS HB3 H -2.123 5.446 -6.947 1.00 . A A . 45 LYS HB3 1 1 8 5675 1 1 45 LYS HD2 H -1.686 4.130 -9.116 1.00 . A A . 45 LYS HD2 1 1 8 5676 1 1 45 LYS HD3 H -3.018 3.941 -10.258 1.00 . A A . 45 LYS HD3 1 1 8 5677 1 1 45 LYS HE2 H -2.787 6.190 -11.015 1.00 . A A . 45 LYS HE2 1 1 8 5678 1 1 45 LYS HE3 H -1.651 6.569 -9.721 1.00 . A A . 45 LYS HE3 1 1 8 5679 1 1 45 LYS HG2 H -3.874 4.224 -8.003 1.00 . A A . 45 LYS HG2 1 1 8 5680 1 1 45 LYS HG3 H -4.315 5.610 -9.003 1.00 . A A . 45 LYS HG3 1 1 8 5681 1 1 45 LYS HZ1 H 0.038 5.436 -10.741 1.00 . A A . 45 LYS HZ1 1 1 8 5682 1 1 45 LYS HZ2 H -0.787 6.051 -12.089 1.00 . A A . 45 LYS HZ2 1 1 8 5683 1 1 45 LYS HZ3 H -1.001 4.436 -11.632 1.00 . A A . 45 LYS HZ3 1 1 8 5684 1 1 45 LYS N N -4.359 5.772 -5.613 1.00 . A A . 45 LYS N 1 1 8 5685 1 1 45 LYS NZ N -0.857 5.403 -11.280 1.00 . A A . 45 LYS NZ 1 1 8 5686 1 1 45 LYS O O -6.050 6.951 -7.386 1.00 . A A . 45 LYS O 1 1 8 5687 1 1 46 GLU C C -5.619 8.479 -10.254 1.00 . A A . 46 GLU C 1 1 8 5688 1 1 46 GLU CA C -5.415 9.198 -8.922 1.00 . A A . 46 GLU CA 1 1 8 5689 1 1 46 GLU CB C -4.846 10.598 -9.154 1.00 . A A . 46 GLU CB 1 1 8 5690 1 1 46 GLU CD C -2.764 11.945 -9.646 1.00 . A A . 46 GLU CD 1 1 8 5691 1 1 46 GLU CG C -3.428 10.587 -9.706 1.00 . A A . 46 GLU CG 1 1 8 5692 1 1 46 GLU H H -3.573 8.723 -8.030 1.00 . A A . 46 GLU H 1 1 8 5693 1 1 46 GLU HA H -6.364 9.279 -8.414 1.00 . A A . 46 GLU HA 1 1 8 5694 1 1 46 GLU HB2 H -5.480 11.121 -9.856 1.00 . A A . 46 GLU HB2 1 1 8 5695 1 1 46 GLU HB3 H -4.841 11.134 -8.217 1.00 . A A . 46 GLU HB3 1 1 8 5696 1 1 46 GLU HG2 H -2.838 9.890 -9.131 1.00 . A A . 46 GLU HG2 1 1 8 5697 1 1 46 GLU HG3 H -3.461 10.264 -10.737 1.00 . A A . 46 GLU HG3 1 1 8 5698 1 1 46 GLU N N -4.510 8.444 -8.076 1.00 . A A . 46 GLU N 1 1 8 5699 1 1 46 GLU O O -4.727 7.762 -10.727 1.00 . A A . 46 GLU O 1 1 8 5700 1 1 46 GLU OE1 O -2.566 12.456 -8.524 1.00 . A A . 46 GLU OE1 1 1 8 5701 1 1 46 GLU OE2 O -2.435 12.492 -10.717 1.00 . A A . 46 GLU OE2 1 1 8 5702 1 1 47 CYS C C -8.488 8.605 -12.568 1.00 . A A . 47 CYS C 1 1 8 5703 1 1 47 CYS CA C -7.137 8.070 -12.120 1.00 . A A . 47 CYS CA 1 1 8 5704 1 1 47 CYS CB C -7.186 6.543 -12.021 1.00 . A A . 47 CYS CB 1 1 8 5705 1 1 47 CYS H H -7.445 9.259 -10.413 1.00 . A A . 47 CYS H 1 1 8 5706 1 1 47 CYS HA H -6.387 8.355 -12.840 1.00 . A A . 47 CYS HA 1 1 8 5707 1 1 47 CYS HB2 H -7.402 6.134 -12.997 1.00 . A A . 47 CYS HB2 1 1 8 5708 1 1 47 CYS HB3 H -6.223 6.182 -11.692 1.00 . A A . 47 CYS HB3 1 1 8 5709 1 1 47 CYS N N -6.787 8.675 -10.844 1.00 . A A . 47 CYS N 1 1 8 5710 1 1 47 CYS O O -9.089 9.380 -11.790 1.00 . A A . 47 CYS O 1 1 8 5711 1 1 47 CYS OXT O -8.944 8.253 -13.671 1.00 . A A . 47 CYS OXT 1 1 8 5712 1 1 47 CYS SG S -8.442 5.903 -10.869 1.00 . A A . 47 CYS SG 1 1 9 5713 1 1 1 ALA C C -9.714 10.886 -6.555 1.00 . A A . 1 ALA C 1 1 9 5714 1 1 1 ALA CA C -10.580 11.641 -7.563 1.00 . A A . 1 ALA CA 1 1 9 5715 1 1 1 ALA CB C -9.709 12.438 -8.527 1.00 . A A . 1 ALA CB 1 1 9 5716 1 1 1 ALA H1 H -11.525 13.473 -7.326 1.00 . A A . 1 ALA H1 1 1 9 5717 1 1 1 ALA H2 H -11.236 12.655 -5.874 1.00 . A A . 1 ALA H2 1 1 9 5718 1 1 1 ALA H3 H -12.481 12.145 -6.901 1.00 . A A . 1 ALA H3 1 1 9 5719 1 1 1 ALA HA H -11.157 10.930 -8.137 1.00 . A A . 1 ALA HA 1 1 9 5720 1 1 1 ALA HB1 H -8.938 12.953 -7.973 1.00 . A A . 1 ALA HB1 1 1 9 5721 1 1 1 ALA HB2 H -10.318 13.158 -9.052 1.00 . A A . 1 ALA HB2 1 1 9 5722 1 1 1 ALA HB3 H -9.252 11.766 -9.238 1.00 . A A . 1 ALA HB3 1 1 9 5723 1 1 1 ALA N N -11.522 12.542 -6.867 1.00 . A A . 1 ALA N 1 1 9 5724 1 1 1 ALA O O -8.498 10.799 -6.705 1.00 . A A . 1 ALA O 1 1 9 5725 1 1 2 THR C C -9.827 8.106 -4.742 1.00 . A A . 2 THR C 1 1 9 5726 1 1 2 THR CA C -9.639 9.596 -4.502 1.00 . A A . 2 THR CA 1 1 9 5727 1 1 2 THR CB C -10.156 9.966 -3.102 1.00 . A A . 2 THR CB 1 1 9 5728 1 1 2 THR CG2 C -9.195 9.482 -2.025 1.00 . A A . 2 THR CG2 1 1 9 5729 1 1 2 THR H H -11.319 10.436 -5.452 1.00 . A A . 2 THR H 1 1 9 5730 1 1 2 THR HA H -8.588 9.841 -4.563 1.00 . A A . 2 THR HA 1 1 9 5731 1 1 2 THR HB H -11.116 9.493 -2.950 1.00 . A A . 2 THR HB 1 1 9 5732 1 1 2 THR HG1 H -9.842 11.715 -2.237 1.00 . A A . 2 THR HG1 1 1 9 5733 1 1 2 THR HG21 H -9.515 8.515 -1.665 1.00 . A A . 2 THR HG21 1 1 9 5734 1 1 2 THR HG22 H -9.187 10.186 -1.206 1.00 . A A . 2 THR HG22 1 1 9 5735 1 1 2 THR HG23 H -8.200 9.399 -2.440 1.00 . A A . 2 THR HG23 1 1 9 5736 1 1 2 THR N N -10.350 10.344 -5.525 1.00 . A A . 2 THR N 1 1 9 5737 1 1 2 THR O O -10.934 7.587 -4.606 1.00 . A A . 2 THR O 1 1 9 5738 1 1 2 THR OG1 O -10.311 11.392 -3.012 1.00 . A A . 2 THR OG1 1 1 9 5739 1 1 3 CYS C C -7.993 5.164 -4.518 1.00 . A A . 3 CYS C 1 1 9 5740 1 1 3 CYS CA C -8.852 6.014 -5.446 1.00 . A A . 3 CYS CA 1 1 9 5741 1 1 3 CYS CB C -8.456 5.807 -6.903 1.00 . A A . 3 CYS CB 1 1 9 5742 1 1 3 CYS H H -7.909 7.899 -5.275 1.00 . A A . 3 CYS H 1 1 9 5743 1 1 3 CYS HA H -9.883 5.718 -5.325 1.00 . A A . 3 CYS HA 1 1 9 5744 1 1 3 CYS HB2 H -7.431 6.124 -7.046 1.00 . A A . 3 CYS HB2 1 1 9 5745 1 1 3 CYS HB3 H -8.551 4.764 -7.160 1.00 . A A . 3 CYS HB3 1 1 9 5746 1 1 3 CYS N N -8.764 7.430 -5.142 1.00 . A A . 3 CYS N 1 1 9 5747 1 1 3 CYS O O -6.834 5.484 -4.255 1.00 . A A . 3 CYS O 1 1 9 5748 1 1 3 CYS SG S -9.488 6.768 -8.045 1.00 . A A . 3 CYS SG 1 1 9 5749 1 1 4 LYS C C -8.074 1.724 -3.649 1.00 . A A . 4 LYS C 1 1 9 5750 1 1 4 LYS CA C -7.906 3.146 -3.135 1.00 . A A . 4 LYS CA 1 1 9 5751 1 1 4 LYS CB C -8.491 3.261 -1.713 1.00 . A A . 4 LYS CB 1 1 9 5752 1 1 4 LYS CD C -7.789 1.023 -0.689 1.00 . A A . 4 LYS CD 1 1 9 5753 1 1 4 LYS CE C -9.212 0.524 -0.471 1.00 . A A . 4 LYS CE 1 1 9 5754 1 1 4 LYS CG C -7.688 2.548 -0.617 1.00 . A A . 4 LYS CG 1 1 9 5755 1 1 4 LYS H H -9.509 3.883 -4.294 1.00 . A A . 4 LYS H 1 1 9 5756 1 1 4 LYS HA H -6.853 3.394 -3.113 1.00 . A A . 4 LYS HA 1 1 9 5757 1 1 4 LYS HB2 H -8.553 4.306 -1.451 1.00 . A A . 4 LYS HB2 1 1 9 5758 1 1 4 LYS HB3 H -9.489 2.847 -1.720 1.00 . A A . 4 LYS HB3 1 1 9 5759 1 1 4 LYS HD2 H -7.455 0.698 -1.662 1.00 . A A . 4 LYS HD2 1 1 9 5760 1 1 4 LYS HD3 H -7.149 0.597 0.071 1.00 . A A . 4 LYS HD3 1 1 9 5761 1 1 4 LYS HE2 H -9.502 0.737 0.547 1.00 . A A . 4 LYS HE2 1 1 9 5762 1 1 4 LYS HE3 H -9.871 1.047 -1.148 1.00 . A A . 4 LYS HE3 1 1 9 5763 1 1 4 LYS HG2 H -6.650 2.825 -0.714 1.00 . A A . 4 LYS HG2 1 1 9 5764 1 1 4 LYS HG3 H -8.055 2.875 0.346 1.00 . A A . 4 LYS HG3 1 1 9 5765 1 1 4 LYS HZ1 H -10.293 -1.268 -0.490 1.00 . A A . 4 LYS HZ1 1 1 9 5766 1 1 4 LYS HZ2 H -8.657 -1.473 -0.111 1.00 . A A . 4 LYS HZ2 1 1 9 5767 1 1 4 LYS HZ3 H -9.126 -1.165 -1.708 1.00 . A A . 4 LYS HZ3 1 1 9 5768 1 1 4 LYS N N -8.583 4.073 -4.033 1.00 . A A . 4 LYS N 1 1 9 5769 1 1 4 LYS NZ N -9.334 -0.943 -0.712 1.00 . A A . 4 LYS NZ 1 1 9 5770 1 1 4 LYS O O -9.190 1.277 -3.909 1.00 . A A . 4 LYS O 1 1 9 5771 1 1 5 ALA C C -5.688 -1.036 -3.746 1.00 . A A . 5 ALA C 1 1 9 5772 1 1 5 ALA CA C -6.963 -0.361 -4.212 1.00 . A A . 5 ALA CA 1 1 9 5773 1 1 5 ALA CB C -7.079 -0.429 -5.728 1.00 . A A . 5 ALA CB 1 1 9 5774 1 1 5 ALA H H -6.107 1.438 -3.515 1.00 . A A . 5 ALA H 1 1 9 5775 1 1 5 ALA HA H -7.814 -0.864 -3.777 1.00 . A A . 5 ALA HA 1 1 9 5776 1 1 5 ALA HB1 H -6.228 0.064 -6.176 1.00 . A A . 5 ALA HB1 1 1 9 5777 1 1 5 ALA HB2 H -7.986 0.065 -6.042 1.00 . A A . 5 ALA HB2 1 1 9 5778 1 1 5 ALA HB3 H -7.102 -1.462 -6.042 1.00 . A A . 5 ALA HB3 1 1 9 5779 1 1 5 ALA N N -6.965 1.018 -3.760 1.00 . A A . 5 ALA N 1 1 9 5780 1 1 5 ALA O O -4.599 -0.509 -3.957 1.00 . A A . 5 ALA O 1 1 9 5781 1 1 6 GLU C C -3.825 -3.358 -3.784 1.00 . A A . 6 GLU C 1 1 9 5782 1 1 6 GLU CA C -4.670 -2.913 -2.608 1.00 . A A . 6 GLU CA 1 1 9 5783 1 1 6 GLU CB C -5.075 -4.134 -1.756 1.00 . A A . 6 GLU CB 1 1 9 5784 1 1 6 GLU CD C -7.221 -3.219 -0.651 1.00 . A A . 6 GLU CD 1 1 9 5785 1 1 6 GLU CG C -5.821 -3.800 -0.463 1.00 . A A . 6 GLU CG 1 1 9 5786 1 1 6 GLU H H -6.720 -2.556 -2.948 1.00 . A A . 6 GLU H 1 1 9 5787 1 1 6 GLU HA H -4.088 -2.236 -2.000 1.00 . A A . 6 GLU HA 1 1 9 5788 1 1 6 GLU HB2 H -5.687 -4.792 -2.344 1.00 . A A . 6 GLU HB2 1 1 9 5789 1 1 6 GLU HB3 H -4.174 -4.666 -1.486 1.00 . A A . 6 GLU HB3 1 1 9 5790 1 1 6 GLU HG2 H -5.913 -4.706 0.117 1.00 . A A . 6 GLU HG2 1 1 9 5791 1 1 6 GLU HG3 H -5.229 -3.088 0.094 1.00 . A A . 6 GLU HG3 1 1 9 5792 1 1 6 GLU N N -5.821 -2.184 -3.101 1.00 . A A . 6 GLU N 1 1 9 5793 1 1 6 GLU O O -4.360 -3.741 -4.826 1.00 . A A . 6 GLU O 1 1 9 5794 1 1 6 GLU OE1 O -7.745 -3.211 -1.782 1.00 . A A . 6 GLU OE1 1 1 9 5795 1 1 6 GLU OE2 O -7.806 -2.757 0.351 1.00 . A A . 6 GLU OE2 1 1 9 5796 1 1 7 CYS C C -1.921 -5.045 -5.211 1.00 . A A . 7 CYS C 1 1 9 5797 1 1 7 CYS CA C -1.588 -3.652 -4.681 1.00 . A A . 7 CYS CA 1 1 9 5798 1 1 7 CYS CB C -0.142 -3.615 -4.176 1.00 . A A . 7 CYS CB 1 1 9 5799 1 1 7 CYS H H -2.168 -2.935 -2.765 1.00 . A A . 7 CYS H 1 1 9 5800 1 1 7 CYS HA H -1.697 -2.939 -5.484 1.00 . A A . 7 CYS HA 1 1 9 5801 1 1 7 CYS HB2 H 0.054 -2.648 -3.739 1.00 . A A . 7 CYS HB2 1 1 9 5802 1 1 7 CYS HB3 H -0.011 -4.379 -3.423 1.00 . A A . 7 CYS HB3 1 1 9 5803 1 1 7 CYS N N -2.516 -3.275 -3.620 1.00 . A A . 7 CYS N 1 1 9 5804 1 1 7 CYS O O -2.012 -6.005 -4.444 1.00 . A A . 7 CYS O 1 1 9 5805 1 1 7 CYS SG S 1.106 -3.898 -5.481 1.00 . A A . 7 CYS SG 1 1 9 5806 1 1 8 PRO C C -1.482 -7.537 -6.845 1.00 . A A . 8 PRO C 1 1 9 5807 1 1 8 PRO CA C -2.479 -6.436 -7.178 1.00 . A A . 8 PRO CA 1 1 9 5808 1 1 8 PRO CB C -2.435 -6.106 -8.672 1.00 . A A . 8 PRO CB 1 1 9 5809 1 1 8 PRO CD C -2.070 -4.055 -7.505 1.00 . A A . 8 PRO CD 1 1 9 5810 1 1 8 PRO CG C -2.685 -4.640 -8.745 1.00 . A A . 8 PRO CG 1 1 9 5811 1 1 8 PRO HA H -3.474 -6.758 -6.905 1.00 . A A . 8 PRO HA 1 1 9 5812 1 1 8 PRO HB2 H -1.465 -6.362 -9.071 1.00 . A A . 8 PRO HB2 1 1 9 5813 1 1 8 PRO HB3 H -3.202 -6.663 -9.190 1.00 . A A . 8 PRO HB3 1 1 9 5814 1 1 8 PRO HD2 H -1.047 -3.765 -7.693 1.00 . A A . 8 PRO HD2 1 1 9 5815 1 1 8 PRO HD3 H -2.647 -3.210 -7.160 1.00 . A A . 8 PRO HD3 1 1 9 5816 1 1 8 PRO HG2 H -2.214 -4.231 -9.626 1.00 . A A . 8 PRO HG2 1 1 9 5817 1 1 8 PRO HG3 H -3.748 -4.448 -8.763 1.00 . A A . 8 PRO HG3 1 1 9 5818 1 1 8 PRO N N -2.131 -5.163 -6.536 1.00 . A A . 8 PRO N 1 1 9 5819 1 1 8 PRO O O -1.860 -8.673 -6.571 1.00 . A A . 8 PRO O 1 1 9 5820 1 1 9 THR C C 1.149 -8.112 -5.036 1.00 . A A . 9 THR C 1 1 9 5821 1 1 9 THR CA C 0.842 -8.137 -6.528 1.00 . A A . 9 THR CA 1 1 9 5822 1 1 9 THR CB C 2.127 -7.840 -7.325 1.00 . A A . 9 THR CB 1 1 9 5823 1 1 9 THR CG2 C 1.955 -8.217 -8.789 1.00 . A A . 9 THR CG2 1 1 9 5824 1 1 9 THR H H 0.035 -6.261 -7.057 1.00 . A A . 9 THR H 1 1 9 5825 1 1 9 THR HA H 0.493 -9.124 -6.799 1.00 . A A . 9 THR HA 1 1 9 5826 1 1 9 THR HB H 2.934 -8.429 -6.910 1.00 . A A . 9 THR HB 1 1 9 5827 1 1 9 THR HG1 H 2.258 -6.137 -6.320 1.00 . A A . 9 THR HG1 1 1 9 5828 1 1 9 THR HG21 H 2.199 -9.261 -8.923 1.00 . A A . 9 THR HG21 1 1 9 5829 1 1 9 THR HG22 H 2.613 -7.613 -9.397 1.00 . A A . 9 THR HG22 1 1 9 5830 1 1 9 THR HG23 H 0.932 -8.046 -9.087 1.00 . A A . 9 THR HG23 1 1 9 5831 1 1 9 THR N N -0.205 -7.187 -6.849 1.00 . A A . 9 THR N 1 1 9 5832 1 1 9 THR O O 2.311 -8.114 -4.633 1.00 . A A . 9 THR O 1 1 9 5833 1 1 9 THR OG1 O 2.464 -6.446 -7.218 1.00 . A A . 9 THR OG1 1 1 9 5834 1 1 10 TRP C C -0.893 -8.702 -2.070 1.00 . A A . 10 TRP C 1 1 9 5835 1 1 10 TRP CA C 0.275 -8.037 -2.781 1.00 . A A . 10 TRP CA 1 1 9 5836 1 1 10 TRP CB C 0.432 -6.600 -2.287 1.00 . A A . 10 TRP CB 1 1 9 5837 1 1 10 TRP CD1 C 0.145 -6.820 0.248 1.00 . A A . 10 TRP CD1 1 1 9 5838 1 1 10 TRP CD2 C 2.165 -6.097 -0.394 1.00 . A A . 10 TRP CD2 1 1 9 5839 1 1 10 TRP CE2 C 2.149 -6.182 1.010 1.00 . A A . 10 TRP CE2 1 1 9 5840 1 1 10 TRP CE3 C 3.330 -5.659 -1.030 1.00 . A A . 10 TRP CE3 1 1 9 5841 1 1 10 TRP CG C 0.881 -6.519 -0.861 1.00 . A A . 10 TRP CG 1 1 9 5842 1 1 10 TRP CH2 C 4.381 -5.419 1.135 1.00 . A A . 10 TRP CH2 1 1 9 5843 1 1 10 TRP CZ2 C 3.260 -5.846 1.786 1.00 . A A . 10 TRP CZ2 1 1 9 5844 1 1 10 TRP CZ3 C 4.424 -5.325 -0.259 1.00 . A A . 10 TRP CZ3 1 1 9 5845 1 1 10 TRP H H -0.803 -8.064 -4.597 1.00 . A A . 10 TRP H 1 1 9 5846 1 1 10 TRP HA H 1.176 -8.583 -2.545 1.00 . A A . 10 TRP HA 1 1 9 5847 1 1 10 TRP HB2 H 1.168 -6.101 -2.898 1.00 . A A . 10 TRP HB2 1 1 9 5848 1 1 10 TRP HB3 H -0.514 -6.086 -2.375 1.00 . A A . 10 TRP HB3 1 1 9 5849 1 1 10 TRP HD1 H -0.885 -7.168 0.218 1.00 . A A . 10 TRP HD1 1 1 9 5850 1 1 10 TRP HE1 H 0.605 -6.795 2.302 1.00 . A A . 10 TRP HE1 1 1 9 5851 1 1 10 TRP HE3 H 3.383 -5.580 -2.106 1.00 . A A . 10 TRP HE3 1 1 9 5852 1 1 10 TRP HH2 H 5.262 -5.146 1.697 1.00 . A A . 10 TRP HH2 1 1 9 5853 1 1 10 TRP HZ2 H 3.253 -5.911 2.862 1.00 . A A . 10 TRP HZ2 1 1 9 5854 1 1 10 TRP HZ3 H 5.329 -4.978 -0.733 1.00 . A A . 10 TRP HZ3 1 1 9 5855 1 1 10 TRP N N 0.104 -8.074 -4.220 1.00 . A A . 10 TRP N 1 1 9 5856 1 1 10 TRP NE1 N 0.905 -6.633 1.381 1.00 . A A . 10 TRP NE1 1 1 9 5857 1 1 10 TRP O O -1.856 -8.049 -1.654 1.00 . A A . 10 TRP O 1 1 9 5858 1 1 11 ASP C C -1.342 -11.144 0.150 1.00 . A A . 11 ASP C 1 1 9 5859 1 1 11 ASP CA C -1.817 -10.772 -1.245 1.00 . A A . 11 ASP CA 1 1 9 5860 1 1 11 ASP CB C -2.152 -12.035 -2.032 1.00 . A A . 11 ASP CB 1 1 9 5861 1 1 11 ASP CG C -0.986 -13.001 -2.075 1.00 . A A . 11 ASP CG 1 1 9 5862 1 1 11 ASP H H 0.001 -10.466 -2.272 1.00 . A A . 11 ASP H 1 1 9 5863 1 1 11 ASP HA H -2.700 -10.158 -1.163 1.00 . A A . 11 ASP HA 1 1 9 5864 1 1 11 ASP HB2 H -2.991 -12.530 -1.566 1.00 . A A . 11 ASP HB2 1 1 9 5865 1 1 11 ASP HB3 H -2.414 -11.765 -3.044 1.00 . A A . 11 ASP HB3 1 1 9 5866 1 1 11 ASP N N -0.794 -10.001 -1.923 1.00 . A A . 11 ASP N 1 1 9 5867 1 1 11 ASP O O -2.106 -11.658 0.966 1.00 . A A . 11 ASP O 1 1 9 5868 1 1 11 ASP OD1 O 0.107 -12.590 -2.524 1.00 . A A . 11 ASP OD1 1 1 9 5869 1 1 11 ASP OD2 O -1.162 -14.160 -1.654 1.00 . A A . 11 ASP OD2 1 1 9 5870 1 1 12 SER C C 0.286 -10.136 2.732 1.00 . A A . 12 SER C 1 1 9 5871 1 1 12 SER CA C 0.555 -11.206 1.670 1.00 . A A . 12 SER CA 1 1 9 5872 1 1 12 SER CB C 2.061 -11.391 1.462 1.00 . A A . 12 SER CB 1 1 9 5873 1 1 12 SER H H 0.476 -10.482 -0.305 1.00 . A A . 12 SER H 1 1 9 5874 1 1 12 SER HA H 0.139 -12.141 2.013 1.00 . A A . 12 SER HA 1 1 9 5875 1 1 12 SER HB2 H 2.231 -11.929 0.541 1.00 . A A . 12 SER HB2 1 1 9 5876 1 1 12 SER HB3 H 2.534 -10.421 1.403 1.00 . A A . 12 SER HB3 1 1 9 5877 1 1 12 SER HG H 2.750 -13.038 2.264 1.00 . A A . 12 SER HG 1 1 9 5878 1 1 12 SER N N -0.067 -10.887 0.398 1.00 . A A . 12 SER N 1 1 9 5879 1 1 12 SER O O -0.442 -9.164 2.501 1.00 . A A . 12 SER O 1 1 9 5880 1 1 12 SER OG O 2.646 -12.120 2.529 1.00 . A A . 12 SER OG 1 1 9 5881 1 1 13 VAL C C 1.736 -8.279 4.948 1.00 . A A . 13 VAL C 1 1 9 5882 1 1 13 VAL CA C 0.741 -9.436 5.028 1.00 . A A . 13 VAL CA 1 1 9 5883 1 1 13 VAL CB C 0.948 -10.199 6.356 1.00 . A A . 13 VAL CB 1 1 9 5884 1 1 13 VAL CG1 C 0.830 -9.271 7.554 1.00 . A A . 13 VAL CG1 1 1 9 5885 1 1 13 VAL CG2 C -0.042 -11.348 6.470 1.00 . A A . 13 VAL CG2 1 1 9 5886 1 1 13 VAL H H 1.449 -11.135 4.000 1.00 . A A . 13 VAL H 1 1 9 5887 1 1 13 VAL HA H -0.264 -9.039 5.016 1.00 . A A . 13 VAL HA 1 1 9 5888 1 1 13 VAL HB H 1.944 -10.615 6.353 1.00 . A A . 13 VAL HB 1 1 9 5889 1 1 13 VAL HG11 H -0.195 -9.252 7.895 1.00 . A A . 13 VAL HG11 1 1 9 5890 1 1 13 VAL HG12 H 1.133 -8.275 7.269 1.00 . A A . 13 VAL HG12 1 1 9 5891 1 1 13 VAL HG13 H 1.468 -9.628 8.349 1.00 . A A . 13 VAL HG13 1 1 9 5892 1 1 13 VAL HG21 H -0.455 -11.369 7.468 1.00 . A A . 13 VAL HG21 1 1 9 5893 1 1 13 VAL HG22 H 0.465 -12.280 6.269 1.00 . A A . 13 VAL HG22 1 1 9 5894 1 1 13 VAL HG23 H -0.838 -11.209 5.754 1.00 . A A . 13 VAL HG23 1 1 9 5895 1 1 13 VAL N N 0.885 -10.339 3.898 1.00 . A A . 13 VAL N 1 1 9 5896 1 1 13 VAL O O 2.935 -8.488 4.764 1.00 . A A . 13 VAL O 1 1 9 5897 1 1 14 CYS C C 2.764 -5.677 6.418 1.00 . A A . 14 CYS C 1 1 9 5898 1 1 14 CYS CA C 2.068 -5.873 5.072 1.00 . A A . 14 CYS CA 1 1 9 5899 1 1 14 CYS CB C 1.222 -4.645 4.722 1.00 . A A . 14 CYS CB 1 1 9 5900 1 1 14 CYS H H 0.266 -6.963 5.258 1.00 . A A . 14 CYS H 1 1 9 5901 1 1 14 CYS HA H 2.819 -6.014 4.308 1.00 . A A . 14 CYS HA 1 1 9 5902 1 1 14 CYS HB2 H 1.044 -4.632 3.657 1.00 . A A . 14 CYS HB2 1 1 9 5903 1 1 14 CYS HB3 H 0.276 -4.712 5.238 1.00 . A A . 14 CYS HB3 1 1 9 5904 1 1 14 CYS N N 1.232 -7.063 5.103 1.00 . A A . 14 CYS N 1 1 9 5905 1 1 14 CYS O O 2.120 -5.658 7.468 1.00 . A A . 14 CYS O 1 1 9 5906 1 1 14 CYS SG S 1.985 -3.055 5.171 1.00 . A A . 14 CYS SG 1 1 9 5907 1 1 15 ILE C C 5.193 -3.891 7.831 1.00 . A A . 15 ILE C 1 1 9 5908 1 1 15 ILE CA C 4.855 -5.364 7.605 1.00 . A A . 15 ILE CA 1 1 9 5909 1 1 15 ILE CB C 6.164 -6.186 7.564 1.00 . A A . 15 ILE CB 1 1 9 5910 1 1 15 ILE CD1 C 7.098 -8.524 7.146 1.00 . A A . 15 ILE CD1 1 1 9 5911 1 1 15 ILE CG1 C 5.861 -7.659 7.268 1.00 . A A . 15 ILE CG1 1 1 9 5912 1 1 15 ILE CG2 C 6.923 -6.053 8.881 1.00 . A A . 15 ILE CG2 1 1 9 5913 1 1 15 ILE H H 4.542 -5.581 5.525 1.00 . A A . 15 ILE H 1 1 9 5914 1 1 15 ILE HA H 4.258 -5.717 8.434 1.00 . A A . 15 ILE HA 1 1 9 5915 1 1 15 ILE HB H 6.787 -5.789 6.777 1.00 . A A . 15 ILE HB 1 1 9 5916 1 1 15 ILE HD11 H 7.205 -9.126 8.037 1.00 . A A . 15 ILE HD11 1 1 9 5917 1 1 15 ILE HD12 H 7.968 -7.895 7.030 1.00 . A A . 15 ILE HD12 1 1 9 5918 1 1 15 ILE HD13 H 7.003 -9.170 6.286 1.00 . A A . 15 ILE HD13 1 1 9 5919 1 1 15 ILE HG12 H 5.253 -8.062 8.064 1.00 . A A . 15 ILE HG12 1 1 9 5920 1 1 15 ILE HG13 H 5.316 -7.725 6.337 1.00 . A A . 15 ILE HG13 1 1 9 5921 1 1 15 ILE HG21 H 6.354 -5.441 9.564 1.00 . A A . 15 ILE HG21 1 1 9 5922 1 1 15 ILE HG22 H 7.882 -5.593 8.698 1.00 . A A . 15 ILE HG22 1 1 9 5923 1 1 15 ILE HG23 H 7.070 -7.033 9.312 1.00 . A A . 15 ILE HG23 1 1 9 5924 1 1 15 ILE N N 4.080 -5.545 6.385 1.00 . A A . 15 ILE N 1 1 9 5925 1 1 15 ILE O O 5.167 -3.402 8.961 1.00 . A A . 15 ILE O 1 1 9 5926 1 1 16 ASN C C 5.370 -1.019 5.623 1.00 . A A . 16 ASN C 1 1 9 5927 1 1 16 ASN CA C 5.884 -1.781 6.844 1.00 . A A . 16 ASN CA 1 1 9 5928 1 1 16 ASN CB C 7.414 -1.663 6.966 1.00 . A A . 16 ASN CB 1 1 9 5929 1 1 16 ASN CG C 7.901 -0.259 7.291 1.00 . A A . 16 ASN CG 1 1 9 5930 1 1 16 ASN H H 5.528 -3.628 5.881 1.00 . A A . 16 ASN H 1 1 9 5931 1 1 16 ASN HA H 5.426 -1.372 7.732 1.00 . A A . 16 ASN HA 1 1 9 5932 1 1 16 ASN HB2 H 7.754 -2.323 7.749 1.00 . A A . 16 ASN HB2 1 1 9 5933 1 1 16 ASN HB3 H 7.862 -1.969 6.031 1.00 . A A . 16 ASN HB3 1 1 9 5934 1 1 16 ASN HD21 H 8.382 -0.826 9.131 1.00 . A A . 16 ASN HD21 1 1 9 5935 1 1 16 ASN HD22 H 8.699 0.828 8.746 1.00 . A A . 16 ASN HD22 1 1 9 5936 1 1 16 ASN N N 5.520 -3.190 6.754 1.00 . A A . 16 ASN N 1 1 9 5937 1 1 16 ASN ND2 N 8.373 -0.066 8.512 1.00 . A A . 16 ASN ND2 1 1 9 5938 1 1 16 ASN O O 5.059 -1.621 4.593 1.00 . A A . 16 ASN O 1 1 9 5939 1 1 16 ASN OD1 O 7.852 0.643 6.455 1.00 . A A . 16 ASN OD1 1 1 9 5940 1 1 17 LYS C C 5.767 1.126 3.476 1.00 . A A . 17 LYS C 1 1 9 5941 1 1 17 LYS CA C 4.809 1.158 4.669 1.00 . A A . 17 LYS CA 1 1 9 5942 1 1 17 LYS CB C 4.640 2.598 5.174 1.00 . A A . 17 LYS CB 1 1 9 5943 1 1 17 LYS CD C 4.096 5.001 4.655 1.00 . A A . 17 LYS CD 1 1 9 5944 1 1 17 LYS CE C 3.911 6.034 3.549 1.00 . A A . 17 LYS CE 1 1 9 5945 1 1 17 LYS CG C 4.199 3.587 4.102 1.00 . A A . 17 LYS CG 1 1 9 5946 1 1 17 LYS H H 5.545 0.712 6.598 1.00 . A A . 17 LYS H 1 1 9 5947 1 1 17 LYS HA H 3.847 0.785 4.350 1.00 . A A . 17 LYS HA 1 1 9 5948 1 1 17 LYS HB2 H 3.901 2.605 5.962 1.00 . A A . 17 LYS HB2 1 1 9 5949 1 1 17 LYS HB3 H 5.583 2.937 5.577 1.00 . A A . 17 LYS HB3 1 1 9 5950 1 1 17 LYS HD2 H 3.249 5.053 5.324 1.00 . A A . 17 LYS HD2 1 1 9 5951 1 1 17 LYS HD3 H 5.000 5.229 5.200 1.00 . A A . 17 LYS HD3 1 1 9 5952 1 1 17 LYS HE2 H 3.918 7.018 3.991 1.00 . A A . 17 LYS HE2 1 1 9 5953 1 1 17 LYS HE3 H 4.736 5.948 2.856 1.00 . A A . 17 LYS HE3 1 1 9 5954 1 1 17 LYS HG2 H 4.921 3.578 3.299 1.00 . A A . 17 LYS HG2 1 1 9 5955 1 1 17 LYS HG3 H 3.233 3.286 3.723 1.00 . A A . 17 LYS HG3 1 1 9 5956 1 1 17 LYS HZ1 H 2.484 4.847 2.579 1.00 . A A . 17 LYS HZ1 1 1 9 5957 1 1 17 LYS HZ2 H 2.665 6.391 1.906 1.00 . A A . 17 LYS HZ2 1 1 9 5958 1 1 17 LYS HZ3 H 1.837 6.197 3.367 1.00 . A A . 17 LYS HZ3 1 1 9 5959 1 1 17 LYS N N 5.280 0.300 5.749 1.00 . A A . 17 LYS N 1 1 9 5960 1 1 17 LYS NZ N 2.637 5.852 2.806 1.00 . A A . 17 LYS NZ 1 1 9 5961 1 1 17 LYS O O 5.326 1.185 2.332 1.00 . A A . 17 LYS O 1 1 9 5962 1 1 18 LYS C C 7.761 -0.055 1.616 1.00 . A A . 18 LYS C 1 1 9 5963 1 1 18 LYS CA C 8.081 1.015 2.677 1.00 . A A . 18 LYS CA 1 1 9 5964 1 1 18 LYS CB C 9.489 0.808 3.249 1.00 . A A . 18 LYS CB 1 1 9 5965 1 1 18 LYS CD C 10.625 2.154 1.455 1.00 . A A . 18 LYS CD 1 1 9 5966 1 1 18 LYS CE C 11.419 2.054 0.163 1.00 . A A . 18 LYS CE 1 1 9 5967 1 1 18 LYS CG C 10.577 0.820 2.186 1.00 . A A . 18 LYS CG 1 1 9 5968 1 1 18 LYS H H 7.368 1.000 4.685 1.00 . A A . 18 LYS H 1 1 9 5969 1 1 18 LYS HA H 8.051 1.981 2.193 1.00 . A A . 18 LYS HA 1 1 9 5970 1 1 18 LYS HB2 H 9.698 1.595 3.959 1.00 . A A . 18 LYS HB2 1 1 9 5971 1 1 18 LYS HB3 H 9.523 -0.144 3.758 1.00 . A A . 18 LYS HB3 1 1 9 5972 1 1 18 LYS HD2 H 9.617 2.463 1.223 1.00 . A A . 18 LYS HD2 1 1 9 5973 1 1 18 LYS HD3 H 11.090 2.888 2.098 1.00 . A A . 18 LYS HD3 1 1 9 5974 1 1 18 LYS HE2 H 11.487 3.037 -0.280 1.00 . A A . 18 LYS HE2 1 1 9 5975 1 1 18 LYS HE3 H 12.411 1.693 0.391 1.00 . A A . 18 LYS HE3 1 1 9 5976 1 1 18 LYS HG2 H 11.531 0.645 2.659 1.00 . A A . 18 LYS HG2 1 1 9 5977 1 1 18 LYS HG3 H 10.377 0.035 1.471 1.00 . A A . 18 LYS HG3 1 1 9 5978 1 1 18 LYS HZ1 H 9.795 0.929 -0.524 1.00 . A A . 18 LYS HZ1 1 1 9 5979 1 1 18 LYS HZ2 H 11.301 0.231 -0.852 1.00 . A A . 18 LYS HZ2 1 1 9 5980 1 1 18 LYS HZ3 H 10.769 1.554 -1.759 1.00 . A A . 18 LYS HZ3 1 1 9 5981 1 1 18 LYS N N 7.073 1.041 3.746 1.00 . A A . 18 LYS N 1 1 9 5982 1 1 18 LYS NZ N 10.776 1.127 -0.811 1.00 . A A . 18 LYS NZ 1 1 9 5983 1 1 18 LYS O O 7.629 0.281 0.434 1.00 . A A . 18 LYS O 1 1 9 5984 1 1 19 PRO C C 6.008 -2.118 0.295 1.00 . A A . 19 PRO C 1 1 9 5985 1 1 19 PRO CA C 7.300 -2.421 1.047 1.00 . A A . 19 PRO CA 1 1 9 5986 1 1 19 PRO CB C 7.097 -3.645 1.946 1.00 . A A . 19 PRO CB 1 1 9 5987 1 1 19 PRO CD C 7.780 -1.879 3.369 1.00 . A A . 19 PRO CD 1 1 9 5988 1 1 19 PRO CG C 7.914 -3.357 3.150 1.00 . A A . 19 PRO CG 1 1 9 5989 1 1 19 PRO HA H 8.102 -2.601 0.346 1.00 . A A . 19 PRO HA 1 1 9 5990 1 1 19 PRO HB2 H 6.049 -3.739 2.194 1.00 . A A . 19 PRO HB2 1 1 9 5991 1 1 19 PRO HB3 H 7.430 -4.538 1.441 1.00 . A A . 19 PRO HB3 1 1 9 5992 1 1 19 PRO HD2 H 6.907 -1.663 3.967 1.00 . A A . 19 PRO HD2 1 1 9 5993 1 1 19 PRO HD3 H 8.669 -1.483 3.838 1.00 . A A . 19 PRO HD3 1 1 9 5994 1 1 19 PRO HG2 H 7.527 -3.903 3.998 1.00 . A A . 19 PRO HG2 1 1 9 5995 1 1 19 PRO HG3 H 8.945 -3.619 2.969 1.00 . A A . 19 PRO HG3 1 1 9 5996 1 1 19 PRO N N 7.627 -1.349 1.999 1.00 . A A . 19 PRO N 1 1 9 5997 1 1 19 PRO O O 5.910 -2.323 -0.917 1.00 . A A . 19 PRO O 1 1 9 5998 1 1 20 CYS C C 3.871 -0.194 -0.597 1.00 . A A . 20 CYS C 1 1 9 5999 1 1 20 CYS CA C 3.727 -1.271 0.480 1.00 . A A . 20 CYS CA 1 1 9 6000 1 1 20 CYS CB C 2.798 -0.791 1.601 1.00 . A A . 20 CYS CB 1 1 9 6001 1 1 20 CYS H H 5.182 -1.477 1.995 1.00 . A A . 20 CYS H 1 1 9 6002 1 1 20 CYS HA H 3.311 -2.162 0.031 1.00 . A A . 20 CYS HA 1 1 9 6003 1 1 20 CYS HB2 H 2.796 -1.526 2.392 1.00 . A A . 20 CYS HB2 1 1 9 6004 1 1 20 CYS HB3 H 3.175 0.144 1.991 1.00 . A A . 20 CYS HB3 1 1 9 6005 1 1 20 CYS N N 5.026 -1.619 1.037 1.00 . A A . 20 CYS N 1 1 9 6006 1 1 20 CYS O O 3.386 -0.358 -1.716 1.00 . A A . 20 CYS O 1 1 9 6007 1 1 20 CYS SG S 1.069 -0.524 1.096 1.00 . A A . 20 CYS SG 1 1 9 6008 1 1 21 VAL C C 5.477 1.479 -2.464 1.00 . A A . 21 VAL C 1 1 9 6009 1 1 21 VAL CA C 4.785 1.989 -1.206 1.00 . A A . 21 VAL CA 1 1 9 6010 1 1 21 VAL CB C 5.623 3.132 -0.583 1.00 . A A . 21 VAL CB 1 1 9 6011 1 1 21 VAL CG1 C 5.927 4.213 -1.612 1.00 . A A . 21 VAL CG1 1 1 9 6012 1 1 21 VAL CG2 C 4.896 3.735 0.607 1.00 . A A . 21 VAL CG2 1 1 9 6013 1 1 21 VAL H H 4.943 0.962 0.643 1.00 . A A . 21 VAL H 1 1 9 6014 1 1 21 VAL HA H 3.819 2.389 -1.482 1.00 . A A . 21 VAL HA 1 1 9 6015 1 1 21 VAL HB H 6.559 2.720 -0.236 1.00 . A A . 21 VAL HB 1 1 9 6016 1 1 21 VAL HG11 H 5.072 4.345 -2.258 1.00 . A A . 21 VAL HG11 1 1 9 6017 1 1 21 VAL HG12 H 6.782 3.917 -2.202 1.00 . A A . 21 VAL HG12 1 1 9 6018 1 1 21 VAL HG13 H 6.143 5.142 -1.106 1.00 . A A . 21 VAL HG13 1 1 9 6019 1 1 21 VAL HG21 H 5.007 3.085 1.463 1.00 . A A . 21 VAL HG21 1 1 9 6020 1 1 21 VAL HG22 H 3.848 3.844 0.371 1.00 . A A . 21 VAL HG22 1 1 9 6021 1 1 21 VAL HG23 H 5.318 4.703 0.834 1.00 . A A . 21 VAL HG23 1 1 9 6022 1 1 21 VAL N N 4.563 0.896 -0.262 1.00 . A A . 21 VAL N 1 1 9 6023 1 1 21 VAL O O 5.182 1.931 -3.566 1.00 . A A . 21 VAL O 1 1 9 6024 1 1 22 ALA C C 6.119 -0.775 -4.360 1.00 . A A . 22 ALA C 1 1 9 6025 1 1 22 ALA CA C 7.094 -0.058 -3.428 1.00 . A A . 22 ALA CA 1 1 9 6026 1 1 22 ALA CB C 8.176 -1.010 -2.944 1.00 . A A . 22 ALA CB 1 1 9 6027 1 1 22 ALA H H 6.562 0.189 -1.390 1.00 . A A . 22 ALA H 1 1 9 6028 1 1 22 ALA HA H 7.569 0.747 -3.970 1.00 . A A . 22 ALA HA 1 1 9 6029 1 1 22 ALA HB1 H 9.013 -0.981 -3.626 1.00 . A A . 22 ALA HB1 1 1 9 6030 1 1 22 ALA HB2 H 7.780 -2.014 -2.902 1.00 . A A . 22 ALA HB2 1 1 9 6031 1 1 22 ALA HB3 H 8.504 -0.712 -1.959 1.00 . A A . 22 ALA HB3 1 1 9 6032 1 1 22 ALA N N 6.383 0.523 -2.296 1.00 . A A . 22 ALA N 1 1 9 6033 1 1 22 ALA O O 6.159 -0.592 -5.580 1.00 . A A . 22 ALA O 1 1 9 6034 1 1 23 CYS C C 3.282 -1.313 -5.211 1.00 . A A . 23 CYS C 1 1 9 6035 1 1 23 CYS CA C 4.230 -2.302 -4.544 1.00 . A A . 23 CYS CA 1 1 9 6036 1 1 23 CYS CB C 3.445 -3.251 -3.633 1.00 . A A . 23 CYS CB 1 1 9 6037 1 1 23 CYS H H 5.239 -1.662 -2.795 1.00 . A A . 23 CYS H 1 1 9 6038 1 1 23 CYS HA H 4.739 -2.874 -5.305 1.00 . A A . 23 CYS HA 1 1 9 6039 1 1 23 CYS HB2 H 4.107 -3.634 -2.873 1.00 . A A . 23 CYS HB2 1 1 9 6040 1 1 23 CYS HB3 H 2.645 -2.700 -3.158 1.00 . A A . 23 CYS HB3 1 1 9 6041 1 1 23 CYS N N 5.231 -1.573 -3.774 1.00 . A A . 23 CYS N 1 1 9 6042 1 1 23 CYS O O 2.949 -1.435 -6.388 1.00 . A A . 23 CYS O 1 1 9 6043 1 1 23 CYS SG S 2.698 -4.678 -4.492 1.00 . A A . 23 CYS SG 1 1 9 6044 1 1 24 CYS C C 2.635 1.511 -6.059 1.00 . A A . 24 CYS C 1 1 9 6045 1 1 24 CYS CA C 1.968 0.697 -4.958 1.00 . A A . 24 CYS CA 1 1 9 6046 1 1 24 CYS CB C 1.518 1.605 -3.820 1.00 . A A . 24 CYS CB 1 1 9 6047 1 1 24 CYS H H 3.169 -0.274 -3.515 1.00 . A A . 24 CYS H 1 1 9 6048 1 1 24 CYS HA H 1.103 0.199 -5.370 1.00 . A A . 24 CYS HA 1 1 9 6049 1 1 24 CYS HB2 H 2.383 2.070 -3.372 1.00 . A A . 24 CYS HB2 1 1 9 6050 1 1 24 CYS HB3 H 0.866 2.370 -4.212 1.00 . A A . 24 CYS HB3 1 1 9 6051 1 1 24 CYS N N 2.864 -0.323 -4.451 1.00 . A A . 24 CYS N 1 1 9 6052 1 1 24 CYS O O 1.987 1.915 -7.018 1.00 . A A . 24 CYS O 1 1 9 6053 1 1 24 CYS SG S 0.618 0.721 -2.512 1.00 . A A . 24 CYS SG 1 1 9 6054 1 1 25 LYS C C 4.732 1.783 -8.235 1.00 . A A . 25 LYS C 1 1 9 6055 1 1 25 LYS CA C 4.671 2.522 -6.904 1.00 . A A . 25 LYS CA 1 1 9 6056 1 1 25 LYS CB C 6.080 2.843 -6.399 1.00 . A A . 25 LYS CB 1 1 9 6057 1 1 25 LYS CD C 5.862 5.201 -7.252 1.00 . A A . 25 LYS CD 1 1 9 6058 1 1 25 LYS CE C 5.519 5.751 -5.876 1.00 . A A . 25 LYS CE 1 1 9 6059 1 1 25 LYS CG C 6.757 3.969 -7.168 1.00 . A A . 25 LYS CG 1 1 9 6060 1 1 25 LYS H H 4.403 1.404 -5.127 1.00 . A A . 25 LYS H 1 1 9 6061 1 1 25 LYS HA H 4.138 3.449 -7.054 1.00 . A A . 25 LYS HA 1 1 9 6062 1 1 25 LYS HB2 H 6.021 3.130 -5.359 1.00 . A A . 25 LYS HB2 1 1 9 6063 1 1 25 LYS HB3 H 6.692 1.958 -6.485 1.00 . A A . 25 LYS HB3 1 1 9 6064 1 1 25 LYS HD2 H 6.374 5.966 -7.815 1.00 . A A . 25 LYS HD2 1 1 9 6065 1 1 25 LYS HD3 H 4.946 4.932 -7.760 1.00 . A A . 25 LYS HD3 1 1 9 6066 1 1 25 LYS HE2 H 5.245 4.930 -5.230 1.00 . A A . 25 LYS HE2 1 1 9 6067 1 1 25 LYS HE3 H 6.389 6.249 -5.474 1.00 . A A . 25 LYS HE3 1 1 9 6068 1 1 25 LYS HG2 H 7.674 4.237 -6.665 1.00 . A A . 25 LYS HG2 1 1 9 6069 1 1 25 LYS HG3 H 6.978 3.626 -8.168 1.00 . A A . 25 LYS HG3 1 1 9 6070 1 1 25 LYS HZ1 H 3.495 6.214 -6.118 1.00 . A A . 25 LYS HZ1 1 1 9 6071 1 1 25 LYS HZ2 H 4.546 7.405 -6.701 1.00 . A A . 25 LYS HZ2 1 1 9 6072 1 1 25 LYS HZ3 H 4.306 7.234 -5.034 1.00 . A A . 25 LYS HZ3 1 1 9 6073 1 1 25 LYS N N 3.932 1.751 -5.918 1.00 . A A . 25 LYS N 1 1 9 6074 1 1 25 LYS NZ N 4.391 6.719 -5.937 1.00 . A A . 25 LYS NZ 1 1 9 6075 1 1 25 LYS O O 4.502 2.380 -9.285 1.00 . A A . 25 LYS O 1 1 9 6076 1 1 26 LYS C C 3.680 -0.418 -10.037 1.00 . A A . 26 LYS C 1 1 9 6077 1 1 26 LYS CA C 5.075 -0.313 -9.417 1.00 . A A . 26 LYS CA 1 1 9 6078 1 1 26 LYS CB C 5.695 -1.707 -9.166 1.00 . A A . 26 LYS CB 1 1 9 6079 1 1 26 LYS CD C 3.792 -3.324 -8.745 1.00 . A A . 26 LYS CD 1 1 9 6080 1 1 26 LYS CE C 4.247 -4.571 -9.484 1.00 . A A . 26 LYS CE 1 1 9 6081 1 1 26 LYS CG C 4.966 -2.566 -8.138 1.00 . A A . 26 LYS CG 1 1 9 6082 1 1 26 LYS H H 5.178 0.050 -7.324 1.00 . A A . 26 LYS H 1 1 9 6083 1 1 26 LYS HA H 5.708 0.224 -10.111 1.00 . A A . 26 LYS HA 1 1 9 6084 1 1 26 LYS HB2 H 5.708 -2.249 -10.099 1.00 . A A . 26 LYS HB2 1 1 9 6085 1 1 26 LYS HB3 H 6.714 -1.573 -8.830 1.00 . A A . 26 LYS HB3 1 1 9 6086 1 1 26 LYS HD2 H 3.117 -3.614 -7.954 1.00 . A A . 26 LYS HD2 1 1 9 6087 1 1 26 LYS HD3 H 3.277 -2.673 -9.438 1.00 . A A . 26 LYS HD3 1 1 9 6088 1 1 26 LYS HE2 H 3.415 -4.964 -10.049 1.00 . A A . 26 LYS HE2 1 1 9 6089 1 1 26 LYS HE3 H 5.047 -4.303 -10.158 1.00 . A A . 26 LYS HE3 1 1 9 6090 1 1 26 LYS HG2 H 5.662 -3.279 -7.724 1.00 . A A . 26 LYS HG2 1 1 9 6091 1 1 26 LYS HG3 H 4.598 -1.925 -7.350 1.00 . A A . 26 LYS HG3 1 1 9 6092 1 1 26 LYS HZ1 H 3.933 -5.993 -7.984 1.00 . A A . 26 LYS HZ1 1 1 9 6093 1 1 26 LYS HZ2 H 5.434 -5.213 -7.890 1.00 . A A . 26 LYS HZ2 1 1 9 6094 1 1 26 LYS HZ3 H 5.172 -6.397 -9.068 1.00 . A A . 26 LYS HZ3 1 1 9 6095 1 1 26 LYS N N 5.018 0.482 -8.192 1.00 . A A . 26 LYS N 1 1 9 6096 1 1 26 LYS NZ N 4.733 -5.616 -8.542 1.00 . A A . 26 LYS NZ 1 1 9 6097 1 1 26 LYS O O 3.535 -0.567 -11.249 1.00 . A A . 26 LYS O 1 1 9 6098 1 1 27 ALA C C 0.818 0.980 -10.172 1.00 . A A . 27 ALA C 1 1 9 6099 1 1 27 ALA CA C 1.266 -0.379 -9.630 1.00 . A A . 27 ALA CA 1 1 9 6100 1 1 27 ALA CB C 0.366 -0.831 -8.488 1.00 . A A . 27 ALA CB 1 1 9 6101 1 1 27 ALA H H 2.843 -0.189 -8.232 1.00 . A A . 27 ALA H 1 1 9 6102 1 1 27 ALA HA H 1.201 -1.111 -10.423 1.00 . A A . 27 ALA HA 1 1 9 6103 1 1 27 ALA HB1 H -0.516 -0.209 -8.455 1.00 . A A . 27 ALA HB1 1 1 9 6104 1 1 27 ALA HB2 H 0.901 -0.746 -7.553 1.00 . A A . 27 ALA HB2 1 1 9 6105 1 1 27 ALA HB3 H 0.076 -1.860 -8.643 1.00 . A A . 27 ALA HB3 1 1 9 6106 1 1 27 ALA N N 2.656 -0.320 -9.186 1.00 . A A . 27 ALA N 1 1 9 6107 1 1 27 ALA O O -0.317 1.138 -10.626 1.00 . A A . 27 ALA O 1 1 9 6108 1 1 28 LYS C C 0.569 4.091 -9.694 1.00 . A A . 28 LYS C 1 1 9 6109 1 1 28 LYS CA C 1.517 3.306 -10.610 1.00 . A A . 28 LYS CA 1 1 9 6110 1 1 28 LYS CB C 1.001 3.283 -12.054 1.00 . A A . 28 LYS CB 1 1 9 6111 1 1 28 LYS CD C 1.057 4.362 -14.317 1.00 . A A . 28 LYS CD 1 1 9 6112 1 1 28 LYS CE C 1.981 3.287 -14.868 1.00 . A A . 28 LYS CE 1 1 9 6113 1 1 28 LYS CG C 1.274 4.562 -12.827 1.00 . A A . 28 LYS CG 1 1 9 6114 1 1 28 LYS H H 2.622 1.722 -9.758 1.00 . A A . 28 LYS H 1 1 9 6115 1 1 28 LYS HA H 2.476 3.804 -10.602 1.00 . A A . 28 LYS HA 1 1 9 6116 1 1 28 LYS HB2 H 1.472 2.465 -12.579 1.00 . A A . 28 LYS HB2 1 1 9 6117 1 1 28 LYS HB3 H -0.066 3.120 -12.037 1.00 . A A . 28 LYS HB3 1 1 9 6118 1 1 28 LYS HD2 H 0.033 4.066 -14.487 1.00 . A A . 28 LYS HD2 1 1 9 6119 1 1 28 LYS HD3 H 1.256 5.292 -14.828 1.00 . A A . 28 LYS HD3 1 1 9 6120 1 1 28 LYS HE2 H 3.003 3.617 -14.756 1.00 . A A . 28 LYS HE2 1 1 9 6121 1 1 28 LYS HE3 H 1.833 2.379 -14.302 1.00 . A A . 28 LYS HE3 1 1 9 6122 1 1 28 LYS HG2 H 0.607 5.335 -12.475 1.00 . A A . 28 LYS HG2 1 1 9 6123 1 1 28 LYS HG3 H 2.298 4.862 -12.658 1.00 . A A . 28 LYS HG3 1 1 9 6124 1 1 28 LYS HZ1 H 0.936 2.332 -16.401 1.00 . A A . 28 LYS HZ1 1 1 9 6125 1 1 28 LYS HZ2 H 2.568 2.605 -16.751 1.00 . A A . 28 LYS HZ2 1 1 9 6126 1 1 28 LYS HZ3 H 1.468 3.889 -16.800 1.00 . A A . 28 LYS HZ3 1 1 9 6127 1 1 28 LYS N N 1.740 1.944 -10.126 1.00 . A A . 28 LYS N 1 1 9 6128 1 1 28 LYS NZ N 1.720 3.009 -16.306 1.00 . A A . 28 LYS NZ 1 1 9 6129 1 1 28 LYS O O -0.218 4.930 -10.148 1.00 . A A . 28 LYS O 1 1 9 6130 1 1 29 PHE C C 0.705 5.617 -6.723 1.00 . A A . 29 PHE C 1 1 9 6131 1 1 29 PHE CA C -0.130 4.538 -7.402 1.00 . A A . 29 PHE CA 1 1 9 6132 1 1 29 PHE CB C -0.706 3.574 -6.359 1.00 . A A . 29 PHE CB 1 1 9 6133 1 1 29 PHE CD1 C -1.729 1.834 -7.854 1.00 . A A . 29 PHE CD1 1 1 9 6134 1 1 29 PHE CD2 C -3.144 2.962 -6.307 1.00 . A A . 29 PHE CD2 1 1 9 6135 1 1 29 PHE CE1 C -2.805 1.094 -8.303 1.00 . A A . 29 PHE CE1 1 1 9 6136 1 1 29 PHE CE2 C -4.225 2.225 -6.751 1.00 . A A . 29 PHE CE2 1 1 9 6137 1 1 29 PHE CG C -1.883 2.776 -6.854 1.00 . A A . 29 PHE CG 1 1 9 6138 1 1 29 PHE CZ C -4.055 1.290 -7.752 1.00 . A A . 29 PHE CZ 1 1 9 6139 1 1 29 PHE H H 1.340 3.178 -8.091 1.00 . A A . 29 PHE H 1 1 9 6140 1 1 29 PHE HA H -0.946 5.016 -7.925 1.00 . A A . 29 PHE HA 1 1 9 6141 1 1 29 PHE HB2 H 0.063 2.878 -6.064 1.00 . A A . 29 PHE HB2 1 1 9 6142 1 1 29 PHE HB3 H -1.024 4.137 -5.493 1.00 . A A . 29 PHE HB3 1 1 9 6143 1 1 29 PHE HD1 H -0.752 1.678 -8.288 1.00 . A A . 29 PHE HD1 1 1 9 6144 1 1 29 PHE HD2 H -3.281 3.696 -5.525 1.00 . A A . 29 PHE HD2 1 1 9 6145 1 1 29 PHE HE1 H -2.669 0.362 -9.086 1.00 . A A . 29 PHE HE1 1 1 9 6146 1 1 29 PHE HE2 H -5.201 2.380 -6.315 1.00 . A A . 29 PHE HE2 1 1 9 6147 1 1 29 PHE HZ H -4.897 0.712 -8.101 1.00 . A A . 29 PHE HZ 1 1 9 6148 1 1 29 PHE N N 0.678 3.840 -8.395 1.00 . A A . 29 PHE N 1 1 9 6149 1 1 29 PHE O O 1.928 5.485 -6.592 1.00 . A A . 29 PHE O 1 1 9 6150 1 1 30 SER C C 1.413 7.417 -4.392 1.00 . A A . 30 SER C 1 1 9 6151 1 1 30 SER CA C 0.707 7.819 -5.687 1.00 . A A . 30 SER CA 1 1 9 6152 1 1 30 SER CB C -0.330 8.905 -5.420 1.00 . A A . 30 SER CB 1 1 9 6153 1 1 30 SER H H -0.921 6.745 -6.476 1.00 . A A . 30 SER H 1 1 9 6154 1 1 30 SER HA H 1.440 8.201 -6.375 1.00 . A A . 30 SER HA 1 1 9 6155 1 1 30 SER HB2 H -0.802 8.728 -4.465 1.00 . A A . 30 SER HB2 1 1 9 6156 1 1 30 SER HB3 H 0.148 9.874 -5.418 1.00 . A A . 30 SER HB3 1 1 9 6157 1 1 30 SER HG H -1.365 9.749 -6.881 1.00 . A A . 30 SER HG 1 1 9 6158 1 1 30 SER N N 0.047 6.692 -6.323 1.00 . A A . 30 SER N 1 1 9 6159 1 1 30 SER O O 2.587 7.744 -4.197 1.00 . A A . 30 SER O 1 1 9 6160 1 1 30 SER OG O -1.318 8.881 -6.436 1.00 . A A . 30 SER OG 1 1 9 6161 1 1 31 ASP C C 0.527 5.082 -1.673 1.00 . A A . 31 ASP C 1 1 9 6162 1 1 31 ASP CA C 1.278 6.279 -2.244 1.00 . A A . 31 ASP CA 1 1 9 6163 1 1 31 ASP CB C 1.270 7.440 -1.238 1.00 . A A . 31 ASP CB 1 1 9 6164 1 1 31 ASP CG C 1.660 7.012 0.166 1.00 . A A . 31 ASP CG 1 1 9 6165 1 1 31 ASP H H -0.224 6.475 -3.735 1.00 . A A . 31 ASP H 1 1 9 6166 1 1 31 ASP HA H 2.300 5.987 -2.426 1.00 . A A . 31 ASP HA 1 1 9 6167 1 1 31 ASP HB2 H 1.969 8.196 -1.567 1.00 . A A . 31 ASP HB2 1 1 9 6168 1 1 31 ASP HB3 H 0.278 7.868 -1.201 1.00 . A A . 31 ASP HB3 1 1 9 6169 1 1 31 ASP N N 0.706 6.710 -3.520 1.00 . A A . 31 ASP N 1 1 9 6170 1 1 31 ASP O O -0.689 4.959 -1.841 1.00 . A A . 31 ASP O 1 1 9 6171 1 1 31 ASP OD1 O 0.790 6.511 0.911 1.00 . A A . 31 ASP OD1 1 1 9 6172 1 1 31 ASP OD2 O 2.847 7.144 0.526 1.00 . A A . 31 ASP OD2 1 1 9 6173 1 1 32 GLY C C 0.652 3.114 1.111 1.00 . A A . 32 GLY C 1 1 9 6174 1 1 32 GLY CA C 0.675 3.029 -0.398 1.00 . A A . 32 GLY CA 1 1 9 6175 1 1 32 GLY H H 2.222 4.370 -0.896 1.00 . A A . 32 GLY H 1 1 9 6176 1 1 32 GLY HA2 H -0.337 2.920 -0.759 1.00 . A A . 32 GLY HA2 1 1 9 6177 1 1 32 GLY HA3 H 1.248 2.161 -0.692 1.00 . A A . 32 GLY HA3 1 1 9 6178 1 1 32 GLY N N 1.264 4.206 -0.999 1.00 . A A . 32 GLY N 1 1 9 6179 1 1 32 GLY O O 1.600 3.603 1.730 1.00 . A A . 32 GLY O 1 1 9 6180 1 1 33 HIS C C -0.979 1.308 3.704 1.00 . A A . 33 HIS C 1 1 9 6181 1 1 33 HIS CA C -0.562 2.668 3.157 1.00 . A A . 33 HIS CA 1 1 9 6182 1 1 33 HIS CB C -1.564 3.750 3.593 1.00 . A A . 33 HIS CB 1 1 9 6183 1 1 33 HIS CD2 C -4.111 3.283 3.379 1.00 . A A . 33 HIS CD2 1 1 9 6184 1 1 33 HIS CE1 C -4.368 3.840 1.277 1.00 . A A . 33 HIS CE1 1 1 9 6185 1 1 33 HIS CG C -2.902 3.675 2.913 1.00 . A A . 33 HIS CG 1 1 9 6186 1 1 33 HIS H H -1.147 2.247 1.164 1.00 . A A . 33 HIS H 1 1 9 6187 1 1 33 HIS HA H 0.407 2.914 3.567 1.00 . A A . 33 HIS HA 1 1 9 6188 1 1 33 HIS HB2 H -1.733 3.661 4.656 1.00 . A A . 33 HIS HB2 1 1 9 6189 1 1 33 HIS HB3 H -1.140 4.721 3.386 1.00 . A A . 33 HIS HB3 1 1 9 6190 1 1 33 HIS HD1 H -2.414 4.353 0.972 1.00 . A A . 33 HIS HD1 1 1 9 6191 1 1 33 HIS HD2 H -4.332 2.940 4.379 1.00 . A A . 33 HIS HD2 1 1 9 6192 1 1 33 HIS HE1 H -4.810 4.022 0.309 1.00 . A A . 33 HIS HE1 1 1 9 6193 1 1 33 HIS N N -0.424 2.637 1.711 1.00 . A A . 33 HIS N 1 1 9 6194 1 1 33 HIS ND1 N -3.100 4.018 1.590 1.00 . A A . 33 HIS ND1 1 1 9 6195 1 1 33 HIS NE2 N -5.003 3.395 2.343 1.00 . A A . 33 HIS NE2 1 1 9 6196 1 1 33 HIS O O -1.904 0.671 3.197 1.00 . A A . 33 HIS O 1 1 9 6197 1 1 34 CYS C C -1.905 -0.317 6.117 1.00 . A A . 34 CYS C 1 1 9 6198 1 1 34 CYS CA C -0.555 -0.383 5.404 1.00 . A A . 34 CYS CA 1 1 9 6199 1 1 34 CYS CB C 0.569 -0.669 6.401 1.00 . A A . 34 CYS CB 1 1 9 6200 1 1 34 CYS H H 0.428 1.452 5.099 1.00 . A A . 34 CYS H 1 1 9 6201 1 1 34 CYS HA H -0.580 -1.159 4.655 1.00 . A A . 34 CYS HA 1 1 9 6202 1 1 34 CYS HB2 H 1.490 -0.259 6.015 1.00 . A A . 34 CYS HB2 1 1 9 6203 1 1 34 CYS HB3 H 0.335 -0.188 7.339 1.00 . A A . 34 CYS HB3 1 1 9 6204 1 1 34 CYS N N -0.287 0.886 4.748 1.00 . A A . 34 CYS N 1 1 9 6205 1 1 34 CYS O O -2.206 0.674 6.783 1.00 . A A . 34 CYS O 1 1 9 6206 1 1 34 CYS SG S 0.858 -2.432 6.741 1.00 . A A . 34 CYS SG 1 1 9 6207 1 1 35 SER C C -4.019 -1.929 7.990 1.00 . A A . 35 SER C 1 1 9 6208 1 1 35 SER CA C -4.050 -1.355 6.573 1.00 . A A . 35 SER CA 1 1 9 6209 1 1 35 SER CB C -5.032 -2.141 5.706 1.00 . A A . 35 SER CB 1 1 9 6210 1 1 35 SER H H -2.455 -2.100 5.395 1.00 . A A . 35 SER H 1 1 9 6211 1 1 35 SER HA H -4.389 -0.333 6.630 1.00 . A A . 35 SER HA 1 1 9 6212 1 1 35 SER HB2 H -5.981 -2.212 6.216 1.00 . A A . 35 SER HB2 1 1 9 6213 1 1 35 SER HB3 H -5.167 -1.628 4.766 1.00 . A A . 35 SER HB3 1 1 9 6214 1 1 35 SER HG H -3.993 -3.434 4.659 1.00 . A A . 35 SER HG 1 1 9 6215 1 1 35 SER N N -2.730 -1.345 5.954 1.00 . A A . 35 SER N 1 1 9 6216 1 1 35 SER O O -2.988 -1.915 8.666 1.00 . A A . 35 SER O 1 1 9 6217 1 1 35 SER OG O -4.558 -3.450 5.447 1.00 . A A . 35 SER OG 1 1 9 6218 1 1 36 LYS C C -6.026 -4.339 9.739 1.00 . A A . 36 LYS C 1 1 9 6219 1 1 36 LYS CA C -5.294 -2.998 9.766 1.00 . A A . 36 LYS CA 1 1 9 6220 1 1 36 LYS CB C -6.035 -2.016 10.680 1.00 . A A . 36 LYS CB 1 1 9 6221 1 1 36 LYS CD C -7.169 -1.604 12.895 1.00 . A A . 36 LYS CD 1 1 9 6222 1 1 36 LYS CE C -6.292 -0.423 13.282 1.00 . A A . 36 LYS CE 1 1 9 6223 1 1 36 LYS CG C -6.417 -2.606 12.029 1.00 . A A . 36 LYS CG 1 1 9 6224 1 1 36 LYS H H -5.946 -2.402 7.846 1.00 . A A . 36 LYS H 1 1 9 6225 1 1 36 LYS HA H -4.300 -3.153 10.156 1.00 . A A . 36 LYS HA 1 1 9 6226 1 1 36 LYS HB2 H -5.403 -1.158 10.854 1.00 . A A . 36 LYS HB2 1 1 9 6227 1 1 36 LYS HB3 H -6.939 -1.691 10.184 1.00 . A A . 36 LYS HB3 1 1 9 6228 1 1 36 LYS HD2 H -8.023 -1.239 12.345 1.00 . A A . 36 LYS HD2 1 1 9 6229 1 1 36 LYS HD3 H -7.503 -2.102 13.793 1.00 . A A . 36 LYS HD3 1 1 9 6230 1 1 36 LYS HE2 H -5.454 -0.786 13.859 1.00 . A A . 36 LYS HE2 1 1 9 6231 1 1 36 LYS HE3 H -5.930 0.051 12.382 1.00 . A A . 36 LYS HE3 1 1 9 6232 1 1 36 LYS HG2 H -7.049 -3.467 11.862 1.00 . A A . 36 LYS HG2 1 1 9 6233 1 1 36 LYS HG3 H -5.519 -2.912 12.543 1.00 . A A . 36 LYS HG3 1 1 9 6234 1 1 36 LYS HZ1 H -7.855 0.936 13.556 1.00 . A A . 36 LYS HZ1 1 1 9 6235 1 1 36 LYS HZ2 H -6.419 1.379 14.332 1.00 . A A . 36 LYS HZ2 1 1 9 6236 1 1 36 LYS HZ3 H -7.380 0.143 14.974 1.00 . A A . 36 LYS HZ3 1 1 9 6237 1 1 36 LYS N N -5.165 -2.429 8.432 1.00 . A A . 36 LYS N 1 1 9 6238 1 1 36 LYS NZ N -7.038 0.579 14.093 1.00 . A A . 36 LYS NZ 1 1 9 6239 1 1 36 LYS O O -5.733 -5.215 10.543 1.00 . A A . 36 LYS O 1 1 9 6240 1 1 37 ILE C C -6.917 -6.912 8.378 1.00 . A A . 37 ILE C 1 1 9 6241 1 1 37 ILE CA C -7.789 -5.701 8.715 1.00 . A A . 37 ILE CA 1 1 9 6242 1 1 37 ILE CB C -8.865 -5.581 7.615 1.00 . A A . 37 ILE CB 1 1 9 6243 1 1 37 ILE CD1 C -10.302 -3.928 6.335 1.00 . A A . 37 ILE CD1 1 1 9 6244 1 1 37 ILE CG1 C -9.498 -4.190 7.593 1.00 . A A . 37 ILE CG1 1 1 9 6245 1 1 37 ILE CG2 C -9.938 -6.647 7.811 1.00 . A A . 37 ILE CG2 1 1 9 6246 1 1 37 ILE H H -7.188 -3.727 8.233 1.00 . A A . 37 ILE H 1 1 9 6247 1 1 37 ILE HA H -8.279 -5.870 9.660 1.00 . A A . 37 ILE HA 1 1 9 6248 1 1 37 ILE HB H -8.385 -5.762 6.667 1.00 . A A . 37 ILE HB 1 1 9 6249 1 1 37 ILE HD11 H -9.962 -4.590 5.548 1.00 . A A . 37 ILE HD11 1 1 9 6250 1 1 37 ILE HD12 H -10.165 -2.903 6.026 1.00 . A A . 37 ILE HD12 1 1 9 6251 1 1 37 ILE HD13 H -11.348 -4.110 6.530 1.00 . A A . 37 ILE HD13 1 1 9 6252 1 1 37 ILE HG12 H -10.161 -4.088 8.440 1.00 . A A . 37 ILE HG12 1 1 9 6253 1 1 37 ILE HG13 H -8.720 -3.443 7.655 1.00 . A A . 37 ILE HG13 1 1 9 6254 1 1 37 ILE HG21 H -10.803 -6.403 7.212 1.00 . A A . 37 ILE HG21 1 1 9 6255 1 1 37 ILE HG22 H -10.220 -6.687 8.852 1.00 . A A . 37 ILE HG22 1 1 9 6256 1 1 37 ILE HG23 H -9.549 -7.608 7.507 1.00 . A A . 37 ILE HG23 1 1 9 6257 1 1 37 ILE N N -6.992 -4.474 8.829 1.00 . A A . 37 ILE N 1 1 9 6258 1 1 37 ILE O O -6.289 -7.510 9.246 1.00 . A A . 37 ILE O 1 1 9 6259 1 1 38 LEU C C -4.653 -8.002 6.473 1.00 . A A . 38 LEU C 1 1 9 6260 1 1 38 LEU CA C -6.113 -8.405 6.626 1.00 . A A . 38 LEU CA 1 1 9 6261 1 1 38 LEU CB C -6.666 -8.900 5.292 1.00 . A A . 38 LEU CB 1 1 9 6262 1 1 38 LEU CD1 C -6.438 -11.331 5.863 1.00 . A A . 38 LEU CD1 1 1 9 6263 1 1 38 LEU CD2 C -6.689 -10.629 3.480 1.00 . A A . 38 LEU CD2 1 1 9 6264 1 1 38 LEU CG C -6.122 -10.251 4.838 1.00 . A A . 38 LEU CG 1 1 9 6265 1 1 38 LEU H H -7.423 -6.758 6.453 1.00 . A A . 38 LEU H 1 1 9 6266 1 1 38 LEU HA H -6.187 -9.194 7.360 1.00 . A A . 38 LEU HA 1 1 9 6267 1 1 38 LEU HB2 H -7.737 -8.968 5.371 1.00 . A A . 38 LEU HB2 1 1 9 6268 1 1 38 LEU HB3 H -6.425 -8.170 4.534 1.00 . A A . 38 LEU HB3 1 1 9 6269 1 1 38 LEU HD11 H -7.415 -11.744 5.662 1.00 . A A . 38 LEU HD11 1 1 9 6270 1 1 38 LEU HD12 H -6.426 -10.902 6.854 1.00 . A A . 38 LEU HD12 1 1 9 6271 1 1 38 LEU HD13 H -5.697 -12.114 5.800 1.00 . A A . 38 LEU HD13 1 1 9 6272 1 1 38 LEU HD21 H -6.376 -9.903 2.744 1.00 . A A . 38 LEU HD21 1 1 9 6273 1 1 38 LEU HD22 H -7.767 -10.647 3.532 1.00 . A A . 38 LEU HD22 1 1 9 6274 1 1 38 LEU HD23 H -6.326 -11.607 3.198 1.00 . A A . 38 LEU HD23 1 1 9 6275 1 1 38 LEU HG H -5.049 -10.176 4.750 1.00 . A A . 38 LEU HG 1 1 9 6276 1 1 38 LEU N N -6.895 -7.270 7.097 1.00 . A A . 38 LEU N 1 1 9 6277 1 1 38 LEU O O -3.811 -8.785 6.038 1.00 . A A . 38 LEU O 1 1 9 6278 1 1 39 ARG C C -2.560 -6.103 5.336 1.00 . A A . 39 ARG C 1 1 9 6279 1 1 39 ARG CA C -3.055 -6.179 6.782 1.00 . A A . 39 ARG CA 1 1 9 6280 1 1 39 ARG CB C -2.095 -6.985 7.663 1.00 . A A . 39 ARG CB 1 1 9 6281 1 1 39 ARG CD C -1.047 -5.018 8.837 1.00 . A A . 39 ARG CD 1 1 9 6282 1 1 39 ARG CG C -0.805 -6.263 8.001 1.00 . A A . 39 ARG CG 1 1 9 6283 1 1 39 ARG CZ C 0.316 -3.286 9.965 1.00 . A A . 39 ARG CZ 1 1 9 6284 1 1 39 ARG H H -5.118 -6.215 7.179 1.00 . A A . 39 ARG H 1 1 9 6285 1 1 39 ARG HA H -3.121 -5.174 7.173 1.00 . A A . 39 ARG HA 1 1 9 6286 1 1 39 ARG HB2 H -2.595 -7.229 8.588 1.00 . A A . 39 ARG HB2 1 1 9 6287 1 1 39 ARG HB3 H -1.843 -7.902 7.150 1.00 . A A . 39 ARG HB3 1 1 9 6288 1 1 39 ARG HD2 H -1.626 -4.313 8.257 1.00 . A A . 39 ARG HD2 1 1 9 6289 1 1 39 ARG HD3 H -1.600 -5.293 9.724 1.00 . A A . 39 ARG HD3 1 1 9 6290 1 1 39 ARG HE H 1.045 -4.844 8.936 1.00 . A A . 39 ARG HE 1 1 9 6291 1 1 39 ARG HG2 H -0.166 -6.933 8.555 1.00 . A A . 39 ARG HG2 1 1 9 6292 1 1 39 ARG HG3 H -0.316 -5.977 7.081 1.00 . A A . 39 ARG HG3 1 1 9 6293 1 1 39 ARG HH11 H -1.681 -2.947 10.036 1.00 . A A . 39 ARG HH11 1 1 9 6294 1 1 39 ARG HH12 H -0.703 -1.788 10.870 1.00 . A A . 39 ARG HH12 1 1 9 6295 1 1 39 ARG HH21 H 2.344 -3.307 10.017 1.00 . A A . 39 ARG HH21 1 1 9 6296 1 1 39 ARG HH22 H 1.595 -1.993 10.861 1.00 . A A . 39 ARG HH22 1 1 9 6297 1 1 39 ARG N N -4.385 -6.759 6.843 1.00 . A A . 39 ARG N 1 1 9 6298 1 1 39 ARG NE N 0.217 -4.395 9.233 1.00 . A A . 39 ARG NE 1 1 9 6299 1 1 39 ARG NH1 N -0.776 -2.620 10.322 1.00 . A A . 39 ARG NH1 1 1 9 6300 1 1 39 ARG NH2 N 1.514 -2.823 10.309 1.00 . A A . 39 ARG NH2 1 1 9 6301 1 1 39 ARG O O -1.365 -6.191 5.065 1.00 . A A . 39 ARG O 1 1 9 6302 1 1 40 ARG C C -2.556 -4.418 2.705 1.00 . A A . 40 ARG C 1 1 9 6303 1 1 40 ARG CA C -3.157 -5.790 2.995 1.00 . A A . 40 ARG CA 1 1 9 6304 1 1 40 ARG CB C -4.390 -5.996 2.114 1.00 . A A . 40 ARG CB 1 1 9 6305 1 1 40 ARG CD C -5.875 -7.600 0.880 1.00 . A A . 40 ARG CD 1 1 9 6306 1 1 40 ARG CG C -4.777 -7.451 1.925 1.00 . A A . 40 ARG CG 1 1 9 6307 1 1 40 ARG CZ C -5.414 -9.867 0.024 1.00 . A A . 40 ARG CZ 1 1 9 6308 1 1 40 ARG H H -4.431 -5.834 4.689 1.00 . A A . 40 ARG H 1 1 9 6309 1 1 40 ARG HA H -2.424 -6.548 2.760 1.00 . A A . 40 ARG HA 1 1 9 6310 1 1 40 ARG HB2 H -5.226 -5.481 2.563 1.00 . A A . 40 ARG HB2 1 1 9 6311 1 1 40 ARG HB3 H -4.198 -5.568 1.141 1.00 . A A . 40 ARG HB3 1 1 9 6312 1 1 40 ARG HD2 H -6.753 -7.073 1.218 1.00 . A A . 40 ARG HD2 1 1 9 6313 1 1 40 ARG HD3 H -5.529 -7.167 -0.048 1.00 . A A . 40 ARG HD3 1 1 9 6314 1 1 40 ARG HE H -7.079 -9.317 1.007 1.00 . A A . 40 ARG HE 1 1 9 6315 1 1 40 ARG HG2 H -3.909 -8.007 1.603 1.00 . A A . 40 ARG HG2 1 1 9 6316 1 1 40 ARG HG3 H -5.133 -7.845 2.866 1.00 . A A . 40 ARG HG3 1 1 9 6317 1 1 40 ARG HH11 H -4.042 -8.467 -0.486 1.00 . A A . 40 ARG HH11 1 1 9 6318 1 1 40 ARG HH12 H -3.680 -10.081 -0.994 1.00 . A A . 40 ARG HH12 1 1 9 6319 1 1 40 ARG HH21 H -6.600 -11.486 0.322 1.00 . A A . 40 ARG HH21 1 1 9 6320 1 1 40 ARG HH22 H -5.123 -11.797 -0.530 1.00 . A A . 40 ARG HH22 1 1 9 6321 1 1 40 ARG N N -3.493 -5.912 4.410 1.00 . A A . 40 ARG N 1 1 9 6322 1 1 40 ARG NE N -6.219 -9.002 0.648 1.00 . A A . 40 ARG NE 1 1 9 6323 1 1 40 ARG NH1 N -4.292 -9.437 -0.530 1.00 . A A . 40 ARG NH1 1 1 9 6324 1 1 40 ARG NH2 N -5.743 -11.152 -0.071 1.00 . A A . 40 ARG NH2 1 1 9 6325 1 1 40 ARG O O -2.796 -3.458 3.441 1.00 . A A . 40 ARG O 1 1 9 6326 1 1 41 CYS C C -2.156 -2.255 0.395 1.00 . A A . 41 CYS C 1 1 9 6327 1 1 41 CYS CA C -1.179 -3.069 1.234 1.00 . A A . 41 CYS CA 1 1 9 6328 1 1 41 CYS CB C 0.103 -3.332 0.444 1.00 . A A . 41 CYS CB 1 1 9 6329 1 1 41 CYS H H -1.647 -5.121 1.076 1.00 . A A . 41 CYS H 1 1 9 6330 1 1 41 CYS HA H -0.938 -2.516 2.129 1.00 . A A . 41 CYS HA 1 1 9 6331 1 1 41 CYS HB2 H 0.858 -3.707 1.118 1.00 . A A . 41 CYS HB2 1 1 9 6332 1 1 41 CYS HB3 H -0.098 -4.079 -0.310 1.00 . A A . 41 CYS HB3 1 1 9 6333 1 1 41 CYS N N -1.792 -4.327 1.630 1.00 . A A . 41 CYS N 1 1 9 6334 1 1 41 CYS O O -2.324 -2.509 -0.797 1.00 . A A . 41 CYS O 1 1 9 6335 1 1 41 CYS SG S 0.793 -1.871 -0.394 1.00 . A A . 41 CYS SG 1 1 9 6336 1 1 42 LEU C C -3.041 0.670 -0.419 1.00 . A A . 42 LEU C 1 1 9 6337 1 1 42 LEU CA C -3.761 -0.435 0.336 1.00 . A A . 42 LEU CA 1 1 9 6338 1 1 42 LEU CB C -4.748 0.188 1.334 1.00 . A A . 42 LEU CB 1 1 9 6339 1 1 42 LEU CD1 C -5.449 -1.986 2.405 1.00 . A A . 42 LEU CD1 1 1 9 6340 1 1 42 LEU CD2 C -6.810 0.072 2.750 1.00 . A A . 42 LEU CD2 1 1 9 6341 1 1 42 LEU CG C -5.927 -0.690 1.774 1.00 . A A . 42 LEU CG 1 1 9 6342 1 1 42 LEU H H -2.625 -1.131 1.978 1.00 . A A . 42 LEU H 1 1 9 6343 1 1 42 LEU HA H -4.301 -1.051 -0.372 1.00 . A A . 42 LEU HA 1 1 9 6344 1 1 42 LEU HB2 H -4.195 0.468 2.217 1.00 . A A . 42 LEU HB2 1 1 9 6345 1 1 42 LEU HB3 H -5.150 1.088 0.888 1.00 . A A . 42 LEU HB3 1 1 9 6346 1 1 42 LEU HD11 H -4.582 -2.348 1.873 1.00 . A A . 42 LEU HD11 1 1 9 6347 1 1 42 LEU HD12 H -6.237 -2.724 2.355 1.00 . A A . 42 LEU HD12 1 1 9 6348 1 1 42 LEU HD13 H -5.189 -1.808 3.438 1.00 . A A . 42 LEU HD13 1 1 9 6349 1 1 42 LEU HD21 H -7.836 0.036 2.413 1.00 . A A . 42 LEU HD21 1 1 9 6350 1 1 42 LEU HD22 H -6.484 1.100 2.803 1.00 . A A . 42 LEU HD22 1 1 9 6351 1 1 42 LEU HD23 H -6.738 -0.380 3.729 1.00 . A A . 42 LEU HD23 1 1 9 6352 1 1 42 LEU HG H -6.525 -0.941 0.910 1.00 . A A . 42 LEU HG 1 1 9 6353 1 1 42 LEU N N -2.801 -1.284 1.025 1.00 . A A . 42 LEU N 1 1 9 6354 1 1 42 LEU O O -2.309 1.462 0.174 1.00 . A A . 42 LEU O 1 1 9 6355 1 1 43 CYS C C -3.620 2.847 -2.878 1.00 . A A . 43 CYS C 1 1 9 6356 1 1 43 CYS CA C -2.625 1.750 -2.536 1.00 . A A . 43 CYS CA 1 1 9 6357 1 1 43 CYS CB C -2.064 1.127 -3.812 1.00 . A A . 43 CYS CB 1 1 9 6358 1 1 43 CYS H H -3.855 0.083 -2.145 1.00 . A A . 43 CYS H 1 1 9 6359 1 1 43 CYS HA H -1.813 2.178 -1.967 1.00 . A A . 43 CYS HA 1 1 9 6360 1 1 43 CYS HB2 H -2.876 0.724 -4.397 1.00 . A A . 43 CYS HB2 1 1 9 6361 1 1 43 CYS HB3 H -1.562 1.893 -4.385 1.00 . A A . 43 CYS HB3 1 1 9 6362 1 1 43 CYS N N -3.255 0.733 -1.719 1.00 . A A . 43 CYS N 1 1 9 6363 1 1 43 CYS O O -4.768 2.571 -3.226 1.00 . A A . 43 CYS O 1 1 9 6364 1 1 43 CYS SG S -0.871 -0.213 -3.516 1.00 . A A . 43 CYS SG 1 1 9 6365 1 1 44 THR C C -3.416 6.066 -4.188 1.00 . A A . 44 THR C 1 1 9 6366 1 1 44 THR CA C -4.027 5.224 -3.078 1.00 . A A . 44 THR CA 1 1 9 6367 1 1 44 THR CB C -4.259 6.100 -1.837 1.00 . A A . 44 THR CB 1 1 9 6368 1 1 44 THR CG2 C -5.616 5.810 -1.212 1.00 . A A . 44 THR CG2 1 1 9 6369 1 1 44 THR H H -2.251 4.246 -2.488 1.00 . A A . 44 THR H 1 1 9 6370 1 1 44 THR HA H -4.986 4.850 -3.411 1.00 . A A . 44 THR HA 1 1 9 6371 1 1 44 THR HB H -4.237 7.135 -2.145 1.00 . A A . 44 THR HB 1 1 9 6372 1 1 44 THR HG1 H -2.365 6.101 -1.265 1.00 . A A . 44 THR HG1 1 1 9 6373 1 1 44 THR HG21 H -5.781 6.480 -0.381 1.00 . A A . 44 THR HG21 1 1 9 6374 1 1 44 THR HG22 H -5.639 4.789 -0.860 1.00 . A A . 44 THR HG22 1 1 9 6375 1 1 44 THR HG23 H -6.391 5.953 -1.950 1.00 . A A . 44 THR HG23 1 1 9 6376 1 1 44 THR N N -3.180 4.086 -2.775 1.00 . A A . 44 THR N 1 1 9 6377 1 1 44 THR O O -2.200 6.266 -4.233 1.00 . A A . 44 THR O 1 1 9 6378 1 1 44 THR OG1 O -3.218 5.870 -0.874 1.00 . A A . 44 THR OG1 1 1 9 6379 1 1 45 LYS C C -5.007 8.165 -6.744 1.00 . A A . 45 LYS C 1 1 9 6380 1 1 45 LYS CA C -3.836 7.385 -6.188 1.00 . A A . 45 LYS CA 1 1 9 6381 1 1 45 LYS CB C -3.194 6.562 -7.320 1.00 . A A . 45 LYS CB 1 1 9 6382 1 1 45 LYS CD C -3.625 5.261 -9.444 1.00 . A A . 45 LYS CD 1 1 9 6383 1 1 45 LYS CE C -3.635 6.429 -10.422 1.00 . A A . 45 LYS CE 1 1 9 6384 1 1 45 LYS CG C -4.170 5.675 -8.080 1.00 . A A . 45 LYS CG 1 1 9 6385 1 1 45 LYS H H -5.226 6.358 -4.970 1.00 . A A . 45 LYS H 1 1 9 6386 1 1 45 LYS HA H -3.108 8.089 -5.812 1.00 . A A . 45 LYS HA 1 1 9 6387 1 1 45 LYS HB2 H -2.740 7.242 -8.026 1.00 . A A . 45 LYS HB2 1 1 9 6388 1 1 45 LYS HB3 H -2.424 5.934 -6.898 1.00 . A A . 45 LYS HB3 1 1 9 6389 1 1 45 LYS HD2 H -2.610 4.908 -9.328 1.00 . A A . 45 LYS HD2 1 1 9 6390 1 1 45 LYS HD3 H -4.242 4.467 -9.841 1.00 . A A . 45 LYS HD3 1 1 9 6391 1 1 45 LYS HE2 H -3.955 6.071 -11.388 1.00 . A A . 45 LYS HE2 1 1 9 6392 1 1 45 LYS HE3 H -4.344 7.162 -10.061 1.00 . A A . 45 LYS HE3 1 1 9 6393 1 1 45 LYS HG2 H -4.363 4.788 -7.498 1.00 . A A . 45 LYS HG2 1 1 9 6394 1 1 45 LYS HG3 H -5.092 6.219 -8.225 1.00 . A A . 45 LYS HG3 1 1 9 6395 1 1 45 LYS HZ1 H -2.089 7.260 -11.562 1.00 . A A . 45 LYS HZ1 1 1 9 6396 1 1 45 LYS HZ2 H -1.550 6.481 -10.163 1.00 . A A . 45 LYS HZ2 1 1 9 6397 1 1 45 LYS HZ3 H -2.296 8.005 -10.057 1.00 . A A . 45 LYS HZ3 1 1 9 6398 1 1 45 LYS N N -4.267 6.554 -5.075 1.00 . A A . 45 LYS N 1 1 9 6399 1 1 45 LYS NZ N -2.298 7.082 -10.561 1.00 . A A . 45 LYS NZ 1 1 9 6400 1 1 45 LYS O O -6.166 7.862 -6.455 1.00 . A A . 45 LYS O 1 1 9 6401 1 1 46 GLU C C -6.254 9.317 -9.413 1.00 . A A . 46 GLU C 1 1 9 6402 1 1 46 GLU CA C -5.670 10.008 -8.174 1.00 . A A . 46 GLU CA 1 1 9 6403 1 1 46 GLU CB C -5.031 11.364 -8.547 1.00 . A A . 46 GLU CB 1 1 9 6404 1 1 46 GLU CD C -2.739 10.422 -9.187 1.00 . A A . 46 GLU CD 1 1 9 6405 1 1 46 GLU CG C -3.907 11.303 -9.589 1.00 . A A . 46 GLU CG 1 1 9 6406 1 1 46 GLU H H -3.734 9.334 -7.717 1.00 . A A . 46 GLU H 1 1 9 6407 1 1 46 GLU HA H -6.466 10.180 -7.464 1.00 . A A . 46 GLU HA 1 1 9 6408 1 1 46 GLU HB2 H -5.801 12.011 -8.934 1.00 . A A . 46 GLU HB2 1 1 9 6409 1 1 46 GLU HB3 H -4.627 11.810 -7.649 1.00 . A A . 46 GLU HB3 1 1 9 6410 1 1 46 GLU HG2 H -4.316 10.918 -10.509 1.00 . A A . 46 GLU HG2 1 1 9 6411 1 1 46 GLU HG3 H -3.538 12.304 -9.756 1.00 . A A . 46 GLU HG3 1 1 9 6412 1 1 46 GLU N N -4.684 9.160 -7.540 1.00 . A A . 46 GLU N 1 1 9 6413 1 1 46 GLU O O -5.520 8.923 -10.322 1.00 . A A . 46 GLU O 1 1 9 6414 1 1 46 GLU OE1 O -2.163 10.638 -8.104 1.00 . A A . 46 GLU OE1 1 1 9 6415 1 1 46 GLU OE2 O -2.408 9.495 -9.948 1.00 . A A . 46 GLU OE2 1 1 9 6416 1 1 47 CYS C C -9.736 8.858 -10.498 1.00 . A A . 47 CYS C 1 1 9 6417 1 1 47 CYS CA C -8.243 8.569 -10.588 1.00 . A A . 47 CYS CA 1 1 9 6418 1 1 47 CYS CB C -7.958 7.054 -10.689 1.00 . A A . 47 CYS CB 1 1 9 6419 1 1 47 CYS H H -8.112 9.518 -8.711 1.00 . A A . 47 CYS H 1 1 9 6420 1 1 47 CYS HA H -7.861 9.048 -11.472 1.00 . A A . 47 CYS HA 1 1 9 6421 1 1 47 CYS HB2 H -7.948 6.776 -11.732 1.00 . A A . 47 CYS HB2 1 1 9 6422 1 1 47 CYS HB3 H -6.978 6.864 -10.274 1.00 . A A . 47 CYS HB3 1 1 9 6423 1 1 47 CYS N N -7.571 9.183 -9.453 1.00 . A A . 47 CYS N 1 1 9 6424 1 1 47 CYS O O -10.475 8.507 -11.437 1.00 . A A . 47 CYS O 1 1 9 6425 1 1 47 CYS OXT O -10.148 9.481 -9.487 1.00 . A A . 47 CYS OXT 1 1 9 6426 1 1 47 CYS SG S -9.134 5.930 -9.851 1.00 . A A . 47 CYS SG 1 1 10 6427 1 1 1 ALA C C -9.566 10.587 -7.204 1.00 . A A . 1 ALA C 1 1 10 6428 1 1 1 ALA CA C -10.681 11.124 -8.099 1.00 . A A . 1 ALA CA 1 1 10 6429 1 1 1 ALA CB C -10.592 12.640 -8.213 1.00 . A A . 1 ALA CB 1 1 10 6430 1 1 1 ALA H1 H -11.921 10.463 -6.570 1.00 . A A . 1 ALA H1 1 1 10 6431 1 1 1 ALA H2 H -12.371 9.918 -8.108 1.00 . A A . 1 ALA H2 1 1 10 6432 1 1 1 ALA H3 H -12.671 11.519 -7.657 1.00 . A A . 1 ALA H3 1 1 10 6433 1 1 1 ALA HA H -10.574 10.704 -9.088 1.00 . A A . 1 ALA HA 1 1 10 6434 1 1 1 ALA HB1 H -10.651 13.079 -7.228 1.00 . A A . 1 ALA HB1 1 1 10 6435 1 1 1 ALA HB2 H -11.408 13.004 -8.819 1.00 . A A . 1 ALA HB2 1 1 10 6436 1 1 1 ALA HB3 H -9.653 12.911 -8.673 1.00 . A A . 1 ALA HB3 1 1 10 6437 1 1 1 ALA N N -12.004 10.729 -7.571 1.00 . A A . 1 ALA N 1 1 10 6438 1 1 1 ALA O O -8.601 11.288 -6.901 1.00 . A A . 1 ALA O 1 1 10 6439 1 1 2 THR C C -8.743 7.199 -6.132 1.00 . A A . 2 THR C 1 1 10 6440 1 1 2 THR CA C -8.721 8.707 -5.913 1.00 . A A . 2 THR CA 1 1 10 6441 1 1 2 THR CB C -8.996 9.019 -4.427 1.00 . A A . 2 THR CB 1 1 10 6442 1 1 2 THR CG2 C -7.825 8.590 -3.555 1.00 . A A . 2 THR CG2 1 1 10 6443 1 1 2 THR H H -10.493 8.824 -7.043 1.00 . A A . 2 THR H 1 1 10 6444 1 1 2 THR HA H -7.746 9.092 -6.174 1.00 . A A . 2 THR HA 1 1 10 6445 1 1 2 THR HB H -9.877 8.475 -4.117 1.00 . A A . 2 THR HB 1 1 10 6446 1 1 2 THR HG1 H -8.647 10.917 -4.854 1.00 . A A . 2 THR HG1 1 1 10 6447 1 1 2 THR HG21 H -6.954 8.432 -4.174 1.00 . A A . 2 THR HG21 1 1 10 6448 1 1 2 THR HG22 H -8.074 7.673 -3.043 1.00 . A A . 2 THR HG22 1 1 10 6449 1 1 2 THR HG23 H -7.616 9.362 -2.829 1.00 . A A . 2 THR HG23 1 1 10 6450 1 1 2 THR N N -9.709 9.340 -6.773 1.00 . A A . 2 THR N 1 1 10 6451 1 1 2 THR O O -9.798 6.572 -6.036 1.00 . A A . 2 THR O 1 1 10 6452 1 1 2 THR OG1 O -9.228 10.425 -4.260 1.00 . A A . 2 THR OG1 1 1 10 6453 1 1 3 CYS C C -6.625 4.511 -5.650 1.00 . A A . 3 CYS C 1 1 10 6454 1 1 3 CYS CA C -7.500 5.198 -6.692 1.00 . A A . 3 CYS CA 1 1 10 6455 1 1 3 CYS CB C -6.964 4.947 -8.105 1.00 . A A . 3 CYS CB 1 1 10 6456 1 1 3 CYS H H -6.784 7.183 -6.522 1.00 . A A . 3 CYS H 1 1 10 6457 1 1 3 CYS HA H -8.497 4.791 -6.623 1.00 . A A . 3 CYS HA 1 1 10 6458 1 1 3 CYS HB2 H -6.126 5.607 -8.288 1.00 . A A . 3 CYS HB2 1 1 10 6459 1 1 3 CYS HB3 H -6.636 3.921 -8.183 1.00 . A A . 3 CYS HB3 1 1 10 6460 1 1 3 CYS N N -7.592 6.628 -6.443 1.00 . A A . 3 CYS N 1 1 10 6461 1 1 3 CYS O O -5.498 4.935 -5.390 1.00 . A A . 3 CYS O 1 1 10 6462 1 1 3 CYS SG S -8.189 5.246 -9.420 1.00 . A A . 3 CYS SG 1 1 10 6463 1 1 4 LYS C C -6.301 1.237 -4.507 1.00 . A A . 4 LYS C 1 1 10 6464 1 1 4 LYS CA C -6.463 2.677 -4.037 1.00 . A A . 4 LYS CA 1 1 10 6465 1 1 4 LYS CB C -7.262 2.723 -2.718 1.00 . A A . 4 LYS CB 1 1 10 6466 1 1 4 LYS CD C -6.404 0.649 -1.504 1.00 . A A . 4 LYS CD 1 1 10 6467 1 1 4 LYS CE C -7.756 -0.047 -1.594 1.00 . A A . 4 LYS CE 1 1 10 6468 1 1 4 LYS CG C -6.536 2.171 -1.486 1.00 . A A . 4 LYS CG 1 1 10 6469 1 1 4 LYS H H -8.066 3.172 -5.319 1.00 . A A . 4 LYS H 1 1 10 6470 1 1 4 LYS HA H -5.485 3.114 -3.883 1.00 . A A . 4 LYS HA 1 1 10 6471 1 1 4 LYS HB2 H -7.524 3.750 -2.514 1.00 . A A . 4 LYS HB2 1 1 10 6472 1 1 4 LYS HB3 H -8.172 2.156 -2.852 1.00 . A A . 4 LYS HB3 1 1 10 6473 1 1 4 LYS HD2 H -5.810 0.362 -2.359 1.00 . A A . 4 LYS HD2 1 1 10 6474 1 1 4 LYS HD3 H -5.907 0.332 -0.599 1.00 . A A . 4 LYS HD3 1 1 10 6475 1 1 4 LYS HE2 H -8.289 0.109 -0.668 1.00 . A A . 4 LYS HE2 1 1 10 6476 1 1 4 LYS HE3 H -8.317 0.387 -2.409 1.00 . A A . 4 LYS HE3 1 1 10 6477 1 1 4 LYS HG2 H -5.547 2.600 -1.446 1.00 . A A . 4 LYS HG2 1 1 10 6478 1 1 4 LYS HG3 H -7.087 2.462 -0.603 1.00 . A A . 4 LYS HG3 1 1 10 6479 1 1 4 LYS HZ1 H -7.503 -1.705 -2.845 1.00 . A A . 4 LYS HZ1 1 1 10 6480 1 1 4 LYS HZ2 H -8.449 -2.018 -1.482 1.00 . A A . 4 LYS HZ2 1 1 10 6481 1 1 4 LYS HZ3 H -6.767 -1.879 -1.328 1.00 . A A . 4 LYS HZ3 1 1 10 6482 1 1 4 LYS N N -7.163 3.448 -5.059 1.00 . A A . 4 LYS N 1 1 10 6483 1 1 4 LYS NZ N -7.613 -1.512 -1.830 1.00 . A A . 4 LYS NZ 1 1 10 6484 1 1 4 LYS O O -7.252 0.628 -4.999 1.00 . A A . 4 LYS O 1 1 10 6485 1 1 5 ALA C C -3.544 -1.139 -4.023 1.00 . A A . 5 ALA C 1 1 10 6486 1 1 5 ALA CA C -4.814 -0.678 -4.711 1.00 . A A . 5 ALA CA 1 1 10 6487 1 1 5 ALA CB C -4.670 -0.798 -6.223 1.00 . A A . 5 ALA CB 1 1 10 6488 1 1 5 ALA H H -4.394 1.236 -3.908 1.00 . A A . 5 ALA H 1 1 10 6489 1 1 5 ALA HA H -5.638 -1.301 -4.394 1.00 . A A . 5 ALA HA 1 1 10 6490 1 1 5 ALA HB1 H -3.655 -0.565 -6.507 1.00 . A A . 5 ALA HB1 1 1 10 6491 1 1 5 ALA HB2 H -5.346 -0.107 -6.705 1.00 . A A . 5 ALA HB2 1 1 10 6492 1 1 5 ALA HB3 H -4.908 -1.806 -6.528 1.00 . A A . 5 ALA HB3 1 1 10 6493 1 1 5 ALA N N -5.108 0.695 -4.329 1.00 . A A . 5 ALA N 1 1 10 6494 1 1 5 ALA O O -2.569 -0.394 -3.963 1.00 . A A . 5 ALA O 1 1 10 6495 1 1 6 GLU C C -1.275 -3.087 -3.816 1.00 . A A . 6 GLU C 1 1 10 6496 1 1 6 GLU CA C -2.396 -2.892 -2.810 1.00 . A A . 6 GLU CA 1 1 10 6497 1 1 6 GLU CB C -2.706 -4.229 -2.110 1.00 . A A . 6 GLU CB 1 1 10 6498 1 1 6 GLU CD C -5.086 -3.546 -1.451 1.00 . A A . 6 GLU CD 1 1 10 6499 1 1 6 GLU CG C -3.767 -4.161 -1.009 1.00 . A A . 6 GLU CG 1 1 10 6500 1 1 6 GLU H H -4.367 -2.904 -3.562 1.00 . A A . 6 GLU H 1 1 10 6501 1 1 6 GLU HA H -2.080 -2.169 -2.072 1.00 . A A . 6 GLU HA 1 1 10 6502 1 1 6 GLU HB2 H -3.025 -4.946 -2.845 1.00 . A A . 6 GLU HB2 1 1 10 6503 1 1 6 GLU HB3 H -1.791 -4.591 -1.662 1.00 . A A . 6 GLU HB3 1 1 10 6504 1 1 6 GLU HG2 H -3.963 -5.164 -0.661 1.00 . A A . 6 GLU HG2 1 1 10 6505 1 1 6 GLU HG3 H -3.373 -3.575 -0.191 1.00 . A A . 6 GLU HG3 1 1 10 6506 1 1 6 GLU N N -3.557 -2.353 -3.494 1.00 . A A . 6 GLU N 1 1 10 6507 1 1 6 GLU O O -1.521 -3.512 -4.946 1.00 . A A . 6 GLU O 1 1 10 6508 1 1 6 GLU OE1 O -5.627 -3.953 -2.496 1.00 . A A . 6 GLU OE1 1 1 10 6509 1 1 6 GLU OE2 O -5.587 -2.645 -0.750 1.00 . A A . 6 GLU OE2 1 1 10 6510 1 1 7 CYS C C 1.190 -4.308 -4.833 1.00 . A A . 7 CYS C 1 1 10 6511 1 1 7 CYS CA C 1.097 -2.885 -4.286 1.00 . A A . 7 CYS CA 1 1 10 6512 1 1 7 CYS CB C 2.385 -2.523 -3.537 1.00 . A A . 7 CYS CB 1 1 10 6513 1 1 7 CYS H H 0.054 -2.407 -2.500 1.00 . A A . 7 CYS H 1 1 10 6514 1 1 7 CYS HA H 0.966 -2.202 -5.113 1.00 . A A . 7 CYS HA 1 1 10 6515 1 1 7 CYS HB2 H 2.276 -1.541 -3.101 1.00 . A A . 7 CYS HB2 1 1 10 6516 1 1 7 CYS HB3 H 2.549 -3.244 -2.749 1.00 . A A . 7 CYS HB3 1 1 10 6517 1 1 7 CYS N N -0.061 -2.756 -3.410 1.00 . A A . 7 CYS N 1 1 10 6518 1 1 7 CYS O O 1.223 -5.271 -4.066 1.00 . A A . 7 CYS O 1 1 10 6519 1 1 7 CYS SG S 3.879 -2.499 -4.588 1.00 . A A . 7 CYS SG 1 1 10 6520 1 1 8 PRO C C 2.494 -6.565 -6.362 1.00 . A A . 8 PRO C 1 1 10 6521 1 1 8 PRO CA C 1.285 -5.766 -6.826 1.00 . A A . 8 PRO CA 1 1 10 6522 1 1 8 PRO CB C 1.399 -5.430 -8.321 1.00 . A A . 8 PRO CB 1 1 10 6523 1 1 8 PRO CD C 1.153 -3.361 -7.148 1.00 . A A . 8 PRO CD 1 1 10 6524 1 1 8 PRO CG C 1.745 -3.979 -8.380 1.00 . A A . 8 PRO CG 1 1 10 6525 1 1 8 PRO HA H 0.388 -6.343 -6.651 1.00 . A A . 8 PRO HA 1 1 10 6526 1 1 8 PRO HB2 H 2.172 -6.037 -8.769 1.00 . A A . 8 PRO HB2 1 1 10 6527 1 1 8 PRO HB3 H 0.455 -5.628 -8.808 1.00 . A A . 8 PRO HB3 1 1 10 6528 1 1 8 PRO HD2 H 1.748 -2.519 -6.823 1.00 . A A . 8 PRO HD2 1 1 10 6529 1 1 8 PRO HD3 H 0.132 -3.059 -7.327 1.00 . A A . 8 PRO HD3 1 1 10 6530 1 1 8 PRO HG2 H 2.818 -3.858 -8.382 1.00 . A A . 8 PRO HG2 1 1 10 6531 1 1 8 PRO HG3 H 1.315 -3.535 -9.266 1.00 . A A . 8 PRO HG3 1 1 10 6532 1 1 8 PRO N N 1.213 -4.456 -6.171 1.00 . A A . 8 PRO N 1 1 10 6533 1 1 8 PRO O O 2.405 -7.762 -6.104 1.00 . A A . 8 PRO O 1 1 10 6534 1 1 9 THR C C 4.918 -6.498 -4.257 1.00 . A A . 9 THR C 1 1 10 6535 1 1 9 THR CA C 4.847 -6.512 -5.782 1.00 . A A . 9 THR CA 1 1 10 6536 1 1 9 THR CB C 6.080 -5.791 -6.360 1.00 . A A . 9 THR CB 1 1 10 6537 1 1 9 THR CG2 C 6.185 -6.013 -7.862 1.00 . A A . 9 THR CG2 1 1 10 6538 1 1 9 THR H H 3.622 -4.927 -6.441 1.00 . A A . 9 THR H 1 1 10 6539 1 1 9 THR HA H 4.851 -7.535 -6.129 1.00 . A A . 9 THR HA 1 1 10 6540 1 1 9 THR HB H 6.966 -6.191 -5.889 1.00 . A A . 9 THR HB 1 1 10 6541 1 1 9 THR HG1 H 5.345 -4.233 -5.385 1.00 . A A . 9 THR HG1 1 1 10 6542 1 1 9 THR HG21 H 6.654 -6.967 -8.053 1.00 . A A . 9 THR HG21 1 1 10 6543 1 1 9 THR HG22 H 6.778 -5.225 -8.301 1.00 . A A . 9 THR HG22 1 1 10 6544 1 1 9 THR HG23 H 5.196 -6.004 -8.297 1.00 . A A . 9 THR HG23 1 1 10 6545 1 1 9 THR N N 3.621 -5.883 -6.237 1.00 . A A . 9 THR N 1 1 10 6546 1 1 9 THR O O 5.954 -6.167 -3.680 1.00 . A A . 9 THR O 1 1 10 6547 1 1 9 THR OG1 O 5.998 -4.383 -6.085 1.00 . A A . 9 THR OG1 1 1 10 6548 1 1 10 TRP C C 2.810 -7.898 -1.632 1.00 . A A . 10 TRP C 1 1 10 6549 1 1 10 TRP CA C 3.759 -6.832 -2.159 1.00 . A A . 10 TRP CA 1 1 10 6550 1 1 10 TRP CB C 3.298 -5.465 -1.650 1.00 . A A . 10 TRP CB 1 1 10 6551 1 1 10 TRP CD1 C 2.535 -5.714 0.782 1.00 . A A . 10 TRP CD1 1 1 10 6552 1 1 10 TRP CD2 C 4.516 -4.703 0.525 1.00 . A A . 10 TRP CD2 1 1 10 6553 1 1 10 TRP CE2 C 4.237 -4.785 1.901 1.00 . A A . 10 TRP CE2 1 1 10 6554 1 1 10 TRP CE3 C 5.705 -4.100 0.111 1.00 . A A . 10 TRP CE3 1 1 10 6555 1 1 10 TRP CG C 3.430 -5.317 -0.169 1.00 . A A . 10 TRP CG 1 1 10 6556 1 1 10 TRP CH2 C 6.264 -3.694 2.428 1.00 . A A . 10 TRP CH2 1 1 10 6557 1 1 10 TRP CZ2 C 5.112 -4.281 2.865 1.00 . A A . 10 TRP CZ2 1 1 10 6558 1 1 10 TRP CZ3 C 6.563 -3.600 1.066 1.00 . A A . 10 TRP CZ3 1 1 10 6559 1 1 10 TRP H H 3.003 -7.076 -4.118 1.00 . A A . 10 TRP H 1 1 10 6560 1 1 10 TRP HA H 4.752 -7.029 -1.787 1.00 . A A . 10 TRP HA 1 1 10 6561 1 1 10 TRP HB2 H 3.892 -4.694 -2.118 1.00 . A A . 10 TRP HB2 1 1 10 6562 1 1 10 TRP HB3 H 2.260 -5.322 -1.910 1.00 . A A . 10 TRP HB3 1 1 10 6563 1 1 10 TRP HD1 H 1.591 -6.206 0.564 1.00 . A A . 10 TRP HD1 1 1 10 6564 1 1 10 TRP HE1 H 2.572 -5.617 2.889 1.00 . A A . 10 TRP HE1 1 1 10 6565 1 1 10 TRP HE3 H 5.954 -4.018 -0.936 1.00 . A A . 10 TRP HE3 1 1 10 6566 1 1 10 TRP HH2 H 6.966 -3.286 3.139 1.00 . A A . 10 TRP HH2 1 1 10 6567 1 1 10 TRP HZ2 H 4.905 -4.341 3.920 1.00 . A A . 10 TRP HZ2 1 1 10 6568 1 1 10 TRP HZ3 H 7.481 -3.120 0.763 1.00 . A A . 10 TRP HZ3 1 1 10 6569 1 1 10 TRP N N 3.810 -6.834 -3.609 1.00 . A A . 10 TRP N 1 1 10 6570 1 1 10 TRP NE1 N 3.021 -5.415 2.036 1.00 . A A . 10 TRP NE1 1 1 10 6571 1 1 10 TRP O O 1.614 -7.888 -1.929 1.00 . A A . 10 TRP O 1 1 10 6572 1 1 11 ASP C C 3.180 -10.214 1.132 1.00 . A A . 11 ASP C 1 1 10 6573 1 1 11 ASP CA C 2.555 -9.840 -0.202 1.00 . A A . 11 ASP CA 1 1 10 6574 1 1 11 ASP CB C 2.443 -11.061 -1.116 1.00 . A A . 11 ASP CB 1 1 10 6575 1 1 11 ASP CG C 1.151 -11.819 -0.877 1.00 . A A . 11 ASP CG 1 1 10 6576 1 1 11 ASP H H 4.298 -8.720 -0.597 1.00 . A A . 11 ASP H 1 1 10 6577 1 1 11 ASP HA H 1.566 -9.443 -0.020 1.00 . A A . 11 ASP HA 1 1 10 6578 1 1 11 ASP HB2 H 2.469 -10.739 -2.147 1.00 . A A . 11 ASP HB2 1 1 10 6579 1 1 11 ASP HB3 H 3.273 -11.726 -0.926 1.00 . A A . 11 ASP HB3 1 1 10 6580 1 1 11 ASP N N 3.346 -8.786 -0.815 1.00 . A A . 11 ASP N 1 1 10 6581 1 1 11 ASP O O 3.716 -11.307 1.308 1.00 . A A . 11 ASP O 1 1 10 6582 1 1 11 ASP OD1 O 0.978 -12.388 0.215 1.00 . A A . 11 ASP OD1 1 1 10 6583 1 1 11 ASP OD2 O 0.278 -11.800 -1.770 1.00 . A A . 11 ASP OD2 1 1 10 6584 1 1 12 SER C C 3.127 -8.443 4.353 1.00 . A A . 12 SER C 1 1 10 6585 1 1 12 SER CA C 3.705 -9.469 3.382 1.00 . A A . 12 SER CA 1 1 10 6586 1 1 12 SER CB C 5.234 -9.351 3.317 1.00 . A A . 12 SER CB 1 1 10 6587 1 1 12 SER H H 2.713 -8.416 1.854 1.00 . A A . 12 SER H 1 1 10 6588 1 1 12 SER HA H 3.439 -10.460 3.718 1.00 . A A . 12 SER HA 1 1 10 6589 1 1 12 SER HB2 H 5.602 -9.935 2.487 1.00 . A A . 12 SER HB2 1 1 10 6590 1 1 12 SER HB3 H 5.505 -8.315 3.176 1.00 . A A . 12 SER HB3 1 1 10 6591 1 1 12 SER HG H 6.266 -10.669 4.336 1.00 . A A . 12 SER HG 1 1 10 6592 1 1 12 SER N N 3.134 -9.273 2.064 1.00 . A A . 12 SER N 1 1 10 6593 1 1 12 SER O O 2.302 -7.606 3.967 1.00 . A A . 12 SER O 1 1 10 6594 1 1 12 SER OG O 5.841 -9.824 4.509 1.00 . A A . 12 SER OG 1 1 10 6595 1 1 13 VAL C C 3.771 -6.248 6.543 1.00 . A A . 13 VAL C 1 1 10 6596 1 1 13 VAL CA C 3.082 -7.607 6.637 1.00 . A A . 13 VAL CA 1 1 10 6597 1 1 13 VAL CB C 3.316 -8.200 8.045 1.00 . A A . 13 VAL CB 1 1 10 6598 1 1 13 VAL CG1 C 2.816 -7.256 9.129 1.00 . A A . 13 VAL CG1 1 1 10 6599 1 1 13 VAL CG2 C 2.645 -9.560 8.169 1.00 . A A . 13 VAL CG2 1 1 10 6600 1 1 13 VAL H H 4.215 -9.203 5.840 1.00 . A A . 13 VAL H 1 1 10 6601 1 1 13 VAL HA H 2.020 -7.471 6.499 1.00 . A A . 13 VAL HA 1 1 10 6602 1 1 13 VAL HB H 4.379 -8.336 8.183 1.00 . A A . 13 VAL HB 1 1 10 6603 1 1 13 VAL HG11 H 2.847 -7.757 10.085 1.00 . A A . 13 VAL HG11 1 1 10 6604 1 1 13 VAL HG12 H 1.800 -6.962 8.909 1.00 . A A . 13 VAL HG12 1 1 10 6605 1 1 13 VAL HG13 H 3.445 -6.379 9.161 1.00 . A A . 13 VAL HG13 1 1 10 6606 1 1 13 VAL HG21 H 2.353 -9.908 7.189 1.00 . A A . 13 VAL HG21 1 1 10 6607 1 1 13 VAL HG22 H 1.770 -9.474 8.796 1.00 . A A . 13 VAL HG22 1 1 10 6608 1 1 13 VAL HG23 H 3.336 -10.264 8.610 1.00 . A A . 13 VAL HG23 1 1 10 6609 1 1 13 VAL N N 3.557 -8.514 5.604 1.00 . A A . 13 VAL N 1 1 10 6610 1 1 13 VAL O O 4.987 -6.137 6.698 1.00 . A A . 13 VAL O 1 1 10 6611 1 1 14 CYS C C 3.701 -3.283 7.593 1.00 . A A . 14 CYS C 1 1 10 6612 1 1 14 CYS CA C 3.491 -3.861 6.197 1.00 . A A . 14 CYS CA 1 1 10 6613 1 1 14 CYS CB C 2.505 -2.997 5.403 1.00 . A A . 14 CYS CB 1 1 10 6614 1 1 14 CYS H H 2.015 -5.371 6.190 1.00 . A A . 14 CYS H 1 1 10 6615 1 1 14 CYS HA H 4.437 -3.893 5.678 1.00 . A A . 14 CYS HA 1 1 10 6616 1 1 14 CYS HB2 H 2.298 -3.480 4.461 1.00 . A A . 14 CYS HB2 1 1 10 6617 1 1 14 CYS HB3 H 1.584 -2.915 5.964 1.00 . A A . 14 CYS HB3 1 1 10 6618 1 1 14 CYS N N 2.978 -5.217 6.298 1.00 . A A . 14 CYS N 1 1 10 6619 1 1 14 CYS O O 2.739 -2.956 8.292 1.00 . A A . 14 CYS O 1 1 10 6620 1 1 14 CYS SG S 3.076 -1.306 5.034 1.00 . A A . 14 CYS SG 1 1 10 6621 1 1 15 ILE C C 5.664 -1.171 9.220 1.00 . A A . 15 ILE C 1 1 10 6622 1 1 15 ILE CA C 5.264 -2.637 9.324 1.00 . A A . 15 ILE CA 1 1 10 6623 1 1 15 ILE CB C 6.399 -3.437 10.002 1.00 . A A . 15 ILE CB 1 1 10 6624 1 1 15 ILE CD1 C 7.130 -5.800 10.634 1.00 . A A . 15 ILE CD1 1 1 10 6625 1 1 15 ILE CG1 C 6.031 -4.923 10.070 1.00 . A A . 15 ILE CG1 1 1 10 6626 1 1 15 ILE CG2 C 6.678 -2.890 11.397 1.00 . A A . 15 ILE CG2 1 1 10 6627 1 1 15 ILE H H 5.679 -3.455 7.417 1.00 . A A . 15 ILE H 1 1 10 6628 1 1 15 ILE HA H 4.376 -2.717 9.936 1.00 . A A . 15 ILE HA 1 1 10 6629 1 1 15 ILE HB H 7.294 -3.321 9.410 1.00 . A A . 15 ILE HB 1 1 10 6630 1 1 15 ILE HD11 H 8.040 -5.641 10.074 1.00 . A A . 15 ILE HD11 1 1 10 6631 1 1 15 ILE HD12 H 6.837 -6.837 10.559 1.00 . A A . 15 ILE HD12 1 1 10 6632 1 1 15 ILE HD13 H 7.296 -5.547 11.671 1.00 . A A . 15 ILE HD13 1 1 10 6633 1 1 15 ILE HG12 H 5.160 -5.043 10.697 1.00 . A A . 15 ILE HG12 1 1 10 6634 1 1 15 ILE HG13 H 5.802 -5.276 9.075 1.00 . A A . 15 ILE HG13 1 1 10 6635 1 1 15 ILE HG21 H 6.381 -1.852 11.442 1.00 . A A . 15 ILE HG21 1 1 10 6636 1 1 15 ILE HG22 H 7.733 -2.972 11.611 1.00 . A A . 15 ILE HG22 1 1 10 6637 1 1 15 ILE HG23 H 6.117 -3.457 12.125 1.00 . A A . 15 ILE HG23 1 1 10 6638 1 1 15 ILE N N 4.951 -3.170 8.006 1.00 . A A . 15 ILE N 1 1 10 6639 1 1 15 ILE O O 5.044 -0.298 9.829 1.00 . A A . 15 ILE O 1 1 10 6640 1 1 16 ASN C C 6.555 1.019 6.952 1.00 . A A . 16 ASN C 1 1 10 6641 1 1 16 ASN CA C 7.172 0.448 8.225 1.00 . A A . 16 ASN CA 1 1 10 6642 1 1 16 ASN CB C 8.704 0.468 8.143 1.00 . A A . 16 ASN CB 1 1 10 6643 1 1 16 ASN CG C 9.293 1.862 8.304 1.00 . A A . 16 ASN CG 1 1 10 6644 1 1 16 ASN H H 7.132 -1.645 7.961 1.00 . A A . 16 ASN H 1 1 10 6645 1 1 16 ASN HA H 6.853 1.045 9.067 1.00 . A A . 16 ASN HA 1 1 10 6646 1 1 16 ASN HB2 H 9.106 -0.161 8.922 1.00 . A A . 16 ASN HB2 1 1 10 6647 1 1 16 ASN HB3 H 9.009 0.079 7.182 1.00 . A A . 16 ASN HB3 1 1 10 6648 1 1 16 ASN HD21 H 10.351 1.259 9.874 1.00 . A A . 16 ASN HD21 1 1 10 6649 1 1 16 ASN HD22 H 10.549 2.916 9.424 1.00 . A A . 16 ASN HD22 1 1 10 6650 1 1 16 ASN N N 6.693 -0.909 8.430 1.00 . A A . 16 ASN N 1 1 10 6651 1 1 16 ASN ND2 N 10.148 2.030 9.302 1.00 . A A . 16 ASN ND2 1 1 10 6652 1 1 16 ASN O O 6.301 0.286 5.997 1.00 . A A . 16 ASN O 1 1 10 6653 1 1 16 ASN OD1 O 8.988 2.779 7.541 1.00 . A A . 16 ASN OD1 1 1 10 6654 1 1 17 LYS C C 6.673 3.054 4.613 1.00 . A A . 17 LYS C 1 1 10 6655 1 1 17 LYS CA C 5.708 2.986 5.798 1.00 . A A . 17 LYS CA 1 1 10 6656 1 1 17 LYS CB C 5.246 4.396 6.173 1.00 . A A . 17 LYS CB 1 1 10 6657 1 1 17 LYS CD C 3.588 5.825 7.421 1.00 . A A . 17 LYS CD 1 1 10 6658 1 1 17 LYS CE C 4.631 6.741 8.048 1.00 . A A . 17 LYS CE 1 1 10 6659 1 1 17 LYS CG C 4.125 4.417 7.202 1.00 . A A . 17 LYS CG 1 1 10 6660 1 1 17 LYS H H 6.526 2.845 7.742 1.00 . A A . 17 LYS H 1 1 10 6661 1 1 17 LYS HA H 4.846 2.409 5.501 1.00 . A A . 17 LYS HA 1 1 10 6662 1 1 17 LYS HB2 H 6.085 4.942 6.577 1.00 . A A . 17 LYS HB2 1 1 10 6663 1 1 17 LYS HB3 H 4.896 4.897 5.282 1.00 . A A . 17 LYS HB3 1 1 10 6664 1 1 17 LYS HD2 H 3.292 6.237 6.468 1.00 . A A . 17 LYS HD2 1 1 10 6665 1 1 17 LYS HD3 H 2.730 5.773 8.074 1.00 . A A . 17 LYS HD3 1 1 10 6666 1 1 17 LYS HE2 H 5.520 6.723 7.436 1.00 . A A . 17 LYS HE2 1 1 10 6667 1 1 17 LYS HE3 H 4.236 7.746 8.078 1.00 . A A . 17 LYS HE3 1 1 10 6668 1 1 17 LYS HG2 H 3.320 3.787 6.856 1.00 . A A . 17 LYS HG2 1 1 10 6669 1 1 17 LYS HG3 H 4.504 4.036 8.140 1.00 . A A . 17 LYS HG3 1 1 10 6670 1 1 17 LYS HZ1 H 4.548 5.399 9.647 1.00 . A A . 17 LYS HZ1 1 1 10 6671 1 1 17 LYS HZ2 H 4.648 7.021 10.118 1.00 . A A . 17 LYS HZ2 1 1 10 6672 1 1 17 LYS HZ3 H 6.018 6.228 9.523 1.00 . A A . 17 LYS HZ3 1 1 10 6673 1 1 17 LYS N N 6.305 2.320 6.949 1.00 . A A . 17 LYS N 1 1 10 6674 1 1 17 LYS NZ N 4.987 6.317 9.431 1.00 . A A . 17 LYS NZ 1 1 10 6675 1 1 17 LYS O O 6.243 2.993 3.465 1.00 . A A . 17 LYS O 1 1 10 6676 1 1 18 LYS C C 8.853 2.134 2.829 1.00 . A A . 18 LYS C 1 1 10 6677 1 1 18 LYS CA C 8.992 3.281 3.846 1.00 . A A . 18 LYS CA 1 1 10 6678 1 1 18 LYS CB C 10.402 3.312 4.467 1.00 . A A . 18 LYS CB 1 1 10 6679 1 1 18 LYS CD C 11.927 2.791 2.511 1.00 . A A . 18 LYS CD 1 1 10 6680 1 1 18 LYS CE C 12.996 3.338 1.579 1.00 . A A . 18 LYS CE 1 1 10 6681 1 1 18 LYS CG C 11.496 3.830 3.536 1.00 . A A . 18 LYS CG 1 1 10 6682 1 1 18 LYS H H 8.251 3.237 5.839 1.00 . A A . 18 LYS H 1 1 10 6683 1 1 18 LYS HA H 8.828 4.213 3.324 1.00 . A A . 18 LYS HA 1 1 10 6684 1 1 18 LYS HB2 H 10.380 3.945 5.341 1.00 . A A . 18 LYS HB2 1 1 10 6685 1 1 18 LYS HB3 H 10.666 2.310 4.771 1.00 . A A . 18 LYS HB3 1 1 10 6686 1 1 18 LYS HD2 H 12.321 1.930 3.029 1.00 . A A . 18 LYS HD2 1 1 10 6687 1 1 18 LYS HD3 H 11.067 2.499 1.926 1.00 . A A . 18 LYS HD3 1 1 10 6688 1 1 18 LYS HE2 H 12.603 4.205 1.070 1.00 . A A . 18 LYS HE2 1 1 10 6689 1 1 18 LYS HE3 H 13.855 3.625 2.167 1.00 . A A . 18 LYS HE3 1 1 10 6690 1 1 18 LYS HG2 H 11.124 4.698 3.013 1.00 . A A . 18 LYS HG2 1 1 10 6691 1 1 18 LYS HG3 H 12.353 4.111 4.131 1.00 . A A . 18 LYS HG3 1 1 10 6692 1 1 18 LYS HZ1 H 13.092 1.384 0.843 1.00 . A A . 18 LYS HZ1 1 1 10 6693 1 1 18 LYS HZ2 H 14.455 2.319 0.484 1.00 . A A . 18 LYS HZ2 1 1 10 6694 1 1 18 LYS HZ3 H 13.012 2.568 -0.363 1.00 . A A . 18 LYS HZ3 1 1 10 6695 1 1 18 LYS N N 7.972 3.190 4.898 1.00 . A A . 18 LYS N 1 1 10 6696 1 1 18 LYS NZ N 13.418 2.332 0.565 1.00 . A A . 18 LYS NZ 1 1 10 6697 1 1 18 LYS O O 8.711 2.395 1.633 1.00 . A A . 18 LYS O 1 1 10 6698 1 1 19 PRO C C 7.502 -0.196 1.486 1.00 . A A . 19 PRO C 1 1 10 6699 1 1 19 PRO CA C 8.742 -0.302 2.369 1.00 . A A . 19 PRO CA 1 1 10 6700 1 1 19 PRO CB C 8.579 -1.478 3.337 1.00 . A A . 19 PRO CB 1 1 10 6701 1 1 19 PRO CD C 9.064 0.414 4.673 1.00 . A A . 19 PRO CD 1 1 10 6702 1 1 19 PRO CG C 9.327 -1.058 4.545 1.00 . A A . 19 PRO CG 1 1 10 6703 1 1 19 PRO HA H 9.619 -0.447 1.757 1.00 . A A . 19 PRO HA 1 1 10 6704 1 1 19 PRO HB2 H 7.530 -1.621 3.554 1.00 . A A . 19 PRO HB2 1 1 10 6705 1 1 19 PRO HB3 H 8.986 -2.379 2.905 1.00 . A A . 19 PRO HB3 1 1 10 6706 1 1 19 PRO HD2 H 8.168 0.588 5.250 1.00 . A A . 19 PRO HD2 1 1 10 6707 1 1 19 PRO HD3 H 9.909 0.911 5.125 1.00 . A A . 19 PRO HD3 1 1 10 6708 1 1 19 PRO HG2 H 8.957 -1.586 5.412 1.00 . A A . 19 PRO HG2 1 1 10 6709 1 1 19 PRO HG3 H 10.383 -1.241 4.410 1.00 . A A . 19 PRO HG3 1 1 10 6710 1 1 19 PRO N N 8.884 0.852 3.272 1.00 . A A . 19 PRO N 1 1 10 6711 1 1 19 PRO O O 7.551 -0.475 0.285 1.00 . A A . 19 PRO O 1 1 10 6712 1 1 20 CYS C C 5.189 1.448 0.349 1.00 . A A . 20 CYS C 1 1 10 6713 1 1 20 CYS CA C 5.130 0.338 1.398 1.00 . A A . 20 CYS CA 1 1 10 6714 1 1 20 CYS CB C 4.010 0.616 2.402 1.00 . A A . 20 CYS CB 1 1 10 6715 1 1 20 CYS H H 6.432 0.406 3.058 1.00 . A A . 20 CYS H 1 1 10 6716 1 1 20 CYS HA H 4.931 -0.602 0.901 1.00 . A A . 20 CYS HA 1 1 10 6717 1 1 20 CYS HB2 H 4.041 -0.132 3.180 1.00 . A A . 20 CYS HB2 1 1 10 6718 1 1 20 CYS HB3 H 4.167 1.590 2.843 1.00 . A A . 20 CYS HB3 1 1 10 6719 1 1 20 CYS N N 6.396 0.203 2.099 1.00 . A A . 20 CYS N 1 1 10 6720 1 1 20 CYS O O 4.927 1.204 -0.830 1.00 . A A . 20 CYS O 1 1 10 6721 1 1 20 CYS SG S 2.336 0.596 1.688 1.00 . A A . 20 CYS SG 1 1 10 6722 1 1 21 VAL C C 6.560 3.464 -1.310 1.00 . A A . 21 VAL C 1 1 10 6723 1 1 21 VAL CA C 5.647 3.800 -0.135 1.00 . A A . 21 VAL CA 1 1 10 6724 1 1 21 VAL CB C 6.184 5.060 0.584 1.00 . A A . 21 VAL CB 1 1 10 6725 1 1 21 VAL CG1 C 6.315 6.225 -0.387 1.00 . A A . 21 VAL CG1 1 1 10 6726 1 1 21 VAL CG2 C 5.281 5.441 1.747 1.00 . A A . 21 VAL CG2 1 1 10 6727 1 1 21 VAL H H 5.756 2.789 1.729 1.00 . A A . 21 VAL H 1 1 10 6728 1 1 21 VAL HA H 4.651 4.021 -0.515 1.00 . A A . 21 VAL HA 1 1 10 6729 1 1 21 VAL HB H 7.165 4.835 0.976 1.00 . A A . 21 VAL HB 1 1 10 6730 1 1 21 VAL HG11 H 7.234 6.758 -0.187 1.00 . A A . 21 VAL HG11 1 1 10 6731 1 1 21 VAL HG12 H 5.477 6.894 -0.261 1.00 . A A . 21 VAL HG12 1 1 10 6732 1 1 21 VAL HG13 H 6.329 5.851 -1.400 1.00 . A A . 21 VAL HG13 1 1 10 6733 1 1 21 VAL HG21 H 5.100 6.506 1.728 1.00 . A A . 21 VAL HG21 1 1 10 6734 1 1 21 VAL HG22 H 5.761 5.174 2.677 1.00 . A A . 21 VAL HG22 1 1 10 6735 1 1 21 VAL HG23 H 4.342 4.915 1.662 1.00 . A A . 21 VAL HG23 1 1 10 6736 1 1 21 VAL N N 5.548 2.659 0.776 1.00 . A A . 21 VAL N 1 1 10 6737 1 1 21 VAL O O 6.220 3.725 -2.460 1.00 . A A . 21 VAL O 1 1 10 6738 1 1 22 ALA C C 8.019 1.514 -3.048 1.00 . A A . 22 ALA C 1 1 10 6739 1 1 22 ALA CA C 8.665 2.473 -2.051 1.00 . A A . 22 ALA CA 1 1 10 6740 1 1 22 ALA CB C 9.899 1.840 -1.427 1.00 . A A . 22 ALA CB 1 1 10 6741 1 1 22 ALA H H 7.917 2.663 -0.072 1.00 . A A . 22 ALA H 1 1 10 6742 1 1 22 ALA HA H 8.971 3.368 -2.574 1.00 . A A . 22 ALA HA 1 1 10 6743 1 1 22 ALA HB1 H 9.696 1.597 -0.395 1.00 . A A . 22 ALA HB1 1 1 10 6744 1 1 22 ALA HB2 H 10.725 2.535 -1.478 1.00 . A A . 22 ALA HB2 1 1 10 6745 1 1 22 ALA HB3 H 10.153 0.939 -1.966 1.00 . A A . 22 ALA HB3 1 1 10 6746 1 1 22 ALA N N 7.711 2.862 -1.014 1.00 . A A . 22 ALA N 1 1 10 6747 1 1 22 ALA O O 8.186 1.654 -4.267 1.00 . A A . 22 ALA O 1 1 10 6748 1 1 23 CYS C C 5.588 0.318 -4.258 1.00 . A A . 23 CYS C 1 1 10 6749 1 1 23 CYS CA C 6.568 -0.412 -3.355 1.00 . A A . 23 CYS CA 1 1 10 6750 1 1 23 CYS CB C 5.818 -1.424 -2.481 1.00 . A A . 23 CYS CB 1 1 10 6751 1 1 23 CYS H H 7.156 0.512 -1.546 1.00 . A A . 23 CYS H 1 1 10 6752 1 1 23 CYS HA H 7.298 -0.928 -3.961 1.00 . A A . 23 CYS HA 1 1 10 6753 1 1 23 CYS HB2 H 6.428 -1.669 -1.626 1.00 . A A . 23 CYS HB2 1 1 10 6754 1 1 23 CYS HB3 H 4.896 -0.976 -2.140 1.00 . A A . 23 CYS HB3 1 1 10 6755 1 1 23 CYS N N 7.263 0.556 -2.523 1.00 . A A . 23 CYS N 1 1 10 6756 1 1 23 CYS O O 5.528 0.077 -5.465 1.00 . A A . 23 CYS O 1 1 10 6757 1 1 23 CYS SG S 5.396 -2.986 -3.327 1.00 . A A . 23 CYS SG 1 1 10 6758 1 1 24 CYS C C 4.492 2.888 -5.426 1.00 . A A . 24 CYS C 1 1 10 6759 1 1 24 CYS CA C 3.851 2.019 -4.354 1.00 . A A . 24 CYS CA 1 1 10 6760 1 1 24 CYS CB C 3.093 2.878 -3.350 1.00 . A A . 24 CYS CB 1 1 10 6761 1 1 24 CYS H H 4.953 1.358 -2.683 1.00 . A A . 24 CYS H 1 1 10 6762 1 1 24 CYS HA H 3.156 1.342 -4.827 1.00 . A A . 24 CYS HA 1 1 10 6763 1 1 24 CYS HB2 H 3.796 3.492 -2.805 1.00 . A A . 24 CYS HB2 1 1 10 6764 1 1 24 CYS HB3 H 2.397 3.513 -3.872 1.00 . A A . 24 CYS HB3 1 1 10 6765 1 1 24 CYS N N 4.838 1.220 -3.652 1.00 . A A . 24 CYS N 1 1 10 6766 1 1 24 CYS O O 3.946 3.034 -6.515 1.00 . A A . 24 CYS O 1 1 10 6767 1 1 24 CYS SG S 2.155 1.889 -2.147 1.00 . A A . 24 CYS SG 1 1 10 6768 1 1 25 LYS C C 6.707 3.522 -7.331 1.00 . A A . 25 LYS C 1 1 10 6769 1 1 25 LYS CA C 6.336 4.313 -6.083 1.00 . A A . 25 LYS CA 1 1 10 6770 1 1 25 LYS CB C 7.587 4.966 -5.478 1.00 . A A . 25 LYS CB 1 1 10 6771 1 1 25 LYS CD C 6.049 6.630 -4.336 1.00 . A A . 25 LYS CD 1 1 10 6772 1 1 25 LYS CE C 6.146 7.689 -5.422 1.00 . A A . 25 LYS CE 1 1 10 6773 1 1 25 LYS CG C 7.321 5.795 -4.225 1.00 . A A . 25 LYS CG 1 1 10 6774 1 1 25 LYS H H 6.046 3.315 -4.233 1.00 . A A . 25 LYS H 1 1 10 6775 1 1 25 LYS HA H 5.646 5.093 -6.371 1.00 . A A . 25 LYS HA 1 1 10 6776 1 1 25 LYS HB2 H 8.292 4.189 -5.222 1.00 . A A . 25 LYS HB2 1 1 10 6777 1 1 25 LYS HB3 H 8.033 5.611 -6.221 1.00 . A A . 25 LYS HB3 1 1 10 6778 1 1 25 LYS HD2 H 5.222 5.975 -4.565 1.00 . A A . 25 LYS HD2 1 1 10 6779 1 1 25 LYS HD3 H 5.870 7.117 -3.388 1.00 . A A . 25 LYS HD3 1 1 10 6780 1 1 25 LYS HE2 H 6.424 7.210 -6.348 1.00 . A A . 25 LYS HE2 1 1 10 6781 1 1 25 LYS HE3 H 5.179 8.157 -5.535 1.00 . A A . 25 LYS HE3 1 1 10 6782 1 1 25 LYS HG2 H 7.224 5.129 -3.382 1.00 . A A . 25 LYS HG2 1 1 10 6783 1 1 25 LYS HG3 H 8.160 6.457 -4.063 1.00 . A A . 25 LYS HG3 1 1 10 6784 1 1 25 LYS HZ1 H 7.050 9.030 -4.103 1.00 . A A . 25 LYS HZ1 1 1 10 6785 1 1 25 LYS HZ2 H 7.025 9.560 -5.708 1.00 . A A . 25 LYS HZ2 1 1 10 6786 1 1 25 LYS HZ3 H 8.115 8.358 -5.234 1.00 . A A . 25 LYS HZ3 1 1 10 6787 1 1 25 LYS N N 5.650 3.463 -5.122 1.00 . A A . 25 LYS N 1 1 10 6788 1 1 25 LYS NZ N 7.155 8.732 -5.094 1.00 . A A . 25 LYS NZ 1 1 10 6789 1 1 25 LYS O O 6.534 4.011 -8.446 1.00 . A A . 25 LYS O 1 1 10 6790 1 1 26 LYS C C 6.311 1.060 -9.069 1.00 . A A . 26 LYS C 1 1 10 6791 1 1 26 LYS CA C 7.568 1.465 -8.294 1.00 . A A . 26 LYS CA 1 1 10 6792 1 1 26 LYS CB C 8.366 0.218 -7.871 1.00 . A A . 26 LYS CB 1 1 10 6793 1 1 26 LYS CD C 8.359 -2.280 -7.543 1.00 . A A . 26 LYS CD 1 1 10 6794 1 1 26 LYS CE C 9.044 -2.469 -6.200 1.00 . A A . 26 LYS CE 1 1 10 6795 1 1 26 LYS CG C 7.516 -1.013 -7.580 1.00 . A A . 26 LYS CG 1 1 10 6796 1 1 26 LYS H H 7.307 1.946 -6.237 1.00 . A A . 26 LYS H 1 1 10 6797 1 1 26 LYS HA H 8.186 2.070 -8.943 1.00 . A A . 26 LYS HA 1 1 10 6798 1 1 26 LYS HB2 H 9.057 -0.034 -8.661 1.00 . A A . 26 LYS HB2 1 1 10 6799 1 1 26 LYS HB3 H 8.930 0.455 -6.980 1.00 . A A . 26 LYS HB3 1 1 10 6800 1 1 26 LYS HD2 H 7.720 -3.130 -7.729 1.00 . A A . 26 LYS HD2 1 1 10 6801 1 1 26 LYS HD3 H 9.112 -2.220 -8.315 1.00 . A A . 26 LYS HD3 1 1 10 6802 1 1 26 LYS HE2 H 9.792 -3.242 -6.296 1.00 . A A . 26 LYS HE2 1 1 10 6803 1 1 26 LYS HE3 H 9.519 -1.540 -5.919 1.00 . A A . 26 LYS HE3 1 1 10 6804 1 1 26 LYS HG2 H 7.033 -0.887 -6.622 1.00 . A A . 26 LYS HG2 1 1 10 6805 1 1 26 LYS HG3 H 6.767 -1.112 -8.352 1.00 . A A . 26 LYS HG3 1 1 10 6806 1 1 26 LYS HZ1 H 7.619 -2.015 -4.745 1.00 . A A . 26 LYS HZ1 1 1 10 6807 1 1 26 LYS HZ2 H 8.564 -3.368 -4.378 1.00 . A A . 26 LYS HZ2 1 1 10 6808 1 1 26 LYS HZ3 H 7.338 -3.482 -5.543 1.00 . A A . 26 LYS HZ3 1 1 10 6809 1 1 26 LYS N N 7.200 2.295 -7.148 1.00 . A A . 26 LYS N 1 1 10 6810 1 1 26 LYS NZ N 8.076 -2.859 -5.142 1.00 . A A . 26 LYS NZ 1 1 10 6811 1 1 26 LYS O O 6.347 0.884 -10.286 1.00 . A A . 26 LYS O 1 1 10 6812 1 1 27 ALA C C 3.248 1.769 -9.594 1.00 . A A . 27 ALA C 1 1 10 6813 1 1 27 ALA CA C 3.922 0.555 -8.954 1.00 . A A . 27 ALA CA 1 1 10 6814 1 1 27 ALA CB C 3.010 -0.078 -7.914 1.00 . A A . 27 ALA CB 1 1 10 6815 1 1 27 ALA H H 5.233 1.090 -7.382 1.00 . A A . 27 ALA H 1 1 10 6816 1 1 27 ALA HA H 4.120 -0.180 -9.721 1.00 . A A . 27 ALA HA 1 1 10 6817 1 1 27 ALA HB1 H 3.466 0.004 -6.938 1.00 . A A . 27 ALA HB1 1 1 10 6818 1 1 27 ALA HB2 H 2.858 -1.119 -8.155 1.00 . A A . 27 ALA HB2 1 1 10 6819 1 1 27 ALA HB3 H 2.059 0.434 -7.911 1.00 . A A . 27 ALA HB3 1 1 10 6820 1 1 27 ALA N N 5.197 0.926 -8.348 1.00 . A A . 27 ALA N 1 1 10 6821 1 1 27 ALA O O 2.123 1.679 -10.095 1.00 . A A . 27 ALA O 1 1 10 6822 1 1 28 LYS C C 2.306 4.724 -9.343 1.00 . A A . 28 LYS C 1 1 10 6823 1 1 28 LYS CA C 3.479 4.149 -10.147 1.00 . A A . 28 LYS CA 1 1 10 6824 1 1 28 LYS CB C 3.103 3.954 -11.624 1.00 . A A . 28 LYS CB 1 1 10 6825 1 1 28 LYS CD C 2.911 4.966 -13.917 1.00 . A A . 28 LYS CD 1 1 10 6826 1 1 28 LYS CE C 4.124 4.210 -14.442 1.00 . A A . 28 LYS CE 1 1 10 6827 1 1 28 LYS CG C 3.034 5.246 -12.426 1.00 . A A . 28 LYS CG 1 1 10 6828 1 1 28 LYS H H 4.847 2.879 -9.162 1.00 . A A . 28 LYS H 1 1 10 6829 1 1 28 LYS HA H 4.296 4.853 -10.094 1.00 . A A . 28 LYS HA 1 1 10 6830 1 1 28 LYS HB2 H 3.837 3.312 -12.086 1.00 . A A . 28 LYS HB2 1 1 10 6831 1 1 28 LYS HB3 H 2.137 3.473 -11.675 1.00 . A A . 28 LYS HB3 1 1 10 6832 1 1 28 LYS HD2 H 2.026 4.373 -14.091 1.00 . A A . 28 LYS HD2 1 1 10 6833 1 1 28 LYS HD3 H 2.828 5.906 -14.443 1.00 . A A . 28 LYS HD3 1 1 10 6834 1 1 28 LYS HE2 H 5.006 4.811 -14.278 1.00 . A A . 28 LYS HE2 1 1 10 6835 1 1 28 LYS HE3 H 4.217 3.282 -13.896 1.00 . A A . 28 LYS HE3 1 1 10 6836 1 1 28 LYS HG2 H 2.173 5.812 -12.104 1.00 . A A . 28 LYS HG2 1 1 10 6837 1 1 28 LYS HG3 H 3.932 5.818 -12.247 1.00 . A A . 28 LYS HG3 1 1 10 6838 1 1 28 LYS HZ1 H 4.788 3.284 -16.192 1.00 . A A . 28 LYS HZ1 1 1 10 6839 1 1 28 LYS HZ2 H 4.056 4.787 -16.449 1.00 . A A . 28 LYS HZ2 1 1 10 6840 1 1 28 LYS HZ3 H 3.106 3.433 -16.093 1.00 . A A . 28 LYS HZ3 1 1 10 6841 1 1 28 LYS N N 3.957 2.896 -9.575 1.00 . A A . 28 LYS N 1 1 10 6842 1 1 28 LYS NZ N 4.010 3.908 -15.896 1.00 . A A . 28 LYS NZ 1 1 10 6843 1 1 28 LYS O O 1.290 5.147 -9.904 1.00 . A A . 28 LYS O 1 1 10 6844 1 1 29 PHE C C 2.106 6.437 -6.311 1.00 . A A . 29 PHE C 1 1 10 6845 1 1 29 PHE CA C 1.472 5.312 -7.118 1.00 . A A . 29 PHE CA 1 1 10 6846 1 1 29 PHE CB C 0.895 4.257 -6.166 1.00 . A A . 29 PHE CB 1 1 10 6847 1 1 29 PHE CD1 C 0.295 2.356 -7.700 1.00 . A A . 29 PHE CD1 1 1 10 6848 1 1 29 PHE CD2 C -1.450 3.418 -6.474 1.00 . A A . 29 PHE CD2 1 1 10 6849 1 1 29 PHE CE1 C -0.626 1.497 -8.270 1.00 . A A . 29 PHE CE1 1 1 10 6850 1 1 29 PHE CE2 C -2.374 2.561 -7.038 1.00 . A A . 29 PHE CE2 1 1 10 6851 1 1 29 PHE CG C -0.105 3.327 -6.799 1.00 . A A . 29 PHE CG 1 1 10 6852 1 1 29 PHE CZ C -1.962 1.599 -7.938 1.00 . A A . 29 PHE CZ 1 1 10 6853 1 1 29 PHE H H 3.316 4.420 -7.646 1.00 . A A . 29 PHE H 1 1 10 6854 1 1 29 PHE HA H 0.673 5.723 -7.719 1.00 . A A . 29 PHE HA 1 1 10 6855 1 1 29 PHE HB2 H 1.701 3.657 -5.775 1.00 . A A . 29 PHE HB2 1 1 10 6856 1 1 29 PHE HB3 H 0.404 4.761 -5.345 1.00 . A A . 29 PHE HB3 1 1 10 6857 1 1 29 PHE HD1 H 1.340 2.275 -7.962 1.00 . A A . 29 PHE HD1 1 1 10 6858 1 1 29 PHE HD2 H -1.774 4.173 -5.773 1.00 . A A . 29 PHE HD2 1 1 10 6859 1 1 29 PHE HE1 H -0.300 0.745 -8.973 1.00 . A A . 29 PHE HE1 1 1 10 6860 1 1 29 PHE HE2 H -3.419 2.643 -6.775 1.00 . A A . 29 PHE HE2 1 1 10 6861 1 1 29 PHE HZ H -2.682 0.927 -8.380 1.00 . A A . 29 PHE HZ 1 1 10 6862 1 1 29 PHE N N 2.473 4.759 -8.025 1.00 . A A . 29 PHE N 1 1 10 6863 1 1 29 PHE O O 3.303 6.406 -6.029 1.00 . A A . 29 PHE O 1 1 10 6864 1 1 30 SER C C 2.001 8.295 -3.748 1.00 . A A . 30 SER C 1 1 10 6865 1 1 30 SER CA C 1.806 8.591 -5.238 1.00 . A A . 30 SER CA 1 1 10 6866 1 1 30 SER CB C 0.826 9.751 -5.413 1.00 . A A . 30 SER CB 1 1 10 6867 1 1 30 SER H H 0.377 7.419 -6.253 1.00 . A A . 30 SER H 1 1 10 6868 1 1 30 SER HA H 2.755 8.873 -5.661 1.00 . A A . 30 SER HA 1 1 10 6869 1 1 30 SER HB2 H -0.026 9.602 -4.766 1.00 . A A . 30 SER HB2 1 1 10 6870 1 1 30 SER HB3 H 1.317 10.678 -5.158 1.00 . A A . 30 SER HB3 1 1 10 6871 1 1 30 SER HG H 0.389 10.744 -7.053 1.00 . A A . 30 SER HG 1 1 10 6872 1 1 30 SER N N 1.315 7.438 -5.976 1.00 . A A . 30 SER N 1 1 10 6873 1 1 30 SER O O 2.982 8.735 -3.146 1.00 . A A . 30 SER O 1 1 10 6874 1 1 30 SER OG O 0.373 9.826 -6.757 1.00 . A A . 30 SER OG 1 1 10 6875 1 1 31 ASP C C 1.082 5.768 -1.463 1.00 . A A . 31 ASP C 1 1 10 6876 1 1 31 ASP CA C 1.079 7.271 -1.731 1.00 . A A . 31 ASP CA 1 1 10 6877 1 1 31 ASP CB C -0.134 7.933 -1.054 1.00 . A A . 31 ASP CB 1 1 10 6878 1 1 31 ASP CG C -0.460 7.359 0.314 1.00 . A A . 31 ASP CG 1 1 10 6879 1 1 31 ASP H H 0.279 7.286 -3.693 1.00 . A A . 31 ASP H 1 1 10 6880 1 1 31 ASP HA H 1.983 7.691 -1.317 1.00 . A A . 31 ASP HA 1 1 10 6881 1 1 31 ASP HB2 H 0.065 8.987 -0.936 1.00 . A A . 31 ASP HB2 1 1 10 6882 1 1 31 ASP HB3 H -0.998 7.808 -1.690 1.00 . A A . 31 ASP HB3 1 1 10 6883 1 1 31 ASP N N 1.049 7.586 -3.160 1.00 . A A . 31 ASP N 1 1 10 6884 1 1 31 ASP O O 0.606 4.974 -2.279 1.00 . A A . 31 ASP O 1 1 10 6885 1 1 31 ASP OD1 O 0.378 7.476 1.229 1.00 . A A . 31 ASP OD1 1 1 10 6886 1 1 31 ASP OD2 O -1.560 6.779 0.464 1.00 . A A . 31 ASP OD2 1 1 10 6887 1 1 32 GLY C C 1.491 3.946 1.638 1.00 . A A . 32 GLY C 1 1 10 6888 1 1 32 GLY CA C 1.660 4.032 0.137 1.00 . A A . 32 GLY CA 1 1 10 6889 1 1 32 GLY H H 1.936 6.110 0.307 1.00 . A A . 32 GLY H 1 1 10 6890 1 1 32 GLY HA2 H 0.871 3.473 -0.346 1.00 . A A . 32 GLY HA2 1 1 10 6891 1 1 32 GLY HA3 H 2.616 3.611 -0.136 1.00 . A A . 32 GLY HA3 1 1 10 6892 1 1 32 GLY N N 1.603 5.408 -0.296 1.00 . A A . 32 GLY N 1 1 10 6893 1 1 32 GLY O O 2.185 4.637 2.385 1.00 . A A . 32 GLY O 1 1 10 6894 1 1 33 HIS C C -0.191 1.608 3.890 1.00 . A A . 33 HIS C 1 1 10 6895 1 1 33 HIS CA C 0.293 3.006 3.517 1.00 . A A . 33 HIS CA 1 1 10 6896 1 1 33 HIS CB C -0.747 4.053 3.937 1.00 . A A . 33 HIS CB 1 1 10 6897 1 1 33 HIS CD2 C -2.594 4.372 2.130 1.00 . A A . 33 HIS CD2 1 1 10 6898 1 1 33 HIS CE1 C -4.126 3.079 3.010 1.00 . A A . 33 HIS CE1 1 1 10 6899 1 1 33 HIS CG C -2.090 3.873 3.286 1.00 . A A . 33 HIS CG 1 1 10 6900 1 1 33 HIS H H 0.012 2.612 1.450 1.00 . A A . 33 HIS H 1 1 10 6901 1 1 33 HIS HA H 1.215 3.205 4.040 1.00 . A A . 33 HIS HA 1 1 10 6902 1 1 33 HIS HB2 H -0.890 3.997 5.006 1.00 . A A . 33 HIS HB2 1 1 10 6903 1 1 33 HIS HB3 H -0.380 5.034 3.681 1.00 . A A . 33 HIS HB3 1 1 10 6904 1 1 33 HIS HD1 H -3.014 2.549 4.643 1.00 . A A . 33 HIS HD1 1 1 10 6905 1 1 33 HIS HD2 H -2.086 5.020 1.435 1.00 . A A . 33 HIS HD2 1 1 10 6906 1 1 33 HIS HE1 H -5.039 2.522 3.155 1.00 . A A . 33 HIS HE1 1 1 10 6907 1 1 33 HIS N N 0.554 3.128 2.091 1.00 . A A . 33 HIS N 1 1 10 6908 1 1 33 HIS ND1 N -3.078 3.065 3.812 1.00 . A A . 33 HIS ND1 1 1 10 6909 1 1 33 HIS NE2 N -3.860 3.864 1.987 1.00 . A A . 33 HIS NE2 1 1 10 6910 1 1 33 HIS O O -0.959 0.984 3.161 1.00 . A A . 33 HIS O 1 1 10 6911 1 1 34 CYS C C -1.620 -0.206 5.875 1.00 . A A . 34 CYS C 1 1 10 6912 1 1 34 CYS CA C -0.128 -0.183 5.535 1.00 . A A . 34 CYS CA 1 1 10 6913 1 1 34 CYS CB C 0.689 -0.533 6.781 1.00 . A A . 34 CYS CB 1 1 10 6914 1 1 34 CYS H H 0.861 1.684 5.577 1.00 . A A . 34 CYS H 1 1 10 6915 1 1 34 CYS HA H 0.072 -0.908 4.761 1.00 . A A . 34 CYS HA 1 1 10 6916 1 1 34 CYS HB2 H 0.320 0.044 7.615 1.00 . A A . 34 CYS HB2 1 1 10 6917 1 1 34 CYS HB3 H 0.563 -1.585 6.997 1.00 . A A . 34 CYS HB3 1 1 10 6918 1 1 34 CYS N N 0.258 1.132 5.039 1.00 . A A . 34 CYS N 1 1 10 6919 1 1 34 CYS O O -2.181 0.810 6.294 1.00 . A A . 34 CYS O 1 1 10 6920 1 1 34 CYS SG S 2.480 -0.208 6.637 1.00 . A A . 34 CYS SG 1 1 10 6921 1 1 35 SER C C -3.928 -1.988 7.396 1.00 . A A . 35 SER C 1 1 10 6922 1 1 35 SER CA C -3.689 -1.478 5.975 1.00 . A A . 35 SER CA 1 1 10 6923 1 1 35 SER CB C -4.354 -2.408 4.964 1.00 . A A . 35 SER CB 1 1 10 6924 1 1 35 SER H H -1.777 -2.128 5.338 1.00 . A A . 35 SER H 1 1 10 6925 1 1 35 SER HA H -4.129 -0.497 5.885 1.00 . A A . 35 SER HA 1 1 10 6926 1 1 35 SER HB2 H -5.338 -2.677 5.318 1.00 . A A . 35 SER HB2 1 1 10 6927 1 1 35 SER HB3 H -4.440 -1.901 4.014 1.00 . A A . 35 SER HB3 1 1 10 6928 1 1 35 SER HG H -2.924 -3.434 4.103 1.00 . A A . 35 SER HG 1 1 10 6929 1 1 35 SER N N -2.265 -1.352 5.684 1.00 . A A . 35 SER N 1 1 10 6930 1 1 35 SER O O -3.061 -1.881 8.264 1.00 . A A . 35 SER O 1 1 10 6931 1 1 35 SER OG O -3.596 -3.590 4.783 1.00 . A A . 35 SER OG 1 1 10 6932 1 1 36 LYS C C -5.737 -4.569 8.884 1.00 . A A . 36 LYS C 1 1 10 6933 1 1 36 LYS CA C -5.485 -3.063 8.929 1.00 . A A . 36 LYS CA 1 1 10 6934 1 1 36 LYS CB C -6.735 -2.340 9.442 1.00 . A A . 36 LYS CB 1 1 10 6935 1 1 36 LYS CD C -8.542 -2.185 11.185 1.00 . A A . 36 LYS CD 1 1 10 6936 1 1 36 LYS CE C -9.106 -2.786 12.463 1.00 . A A . 36 LYS CE 1 1 10 6937 1 1 36 LYS CG C -7.292 -2.921 10.732 1.00 . A A . 36 LYS CG 1 1 10 6938 1 1 36 LYS H H -5.757 -2.590 6.888 1.00 . A A . 36 LYS H 1 1 10 6939 1 1 36 LYS HA H -4.668 -2.867 9.606 1.00 . A A . 36 LYS HA 1 1 10 6940 1 1 36 LYS HB2 H -6.491 -1.303 9.616 1.00 . A A . 36 LYS HB2 1 1 10 6941 1 1 36 LYS HB3 H -7.504 -2.397 8.685 1.00 . A A . 36 LYS HB3 1 1 10 6942 1 1 36 LYS HD2 H -8.294 -1.150 11.365 1.00 . A A . 36 LYS HD2 1 1 10 6943 1 1 36 LYS HD3 H -9.288 -2.250 10.407 1.00 . A A . 36 LYS HD3 1 1 10 6944 1 1 36 LYS HE2 H -9.341 -3.824 12.285 1.00 . A A . 36 LYS HE2 1 1 10 6945 1 1 36 LYS HE3 H -8.358 -2.715 13.240 1.00 . A A . 36 LYS HE3 1 1 10 6946 1 1 36 LYS HG2 H -7.538 -3.960 10.567 1.00 . A A . 36 LYS HG2 1 1 10 6947 1 1 36 LYS HG3 H -6.539 -2.846 11.503 1.00 . A A . 36 LYS HG3 1 1 10 6948 1 1 36 LYS HZ1 H -10.087 -1.208 13.419 1.00 . A A . 36 LYS HZ1 1 1 10 6949 1 1 36 LYS HZ2 H -10.888 -2.692 13.550 1.00 . A A . 36 LYS HZ2 1 1 10 6950 1 1 36 LYS HZ3 H -10.929 -1.836 12.092 1.00 . A A . 36 LYS HZ3 1 1 10 6951 1 1 36 LYS N N -5.113 -2.541 7.621 1.00 . A A . 36 LYS N 1 1 10 6952 1 1 36 LYS NZ N -10.339 -2.081 12.912 1.00 . A A . 36 LYS NZ 1 1 10 6953 1 1 36 LYS O O -5.461 -5.272 9.850 1.00 . A A . 36 LYS O 1 1 10 6954 1 1 37 ILE C C -5.354 -7.333 7.551 1.00 . A A . 37 ILE C 1 1 10 6955 1 1 37 ILE CA C -6.616 -6.465 7.615 1.00 . A A . 37 ILE CA 1 1 10 6956 1 1 37 ILE CB C -7.464 -6.709 6.347 1.00 . A A . 37 ILE CB 1 1 10 6957 1 1 37 ILE CD1 C -9.301 -5.711 4.894 1.00 . A A . 37 ILE CD1 1 1 10 6958 1 1 37 ILE CG1 C -8.551 -5.639 6.208 1.00 . A A . 37 ILE CG1 1 1 10 6959 1 1 37 ILE CG2 C -8.097 -8.097 6.389 1.00 . A A . 37 ILE CG2 1 1 10 6960 1 1 37 ILE H H -6.510 -4.429 7.049 1.00 . A A . 37 ILE H 1 1 10 6961 1 1 37 ILE HA H -7.197 -6.765 8.473 1.00 . A A . 37 ILE HA 1 1 10 6962 1 1 37 ILE HB H -6.811 -6.662 5.491 1.00 . A A . 37 ILE HB 1 1 10 6963 1 1 37 ILE HD11 H -8.707 -6.249 4.169 1.00 . A A . 37 ILE HD11 1 1 10 6964 1 1 37 ILE HD12 H -9.491 -4.711 4.533 1.00 . A A . 37 ILE HD12 1 1 10 6965 1 1 37 ILE HD13 H -10.239 -6.224 5.043 1.00 . A A . 37 ILE HD13 1 1 10 6966 1 1 37 ILE HG12 H -9.268 -5.757 7.006 1.00 . A A . 37 ILE HG12 1 1 10 6967 1 1 37 ILE HG13 H -8.096 -4.662 6.279 1.00 . A A . 37 ILE HG13 1 1 10 6968 1 1 37 ILE HG21 H -8.044 -8.547 5.409 1.00 . A A . 37 ILE HG21 1 1 10 6969 1 1 37 ILE HG22 H -9.130 -8.013 6.692 1.00 . A A . 37 ILE HG22 1 1 10 6970 1 1 37 ILE HG23 H -7.563 -8.714 7.098 1.00 . A A . 37 ILE HG23 1 1 10 6971 1 1 37 ILE N N -6.292 -5.046 7.773 1.00 . A A . 37 ILE N 1 1 10 6972 1 1 37 ILE O O -4.736 -7.621 8.570 1.00 . A A . 37 ILE O 1 1 10 6973 1 1 38 LEU C C -2.526 -7.762 6.238 1.00 . A A . 38 LEU C 1 1 10 6974 1 1 38 LEU CA C -3.800 -8.596 6.159 1.00 . A A . 38 LEU CA 1 1 10 6975 1 1 38 LEU CB C -3.868 -9.311 4.811 1.00 . A A . 38 LEU CB 1 1 10 6976 1 1 38 LEU CD1 C -3.036 -11.520 5.658 1.00 . A A . 38 LEU CD1 1 1 10 6977 1 1 38 LEU CD2 C -2.898 -10.988 3.220 1.00 . A A . 38 LEU CD2 1 1 10 6978 1 1 38 LEU CG C -2.834 -10.419 4.627 1.00 . A A . 38 LEU CG 1 1 10 6979 1 1 38 LEU H H -5.514 -7.503 5.566 1.00 . A A . 38 LEU H 1 1 10 6980 1 1 38 LEU HA H -3.787 -9.332 6.949 1.00 . A A . 38 LEU HA 1 1 10 6981 1 1 38 LEU HB2 H -4.852 -9.734 4.700 1.00 . A A . 38 LEU HB2 1 1 10 6982 1 1 38 LEU HB3 H -3.720 -8.580 4.031 1.00 . A A . 38 LEU HB3 1 1 10 6983 1 1 38 LEU HD11 H -3.470 -11.099 6.553 1.00 . A A . 38 LEU HD11 1 1 10 6984 1 1 38 LEU HD12 H -2.083 -11.969 5.896 1.00 . A A . 38 LEU HD12 1 1 10 6985 1 1 38 LEU HD13 H -3.698 -12.272 5.256 1.00 . A A . 38 LEU HD13 1 1 10 6986 1 1 38 LEU HD21 H -1.898 -11.196 2.870 1.00 . A A . 38 LEU HD21 1 1 10 6987 1 1 38 LEU HD22 H -3.367 -10.271 2.562 1.00 . A A . 38 LEU HD22 1 1 10 6988 1 1 38 LEU HD23 H -3.474 -11.902 3.226 1.00 . A A . 38 LEU HD23 1 1 10 6989 1 1 38 LEU HG H -1.851 -9.997 4.778 1.00 . A A . 38 LEU HG 1 1 10 6990 1 1 38 LEU N N -4.981 -7.755 6.345 1.00 . A A . 38 LEU N 1 1 10 6991 1 1 38 LEU O O -1.424 -8.247 5.990 1.00 . A A . 38 LEU O 1 1 10 6992 1 1 39 ARG C C -0.878 -5.374 5.395 1.00 . A A . 39 ARG C 1 1 10 6993 1 1 39 ARG CA C -1.617 -5.549 6.725 1.00 . A A . 39 ARG CA 1 1 10 6994 1 1 39 ARG CB C -0.661 -6.000 7.836 1.00 . A A . 39 ARG CB 1 1 10 6995 1 1 39 ARG CD C -0.544 -3.798 9.052 1.00 . A A . 39 ARG CD 1 1 10 6996 1 1 39 ARG CG C 0.243 -4.899 8.360 1.00 . A A . 39 ARG CG 1 1 10 6997 1 1 39 ARG CZ C -0.064 -1.668 10.222 1.00 . A A . 39 ARG CZ 1 1 10 6998 1 1 39 ARG H H -3.616 -6.202 6.771 1.00 . A A . 39 ARG H 1 1 10 6999 1 1 39 ARG HA H -2.048 -4.599 7.004 1.00 . A A . 39 ARG HA 1 1 10 7000 1 1 39 ARG HB2 H -1.244 -6.379 8.663 1.00 . A A . 39 ARG HB2 1 1 10 7001 1 1 39 ARG HB3 H -0.038 -6.796 7.455 1.00 . A A . 39 ARG HB3 1 1 10 7002 1 1 39 ARG HD2 H -1.257 -3.386 8.353 1.00 . A A . 39 ARG HD2 1 1 10 7003 1 1 39 ARG HD3 H -1.069 -4.221 9.896 1.00 . A A . 39 ARG HD3 1 1 10 7004 1 1 39 ARG HE H 1.301 -2.817 9.307 1.00 . A A . 39 ARG HE 1 1 10 7005 1 1 39 ARG HG2 H 0.939 -5.326 9.067 1.00 . A A . 39 ARG HG2 1 1 10 7006 1 1 39 ARG HG3 H 0.788 -4.472 7.531 1.00 . A A . 39 ARG HG3 1 1 10 7007 1 1 39 ARG HH11 H -2.030 -2.159 10.164 1.00 . A A . 39 ARG HH11 1 1 10 7008 1 1 39 ARG HH12 H -1.657 -0.699 11.017 1.00 . A A . 39 ARG HH12 1 1 10 7009 1 1 39 ARG HH21 H 1.799 -0.887 10.410 1.00 . A A . 39 ARG HH21 1 1 10 7010 1 1 39 ARG HH22 H 0.532 0.031 11.157 1.00 . A A . 39 ARG HH22 1 1 10 7011 1 1 39 ARG N N -2.707 -6.500 6.589 1.00 . A A . 39 ARG N 1 1 10 7012 1 1 39 ARG NE N 0.339 -2.729 9.524 1.00 . A A . 39 ARG NE 1 1 10 7013 1 1 39 ARG NH1 N -1.353 -1.493 10.491 1.00 . A A . 39 ARG NH1 1 1 10 7014 1 1 39 ARG NH2 N 0.825 -0.768 10.629 1.00 . A A . 39 ARG NH2 1 1 10 7015 1 1 39 ARG O O 0.313 -5.071 5.363 1.00 . A A . 39 ARG O 1 1 10 7016 1 1 40 ARG C C -0.731 -3.900 2.704 1.00 . A A . 40 ARG C 1 1 10 7017 1 1 40 ARG CA C -1.039 -5.371 2.962 1.00 . A A . 40 ARG CA 1 1 10 7018 1 1 40 ARG CB C -1.993 -5.889 1.882 1.00 . A A . 40 ARG CB 1 1 10 7019 1 1 40 ARG CD C -2.934 -7.842 0.610 1.00 . A A . 40 ARG CD 1 1 10 7020 1 1 40 ARG CG C -1.977 -7.399 1.710 1.00 . A A . 40 ARG CG 1 1 10 7021 1 1 40 ARG CZ C -1.908 -9.920 -0.271 1.00 . A A . 40 ARG CZ 1 1 10 7022 1 1 40 ARG H H -2.560 -5.764 4.386 1.00 . A A . 40 ARG H 1 1 10 7023 1 1 40 ARG HA H -0.118 -5.933 2.920 1.00 . A A . 40 ARG HA 1 1 10 7024 1 1 40 ARG HB2 H -2.999 -5.591 2.136 1.00 . A A . 40 ARG HB2 1 1 10 7025 1 1 40 ARG HB3 H -1.724 -5.439 0.937 1.00 . A A . 40 ARG HB3 1 1 10 7026 1 1 40 ARG HD2 H -3.938 -7.563 0.892 1.00 . A A . 40 ARG HD2 1 1 10 7027 1 1 40 ARG HD3 H -2.665 -7.338 -0.306 1.00 . A A . 40 ARG HD3 1 1 10 7028 1 1 40 ARG HE H -3.608 -9.822 0.788 1.00 . A A . 40 ARG HE 1 1 10 7029 1 1 40 ARG HG2 H -0.976 -7.712 1.451 1.00 . A A . 40 ARG HG2 1 1 10 7030 1 1 40 ARG HG3 H -2.272 -7.861 2.641 1.00 . A A . 40 ARG HG3 1 1 10 7031 1 1 40 ARG HH11 H -0.972 -8.236 -0.901 1.00 . A A . 40 ARG HH11 1 1 10 7032 1 1 40 ARG HH12 H -0.236 -9.725 -1.404 1.00 . A A . 40 ARG HH12 1 1 10 7033 1 1 40 ARG HH21 H -2.599 -11.784 0.116 1.00 . A A . 40 ARG HH21 1 1 10 7034 1 1 40 ARG HH22 H -1.130 -11.718 -0.819 1.00 . A A . 40 ARG HH22 1 1 10 7035 1 1 40 ARG N N -1.608 -5.540 4.295 1.00 . A A . 40 ARG N 1 1 10 7036 1 1 40 ARG NE N -2.888 -9.288 0.389 1.00 . A A . 40 ARG NE 1 1 10 7037 1 1 40 ARG NH1 N -0.965 -9.234 -0.905 1.00 . A A . 40 ARG NH1 1 1 10 7038 1 1 40 ARG NH2 N -1.889 -11.244 -0.328 1.00 . A A . 40 ARG NH2 1 1 10 7039 1 1 40 ARG O O -1.352 -3.016 3.299 1.00 . A A . 40 ARG O 1 1 10 7040 1 1 41 CYS C C -0.418 -1.679 0.520 1.00 . A A . 41 CYS C 1 1 10 7041 1 1 41 CYS CA C 0.601 -2.288 1.473 1.00 . A A . 41 CYS CA 1 1 10 7042 1 1 41 CYS CB C 1.987 -2.282 0.828 1.00 . A A . 41 CYS CB 1 1 10 7043 1 1 41 CYS H H 0.672 -4.393 1.377 1.00 . A A . 41 CYS H 1 1 10 7044 1 1 41 CYS HA H 0.629 -1.704 2.381 1.00 . A A . 41 CYS HA 1 1 10 7045 1 1 41 CYS HB2 H 2.721 -2.554 1.572 1.00 . A A . 41 CYS HB2 1 1 10 7046 1 1 41 CYS HB3 H 2.006 -3.012 0.032 1.00 . A A . 41 CYS HB3 1 1 10 7047 1 1 41 CYS N N 0.219 -3.648 1.819 1.00 . A A . 41 CYS N 1 1 10 7048 1 1 41 CYS O O -0.515 -2.089 -0.636 1.00 . A A . 41 CYS O 1 1 10 7049 1 1 41 CYS SG S 2.487 -0.683 0.125 1.00 . A A . 41 CYS SG 1 1 10 7050 1 1 42 LEU C C -1.563 1.164 -0.505 1.00 . A A . 42 LEU C 1 1 10 7051 1 1 42 LEU CA C -2.170 -0.030 0.197 1.00 . A A . 42 LEU CA 1 1 10 7052 1 1 42 LEU CB C -3.351 0.430 1.058 1.00 . A A . 42 LEU CB 1 1 10 7053 1 1 42 LEU CD1 C -3.982 -1.895 1.760 1.00 . A A . 42 LEU CD1 1 1 10 7054 1 1 42 LEU CD2 C -5.590 -0.017 2.094 1.00 . A A . 42 LEU CD2 1 1 10 7055 1 1 42 LEU CG C -4.492 -0.579 1.204 1.00 . A A . 42 LEU CG 1 1 10 7056 1 1 42 LEU H H -1.036 -0.413 1.937 1.00 . A A . 42 LEU H 1 1 10 7057 1 1 42 LEU HA H -2.523 -0.731 -0.546 1.00 . A A . 42 LEU HA 1 1 10 7058 1 1 42 LEU HB2 H -2.975 0.656 2.046 1.00 . A A . 42 LEU HB2 1 1 10 7059 1 1 42 LEU HB3 H -3.752 1.341 0.629 1.00 . A A . 42 LEU HB3 1 1 10 7060 1 1 42 LEU HD11 H -4.450 -2.090 2.713 1.00 . A A . 42 LEU HD11 1 1 10 7061 1 1 42 LEU HD12 H -2.911 -1.841 1.889 1.00 . A A . 42 LEU HD12 1 1 10 7062 1 1 42 LEU HD13 H -4.221 -2.693 1.072 1.00 . A A . 42 LEU HD13 1 1 10 7063 1 1 42 LEU HD21 H -6.491 -0.599 1.965 1.00 . A A . 42 LEU HD21 1 1 10 7064 1 1 42 LEU HD22 H -5.784 1.010 1.822 1.00 . A A . 42 LEU HD22 1 1 10 7065 1 1 42 LEU HD23 H -5.276 -0.064 3.126 1.00 . A A . 42 LEU HD23 1 1 10 7066 1 1 42 LEU HG H -4.918 -0.772 0.230 1.00 . A A . 42 LEU HG 1 1 10 7067 1 1 42 LEU N N -1.167 -0.702 1.007 1.00 . A A . 42 LEU N 1 1 10 7068 1 1 42 LEU O O -1.011 2.054 0.137 1.00 . A A . 42 LEU O 1 1 10 7069 1 1 43 CYS C C -2.288 3.160 -3.066 1.00 . A A . 43 CYS C 1 1 10 7070 1 1 43 CYS CA C -1.150 2.273 -2.598 1.00 . A A . 43 CYS CA 1 1 10 7071 1 1 43 CYS CB C -0.367 1.727 -3.787 1.00 . A A . 43 CYS CB 1 1 10 7072 1 1 43 CYS H H -2.140 0.448 -2.271 1.00 . A A . 43 CYS H 1 1 10 7073 1 1 43 CYS HA H -0.488 2.850 -1.970 1.00 . A A . 43 CYS HA 1 1 10 7074 1 1 43 CYS HB2 H -1.028 1.140 -4.407 1.00 . A A . 43 CYS HB2 1 1 10 7075 1 1 43 CYS HB3 H 0.021 2.553 -4.365 1.00 . A A . 43 CYS HB3 1 1 10 7076 1 1 43 CYS N N -1.678 1.184 -1.813 1.00 . A A . 43 CYS N 1 1 10 7077 1 1 43 CYS O O -3.320 2.668 -3.530 1.00 . A A . 43 CYS O 1 1 10 7078 1 1 43 CYS SG S 1.037 0.670 -3.318 1.00 . A A . 43 CYS SG 1 1 10 7079 1 1 44 THR C C -2.556 6.477 -4.232 1.00 . A A . 44 THR C 1 1 10 7080 1 1 44 THR CA C -3.135 5.399 -3.335 1.00 . A A . 44 THR CA 1 1 10 7081 1 1 44 THR CB C -3.800 6.068 -2.123 1.00 . A A . 44 THR CB 1 1 10 7082 1 1 44 THR CG2 C -5.315 5.969 -2.213 1.00 . A A . 44 THR CG2 1 1 10 7083 1 1 44 THR H H -1.270 4.795 -2.547 1.00 . A A . 44 THR H 1 1 10 7084 1 1 44 THR HA H -3.892 4.856 -3.882 1.00 . A A . 44 THR HA 1 1 10 7085 1 1 44 THR HB H -3.526 7.111 -2.124 1.00 . A A . 44 THR HB 1 1 10 7086 1 1 44 THR HG1 H -2.686 6.016 -0.476 1.00 . A A . 44 THR HG1 1 1 10 7087 1 1 44 THR HG21 H -5.763 6.726 -1.588 1.00 . A A . 44 THR HG21 1 1 10 7088 1 1 44 THR HG22 H -5.632 4.992 -1.879 1.00 . A A . 44 THR HG22 1 1 10 7089 1 1 44 THR HG23 H -5.625 6.117 -3.237 1.00 . A A . 44 THR HG23 1 1 10 7090 1 1 44 THR N N -2.111 4.458 -2.933 1.00 . A A . 44 THR N 1 1 10 7091 1 1 44 THR O O -1.393 6.858 -4.102 1.00 . A A . 44 THR O 1 1 10 7092 1 1 44 THR OG1 O -3.354 5.448 -0.907 1.00 . A A . 44 THR OG1 1 1 10 7093 1 1 45 LYS C C -4.157 8.669 -6.703 1.00 . A A . 45 LYS C 1 1 10 7094 1 1 45 LYS CA C -2.954 8.007 -6.060 1.00 . A A . 45 LYS CA 1 1 10 7095 1 1 45 LYS CB C -2.015 7.457 -7.138 1.00 . A A . 45 LYS CB 1 1 10 7096 1 1 45 LYS CD C -1.635 5.939 -9.081 1.00 . A A . 45 LYS CD 1 1 10 7097 1 1 45 LYS CE C -2.188 4.824 -9.948 1.00 . A A . 45 LYS CE 1 1 10 7098 1 1 45 LYS CG C -2.641 6.418 -8.052 1.00 . A A . 45 LYS CG 1 1 10 7099 1 1 45 LYS H H -4.290 6.619 -5.185 1.00 . A A . 45 LYS H 1 1 10 7100 1 1 45 LYS HA H -2.422 8.750 -5.486 1.00 . A A . 45 LYS HA 1 1 10 7101 1 1 45 LYS HB2 H -1.674 8.278 -7.750 1.00 . A A . 45 LYS HB2 1 1 10 7102 1 1 45 LYS HB3 H -1.161 7.007 -6.653 1.00 . A A . 45 LYS HB3 1 1 10 7103 1 1 45 LYS HD2 H -1.364 6.770 -9.716 1.00 . A A . 45 LYS HD2 1 1 10 7104 1 1 45 LYS HD3 H -0.756 5.578 -8.566 1.00 . A A . 45 LYS HD3 1 1 10 7105 1 1 45 LYS HE2 H -2.584 4.049 -9.309 1.00 . A A . 45 LYS HE2 1 1 10 7106 1 1 45 LYS HE3 H -2.980 5.222 -10.565 1.00 . A A . 45 LYS HE3 1 1 10 7107 1 1 45 LYS HG2 H -2.968 5.576 -7.459 1.00 . A A . 45 LYS HG2 1 1 10 7108 1 1 45 LYS HG3 H -3.487 6.857 -8.561 1.00 . A A . 45 LYS HG3 1 1 10 7109 1 1 45 LYS HZ1 H -0.200 4.637 -10.566 1.00 . A A . 45 LYS HZ1 1 1 10 7110 1 1 45 LYS HZ2 H -1.331 4.467 -11.817 1.00 . A A . 45 LYS HZ2 1 1 10 7111 1 1 45 LYS HZ3 H -1.103 3.210 -10.709 1.00 . A A . 45 LYS HZ3 1 1 10 7112 1 1 45 LYS N N -3.372 6.963 -5.141 1.00 . A A . 45 LYS N 1 1 10 7113 1 1 45 LYS NZ N -1.135 4.243 -10.823 1.00 . A A . 45 LYS NZ 1 1 10 7114 1 1 45 LYS O O -5.296 8.231 -6.516 1.00 . A A . 45 LYS O 1 1 10 7115 1 1 46 GLU C C -5.350 9.715 -9.427 1.00 . A A . 46 GLU C 1 1 10 7116 1 1 46 GLU CA C -4.924 10.451 -8.160 1.00 . A A . 46 GLU CA 1 1 10 7117 1 1 46 GLU CB C -4.418 11.856 -8.488 1.00 . A A . 46 GLU CB 1 1 10 7118 1 1 46 GLU CD C -2.408 13.250 -9.134 1.00 . A A . 46 GLU CD 1 1 10 7119 1 1 46 GLU CG C -3.031 11.869 -9.114 1.00 . A A . 46 GLU CG 1 1 10 7120 1 1 46 GLU H H -2.958 9.996 -7.573 1.00 . A A . 46 GLU H 1 1 10 7121 1 1 46 GLU HA H -5.776 10.530 -7.500 1.00 . A A . 46 GLU HA 1 1 10 7122 1 1 46 GLU HB2 H -5.106 12.323 -9.178 1.00 . A A . 46 GLU HB2 1 1 10 7123 1 1 46 GLU HB3 H -4.385 12.437 -7.578 1.00 . A A . 46 GLU HB3 1 1 10 7124 1 1 46 GLU HG2 H -2.390 11.211 -8.547 1.00 . A A . 46 GLU HG2 1 1 10 7125 1 1 46 GLU HG3 H -3.106 11.509 -10.129 1.00 . A A . 46 GLU HG3 1 1 10 7126 1 1 46 GLU N N -3.889 9.713 -7.464 1.00 . A A . 46 GLU N 1 1 10 7127 1 1 46 GLU O O -4.562 8.975 -10.025 1.00 . A A . 46 GLU O 1 1 10 7128 1 1 46 GLU OE1 O -3.071 14.210 -8.689 1.00 . A A . 46 GLU OE1 1 1 10 7129 1 1 46 GLU OE2 O -1.251 13.370 -9.586 1.00 . A A . 46 GLU OE2 1 1 10 7130 1 1 47 CYS C C -8.533 9.903 -11.274 1.00 . A A . 47 CYS C 1 1 10 7131 1 1 47 CYS CA C -7.165 9.297 -11.001 1.00 . A A . 47 CYS CA 1 1 10 7132 1 1 47 CYS CB C -7.289 7.780 -10.825 1.00 . A A . 47 CYS CB 1 1 10 7133 1 1 47 CYS H H -7.164 10.518 -9.290 1.00 . A A . 47 CYS H 1 1 10 7134 1 1 47 CYS HA H -6.512 9.505 -11.833 1.00 . A A . 47 CYS HA 1 1 10 7135 1 1 47 CYS HB2 H -7.680 7.352 -11.736 1.00 . A A . 47 CYS HB2 1 1 10 7136 1 1 47 CYS HB3 H -6.309 7.367 -10.633 1.00 . A A . 47 CYS HB3 1 1 10 7137 1 1 47 CYS N N -6.597 9.920 -9.816 1.00 . A A . 47 CYS N 1 1 10 7138 1 1 47 CYS O O -9.069 10.563 -10.353 1.00 . A A . 47 CYS O 1 1 10 7139 1 1 47 CYS OXT O -9.058 9.728 -12.388 1.00 . A A . 47 CYS OXT 1 1 10 7140 1 1 47 CYS SG S -8.384 7.266 -9.462 1.00 . A A . 47 CYS SG 1 1 11 7141 1 1 1 ALA C C -8.395 8.849 -8.919 1.00 . A A . 1 ALA C 1 1 11 7142 1 1 1 ALA CA C -9.486 9.320 -9.865 1.00 . A A . 1 ALA CA 1 1 11 7143 1 1 1 ALA CB C -9.995 8.166 -10.717 1.00 . A A . 1 ALA CB 1 1 11 7144 1 1 1 ALA H1 H -8.406 11.068 -10.158 1.00 . A A . 1 ALA H1 1 1 11 7145 1 1 1 ALA H2 H -9.771 10.935 -11.144 1.00 . A A . 1 ALA H2 1 1 11 7146 1 1 1 ALA H3 H -8.385 10.021 -11.488 1.00 . A A . 1 ALA H3 1 1 11 7147 1 1 1 ALA HA H -10.307 9.698 -9.282 1.00 . A A . 1 ALA HA 1 1 11 7148 1 1 1 ALA HB1 H -9.616 8.267 -11.724 1.00 . A A . 1 ALA HB1 1 1 11 7149 1 1 1 ALA HB2 H -11.075 8.181 -10.735 1.00 . A A . 1 ALA HB2 1 1 11 7150 1 1 1 ALA HB3 H -9.655 7.231 -10.297 1.00 . A A . 1 ALA HB3 1 1 11 7151 1 1 1 ALA N N -8.983 10.415 -10.720 1.00 . A A . 1 ALA N 1 1 11 7152 1 1 1 ALA O O -7.242 9.258 -9.047 1.00 . A A . 1 ALA O 1 1 11 7153 1 1 2 THR C C -7.778 5.956 -7.092 1.00 . A A . 2 THR C 1 1 11 7154 1 1 2 THR CA C -7.813 7.477 -7.008 1.00 . A A . 2 THR CA 1 1 11 7155 1 1 2 THR CB C -8.180 7.912 -5.577 1.00 . A A . 2 THR CB 1 1 11 7156 1 1 2 THR CG2 C -7.048 7.603 -4.607 1.00 . A A . 2 THR CG2 1 1 11 7157 1 1 2 THR H H -9.696 7.714 -7.918 1.00 . A A . 2 THR H 1 1 11 7158 1 1 2 THR HA H -6.835 7.869 -7.249 1.00 . A A . 2 THR HA 1 1 11 7159 1 1 2 THR HB H -9.062 7.370 -5.266 1.00 . A A . 2 THR HB 1 1 11 7160 1 1 2 THR HG1 H -8.078 9.709 -4.767 1.00 . A A . 2 THR HG1 1 1 11 7161 1 1 2 THR HG21 H -7.450 7.130 -3.723 1.00 . A A . 2 THR HG21 1 1 11 7162 1 1 2 THR HG22 H -6.551 8.521 -4.329 1.00 . A A . 2 THR HG22 1 1 11 7163 1 1 2 THR HG23 H -6.339 6.939 -5.080 1.00 . A A . 2 THR HG23 1 1 11 7164 1 1 2 THR N N -8.763 8.000 -7.972 1.00 . A A . 2 THR N 1 1 11 7165 1 1 2 THR O O -8.712 5.276 -6.666 1.00 . A A . 2 THR O 1 1 11 7166 1 1 2 THR OG1 O -8.461 9.319 -5.557 1.00 . A A . 2 THR OG1 1 1 11 7167 1 1 3 CYS C C -5.807 3.401 -6.634 1.00 . A A . 3 CYS C 1 1 11 7168 1 1 3 CYS CA C -6.545 4.004 -7.820 1.00 . A A . 3 CYS CA 1 1 11 7169 1 1 3 CYS CB C -5.811 3.708 -9.128 1.00 . A A . 3 CYS CB 1 1 11 7170 1 1 3 CYS H H -6.003 6.036 -7.988 1.00 . A A . 3 CYS H 1 1 11 7171 1 1 3 CYS HA H -7.531 3.567 -7.869 1.00 . A A . 3 CYS HA 1 1 11 7172 1 1 3 CYS HB2 H -4.962 4.373 -9.217 1.00 . A A . 3 CYS HB2 1 1 11 7173 1 1 3 CYS HB3 H -5.465 2.685 -9.119 1.00 . A A . 3 CYS HB3 1 1 11 7174 1 1 3 CYS N N -6.708 5.436 -7.658 1.00 . A A . 3 CYS N 1 1 11 7175 1 1 3 CYS O O -4.825 3.962 -6.150 1.00 . A A . 3 CYS O 1 1 11 7176 1 1 3 CYS SG S -6.844 3.938 -10.610 1.00 . A A . 3 CYS SG 1 1 11 7177 1 1 4 LYS C C -5.479 0.102 -5.342 1.00 . A A . 4 LYS C 1 1 11 7178 1 1 4 LYS CA C -5.690 1.576 -5.035 1.00 . A A . 4 LYS CA 1 1 11 7179 1 1 4 LYS CB C -6.580 1.711 -3.803 1.00 . A A . 4 LYS CB 1 1 11 7180 1 1 4 LYS CD C -7.172 0.639 -1.611 1.00 . A A . 4 LYS CD 1 1 11 7181 1 1 4 LYS CE C -8.300 -0.157 -2.259 1.00 . A A . 4 LYS CE 1 1 11 7182 1 1 4 LYS CG C -6.062 0.938 -2.602 1.00 . A A . 4 LYS CG 1 1 11 7183 1 1 4 LYS H H -7.081 1.867 -6.598 1.00 . A A . 4 LYS H 1 1 11 7184 1 1 4 LYS HA H -4.730 2.031 -4.832 1.00 . A A . 4 LYS HA 1 1 11 7185 1 1 4 LYS HB2 H -6.647 2.754 -3.533 1.00 . A A . 4 LYS HB2 1 1 11 7186 1 1 4 LYS HB3 H -7.567 1.344 -4.042 1.00 . A A . 4 LYS HB3 1 1 11 7187 1 1 4 LYS HD2 H -6.763 0.067 -0.792 1.00 . A A . 4 LYS HD2 1 1 11 7188 1 1 4 LYS HD3 H -7.568 1.573 -1.238 1.00 . A A . 4 LYS HD3 1 1 11 7189 1 1 4 LYS HE2 H -9.015 -0.428 -1.497 1.00 . A A . 4 LYS HE2 1 1 11 7190 1 1 4 LYS HE3 H -8.784 0.466 -2.997 1.00 . A A . 4 LYS HE3 1 1 11 7191 1 1 4 LYS HG2 H -5.637 0.005 -2.942 1.00 . A A . 4 LYS HG2 1 1 11 7192 1 1 4 LYS HG3 H -5.300 1.525 -2.110 1.00 . A A . 4 LYS HG3 1 1 11 7193 1 1 4 LYS HZ1 H -7.073 -1.852 -2.340 1.00 . A A . 4 LYS HZ1 1 1 11 7194 1 1 4 LYS HZ2 H -7.402 -1.173 -3.857 1.00 . A A . 4 LYS HZ2 1 1 11 7195 1 1 4 LYS HZ3 H -8.592 -2.071 -3.054 1.00 . A A . 4 LYS HZ3 1 1 11 7196 1 1 4 LYS N N -6.292 2.259 -6.168 1.00 . A A . 4 LYS N 1 1 11 7197 1 1 4 LYS NZ N -7.807 -1.401 -2.923 1.00 . A A . 4 LYS NZ 1 1 11 7198 1 1 4 LYS O O -6.433 -0.631 -5.618 1.00 . A A . 4 LYS O 1 1 11 7199 1 1 5 ALA C C -2.617 -2.044 -4.710 1.00 . A A . 5 ALA C 1 1 11 7200 1 1 5 ALA CA C -3.866 -1.708 -5.503 1.00 . A A . 5 ALA CA 1 1 11 7201 1 1 5 ALA CB C -3.636 -1.946 -6.989 1.00 . A A . 5 ALA CB 1 1 11 7202 1 1 5 ALA H H -3.528 0.315 -5.003 1.00 . A A . 5 ALA H 1 1 11 7203 1 1 5 ALA HA H -4.678 -2.340 -5.174 1.00 . A A . 5 ALA HA 1 1 11 7204 1 1 5 ALA HB1 H -3.766 -2.995 -7.211 1.00 . A A . 5 ALA HB1 1 1 11 7205 1 1 5 ALA HB2 H -2.633 -1.644 -7.251 1.00 . A A . 5 ALA HB2 1 1 11 7206 1 1 5 ALA HB3 H -4.347 -1.367 -7.560 1.00 . A A . 5 ALA HB3 1 1 11 7207 1 1 5 ALA N N -4.234 -0.326 -5.257 1.00 . A A . 5 ALA N 1 1 11 7208 1 1 5 ALA O O -1.740 -1.198 -4.550 1.00 . A A . 5 ALA O 1 1 11 7209 1 1 6 GLU C C -0.165 -3.747 -4.288 1.00 . A A . 6 GLU C 1 1 11 7210 1 1 6 GLU CA C -1.410 -3.698 -3.417 1.00 . A A . 6 GLU CA 1 1 11 7211 1 1 6 GLU CB C -1.698 -5.063 -2.788 1.00 . A A . 6 GLU CB 1 1 11 7212 1 1 6 GLU CD C -3.500 -6.519 -1.741 1.00 . A A . 6 GLU CD 1 1 11 7213 1 1 6 GLU CG C -3.075 -5.123 -2.142 1.00 . A A . 6 GLU CG 1 1 11 7214 1 1 6 GLU H H -3.281 -3.888 -4.357 1.00 . A A . 6 GLU H 1 1 11 7215 1 1 6 GLU HA H -1.255 -2.973 -2.631 1.00 . A A . 6 GLU HA 1 1 11 7216 1 1 6 GLU HB2 H -1.630 -5.830 -3.543 1.00 . A A . 6 GLU HB2 1 1 11 7217 1 1 6 GLU HB3 H -0.960 -5.256 -2.025 1.00 . A A . 6 GLU HB3 1 1 11 7218 1 1 6 GLU HG2 H -3.066 -4.504 -1.258 1.00 . A A . 6 GLU HG2 1 1 11 7219 1 1 6 GLU HG3 H -3.799 -4.731 -2.842 1.00 . A A . 6 GLU HG3 1 1 11 7220 1 1 6 GLU N N -2.549 -3.263 -4.203 1.00 . A A . 6 GLU N 1 1 11 7221 1 1 6 GLU O O -0.234 -4.138 -5.455 1.00 . A A . 6 GLU O 1 1 11 7222 1 1 6 GLU OE1 O -2.885 -7.498 -2.212 1.00 . A A . 6 GLU OE1 1 1 11 7223 1 1 6 GLU OE2 O -4.465 -6.640 -0.959 1.00 . A A . 6 GLU OE2 1 1 11 7224 1 1 7 CYS C C 2.520 -4.673 -5.030 1.00 . A A . 7 CYS C 1 1 11 7225 1 1 7 CYS CA C 2.222 -3.293 -4.448 1.00 . A A . 7 CYS CA 1 1 11 7226 1 1 7 CYS CB C 3.362 -2.847 -3.521 1.00 . A A . 7 CYS CB 1 1 11 7227 1 1 7 CYS H H 0.923 -3.000 -2.796 1.00 . A A . 7 CYS H 1 1 11 7228 1 1 7 CYS HA H 2.127 -2.584 -5.258 1.00 . A A . 7 CYS HA 1 1 11 7229 1 1 7 CYS HB2 H 3.044 -1.978 -2.964 1.00 . A A . 7 CYS HB2 1 1 11 7230 1 1 7 CYS HB3 H 3.586 -3.647 -2.830 1.00 . A A . 7 CYS HB3 1 1 11 7231 1 1 7 CYS N N 0.955 -3.319 -3.723 1.00 . A A . 7 CYS N 1 1 11 7232 1 1 7 CYS O O 2.501 -5.669 -4.309 1.00 . A A . 7 CYS O 1 1 11 7233 1 1 7 CYS SG S 4.912 -2.411 -4.388 1.00 . A A . 7 CYS SG 1 1 11 7234 1 1 8 PRO C C 4.143 -6.830 -6.368 1.00 . A A . 8 PRO C 1 1 11 7235 1 1 8 PRO CA C 3.051 -6.013 -7.047 1.00 . A A . 8 PRO CA 1 1 11 7236 1 1 8 PRO CB C 3.508 -5.559 -8.434 1.00 . A A . 8 PRO CB 1 1 11 7237 1 1 8 PRO CD C 2.779 -3.599 -7.277 1.00 . A A . 8 PRO CD 1 1 11 7238 1 1 8 PRO CG C 2.846 -4.241 -8.635 1.00 . A A . 8 PRO CG 1 1 11 7239 1 1 8 PRO HA H 2.159 -6.615 -7.140 1.00 . A A . 8 PRO HA 1 1 11 7240 1 1 8 PRO HB2 H 4.585 -5.469 -8.450 1.00 . A A . 8 PRO HB2 1 1 11 7241 1 1 8 PRO HB3 H 3.190 -6.277 -9.175 1.00 . A A . 8 PRO HB3 1 1 11 7242 1 1 8 PRO HD2 H 3.645 -2.975 -7.111 1.00 . A A . 8 PRO HD2 1 1 11 7243 1 1 8 PRO HD3 H 1.872 -3.021 -7.177 1.00 . A A . 8 PRO HD3 1 1 11 7244 1 1 8 PRO HG2 H 3.433 -3.634 -9.308 1.00 . A A . 8 PRO HG2 1 1 11 7245 1 1 8 PRO HG3 H 1.851 -4.386 -9.030 1.00 . A A . 8 PRO HG3 1 1 11 7246 1 1 8 PRO N N 2.774 -4.747 -6.351 1.00 . A A . 8 PRO N 1 1 11 7247 1 1 8 PRO O O 4.049 -8.050 -6.262 1.00 . A A . 8 PRO O 1 1 11 7248 1 1 9 THR C C 6.019 -6.814 -3.708 1.00 . A A . 9 THR C 1 1 11 7249 1 1 9 THR CA C 6.270 -6.802 -5.212 1.00 . A A . 9 THR CA 1 1 11 7250 1 1 9 THR CB C 7.604 -6.091 -5.506 1.00 . A A . 9 THR CB 1 1 11 7251 1 1 9 THR CG2 C 8.000 -6.260 -6.966 1.00 . A A . 9 THR CG2 1 1 11 7252 1 1 9 THR H H 5.184 -5.176 -5.998 1.00 . A A . 9 THR H 1 1 11 7253 1 1 9 THR HA H 6.335 -7.819 -5.570 1.00 . A A . 9 THR HA 1 1 11 7254 1 1 9 THR HB H 8.373 -6.526 -4.885 1.00 . A A . 9 THR HB 1 1 11 7255 1 1 9 THR HG1 H 7.128 -4.607 -4.297 1.00 . A A . 9 THR HG1 1 1 11 7256 1 1 9 THR HG21 H 7.522 -7.141 -7.369 1.00 . A A . 9 THR HG21 1 1 11 7257 1 1 9 THR HG22 H 9.072 -6.369 -7.037 1.00 . A A . 9 THR HG22 1 1 11 7258 1 1 9 THR HG23 H 7.688 -5.392 -7.527 1.00 . A A . 9 THR HG23 1 1 11 7259 1 1 9 THR N N 5.172 -6.147 -5.896 1.00 . A A . 9 THR N 1 1 11 7260 1 1 9 THR O O 6.874 -6.400 -2.924 1.00 . A A . 9 THR O 1 1 11 7261 1 1 9 THR OG1 O 7.483 -4.696 -5.197 1.00 . A A . 9 THR OG1 1 1 11 7262 1 1 10 TRP C C 3.369 -8.344 -1.689 1.00 . A A . 10 TRP C 1 1 11 7263 1 1 10 TRP CA C 4.467 -7.311 -1.913 1.00 . A A . 10 TRP CA 1 1 11 7264 1 1 10 TRP CB C 3.985 -5.935 -1.444 1.00 . A A . 10 TRP CB 1 1 11 7265 1 1 10 TRP CD1 C 3.108 -6.332 0.927 1.00 . A A . 10 TRP CD1 1 1 11 7266 1 1 10 TRP CD2 C 4.915 -5.015 0.819 1.00 . A A . 10 TRP CD2 1 1 11 7267 1 1 10 TRP CE2 C 4.546 -5.155 2.170 1.00 . A A . 10 TRP CE2 1 1 11 7268 1 1 10 TRP CE3 C 6.024 -4.227 0.500 1.00 . A A . 10 TRP CE3 1 1 11 7269 1 1 10 TRP CG C 3.990 -5.783 0.044 1.00 . A A . 10 TRP CG 1 1 11 7270 1 1 10 TRP CH2 C 6.331 -3.768 2.857 1.00 . A A . 10 TRP CH2 1 1 11 7271 1 1 10 TRP CZ2 C 5.252 -4.533 3.201 1.00 . A A . 10 TRP CZ2 1 1 11 7272 1 1 10 TRP CZ3 C 6.719 -3.612 1.522 1.00 . A A . 10 TRP CZ3 1 1 11 7273 1 1 10 TRP H H 4.187 -7.567 -3.989 1.00 . A A . 10 TRP H 1 1 11 7274 1 1 10 TRP HA H 5.339 -7.594 -1.344 1.00 . A A . 10 TRP HA 1 1 11 7275 1 1 10 TRP HB2 H 4.629 -5.175 -1.859 1.00 . A A . 10 TRP HB2 1 1 11 7276 1 1 10 TRP HB3 H 2.975 -5.776 -1.794 1.00 . A A . 10 TRP HB3 1 1 11 7277 1 1 10 TRP HD1 H 2.280 -6.971 0.642 1.00 . A A . 10 TRP HD1 1 1 11 7278 1 1 10 TRP HE1 H 2.964 -6.250 3.024 1.00 . A A . 10 TRP HE1 1 1 11 7279 1 1 10 TRP HE3 H 6.338 -4.095 -0.525 1.00 . A A . 10 TRP HE3 1 1 11 7280 1 1 10 TRP HH2 H 6.904 -3.267 3.622 1.00 . A A . 10 TRP HH2 1 1 11 7281 1 1 10 TRP HZ2 H 4.971 -4.640 4.236 1.00 . A A . 10 TRP HZ2 1 1 11 7282 1 1 10 TRP HZ3 H 7.576 -2.996 1.294 1.00 . A A . 10 TRP HZ3 1 1 11 7283 1 1 10 TRP N N 4.837 -7.265 -3.315 1.00 . A A . 10 TRP N 1 1 11 7284 1 1 10 TRP NE1 N 3.441 -5.969 2.211 1.00 . A A . 10 TRP NE1 1 1 11 7285 1 1 10 TRP O O 2.430 -8.447 -2.476 1.00 . A A . 10 TRP O 1 1 11 7286 1 1 11 ASP C C 2.488 -10.346 1.238 1.00 . A A . 11 ASP C 1 1 11 7287 1 1 11 ASP CA C 2.541 -10.142 -0.271 1.00 . A A . 11 ASP CA 1 1 11 7288 1 1 11 ASP CB C 2.916 -11.466 -0.958 1.00 . A A . 11 ASP CB 1 1 11 7289 1 1 11 ASP CG C 4.333 -11.929 -0.637 1.00 . A A . 11 ASP CG 1 1 11 7290 1 1 11 ASP H H 4.282 -8.970 -0.040 1.00 . A A . 11 ASP H 1 1 11 7291 1 1 11 ASP HA H 1.570 -9.826 -0.618 1.00 . A A . 11 ASP HA 1 1 11 7292 1 1 11 ASP HB2 H 2.229 -12.235 -0.638 1.00 . A A . 11 ASP HB2 1 1 11 7293 1 1 11 ASP HB3 H 2.833 -11.342 -2.028 1.00 . A A . 11 ASP HB3 1 1 11 7294 1 1 11 ASP N N 3.505 -9.104 -0.616 1.00 . A A . 11 ASP N 1 1 11 7295 1 1 11 ASP O O 1.465 -10.757 1.792 1.00 . A A . 11 ASP O 1 1 11 7296 1 1 11 ASP OD1 O 4.620 -12.221 0.547 1.00 . A A . 11 ASP OD1 1 1 11 7297 1 1 11 ASP OD2 O 5.162 -11.988 -1.566 1.00 . A A . 11 ASP OD2 1 1 11 7298 1 1 12 SER C C 3.020 -9.213 4.133 1.00 . A A . 12 SER C 1 1 11 7299 1 1 12 SER CA C 3.760 -10.273 3.314 1.00 . A A . 12 SER CA 1 1 11 7300 1 1 12 SER CB C 5.245 -10.273 3.666 1.00 . A A . 12 SER CB 1 1 11 7301 1 1 12 SER H H 4.390 -9.796 1.367 1.00 . A A . 12 SER H 1 1 11 7302 1 1 12 SER HA H 3.352 -11.241 3.560 1.00 . A A . 12 SER HA 1 1 11 7303 1 1 12 SER HB2 H 5.655 -9.289 3.490 1.00 . A A . 12 SER HB2 1 1 11 7304 1 1 12 SER HB3 H 5.367 -10.533 4.707 1.00 . A A . 12 SER HB3 1 1 11 7305 1 1 12 SER HG H 5.378 -11.550 2.162 1.00 . A A . 12 SER HG 1 1 11 7306 1 1 12 SER N N 3.615 -10.089 1.882 1.00 . A A . 12 SER N 1 1 11 7307 1 1 12 SER O O 2.441 -8.264 3.595 1.00 . A A . 12 SER O 1 1 11 7308 1 1 12 SER OG O 5.955 -11.212 2.873 1.00 . A A . 12 SER OG 1 1 11 7309 1 1 13 VAL C C 3.233 -7.233 6.596 1.00 . A A . 13 VAL C 1 1 11 7310 1 1 13 VAL CA C 2.401 -8.497 6.382 1.00 . A A . 13 VAL CA 1 1 11 7311 1 1 13 VAL CB C 2.180 -9.201 7.743 1.00 . A A . 13 VAL CB 1 1 11 7312 1 1 13 VAL CG1 C 1.564 -8.258 8.765 1.00 . A A . 13 VAL CG1 1 1 11 7313 1 1 13 VAL CG2 C 1.312 -10.439 7.566 1.00 . A A . 13 VAL CG2 1 1 11 7314 1 1 13 VAL H H 3.533 -10.174 5.800 1.00 . A A . 13 VAL H 1 1 11 7315 1 1 13 VAL HA H 1.438 -8.225 5.977 1.00 . A A . 13 VAL HA 1 1 11 7316 1 1 13 VAL HB H 3.142 -9.518 8.118 1.00 . A A . 13 VAL HB 1 1 11 7317 1 1 13 VAL HG11 H 0.837 -8.794 9.357 1.00 . A A . 13 VAL HG11 1 1 11 7318 1 1 13 VAL HG12 H 1.078 -7.440 8.253 1.00 . A A . 13 VAL HG12 1 1 11 7319 1 1 13 VAL HG13 H 2.338 -7.870 9.409 1.00 . A A . 13 VAL HG13 1 1 11 7320 1 1 13 VAL HG21 H 1.140 -10.611 6.514 1.00 . A A . 13 VAL HG21 1 1 11 7321 1 1 13 VAL HG22 H 0.366 -10.289 8.066 1.00 . A A . 13 VAL HG22 1 1 11 7322 1 1 13 VAL HG23 H 1.814 -11.294 7.994 1.00 . A A . 13 VAL HG23 1 1 11 7323 1 1 13 VAL N N 3.053 -9.398 5.446 1.00 . A A . 13 VAL N 1 1 11 7324 1 1 13 VAL O O 4.433 -7.304 6.864 1.00 . A A . 13 VAL O 1 1 11 7325 1 1 14 CYS C C 3.576 -4.562 8.130 1.00 . A A . 14 CYS C 1 1 11 7326 1 1 14 CYS CA C 3.243 -4.799 6.662 1.00 . A A . 14 CYS CA 1 1 11 7327 1 1 14 CYS CB C 2.354 -3.669 6.137 1.00 . A A . 14 CYS CB 1 1 11 7328 1 1 14 CYS H H 1.625 -6.098 6.262 1.00 . A A . 14 CYS H 1 1 11 7329 1 1 14 CYS HA H 4.161 -4.814 6.095 1.00 . A A . 14 CYS HA 1 1 11 7330 1 1 14 CYS HB2 H 2.579 -3.500 5.095 1.00 . A A . 14 CYS HB2 1 1 11 7331 1 1 14 CYS HB3 H 1.319 -3.964 6.232 1.00 . A A . 14 CYS HB3 1 1 11 7332 1 1 14 CYS N N 2.583 -6.084 6.476 1.00 . A A . 14 CYS N 1 1 11 7333 1 1 14 CYS O O 2.713 -4.672 9.003 1.00 . A A . 14 CYS O 1 1 11 7334 1 1 14 CYS SG S 2.560 -2.082 7.009 1.00 . A A . 14 CYS SG 1 1 11 7335 1 1 15 ILE C C 5.351 -2.472 10.011 1.00 . A A . 15 ILE C 1 1 11 7336 1 1 15 ILE CA C 5.294 -3.976 9.745 1.00 . A A . 15 ILE CA 1 1 11 7337 1 1 15 ILE CB C 6.689 -4.601 9.985 1.00 . A A . 15 ILE CB 1 1 11 7338 1 1 15 ILE CD1 C 8.033 -6.754 9.706 1.00 . A A . 15 ILE CD1 1 1 11 7339 1 1 15 ILE CG1 C 6.680 -6.083 9.595 1.00 . A A . 15 ILE CG1 1 1 11 7340 1 1 15 ILE CG2 C 7.109 -4.439 11.442 1.00 . A A . 15 ILE CG2 1 1 11 7341 1 1 15 ILE H H 5.467 -4.166 7.651 1.00 . A A . 15 ILE H 1 1 11 7342 1 1 15 ILE HA H 4.593 -4.429 10.431 1.00 . A A . 15 ILE HA 1 1 11 7343 1 1 15 ILE HB H 7.405 -4.078 9.369 1.00 . A A . 15 ILE HB 1 1 11 7344 1 1 15 ILE HD11 H 8.074 -7.595 9.030 1.00 . A A . 15 ILE HD11 1 1 11 7345 1 1 15 ILE HD12 H 8.182 -7.098 10.719 1.00 . A A . 15 ILE HD12 1 1 11 7346 1 1 15 ILE HD13 H 8.807 -6.046 9.449 1.00 . A A . 15 ILE HD13 1 1 11 7347 1 1 15 ILE HG12 H 5.996 -6.613 10.241 1.00 . A A . 15 ILE HG12 1 1 11 7348 1 1 15 ILE HG13 H 6.346 -6.176 8.572 1.00 . A A . 15 ILE HG13 1 1 11 7349 1 1 15 ILE HG21 H 6.625 -3.569 11.861 1.00 . A A . 15 ILE HG21 1 1 11 7350 1 1 15 ILE HG22 H 8.180 -4.316 11.496 1.00 . A A . 15 ILE HG22 1 1 11 7351 1 1 15 ILE HG23 H 6.819 -5.317 12.000 1.00 . A A . 15 ILE HG23 1 1 11 7352 1 1 15 ILE N N 4.832 -4.234 8.390 1.00 . A A . 15 ILE N 1 1 11 7353 1 1 15 ILE O O 5.247 -2.023 11.152 1.00 . A A . 15 ILE O 1 1 11 7354 1 1 16 ASN C C 5.150 0.436 7.780 1.00 . A A . 16 ASN C 1 1 11 7355 1 1 16 ASN CA C 5.601 -0.243 9.074 1.00 . A A . 16 ASN CA 1 1 11 7356 1 1 16 ASN CB C 7.039 0.166 9.437 1.00 . A A . 16 ASN CB 1 1 11 7357 1 1 16 ASN CG C 7.178 1.634 9.807 1.00 . A A . 16 ASN CG 1 1 11 7358 1 1 16 ASN H H 5.595 -2.098 8.061 1.00 . A A . 16 ASN H 1 1 11 7359 1 1 16 ASN HA H 4.939 0.056 9.872 1.00 . A A . 16 ASN HA 1 1 11 7360 1 1 16 ASN HB2 H 7.368 -0.425 10.279 1.00 . A A . 16 ASN HB2 1 1 11 7361 1 1 16 ASN HB3 H 7.683 -0.035 8.593 1.00 . A A . 16 ASN HB3 1 1 11 7362 1 1 16 ASN HD21 H 7.379 1.155 11.724 1.00 . A A . 16 ASN HD21 1 1 11 7363 1 1 16 ASN HD22 H 7.440 2.843 11.359 1.00 . A A . 16 ASN HD22 1 1 11 7364 1 1 16 ASN N N 5.520 -1.692 8.948 1.00 . A A . 16 ASN N 1 1 11 7365 1 1 16 ASN ND2 N 7.351 1.905 11.091 1.00 . A A . 16 ASN ND2 1 1 11 7366 1 1 16 ASN O O 5.232 -0.150 6.700 1.00 . A A . 16 ASN O 1 1 11 7367 1 1 16 ASN OD1 O 7.130 2.516 8.950 1.00 . A A . 16 ASN OD1 1 1 11 7368 1 1 17 LYS C C 5.290 2.743 5.766 1.00 . A A . 17 LYS C 1 1 11 7369 1 1 17 LYS CA C 4.179 2.458 6.784 1.00 . A A . 17 LYS CA 1 1 11 7370 1 1 17 LYS CB C 3.603 3.780 7.317 1.00 . A A . 17 LYS CB 1 1 11 7371 1 1 17 LYS CD C 1.640 4.402 5.854 1.00 . A A . 17 LYS CD 1 1 11 7372 1 1 17 LYS CE C 0.945 5.602 5.219 1.00 . A A . 17 LYS CE 1 1 11 7373 1 1 17 LYS CG C 3.070 4.734 6.254 1.00 . A A . 17 LYS CG 1 1 11 7374 1 1 17 LYS H H 4.626 2.057 8.809 1.00 . A A . 17 LYS H 1 1 11 7375 1 1 17 LYS HA H 3.390 1.904 6.299 1.00 . A A . 17 LYS HA 1 1 11 7376 1 1 17 LYS HB2 H 2.791 3.551 7.989 1.00 . A A . 17 LYS HB2 1 1 11 7377 1 1 17 LYS HB3 H 4.376 4.292 7.870 1.00 . A A . 17 LYS HB3 1 1 11 7378 1 1 17 LYS HD2 H 1.655 3.589 5.144 1.00 . A A . 17 LYS HD2 1 1 11 7379 1 1 17 LYS HD3 H 1.091 4.103 6.735 1.00 . A A . 17 LYS HD3 1 1 11 7380 1 1 17 LYS HE2 H -0.069 5.324 4.974 1.00 . A A . 17 LYS HE2 1 1 11 7381 1 1 17 LYS HE3 H 0.931 6.412 5.934 1.00 . A A . 17 LYS HE3 1 1 11 7382 1 1 17 LYS HG2 H 3.097 5.741 6.642 1.00 . A A . 17 LYS HG2 1 1 11 7383 1 1 17 LYS HG3 H 3.701 4.668 5.379 1.00 . A A . 17 LYS HG3 1 1 11 7384 1 1 17 LYS HZ1 H 2.598 6.363 4.191 1.00 . A A . 17 LYS HZ1 1 1 11 7385 1 1 17 LYS HZ2 H 1.112 6.867 3.553 1.00 . A A . 17 LYS HZ2 1 1 11 7386 1 1 17 LYS HZ3 H 1.663 5.287 3.282 1.00 . A A . 17 LYS HZ3 1 1 11 7387 1 1 17 LYS N N 4.664 1.665 7.912 1.00 . A A . 17 LYS N 1 1 11 7388 1 1 17 LYS NZ N 1.629 6.060 3.982 1.00 . A A . 17 LYS NZ 1 1 11 7389 1 1 17 LYS O O 5.048 2.710 4.560 1.00 . A A . 17 LYS O 1 1 11 7390 1 1 18 LYS C C 7.875 2.293 4.307 1.00 . A A . 18 LYS C 1 1 11 7391 1 1 18 LYS CA C 7.641 3.356 5.395 1.00 . A A . 18 LYS CA 1 1 11 7392 1 1 18 LYS CB C 8.911 3.568 6.230 1.00 . A A . 18 LYS CB 1 1 11 7393 1 1 18 LYS CD C 11.334 4.263 6.285 1.00 . A A . 18 LYS CD 1 1 11 7394 1 1 18 LYS CE C 11.807 2.992 6.974 1.00 . A A . 18 LYS CE 1 1 11 7395 1 1 18 LYS CG C 10.115 4.011 5.410 1.00 . A A . 18 LYS CG 1 1 11 7396 1 1 18 LYS H H 6.617 3.055 7.236 1.00 . A A . 18 LYS H 1 1 11 7397 1 1 18 LYS HA H 7.406 4.287 4.900 1.00 . A A . 18 LYS HA 1 1 11 7398 1 1 18 LYS HB2 H 8.714 4.322 6.978 1.00 . A A . 18 LYS HB2 1 1 11 7399 1 1 18 LYS HB3 H 9.161 2.640 6.725 1.00 . A A . 18 LYS HB3 1 1 11 7400 1 1 18 LYS HD2 H 12.134 4.643 5.668 1.00 . A A . 18 LYS HD2 1 1 11 7401 1 1 18 LYS HD3 H 11.079 4.996 7.036 1.00 . A A . 18 LYS HD3 1 1 11 7402 1 1 18 LYS HE2 H 11.012 2.624 7.605 1.00 . A A . 18 LYS HE2 1 1 11 7403 1 1 18 LYS HE3 H 12.039 2.255 6.220 1.00 . A A . 18 LYS HE3 1 1 11 7404 1 1 18 LYS HG2 H 10.353 3.239 4.694 1.00 . A A . 18 LYS HG2 1 1 11 7405 1 1 18 LYS HG3 H 9.864 4.923 4.887 1.00 . A A . 18 LYS HG3 1 1 11 7406 1 1 18 LYS HZ1 H 13.251 2.377 8.352 1.00 . A A . 18 LYS HZ1 1 1 11 7407 1 1 18 LYS HZ2 H 12.845 4.015 8.470 1.00 . A A . 18 LYS HZ2 1 1 11 7408 1 1 18 LYS HZ3 H 13.825 3.477 7.202 1.00 . A A . 18 LYS HZ3 1 1 11 7409 1 1 18 LYS N N 6.496 3.037 6.260 1.00 . A A . 18 LYS N 1 1 11 7410 1 1 18 LYS NZ N 13.016 3.232 7.808 1.00 . A A . 18 LYS NZ 1 1 11 7411 1 1 18 LYS O O 7.878 2.632 3.124 1.00 . A A . 18 LYS O 1 1 11 7412 1 1 19 PRO C C 7.231 -0.066 2.582 1.00 . A A . 19 PRO C 1 1 11 7413 1 1 19 PRO CA C 8.291 -0.072 3.679 1.00 . A A . 19 PRO CA 1 1 11 7414 1 1 19 PRO CB C 8.168 -1.347 4.516 1.00 . A A . 19 PRO CB 1 1 11 7415 1 1 19 PRO CD C 8.106 0.470 6.047 1.00 . A A . 19 PRO CD 1 1 11 7416 1 1 19 PRO CG C 8.606 -0.936 5.873 1.00 . A A . 19 PRO CG 1 1 11 7417 1 1 19 PRO HA H 9.275 -0.015 3.237 1.00 . A A . 19 PRO HA 1 1 11 7418 1 1 19 PRO HB2 H 7.140 -1.680 4.515 1.00 . A A . 19 PRO HB2 1 1 11 7419 1 1 19 PRO HB3 H 8.801 -2.120 4.109 1.00 . A A . 19 PRO HB3 1 1 11 7420 1 1 19 PRO HD2 H 7.117 0.467 6.483 1.00 . A A . 19 PRO HD2 1 1 11 7421 1 1 19 PRO HD3 H 8.788 1.040 6.660 1.00 . A A . 19 PRO HD3 1 1 11 7422 1 1 19 PRO HG2 H 8.167 -1.588 6.615 1.00 . A A . 19 PRO HG2 1 1 11 7423 1 1 19 PRO HG3 H 9.683 -0.962 5.937 1.00 . A A . 19 PRO HG3 1 1 11 7424 1 1 19 PRO N N 8.072 0.999 4.668 1.00 . A A . 19 PRO N 1 1 11 7425 1 1 19 PRO O O 7.538 -0.221 1.395 1.00 . A A . 19 PRO O 1 1 11 7426 1 1 20 CYS C C 5.014 1.346 1.108 1.00 . A A . 20 CYS C 1 1 11 7427 1 1 20 CYS CA C 4.868 0.166 2.065 1.00 . A A . 20 CYS CA 1 1 11 7428 1 1 20 CYS CB C 3.549 0.261 2.838 1.00 . A A . 20 CYS CB 1 1 11 7429 1 1 20 CYS H H 5.814 0.254 3.950 1.00 . A A . 20 CYS H 1 1 11 7430 1 1 20 CYS HA H 4.879 -0.751 1.494 1.00 . A A . 20 CYS HA 1 1 11 7431 1 1 20 CYS HB2 H 3.509 -0.536 3.565 1.00 . A A . 20 CYS HB2 1 1 11 7432 1 1 20 CYS HB3 H 3.510 1.211 3.351 1.00 . A A . 20 CYS HB3 1 1 11 7433 1 1 20 CYS N N 5.985 0.126 2.993 1.00 . A A . 20 CYS N 1 1 11 7434 1 1 20 CYS O O 4.943 1.180 -0.111 1.00 . A A . 20 CYS O 1 1 11 7435 1 1 20 CYS SG S 2.061 0.131 1.798 1.00 . A A . 20 CYS SG 1 1 11 7436 1 1 21 VAL C C 6.559 3.560 -0.137 1.00 . A A . 21 VAL C 1 1 11 7437 1 1 21 VAL CA C 5.424 3.739 0.862 1.00 . A A . 21 VAL CA 1 1 11 7438 1 1 21 VAL CB C 5.717 4.978 1.741 1.00 . A A . 21 VAL CB 1 1 11 7439 1 1 21 VAL CG1 C 5.867 6.230 0.887 1.00 . A A . 21 VAL CG1 1 1 11 7440 1 1 21 VAL CG2 C 4.624 5.171 2.777 1.00 . A A . 21 VAL CG2 1 1 11 7441 1 1 21 VAL H H 5.316 2.596 2.644 1.00 . A A . 21 VAL H 1 1 11 7442 1 1 21 VAL HA H 4.505 3.916 0.316 1.00 . A A . 21 VAL HA 1 1 11 7443 1 1 21 VAL HB H 6.649 4.811 2.261 1.00 . A A . 21 VAL HB 1 1 11 7444 1 1 21 VAL HG11 H 6.239 5.957 -0.089 1.00 . A A . 21 VAL HG11 1 1 11 7445 1 1 21 VAL HG12 H 6.561 6.907 1.362 1.00 . A A . 21 VAL HG12 1 1 11 7446 1 1 21 VAL HG13 H 4.906 6.712 0.784 1.00 . A A . 21 VAL HG13 1 1 11 7447 1 1 21 VAL HG21 H 4.763 6.120 3.274 1.00 . A A . 21 VAL HG21 1 1 11 7448 1 1 21 VAL HG22 H 4.671 4.374 3.504 1.00 . A A . 21 VAL HG22 1 1 11 7449 1 1 21 VAL HG23 H 3.660 5.158 2.291 1.00 . A A . 21 VAL HG23 1 1 11 7450 1 1 21 VAL N N 5.248 2.533 1.665 1.00 . A A . 21 VAL N 1 1 11 7451 1 1 21 VAL O O 6.452 3.985 -1.281 1.00 . A A . 21 VAL O 1 1 11 7452 1 1 22 ALA C C 8.395 1.820 -1.768 1.00 . A A . 22 ALA C 1 1 11 7453 1 1 22 ALA CA C 8.788 2.679 -0.566 1.00 . A A . 22 ALA CA 1 1 11 7454 1 1 22 ALA CB C 9.911 2.017 0.218 1.00 . A A . 22 ALA CB 1 1 11 7455 1 1 22 ALA H H 7.661 2.598 1.228 1.00 . A A . 22 ALA H 1 1 11 7456 1 1 22 ALA HA H 9.143 3.635 -0.922 1.00 . A A . 22 ALA HA 1 1 11 7457 1 1 22 ALA HB1 H 9.810 0.944 0.156 1.00 . A A . 22 ALA HB1 1 1 11 7458 1 1 22 ALA HB2 H 9.857 2.324 1.252 1.00 . A A . 22 ALA HB2 1 1 11 7459 1 1 22 ALA HB3 H 10.863 2.314 -0.197 1.00 . A A . 22 ALA HB3 1 1 11 7460 1 1 22 ALA N N 7.639 2.920 0.299 1.00 . A A . 22 ALA N 1 1 11 7461 1 1 22 ALA O O 8.737 2.137 -2.912 1.00 . A A . 22 ALA O 1 1 11 7462 1 1 23 CYS C C 6.295 0.601 -3.524 1.00 . A A . 23 CYS C 1 1 11 7463 1 1 23 CYS CA C 7.207 -0.156 -2.563 1.00 . A A . 23 CYS CA 1 1 11 7464 1 1 23 CYS CB C 6.456 -1.350 -1.961 1.00 . A A . 23 CYS CB 1 1 11 7465 1 1 23 CYS H H 7.409 0.549 -0.572 1.00 . A A . 23 CYS H 1 1 11 7466 1 1 23 CYS HA H 8.074 -0.511 -3.101 1.00 . A A . 23 CYS HA 1 1 11 7467 1 1 23 CYS HB2 H 6.941 -1.643 -1.044 1.00 . A A . 23 CYS HB2 1 1 11 7468 1 1 23 CYS HB3 H 5.441 -1.051 -1.742 1.00 . A A . 23 CYS HB3 1 1 11 7469 1 1 23 CYS N N 7.661 0.741 -1.504 1.00 . A A . 23 CYS N 1 1 11 7470 1 1 23 CYS O O 6.438 0.523 -4.751 1.00 . A A . 23 CYS O 1 1 11 7471 1 1 23 CYS SG S 6.379 -2.822 -3.042 1.00 . A A . 23 CYS SG 1 1 11 7472 1 1 24 CYS C C 5.092 3.248 -4.478 1.00 . A A . 24 CYS C 1 1 11 7473 1 1 24 CYS CA C 4.408 2.128 -3.698 1.00 . A A . 24 CYS CA 1 1 11 7474 1 1 24 CYS CB C 3.374 2.710 -2.738 1.00 . A A . 24 CYS CB 1 1 11 7475 1 1 24 CYS H H 5.316 1.350 -1.959 1.00 . A A . 24 CYS H 1 1 11 7476 1 1 24 CYS HA H 3.908 1.471 -4.394 1.00 . A A . 24 CYS HA 1 1 11 7477 1 1 24 CYS HB2 H 3.879 3.335 -2.015 1.00 . A A . 24 CYS HB2 1 1 11 7478 1 1 24 CYS HB3 H 2.669 3.309 -3.289 1.00 . A A . 24 CYS HB3 1 1 11 7479 1 1 24 CYS N N 5.365 1.338 -2.944 1.00 . A A . 24 CYS N 1 1 11 7480 1 1 24 CYS O O 4.709 3.554 -5.604 1.00 . A A . 24 CYS O 1 1 11 7481 1 1 24 CYS SG S 2.438 1.449 -1.818 1.00 . A A . 24 CYS SG 1 1 11 7482 1 1 25 LYS C C 7.524 4.504 -5.761 1.00 . A A . 25 LYS C 1 1 11 7483 1 1 25 LYS CA C 6.805 4.968 -4.503 1.00 . A A . 25 LYS CA 1 1 11 7484 1 1 25 LYS CB C 7.796 5.603 -3.525 1.00 . A A . 25 LYS CB 1 1 11 7485 1 1 25 LYS CD C 7.077 7.911 -4.225 1.00 . A A . 25 LYS CD 1 1 11 7486 1 1 25 LYS CE C 6.158 8.042 -3.018 1.00 . A A . 25 LYS CE 1 1 11 7487 1 1 25 LYS CG C 8.259 6.992 -3.942 1.00 . A A . 25 LYS CG 1 1 11 7488 1 1 25 LYS H H 6.347 3.594 -2.959 1.00 . A A . 25 LYS H 1 1 11 7489 1 1 25 LYS HA H 6.073 5.712 -4.783 1.00 . A A . 25 LYS HA 1 1 11 7490 1 1 25 LYS HB2 H 7.328 5.679 -2.554 1.00 . A A . 25 LYS HB2 1 1 11 7491 1 1 25 LYS HB3 H 8.665 4.966 -3.447 1.00 . A A . 25 LYS HB3 1 1 11 7492 1 1 25 LYS HD2 H 7.450 8.890 -4.486 1.00 . A A . 25 LYS HD2 1 1 11 7493 1 1 25 LYS HD3 H 6.512 7.508 -5.054 1.00 . A A . 25 LYS HD3 1 1 11 7494 1 1 25 LYS HE2 H 5.930 7.054 -2.646 1.00 . A A . 25 LYS HE2 1 1 11 7495 1 1 25 LYS HE3 H 6.669 8.607 -2.253 1.00 . A A . 25 LYS HE3 1 1 11 7496 1 1 25 LYS HG2 H 8.850 7.418 -3.146 1.00 . A A . 25 LYS HG2 1 1 11 7497 1 1 25 LYS HG3 H 8.860 6.907 -4.835 1.00 . A A . 25 LYS HG3 1 1 11 7498 1 1 25 LYS HZ1 H 4.347 8.163 -4.053 1.00 . A A . 25 LYS HZ1 1 1 11 7499 1 1 25 LYS HZ2 H 5.086 9.662 -3.783 1.00 . A A . 25 LYS HZ2 1 1 11 7500 1 1 25 LYS HZ3 H 4.303 8.866 -2.512 1.00 . A A . 25 LYS HZ3 1 1 11 7501 1 1 25 LYS N N 6.091 3.871 -3.870 1.00 . A A . 25 LYS N 1 1 11 7502 1 1 25 LYS NZ N 4.888 8.733 -3.366 1.00 . A A . 25 LYS NZ 1 1 11 7503 1 1 25 LYS O O 7.414 5.140 -6.808 1.00 . A A . 25 LYS O 1 1 11 7504 1 1 26 LYS C C 7.981 2.384 -7.887 1.00 . A A . 26 LYS C 1 1 11 7505 1 1 26 LYS CA C 8.965 2.862 -6.819 1.00 . A A . 26 LYS CA 1 1 11 7506 1 1 26 LYS CB C 9.918 1.728 -6.418 1.00 . A A . 26 LYS CB 1 1 11 7507 1 1 26 LYS CD C 10.176 -0.632 -5.593 1.00 . A A . 26 LYS CD 1 1 11 7508 1 1 26 LYS CE C 9.457 -1.824 -4.986 1.00 . A A . 26 LYS CE 1 1 11 7509 1 1 26 LYS CG C 9.224 0.533 -5.795 1.00 . A A . 26 LYS CG 1 1 11 7510 1 1 26 LYS H H 8.295 2.918 -4.804 1.00 . A A . 26 LYS H 1 1 11 7511 1 1 26 LYS HA H 9.547 3.672 -7.234 1.00 . A A . 26 LYS HA 1 1 11 7512 1 1 26 LYS HB2 H 10.446 1.391 -7.297 1.00 . A A . 26 LYS HB2 1 1 11 7513 1 1 26 LYS HB3 H 10.633 2.112 -5.705 1.00 . A A . 26 LYS HB3 1 1 11 7514 1 1 26 LYS HD2 H 10.589 -0.920 -6.549 1.00 . A A . 26 LYS HD2 1 1 11 7515 1 1 26 LYS HD3 H 10.971 -0.326 -4.930 1.00 . A A . 26 LYS HD3 1 1 11 7516 1 1 26 LYS HE2 H 10.134 -2.666 -4.967 1.00 . A A . 26 LYS HE2 1 1 11 7517 1 1 26 LYS HE3 H 9.162 -1.576 -3.977 1.00 . A A . 26 LYS HE3 1 1 11 7518 1 1 26 LYS HG2 H 8.821 0.823 -4.837 1.00 . A A . 26 LYS HG2 1 1 11 7519 1 1 26 LYS HG3 H 8.419 0.219 -6.445 1.00 . A A . 26 LYS HG3 1 1 11 7520 1 1 26 LYS HZ1 H 8.411 -2.036 -6.782 1.00 . A A . 26 LYS HZ1 1 1 11 7521 1 1 26 LYS HZ2 H 7.433 -1.619 -5.465 1.00 . A A . 26 LYS HZ2 1 1 11 7522 1 1 26 LYS HZ3 H 8.016 -3.204 -5.618 1.00 . A A . 26 LYS HZ3 1 1 11 7523 1 1 26 LYS N N 8.248 3.391 -5.664 1.00 . A A . 26 LYS N 1 1 11 7524 1 1 26 LYS NZ N 8.246 -2.195 -5.769 1.00 . A A . 26 LYS NZ 1 1 11 7525 1 1 26 LYS O O 8.286 2.408 -9.076 1.00 . A A . 26 LYS O 1 1 11 7526 1 1 27 ALA C C 4.947 2.672 -8.939 1.00 . A A . 27 ALA C 1 1 11 7527 1 1 27 ALA CA C 5.765 1.497 -8.387 1.00 . A A . 27 ALA CA 1 1 11 7528 1 1 27 ALA CB C 4.859 0.481 -7.708 1.00 . A A . 27 ALA CB 1 1 11 7529 1 1 27 ALA H H 6.597 1.970 -6.493 1.00 . A A . 27 ALA H 1 1 11 7530 1 1 27 ALA HA H 6.264 1.004 -9.210 1.00 . A A . 27 ALA HA 1 1 11 7531 1 1 27 ALA HB1 H 5.094 -0.509 -8.070 1.00 . A A . 27 ALA HB1 1 1 11 7532 1 1 27 ALA HB2 H 3.828 0.712 -7.932 1.00 . A A . 27 ALA HB2 1 1 11 7533 1 1 27 ALA HB3 H 5.013 0.519 -6.639 1.00 . A A . 27 ALA HB3 1 1 11 7534 1 1 27 ALA N N 6.792 1.960 -7.456 1.00 . A A . 27 ALA N 1 1 11 7535 1 1 27 ALA O O 3.951 2.478 -9.643 1.00 . A A . 27 ALA O 1 1 11 7536 1 1 28 LYS C C 3.343 5.254 -8.433 1.00 . A A . 28 LYS C 1 1 11 7537 1 1 28 LYS CA C 4.741 5.124 -9.031 1.00 . A A . 28 LYS CA 1 1 11 7538 1 1 28 LYS CB C 4.697 5.255 -10.567 1.00 . A A . 28 LYS CB 1 1 11 7539 1 1 28 LYS CD C 3.276 7.353 -10.798 1.00 . A A . 28 LYS CD 1 1 11 7540 1 1 28 LYS CE C 3.290 8.853 -11.046 1.00 . A A . 28 LYS CE 1 1 11 7541 1 1 28 LYS CG C 4.630 6.704 -11.071 1.00 . A A . 28 LYS CG 1 1 11 7542 1 1 28 LYS H H 6.181 3.952 -8.036 1.00 . A A . 28 LYS H 1 1 11 7543 1 1 28 LYS HA H 5.340 5.935 -8.642 1.00 . A A . 28 LYS HA 1 1 11 7544 1 1 28 LYS HB2 H 5.583 4.796 -10.980 1.00 . A A . 28 LYS HB2 1 1 11 7545 1 1 28 LYS HB3 H 3.828 4.730 -10.935 1.00 . A A . 28 LYS HB3 1 1 11 7546 1 1 28 LYS HD2 H 2.538 6.903 -11.445 1.00 . A A . 28 LYS HD2 1 1 11 7547 1 1 28 LYS HD3 H 3.006 7.171 -9.767 1.00 . A A . 28 LYS HD3 1 1 11 7548 1 1 28 LYS HE2 H 4.043 9.303 -10.416 1.00 . A A . 28 LYS HE2 1 1 11 7549 1 1 28 LYS HE3 H 3.535 9.032 -12.083 1.00 . A A . 28 LYS HE3 1 1 11 7550 1 1 28 LYS HG2 H 5.396 7.280 -10.575 1.00 . A A . 28 LYS HG2 1 1 11 7551 1 1 28 LYS HG3 H 4.811 6.708 -12.136 1.00 . A A . 28 LYS HG3 1 1 11 7552 1 1 28 LYS HZ1 H 2.097 10.398 -10.276 1.00 . A A . 28 LYS HZ1 1 1 11 7553 1 1 28 LYS HZ2 H 1.412 8.863 -10.108 1.00 . A A . 28 LYS HZ2 1 1 11 7554 1 1 28 LYS HZ3 H 1.430 9.620 -11.618 1.00 . A A . 28 LYS HZ3 1 1 11 7555 1 1 28 LYS N N 5.385 3.886 -8.604 1.00 . A A . 28 LYS N 1 1 11 7556 1 1 28 LYS NZ N 1.970 9.475 -10.744 1.00 . A A . 28 LYS NZ 1 1 11 7557 1 1 28 LYS O O 2.337 5.209 -9.140 1.00 . A A . 28 LYS O 1 1 11 7558 1 1 29 PHE C C 2.179 6.821 -5.478 1.00 . A A . 29 PHE C 1 1 11 7559 1 1 29 PHE CA C 2.043 5.622 -6.410 1.00 . A A . 29 PHE CA 1 1 11 7560 1 1 29 PHE CB C 1.634 4.375 -5.613 1.00 . A A . 29 PHE CB 1 1 11 7561 1 1 29 PHE CD1 C 1.933 2.400 -7.140 1.00 . A A . 29 PHE CD1 1 1 11 7562 1 1 29 PHE CD2 C -0.281 3.036 -6.535 1.00 . A A . 29 PHE CD2 1 1 11 7563 1 1 29 PHE CE1 C 1.428 1.358 -7.896 1.00 . A A . 29 PHE CE1 1 1 11 7564 1 1 29 PHE CE2 C -0.791 1.995 -7.287 1.00 . A A . 29 PHE CE2 1 1 11 7565 1 1 29 PHE CG C 1.087 3.252 -6.454 1.00 . A A . 29 PHE CG 1 1 11 7566 1 1 29 PHE CZ C 0.065 1.155 -7.969 1.00 . A A . 29 PHE CZ 1 1 11 7567 1 1 29 PHE H H 4.145 5.467 -6.626 1.00 . A A . 29 PHE H 1 1 11 7568 1 1 29 PHE HA H 1.278 5.840 -7.142 1.00 . A A . 29 PHE HA 1 1 11 7569 1 1 29 PHE HB2 H 2.496 4.000 -5.085 1.00 . A A . 29 PHE HB2 1 1 11 7570 1 1 29 PHE HB3 H 0.874 4.650 -4.896 1.00 . A A . 29 PHE HB3 1 1 11 7571 1 1 29 PHE HD1 H 3.000 2.556 -7.086 1.00 . A A . 29 PHE HD1 1 1 11 7572 1 1 29 PHE HD2 H -0.954 3.695 -6.005 1.00 . A A . 29 PHE HD2 1 1 11 7573 1 1 29 PHE HE1 H 2.101 0.703 -8.429 1.00 . A A . 29 PHE HE1 1 1 11 7574 1 1 29 PHE HE2 H -1.858 1.838 -7.341 1.00 . A A . 29 PHE HE2 1 1 11 7575 1 1 29 PHE HZ H -0.330 0.340 -8.557 1.00 . A A . 29 PHE HZ 1 1 11 7576 1 1 29 PHE N N 3.299 5.437 -7.127 1.00 . A A . 29 PHE N 1 1 11 7577 1 1 29 PHE O O 3.273 7.097 -4.969 1.00 . A A . 29 PHE O 1 1 11 7578 1 1 30 SER C C 1.515 8.364 -3.003 1.00 . A A . 30 SER C 1 1 11 7579 1 1 30 SER CA C 1.084 8.724 -4.421 1.00 . A A . 30 SER CA 1 1 11 7580 1 1 30 SER CB C -0.307 9.358 -4.411 1.00 . A A . 30 SER CB 1 1 11 7581 1 1 30 SER H H 0.250 7.280 -5.719 1.00 . A A . 30 SER H 1 1 11 7582 1 1 30 SER HA H 1.789 9.428 -4.829 1.00 . A A . 30 SER HA 1 1 11 7583 1 1 30 SER HB2 H -0.976 8.749 -3.821 1.00 . A A . 30 SER HB2 1 1 11 7584 1 1 30 SER HB3 H -0.247 10.348 -3.982 1.00 . A A . 30 SER HB3 1 1 11 7585 1 1 30 SER HG H -0.537 10.288 -6.127 1.00 . A A . 30 SER HG 1 1 11 7586 1 1 30 SER N N 1.084 7.542 -5.275 1.00 . A A . 30 SER N 1 1 11 7587 1 1 30 SER O O 2.398 9.007 -2.430 1.00 . A A . 30 SER O 1 1 11 7588 1 1 30 SER OG O -0.823 9.459 -5.728 1.00 . A A . 30 SER OG 1 1 11 7589 1 1 31 ASP C C 0.731 5.432 -0.920 1.00 . A A . 31 ASP C 1 1 11 7590 1 1 31 ASP CA C 1.244 6.851 -1.118 1.00 . A A . 31 ASP CA 1 1 11 7591 1 1 31 ASP CB C 0.646 7.765 -0.040 1.00 . A A . 31 ASP CB 1 1 11 7592 1 1 31 ASP CG C 1.196 7.451 1.343 1.00 . A A . 31 ASP CG 1 1 11 7593 1 1 31 ASP H H 0.233 6.835 -2.979 1.00 . A A . 31 ASP H 1 1 11 7594 1 1 31 ASP HA H 2.320 6.850 -1.023 1.00 . A A . 31 ASP HA 1 1 11 7595 1 1 31 ASP HB2 H 0.878 8.793 -0.276 1.00 . A A . 31 ASP HB2 1 1 11 7596 1 1 31 ASP HB3 H -0.426 7.636 -0.020 1.00 . A A . 31 ASP HB3 1 1 11 7597 1 1 31 ASP N N 0.913 7.319 -2.459 1.00 . A A . 31 ASP N 1 1 11 7598 1 1 31 ASP O O -0.247 5.024 -1.549 1.00 . A A . 31 ASP O 1 1 11 7599 1 1 31 ASP OD1 O 2.236 6.763 1.430 1.00 . A A . 31 ASP OD1 1 1 11 7600 1 1 31 ASP OD2 O 0.598 7.886 2.350 1.00 . A A . 31 ASP OD2 1 1 11 7601 1 1 32 GLY C C 0.486 3.208 1.663 1.00 . A A . 32 GLY C 1 1 11 7602 1 1 32 GLY CA C 0.990 3.339 0.248 1.00 . A A . 32 GLY CA 1 1 11 7603 1 1 32 GLY H H 2.149 5.094 0.436 1.00 . A A . 32 GLY H 1 1 11 7604 1 1 32 GLY HA2 H 0.202 3.048 -0.435 1.00 . A A . 32 GLY HA2 1 1 11 7605 1 1 32 GLY HA3 H 1.837 2.684 0.112 1.00 . A A . 32 GLY HA3 1 1 11 7606 1 1 32 GLY N N 1.387 4.697 -0.042 1.00 . A A . 32 GLY N 1 1 11 7607 1 1 32 GLY O O 1.005 3.852 2.575 1.00 . A A . 32 GLY O 1 1 11 7608 1 1 33 HIS C C -1.391 0.721 3.415 1.00 . A A . 33 HIS C 1 1 11 7609 1 1 33 HIS CA C -1.103 2.192 3.170 1.00 . A A . 33 HIS CA 1 1 11 7610 1 1 33 HIS CB C -2.385 3.020 3.316 1.00 . A A . 33 HIS CB 1 1 11 7611 1 1 33 HIS CD2 C -3.768 3.013 1.106 1.00 . A A . 33 HIS CD2 1 1 11 7612 1 1 33 HIS CE1 C -5.257 1.511 1.672 1.00 . A A . 33 HIS CE1 1 1 11 7613 1 1 33 HIS CG C -3.490 2.621 2.375 1.00 . A A . 33 HIS CG 1 1 11 7614 1 1 33 HIS H H -0.902 1.900 1.083 1.00 . A A . 33 HIS H 1 1 11 7615 1 1 33 HIS HA H -0.380 2.532 3.901 1.00 . A A . 33 HIS HA 1 1 11 7616 1 1 33 HIS HB2 H -2.758 2.913 4.323 1.00 . A A . 33 HIS HB2 1 1 11 7617 1 1 33 HIS HB3 H -2.150 4.055 3.137 1.00 . A A . 33 HIS HB3 1 1 11 7618 1 1 33 HIS HD1 H -4.511 1.200 3.549 1.00 . A A . 33 HIS HD1 1 1 11 7619 1 1 33 HIS HD2 H -3.208 3.719 0.515 1.00 . A A . 33 HIS HD2 1 1 11 7620 1 1 33 HIS HE1 H -6.085 0.820 1.629 1.00 . A A . 33 HIS HE1 1 1 11 7621 1 1 33 HIS N N -0.526 2.388 1.854 1.00 . A A . 33 HIS N 1 1 11 7622 1 1 33 HIS ND1 N -4.445 1.679 2.697 1.00 . A A . 33 HIS ND1 1 1 11 7623 1 1 33 HIS NE2 N -4.872 2.309 0.697 1.00 . A A . 33 HIS NE2 1 1 11 7624 1 1 33 HIS O O -1.963 0.031 2.575 1.00 . A A . 33 HIS O 1 1 11 7625 1 1 34 CYS C C -2.660 -1.384 5.275 1.00 . A A . 34 CYS C 1 1 11 7626 1 1 34 CYS CA C -1.188 -1.131 4.953 1.00 . A A . 34 CYS CA 1 1 11 7627 1 1 34 CYS CB C -0.293 -1.449 6.147 1.00 . A A . 34 CYS CB 1 1 11 7628 1 1 34 CYS H H -0.538 0.862 5.193 1.00 . A A . 34 CYS H 1 1 11 7629 1 1 34 CYS HA H -0.900 -1.753 4.118 1.00 . A A . 34 CYS HA 1 1 11 7630 1 1 34 CYS HB2 H -0.718 -1.011 7.039 1.00 . A A . 34 CYS HB2 1 1 11 7631 1 1 34 CYS HB3 H -0.226 -2.519 6.270 1.00 . A A . 34 CYS HB3 1 1 11 7632 1 1 34 CYS N N -0.988 0.255 4.572 1.00 . A A . 34 CYS N 1 1 11 7633 1 1 34 CYS O O -3.297 -0.583 5.963 1.00 . A A . 34 CYS O 1 1 11 7634 1 1 34 CYS SG S 1.401 -0.798 5.952 1.00 . A A . 34 CYS SG 1 1 11 7635 1 1 35 SER C C -4.861 -3.326 6.383 1.00 . A A . 35 SER C 1 1 11 7636 1 1 35 SER CA C -4.607 -2.812 4.964 1.00 . A A . 35 SER CA 1 1 11 7637 1 1 35 SER CB C -5.069 -3.845 3.932 1.00 . A A . 35 SER CB 1 1 11 7638 1 1 35 SER H H -2.652 -3.067 4.188 1.00 . A A . 35 SER H 1 1 11 7639 1 1 35 SER HA H -5.177 -1.907 4.821 1.00 . A A . 35 SER HA 1 1 11 7640 1 1 35 SER HB2 H -6.046 -4.212 4.208 1.00 . A A . 35 SER HB2 1 1 11 7641 1 1 35 SER HB3 H -5.123 -3.377 2.960 1.00 . A A . 35 SER HB3 1 1 11 7642 1 1 35 SER HG H -3.936 -5.096 2.939 1.00 . A A . 35 SER HG 1 1 11 7643 1 1 35 SER N N -3.205 -2.477 4.750 1.00 . A A . 35 SER N 1 1 11 7644 1 1 35 SER O O -3.947 -3.402 7.205 1.00 . A A . 35 SER O 1 1 11 7645 1 1 35 SER OG O -4.175 -4.942 3.861 1.00 . A A . 35 SER OG 1 1 11 7646 1 1 36 LYS C C -6.477 -5.683 8.041 1.00 . A A . 36 LYS C 1 1 11 7647 1 1 36 LYS CA C -6.503 -4.155 7.979 1.00 . A A . 36 LYS CA 1 1 11 7648 1 1 36 LYS CB C -7.901 -3.639 8.340 1.00 . A A . 36 LYS CB 1 1 11 7649 1 1 36 LYS CD C -9.828 -3.669 9.960 1.00 . A A . 36 LYS CD 1 1 11 7650 1 1 36 LYS CE C -10.441 -4.369 11.163 1.00 . A A . 36 LYS CE 1 1 11 7651 1 1 36 LYS CG C -8.474 -4.259 9.605 1.00 . A A . 36 LYS CG 1 1 11 7652 1 1 36 LYS H H -6.796 -3.566 5.971 1.00 . A A . 36 LYS H 1 1 11 7653 1 1 36 LYS HA H -5.795 -3.769 8.697 1.00 . A A . 36 LYS HA 1 1 11 7654 1 1 36 LYS HB2 H -7.852 -2.569 8.479 1.00 . A A . 36 LYS HB2 1 1 11 7655 1 1 36 LYS HB3 H -8.573 -3.856 7.523 1.00 . A A . 36 LYS HB3 1 1 11 7656 1 1 36 LYS HD2 H -9.705 -2.621 10.190 1.00 . A A . 36 LYS HD2 1 1 11 7657 1 1 36 LYS HD3 H -10.491 -3.779 9.114 1.00 . A A . 36 LYS HD3 1 1 11 7658 1 1 36 LYS HE2 H -11.384 -3.897 11.397 1.00 . A A . 36 LYS HE2 1 1 11 7659 1 1 36 LYS HE3 H -10.613 -5.405 10.911 1.00 . A A . 36 LYS HE3 1 1 11 7660 1 1 36 LYS HG2 H -8.586 -5.322 9.450 1.00 . A A . 36 LYS HG2 1 1 11 7661 1 1 36 LYS HG3 H -7.788 -4.083 10.421 1.00 . A A . 36 LYS HG3 1 1 11 7662 1 1 36 LYS HZ1 H -8.603 -4.643 12.120 1.00 . A A . 36 LYS HZ1 1 1 11 7663 1 1 36 LYS HZ2 H -9.942 -4.896 13.123 1.00 . A A . 36 LYS HZ2 1 1 11 7664 1 1 36 LYS HZ3 H -9.489 -3.322 12.701 1.00 . A A . 36 LYS HZ3 1 1 11 7665 1 1 36 LYS N N -6.113 -3.661 6.664 1.00 . A A . 36 LYS N 1 1 11 7666 1 1 36 LYS NZ N -9.557 -4.302 12.361 1.00 . A A . 36 LYS NZ 1 1 11 7667 1 1 36 LYS O O -6.239 -6.258 9.098 1.00 . A A . 36 LYS O 1 1 11 7668 1 1 37 ILE C C -5.409 -8.406 6.982 1.00 . A A . 37 ILE C 1 1 11 7669 1 1 37 ILE CA C -6.804 -7.787 6.847 1.00 . A A . 37 ILE CA 1 1 11 7670 1 1 37 ILE CB C -7.453 -8.273 5.531 1.00 . A A . 37 ILE CB 1 1 11 7671 1 1 37 ILE CD1 C -9.300 -7.765 3.853 1.00 . A A . 37 ILE CD1 1 1 11 7672 1 1 37 ILE CG1 C -8.702 -7.448 5.208 1.00 . A A . 37 ILE CG1 1 1 11 7673 1 1 37 ILE CG2 C -7.811 -9.753 5.630 1.00 . A A . 37 ILE CG2 1 1 11 7674 1 1 37 ILE H H -6.967 -5.810 6.110 1.00 . A A . 37 ILE H 1 1 11 7675 1 1 37 ILE HA H -7.413 -8.132 7.669 1.00 . A A . 37 ILE HA 1 1 11 7676 1 1 37 ILE HB H -6.734 -8.151 4.737 1.00 . A A . 37 ILE HB 1 1 11 7677 1 1 37 ILE HD11 H -9.669 -6.856 3.401 1.00 . A A . 37 ILE HD11 1 1 11 7678 1 1 37 ILE HD12 H -10.113 -8.464 3.973 1.00 . A A . 37 ILE HD12 1 1 11 7679 1 1 37 ILE HD13 H -8.540 -8.200 3.218 1.00 . A A . 37 ILE HD13 1 1 11 7680 1 1 37 ILE HG12 H -9.456 -7.641 5.956 1.00 . A A . 37 ILE HG12 1 1 11 7681 1 1 37 ILE HG13 H -8.446 -6.399 5.222 1.00 . A A . 37 ILE HG13 1 1 11 7682 1 1 37 ILE HG21 H -7.432 -10.273 4.762 1.00 . A A . 37 ILE HG21 1 1 11 7683 1 1 37 ILE HG22 H -8.884 -9.861 5.674 1.00 . A A . 37 ILE HG22 1 1 11 7684 1 1 37 ILE HG23 H -7.369 -10.171 6.522 1.00 . A A . 37 ILE HG23 1 1 11 7685 1 1 37 ILE N N -6.761 -6.327 6.912 1.00 . A A . 37 ILE N 1 1 11 7686 1 1 37 ILE O O -4.874 -8.519 8.079 1.00 . A A . 37 ILE O 1 1 11 7687 1 1 38 LEU C C -2.407 -8.405 6.053 1.00 . A A . 38 LEU C 1 1 11 7688 1 1 38 LEU CA C -3.505 -9.444 5.858 1.00 . A A . 38 LEU CA 1 1 11 7689 1 1 38 LEU CB C -3.272 -10.196 4.548 1.00 . A A . 38 LEU CB 1 1 11 7690 1 1 38 LEU CD1 C -2.207 -12.207 5.603 1.00 . A A . 38 LEU CD1 1 1 11 7691 1 1 38 LEU CD2 C -1.828 -11.726 3.179 1.00 . A A . 38 LEU CD2 1 1 11 7692 1 1 38 LEU CG C -2.053 -11.116 4.553 1.00 . A A . 38 LEU CG 1 1 11 7693 1 1 38 LEU H H -5.305 -8.719 5.009 1.00 . A A . 38 LEU H 1 1 11 7694 1 1 38 LEU HA H -3.470 -10.147 6.677 1.00 . A A . 38 LEU HA 1 1 11 7695 1 1 38 LEU HB2 H -4.149 -10.782 4.332 1.00 . A A . 38 LEU HB2 1 1 11 7696 1 1 38 LEU HB3 H -3.142 -9.470 3.760 1.00 . A A . 38 LEU HB3 1 1 11 7697 1 1 38 LEU HD11 H -1.388 -12.150 6.305 1.00 . A A . 38 LEU HD11 1 1 11 7698 1 1 38 LEU HD12 H -2.202 -13.174 5.122 1.00 . A A . 38 LEU HD12 1 1 11 7699 1 1 38 LEU HD13 H -3.141 -12.071 6.129 1.00 . A A . 38 LEU HD13 1 1 11 7700 1 1 38 LEU HD21 H -2.350 -11.140 2.436 1.00 . A A . 38 LEU HD21 1 1 11 7701 1 1 38 LEU HD22 H -2.204 -12.738 3.168 1.00 . A A . 38 LEU HD22 1 1 11 7702 1 1 38 LEU HD23 H -0.771 -11.731 2.956 1.00 . A A . 38 LEU HD23 1 1 11 7703 1 1 38 LEU HG H -1.182 -10.529 4.809 1.00 . A A . 38 LEU HG 1 1 11 7704 1 1 38 LEU N N -4.828 -8.822 5.856 1.00 . A A . 38 LEU N 1 1 11 7705 1 1 38 LEU O O -1.218 -8.719 6.006 1.00 . A A . 38 LEU O 1 1 11 7706 1 1 39 ARG C C -1.043 -5.845 5.237 1.00 . A A . 39 ARG C 1 1 11 7707 1 1 39 ARG CA C -1.913 -6.056 6.477 1.00 . A A . 39 ARG CA 1 1 11 7708 1 1 39 ARG CB C -1.053 -6.311 7.723 1.00 . A A . 39 ARG CB 1 1 11 7709 1 1 39 ARG CD C -1.447 -4.044 8.709 1.00 . A A . 39 ARG CD 1 1 11 7710 1 1 39 ARG CG C -0.405 -5.066 8.303 1.00 . A A . 39 ARG CG 1 1 11 7711 1 1 39 ARG CZ C -1.526 -1.757 9.619 1.00 . A A . 39 ARG CZ 1 1 11 7712 1 1 39 ARG H H -3.785 -7.004 6.291 1.00 . A A . 39 ARG H 1 1 11 7713 1 1 39 ARG HA H -2.508 -5.168 6.636 1.00 . A A . 39 ARG HA 1 1 11 7714 1 1 39 ARG HB2 H -1.674 -6.752 8.487 1.00 . A A . 39 ARG HB2 1 1 11 7715 1 1 39 ARG HB3 H -0.270 -7.009 7.464 1.00 . A A . 39 ARG HB3 1 1 11 7716 1 1 39 ARG HD2 H -1.983 -3.727 7.826 1.00 . A A . 39 ARG HD2 1 1 11 7717 1 1 39 ARG HD3 H -2.138 -4.509 9.398 1.00 . A A . 39 ARG HD3 1 1 11 7718 1 1 39 ARG HE H 0.093 -2.939 9.616 1.00 . A A . 39 ARG HE 1 1 11 7719 1 1 39 ARG HG2 H 0.171 -5.344 9.173 1.00 . A A . 39 ARG HG2 1 1 11 7720 1 1 39 ARG HG3 H 0.246 -4.630 7.560 1.00 . A A . 39 ARG HG3 1 1 11 7721 1 1 39 ARG HH11 H -3.227 -2.371 8.693 1.00 . A A . 39 ARG HH11 1 1 11 7722 1 1 39 ARG HH12 H -3.298 -0.790 9.405 1.00 . A A . 39 ARG HH12 1 1 11 7723 1 1 39 ARG HH21 H 0.021 -0.849 10.565 1.00 . A A . 39 ARG HH21 1 1 11 7724 1 1 39 ARG HH22 H -1.440 0.078 10.480 1.00 . A A . 39 ARG HH22 1 1 11 7725 1 1 39 ARG N N -2.826 -7.169 6.268 1.00 . A A . 39 ARG N 1 1 11 7726 1 1 39 ARG NE N -0.852 -2.873 9.350 1.00 . A A . 39 ARG NE 1 1 11 7727 1 1 39 ARG NH1 N -2.785 -1.626 9.208 1.00 . A A . 39 ARG NH1 1 1 11 7728 1 1 39 ARG NH2 N -0.935 -0.762 10.273 1.00 . A A . 39 ARG NH2 1 1 11 7729 1 1 39 ARG O O 0.106 -5.422 5.328 1.00 . A A . 39 ARG O 1 1 11 7730 1 1 40 ARG C C -0.688 -4.498 2.495 1.00 . A A . 40 ARG C 1 1 11 7731 1 1 40 ARG CA C -0.912 -5.974 2.806 1.00 . A A . 40 ARG CA 1 1 11 7732 1 1 40 ARG CB C -1.693 -6.612 1.663 1.00 . A A . 40 ARG CB 1 1 11 7733 1 1 40 ARG CD C -2.398 -8.658 0.448 1.00 . A A . 40 ARG CD 1 1 11 7734 1 1 40 ARG CG C -1.748 -8.127 1.709 1.00 . A A . 40 ARG CG 1 1 11 7735 1 1 40 ARG CZ C -2.885 -10.784 -0.672 1.00 . A A . 40 ARG CZ 1 1 11 7736 1 1 40 ARG H H -2.539 -6.468 4.069 1.00 . A A . 40 ARG H 1 1 11 7737 1 1 40 ARG HA H 0.047 -6.461 2.893 1.00 . A A . 40 ARG HA 1 1 11 7738 1 1 40 ARG HB2 H -2.706 -6.240 1.687 1.00 . A A . 40 ARG HB2 1 1 11 7739 1 1 40 ARG HB3 H -1.237 -6.320 0.729 1.00 . A A . 40 ARG HB3 1 1 11 7740 1 1 40 ARG HD2 H -3.402 -8.267 0.390 1.00 . A A . 40 ARG HD2 1 1 11 7741 1 1 40 ARG HD3 H -1.831 -8.307 -0.402 1.00 . A A . 40 ARG HD3 1 1 11 7742 1 1 40 ARG HE H -2.191 -10.606 1.200 1.00 . A A . 40 ARG HE 1 1 11 7743 1 1 40 ARG HG2 H -0.744 -8.518 1.784 1.00 . A A . 40 ARG HG2 1 1 11 7744 1 1 40 ARG HG3 H -2.328 -8.437 2.565 1.00 . A A . 40 ARG HG3 1 1 11 7745 1 1 40 ARG HH11 H -3.165 -9.104 -1.802 1.00 . A A . 40 ARG HH11 1 1 11 7746 1 1 40 ARG HH12 H -3.544 -10.613 -2.583 1.00 . A A . 40 ARG HH12 1 1 11 7747 1 1 40 ARG HH21 H -2.674 -12.612 0.176 1.00 . A A . 40 ARG HH21 1 1 11 7748 1 1 40 ARG HH22 H -3.262 -12.615 -1.452 1.00 . A A . 40 ARG HH22 1 1 11 7749 1 1 40 ARG N N -1.615 -6.138 4.074 1.00 . A A . 40 ARG N 1 1 11 7750 1 1 40 ARG NE N -2.463 -10.113 0.399 1.00 . A A . 40 ARG NE 1 1 11 7751 1 1 40 ARG NH1 N -3.227 -10.123 -1.775 1.00 . A A . 40 ARG NH1 1 1 11 7752 1 1 40 ARG NH2 N -2.946 -12.112 -0.647 1.00 . A A . 40 ARG NH2 1 1 11 7753 1 1 40 ARG O O -1.417 -3.632 2.984 1.00 . A A . 40 ARG O 1 1 11 7754 1 1 41 CYS C C -0.232 -2.378 0.139 1.00 . A A . 41 CYS C 1 1 11 7755 1 1 41 CYS CA C 0.643 -2.855 1.297 1.00 . A A . 41 CYS CA 1 1 11 7756 1 1 41 CYS CB C 2.118 -2.763 0.906 1.00 . A A . 41 CYS CB 1 1 11 7757 1 1 41 CYS H H 0.857 -4.955 1.322 1.00 . A A . 41 CYS H 1 1 11 7758 1 1 41 CYS HA H 0.467 -2.219 2.151 1.00 . A A . 41 CYS HA 1 1 11 7759 1 1 41 CYS HB2 H 2.725 -3.004 1.765 1.00 . A A . 41 CYS HB2 1 1 11 7760 1 1 41 CYS HB3 H 2.318 -3.476 0.120 1.00 . A A . 41 CYS HB3 1 1 11 7761 1 1 41 CYS N N 0.317 -4.220 1.681 1.00 . A A . 41 CYS N 1 1 11 7762 1 1 41 CYS O O 0.068 -2.642 -1.025 1.00 . A A . 41 CYS O 1 1 11 7763 1 1 41 CYS SG S 2.632 -1.124 0.311 1.00 . A A . 41 CYS SG 1 1 11 7764 1 1 42 LEU C C -1.695 0.225 -1.025 1.00 . A A . 42 LEU C 1 1 11 7765 1 1 42 LEU CA C -2.203 -1.128 -0.551 1.00 . A A . 42 LEU CA 1 1 11 7766 1 1 42 LEU CB C -3.624 -0.982 0.009 1.00 . A A . 42 LEU CB 1 1 11 7767 1 1 42 LEU CD1 C -3.906 -3.387 0.693 1.00 . A A . 42 LEU CD1 1 1 11 7768 1 1 42 LEU CD2 C -5.909 -1.931 0.424 1.00 . A A . 42 LEU CD2 1 1 11 7769 1 1 42 LEU CG C -4.509 -2.231 -0.086 1.00 . A A . 42 LEU CG 1 1 11 7770 1 1 42 LEU H H -1.481 -1.469 1.411 1.00 . A A . 42 LEU H 1 1 11 7771 1 1 42 LEU HA H -2.214 -1.814 -1.386 1.00 . A A . 42 LEU HA 1 1 11 7772 1 1 42 LEU HB2 H -3.542 -0.710 1.053 1.00 . A A . 42 LEU HB2 1 1 11 7773 1 1 42 LEU HB3 H -4.117 -0.170 -0.514 1.00 . A A . 42 LEU HB3 1 1 11 7774 1 1 42 LEU HD11 H -4.522 -3.603 1.553 1.00 . A A . 42 LEU HD11 1 1 11 7775 1 1 42 LEU HD12 H -2.911 -3.120 1.021 1.00 . A A . 42 LEU HD12 1 1 11 7776 1 1 42 LEU HD13 H -3.854 -4.260 0.059 1.00 . A A . 42 LEU HD13 1 1 11 7777 1 1 42 LEU HD21 H -6.020 -2.325 1.423 1.00 . A A . 42 LEU HD21 1 1 11 7778 1 1 42 LEU HD22 H -6.636 -2.393 -0.228 1.00 . A A . 42 LEU HD22 1 1 11 7779 1 1 42 LEU HD23 H -6.066 -0.863 0.438 1.00 . A A . 42 LEU HD23 1 1 11 7780 1 1 42 LEU HG H -4.587 -2.531 -1.121 1.00 . A A . 42 LEU HG 1 1 11 7781 1 1 42 LEU N N -1.302 -1.662 0.463 1.00 . A A . 42 LEU N 1 1 11 7782 1 1 42 LEU O O -1.621 1.171 -0.245 1.00 . A A . 42 LEU O 1 1 11 7783 1 1 43 CYS C C -1.955 2.369 -3.483 1.00 . A A . 43 CYS C 1 1 11 7784 1 1 43 CYS CA C -0.839 1.555 -2.846 1.00 . A A . 43 CYS CA 1 1 11 7785 1 1 43 CYS CB C 0.246 1.266 -3.882 1.00 . A A . 43 CYS CB 1 1 11 7786 1 1 43 CYS H H -1.425 -0.470 -2.876 1.00 . A A . 43 CYS H 1 1 11 7787 1 1 43 CYS HA H -0.408 2.128 -2.039 1.00 . A A . 43 CYS HA 1 1 11 7788 1 1 43 CYS HB2 H -0.192 0.737 -4.712 1.00 . A A . 43 CYS HB2 1 1 11 7789 1 1 43 CYS HB3 H 0.647 2.205 -4.236 1.00 . A A . 43 CYS HB3 1 1 11 7790 1 1 43 CYS N N -1.346 0.316 -2.291 1.00 . A A . 43 CYS N 1 1 11 7791 1 1 43 CYS O O -2.796 1.832 -4.205 1.00 . A A . 43 CYS O 1 1 11 7792 1 1 43 CYS SG S 1.638 0.273 -3.262 1.00 . A A . 43 CYS SG 1 1 11 7793 1 1 44 THR C C -2.255 5.624 -4.640 1.00 . A A . 44 THR C 1 1 11 7794 1 1 44 THR CA C -2.937 4.572 -3.774 1.00 . A A . 44 THR CA 1 1 11 7795 1 1 44 THR CB C -3.746 5.268 -2.663 1.00 . A A . 44 THR CB 1 1 11 7796 1 1 44 THR CG2 C -5.079 4.575 -2.439 1.00 . A A . 44 THR CG2 1 1 11 7797 1 1 44 THR H H -1.239 4.029 -2.644 1.00 . A A . 44 THR H 1 1 11 7798 1 1 44 THR HA H -3.617 3.998 -4.386 1.00 . A A . 44 THR HA 1 1 11 7799 1 1 44 THR HB H -3.937 6.287 -2.971 1.00 . A A . 44 THR HB 1 1 11 7800 1 1 44 THR HG1 H -2.065 5.437 -1.630 1.00 . A A . 44 THR HG1 1 1 11 7801 1 1 44 THR HG21 H -5.883 5.262 -2.654 1.00 . A A . 44 THR HG21 1 1 11 7802 1 1 44 THR HG22 H -5.148 4.250 -1.411 1.00 . A A . 44 THR HG22 1 1 11 7803 1 1 44 THR HG23 H -5.153 3.718 -3.092 1.00 . A A . 44 THR HG23 1 1 11 7804 1 1 44 THR N N -1.947 3.664 -3.221 1.00 . A A . 44 THR N 1 1 11 7805 1 1 44 THR O O -1.161 6.088 -4.308 1.00 . A A . 44 THR O 1 1 11 7806 1 1 44 THR OG1 O -2.998 5.281 -1.438 1.00 . A A . 44 THR OG1 1 1 11 7807 1 1 45 LYS C C -3.390 7.602 -7.538 1.00 . A A . 45 LYS C 1 1 11 7808 1 1 45 LYS CA C -2.327 6.990 -6.649 1.00 . A A . 45 LYS CA 1 1 11 7809 1 1 45 LYS CB C -1.221 6.393 -7.520 1.00 . A A . 45 LYS CB 1 1 11 7810 1 1 45 LYS CD C -0.557 4.996 -9.472 1.00 . A A . 45 LYS CD 1 1 11 7811 1 1 45 LYS CE C -0.914 3.840 -10.385 1.00 . A A . 45 LYS CE 1 1 11 7812 1 1 45 LYS CG C -1.701 5.392 -8.559 1.00 . A A . 45 LYS CG 1 1 11 7813 1 1 45 LYS H H -3.758 5.586 -5.957 1.00 . A A . 45 LYS H 1 1 11 7814 1 1 45 LYS HA H -1.900 7.779 -6.050 1.00 . A A . 45 LYS HA 1 1 11 7815 1 1 45 LYS HB2 H -0.720 7.197 -8.039 1.00 . A A . 45 LYS HB2 1 1 11 7816 1 1 45 LYS HB3 H -0.508 5.896 -6.879 1.00 . A A . 45 LYS HB3 1 1 11 7817 1 1 45 LYS HD2 H -0.290 5.847 -10.080 1.00 . A A . 45 LYS HD2 1 1 11 7818 1 1 45 LYS HD3 H 0.289 4.712 -8.863 1.00 . A A . 45 LYS HD3 1 1 11 7819 1 1 45 LYS HE2 H -1.345 3.047 -9.793 1.00 . A A . 45 LYS HE2 1 1 11 7820 1 1 45 LYS HE3 H -1.634 4.180 -11.115 1.00 . A A . 45 LYS HE3 1 1 11 7821 1 1 45 LYS HG2 H -2.076 4.512 -8.057 1.00 . A A . 45 LYS HG2 1 1 11 7822 1 1 45 LYS HG3 H -2.487 5.842 -9.148 1.00 . A A . 45 LYS HG3 1 1 11 7823 1 1 45 LYS HZ1 H 0.349 2.288 -10.989 1.00 . A A . 45 LYS HZ1 1 1 11 7824 1 1 45 LYS HZ2 H 1.152 3.748 -10.691 1.00 . A A . 45 LYS HZ2 1 1 11 7825 1 1 45 LYS HZ3 H 0.240 3.556 -12.104 1.00 . A A . 45 LYS HZ3 1 1 11 7826 1 1 45 LYS N N -2.889 5.993 -5.744 1.00 . A A . 45 LYS N 1 1 11 7827 1 1 45 LYS NZ N 0.290 3.321 -11.093 1.00 . A A . 45 LYS NZ 1 1 11 7828 1 1 45 LYS O O -4.556 7.200 -7.511 1.00 . A A . 45 LYS O 1 1 11 7829 1 1 46 GLU C C -4.057 8.470 -10.508 1.00 . A A . 46 GLU C 1 1 11 7830 1 1 46 GLU CA C -3.825 9.281 -9.234 1.00 . A A . 46 GLU CA 1 1 11 7831 1 1 46 GLU CB C -3.211 10.647 -9.576 1.00 . A A . 46 GLU CB 1 1 11 7832 1 1 46 GLU CD C -0.670 10.272 -9.666 1.00 . A A . 46 GLU CD 1 1 11 7833 1 1 46 GLU CG C -1.947 10.581 -10.435 1.00 . A A . 46 GLU CG 1 1 11 7834 1 1 46 GLU H H -2.009 8.827 -8.281 1.00 . A A . 46 GLU H 1 1 11 7835 1 1 46 GLU HA H -4.773 9.437 -8.743 1.00 . A A . 46 GLU HA 1 1 11 7836 1 1 46 GLU HB2 H -3.946 11.232 -10.109 1.00 . A A . 46 GLU HB2 1 1 11 7837 1 1 46 GLU HB3 H -2.965 11.154 -8.655 1.00 . A A . 46 GLU HB3 1 1 11 7838 1 1 46 GLU HG2 H -2.083 9.806 -11.171 1.00 . A A . 46 GLU HG2 1 1 11 7839 1 1 46 GLU HG3 H -1.824 11.529 -10.936 1.00 . A A . 46 GLU HG3 1 1 11 7840 1 1 46 GLU N N -2.962 8.573 -8.318 1.00 . A A . 46 GLU N 1 1 11 7841 1 1 46 GLU O O -3.164 7.758 -10.981 1.00 . A A . 46 GLU O 1 1 11 7842 1 1 46 GLU OE1 O -0.512 9.135 -9.173 1.00 . A A . 46 GLU OE1 1 1 11 7843 1 1 46 GLU OE2 O 0.212 11.153 -9.593 1.00 . A A . 46 GLU OE2 1 1 11 7844 1 1 47 CYS C C -6.899 8.493 -12.840 1.00 . A A . 47 CYS C 1 1 11 7845 1 1 47 CYS CA C -5.618 7.890 -12.282 1.00 . A A . 47 CYS CA 1 1 11 7846 1 1 47 CYS CB C -5.787 6.388 -12.037 1.00 . A A . 47 CYS CB 1 1 11 7847 1 1 47 CYS H H -5.926 9.172 -10.636 1.00 . A A . 47 CYS H 1 1 11 7848 1 1 47 CYS HA H -4.822 8.043 -12.995 1.00 . A A . 47 CYS HA 1 1 11 7849 1 1 47 CYS HB2 H -6.086 5.914 -12.959 1.00 . A A . 47 CYS HB2 1 1 11 7850 1 1 47 CYS HB3 H -4.838 5.978 -11.722 1.00 . A A . 47 CYS HB3 1 1 11 7851 1 1 47 CYS N N -5.256 8.588 -11.060 1.00 . A A . 47 CYS N 1 1 11 7852 1 1 47 CYS O O -7.536 7.870 -13.705 1.00 . A A . 47 CYS O 1 1 11 7853 1 1 47 CYS OXT O -7.264 9.601 -12.385 1.00 . A A . 47 CYS OXT 1 1 11 7854 1 1 47 CYS SG S -7.024 5.954 -10.771 1.00 . A A . 47 CYS SG 1 1 12 7855 1 1 1 ALA C C -9.808 10.721 -6.299 1.00 . A A . 1 ALA C 1 1 12 7856 1 1 1 ALA CA C -10.875 11.340 -7.199 1.00 . A A . 1 ALA CA 1 1 12 7857 1 1 1 ALA CB C -10.780 12.859 -7.177 1.00 . A A . 1 ALA CB 1 1 12 7858 1 1 1 ALA H1 H -12.880 11.709 -6.806 1.00 . A A . 1 ALA H1 1 1 12 7859 1 1 1 ALA H2 H -12.188 10.533 -5.807 1.00 . A A . 1 ALA H2 1 1 12 7860 1 1 1 ALA H3 H -12.571 10.162 -7.414 1.00 . A A . 1 ALA H3 1 1 12 7861 1 1 1 ALA HA H -10.718 11.007 -8.215 1.00 . A A . 1 ALA HA 1 1 12 7862 1 1 1 ALA HB1 H -9.819 13.154 -6.781 1.00 . A A . 1 ALA HB1 1 1 12 7863 1 1 1 ALA HB2 H -11.564 13.260 -6.552 1.00 . A A . 1 ALA HB2 1 1 12 7864 1 1 1 ALA HB3 H -10.889 13.242 -8.181 1.00 . A A . 1 ALA HB3 1 1 12 7865 1 1 1 ALA N N -12.223 10.906 -6.777 1.00 . A A . 1 ALA N 1 1 12 7866 1 1 1 ALA O O -8.868 11.391 -5.875 1.00 . A A . 1 ALA O 1 1 12 7867 1 1 2 THR C C -9.006 7.248 -5.526 1.00 . A A . 2 THR C 1 1 12 7868 1 1 2 THR CA C -9.017 8.725 -5.156 1.00 . A A . 2 THR CA 1 1 12 7869 1 1 2 THR CB C -9.378 8.881 -3.663 1.00 . A A . 2 THR CB 1 1 12 7870 1 1 2 THR CG2 C -8.262 8.349 -2.774 1.00 . A A . 2 THR CG2 1 1 12 7871 1 1 2 THR H H -10.724 8.946 -6.367 1.00 . A A . 2 THR H 1 1 12 7872 1 1 2 THR HA H -8.034 9.142 -5.320 1.00 . A A . 2 THR HA 1 1 12 7873 1 1 2 THR HB H -10.278 8.317 -3.464 1.00 . A A . 2 THR HB 1 1 12 7874 1 1 2 THR HG1 H -8.995 10.809 -3.864 1.00 . A A . 2 THR HG1 1 1 12 7875 1 1 2 THR HG21 H -8.644 8.183 -1.777 1.00 . A A . 2 THR HG21 1 1 12 7876 1 1 2 THR HG22 H -7.458 9.069 -2.736 1.00 . A A . 2 THR HG22 1 1 12 7877 1 1 2 THR HG23 H -7.892 7.418 -3.178 1.00 . A A . 2 THR HG23 1 1 12 7878 1 1 2 THR N N -9.962 9.436 -6.003 1.00 . A A . 2 THR N 1 1 12 7879 1 1 2 THR O O -10.047 6.591 -5.508 1.00 . A A . 2 THR O 1 1 12 7880 1 1 2 THR OG1 O -9.613 10.263 -3.361 1.00 . A A . 2 THR OG1 1 1 12 7881 1 1 3 CYS C C -6.896 4.560 -5.248 1.00 . A A . 3 CYS C 1 1 12 7882 1 1 3 CYS CA C -7.705 5.346 -6.271 1.00 . A A . 3 CYS CA 1 1 12 7883 1 1 3 CYS CB C -7.063 5.251 -7.657 1.00 . A A . 3 CYS CB 1 1 12 7884 1 1 3 CYS H H -7.044 7.318 -5.887 1.00 . A A . 3 CYS H 1 1 12 7885 1 1 3 CYS HA H -8.698 4.924 -6.320 1.00 . A A . 3 CYS HA 1 1 12 7886 1 1 3 CYS HB2 H -6.216 5.923 -7.703 1.00 . A A . 3 CYS HB2 1 1 12 7887 1 1 3 CYS HB3 H -6.724 4.239 -7.823 1.00 . A A . 3 CYS HB3 1 1 12 7888 1 1 3 CYS N N -7.840 6.738 -5.878 1.00 . A A . 3 CYS N 1 1 12 7889 1 1 3 CYS O O -5.877 5.038 -4.743 1.00 . A A . 3 CYS O 1 1 12 7890 1 1 3 CYS SG S -8.185 5.696 -9.022 1.00 . A A . 3 CYS SG 1 1 12 7891 1 1 4 LYS C C -6.373 1.142 -4.641 1.00 . A A . 4 LYS C 1 1 12 7892 1 1 4 LYS CA C -6.691 2.478 -3.996 1.00 . A A . 4 LYS CA 1 1 12 7893 1 1 4 LYS CB C -7.568 2.239 -2.763 1.00 . A A . 4 LYS CB 1 1 12 7894 1 1 4 LYS CD C -8.628 3.189 -0.694 1.00 . A A . 4 LYS CD 1 1 12 7895 1 1 4 LYS CE C -9.973 2.512 -0.916 1.00 . A A . 4 LYS CE 1 1 12 7896 1 1 4 LYS CG C -7.938 3.504 -2.011 1.00 . A A . 4 LYS CG 1 1 12 7897 1 1 4 LYS H H -8.173 3.030 -5.395 1.00 . A A . 4 LYS H 1 1 12 7898 1 1 4 LYS HA H -5.767 2.951 -3.690 1.00 . A A . 4 LYS HA 1 1 12 7899 1 1 4 LYS HB2 H -8.482 1.755 -3.076 1.00 . A A . 4 LYS HB2 1 1 12 7900 1 1 4 LYS HB3 H -7.041 1.585 -2.085 1.00 . A A . 4 LYS HB3 1 1 12 7901 1 1 4 LYS HD2 H -7.991 2.531 -0.117 1.00 . A A . 4 LYS HD2 1 1 12 7902 1 1 4 LYS HD3 H -8.780 4.110 -0.150 1.00 . A A . 4 LYS HD3 1 1 12 7903 1 1 4 LYS HE2 H -10.584 3.149 -1.538 1.00 . A A . 4 LYS HE2 1 1 12 7904 1 1 4 LYS HE3 H -9.808 1.571 -1.420 1.00 . A A . 4 LYS HE3 1 1 12 7905 1 1 4 LYS HG2 H -7.039 4.066 -1.809 1.00 . A A . 4 LYS HG2 1 1 12 7906 1 1 4 LYS HG3 H -8.604 4.094 -2.624 1.00 . A A . 4 LYS HG3 1 1 12 7907 1 1 4 LYS HZ1 H -10.734 1.234 0.552 1.00 . A A . 4 LYS HZ1 1 1 12 7908 1 1 4 LYS HZ2 H -11.662 2.627 0.309 1.00 . A A . 4 LYS HZ2 1 1 12 7909 1 1 4 LYS HZ3 H -10.199 2.723 1.151 1.00 . A A . 4 LYS HZ3 1 1 12 7910 1 1 4 LYS N N -7.359 3.350 -4.951 1.00 . A A . 4 LYS N 1 1 12 7911 1 1 4 LYS NZ N -10.692 2.256 0.364 1.00 . A A . 4 LYS NZ 1 1 12 7912 1 1 4 LYS O O -7.216 0.559 -5.320 1.00 . A A . 4 LYS O 1 1 12 7913 1 1 5 ALA C C -3.505 -1.100 -4.202 1.00 . A A . 5 ALA C 1 1 12 7914 1 1 5 ALA CA C -4.720 -0.607 -4.965 1.00 . A A . 5 ALA CA 1 1 12 7915 1 1 5 ALA CB C -4.394 -0.471 -6.447 1.00 . A A . 5 ALA CB 1 1 12 7916 1 1 5 ALA H H -4.541 1.185 -3.860 1.00 . A A . 5 ALA H 1 1 12 7917 1 1 5 ALA HA H -5.523 -1.321 -4.856 1.00 . A A . 5 ALA HA 1 1 12 7918 1 1 5 ALA HB1 H -3.444 -0.942 -6.651 1.00 . A A . 5 ALA HB1 1 1 12 7919 1 1 5 ALA HB2 H -4.340 0.576 -6.709 1.00 . A A . 5 ALA HB2 1 1 12 7920 1 1 5 ALA HB3 H -5.166 -0.949 -7.031 1.00 . A A . 5 ALA HB3 1 1 12 7921 1 1 5 ALA N N -5.163 0.665 -4.418 1.00 . A A . 5 ALA N 1 1 12 7922 1 1 5 ALA O O -2.626 -0.312 -3.864 1.00 . A A . 5 ALA O 1 1 12 7923 1 1 6 GLU C C -1.085 -2.852 -4.032 1.00 . A A . 6 GLU C 1 1 12 7924 1 1 6 GLU CA C -2.351 -2.987 -3.204 1.00 . A A . 6 GLU CA 1 1 12 7925 1 1 6 GLU CB C -2.636 -4.460 -2.916 1.00 . A A . 6 GLU CB 1 1 12 7926 1 1 6 GLU CD C -4.479 -6.173 -2.692 1.00 . A A . 6 GLU CD 1 1 12 7927 1 1 6 GLU CG C -4.085 -4.721 -2.542 1.00 . A A . 6 GLU CG 1 1 12 7928 1 1 6 GLU H H -4.194 -2.970 -4.221 1.00 . A A . 6 GLU H 1 1 12 7929 1 1 6 GLU HA H -2.227 -2.454 -2.273 1.00 . A A . 6 GLU HA 1 1 12 7930 1 1 6 GLU HB2 H -2.390 -5.047 -3.786 1.00 . A A . 6 GLU HB2 1 1 12 7931 1 1 6 GLU HB3 H -2.014 -4.778 -2.092 1.00 . A A . 6 GLU HB3 1 1 12 7932 1 1 6 GLU HG2 H -4.236 -4.429 -1.514 1.00 . A A . 6 GLU HG2 1 1 12 7933 1 1 6 GLU HG3 H -4.720 -4.124 -3.180 1.00 . A A . 6 GLU HG3 1 1 12 7934 1 1 6 GLU N N -3.463 -2.394 -3.927 1.00 . A A . 6 GLU N 1 1 12 7935 1 1 6 GLU O O -1.133 -2.966 -5.259 1.00 . A A . 6 GLU O 1 1 12 7936 1 1 6 GLU OE1 O -3.862 -7.034 -2.030 1.00 . A A . 6 GLU OE1 1 1 12 7937 1 1 6 GLU OE2 O -5.427 -6.457 -3.450 1.00 . A A . 6 GLU OE2 1 1 12 7938 1 1 7 CYS C C 1.604 -3.675 -4.908 1.00 . A A . 7 CYS C 1 1 12 7939 1 1 7 CYS CA C 1.298 -2.428 -4.082 1.00 . A A . 7 CYS CA 1 1 12 7940 1 1 7 CYS CB C 2.455 -2.150 -3.116 1.00 . A A . 7 CYS CB 1 1 12 7941 1 1 7 CYS H H -0.002 -2.492 -2.398 1.00 . A A . 7 CYS H 1 1 12 7942 1 1 7 CYS HA H 1.192 -1.588 -4.753 1.00 . A A . 7 CYS HA 1 1 12 7943 1 1 7 CYS HB2 H 2.209 -1.295 -2.504 1.00 . A A . 7 CYS HB2 1 1 12 7944 1 1 7 CYS HB3 H 2.604 -3.012 -2.483 1.00 . A A . 7 CYS HB3 1 1 12 7945 1 1 7 CYS N N 0.031 -2.589 -3.373 1.00 . A A . 7 CYS N 1 1 12 7946 1 1 7 CYS O O 1.593 -4.791 -4.389 1.00 . A A . 7 CYS O 1 1 12 7947 1 1 7 CYS SG S 4.036 -1.796 -3.963 1.00 . A A . 7 CYS SG 1 1 12 7948 1 1 8 PRO C C 3.300 -5.481 -6.648 1.00 . A A . 8 PRO C 1 1 12 7949 1 1 8 PRO CA C 2.154 -4.601 -7.136 1.00 . A A . 8 PRO CA 1 1 12 7950 1 1 8 PRO CB C 2.542 -3.893 -8.436 1.00 . A A . 8 PRO CB 1 1 12 7951 1 1 8 PRO CD C 1.865 -2.192 -6.905 1.00 . A A . 8 PRO CD 1 1 12 7952 1 1 8 PRO CG C 1.871 -2.567 -8.360 1.00 . A A . 8 PRO CG 1 1 12 7953 1 1 8 PRO HA H 1.281 -5.214 -7.304 1.00 . A A . 8 PRO HA 1 1 12 7954 1 1 8 PRO HB2 H 3.616 -3.791 -8.488 1.00 . A A . 8 PRO HB2 1 1 12 7955 1 1 8 PRO HB3 H 2.188 -4.466 -9.281 1.00 . A A . 8 PRO HB3 1 1 12 7956 1 1 8 PRO HD2 H 2.751 -1.627 -6.657 1.00 . A A . 8 PRO HD2 1 1 12 7957 1 1 8 PRO HD3 H 0.976 -1.628 -6.664 1.00 . A A . 8 PRO HD3 1 1 12 7958 1 1 8 PRO HG2 H 2.427 -1.840 -8.933 1.00 . A A . 8 PRO HG2 1 1 12 7959 1 1 8 PRO HG3 H 0.860 -2.644 -8.731 1.00 . A A . 8 PRO HG3 1 1 12 7960 1 1 8 PRO N N 1.862 -3.495 -6.217 1.00 . A A . 8 PRO N 1 1 12 7961 1 1 8 PRO O O 3.260 -6.701 -6.780 1.00 . A A . 8 PRO O 1 1 12 7962 1 1 9 THR C C 5.345 -5.818 -4.067 1.00 . A A . 9 THR C 1 1 12 7963 1 1 9 THR CA C 5.463 -5.592 -5.571 1.00 . A A . 9 THR CA 1 1 12 7964 1 1 9 THR CB C 6.785 -4.866 -5.888 1.00 . A A . 9 THR CB 1 1 12 7965 1 1 9 THR CG2 C 7.111 -4.960 -7.371 1.00 . A A . 9 THR CG2 1 1 12 7966 1 1 9 THR H H 4.297 -3.882 -5.992 1.00 . A A . 9 THR H 1 1 12 7967 1 1 9 THR HA H 5.481 -6.553 -6.064 1.00 . A A . 9 THR HA 1 1 12 7968 1 1 9 THR HB H 7.580 -5.342 -5.332 1.00 . A A . 9 THR HB 1 1 12 7969 1 1 9 THR HG1 H 6.196 -3.413 -4.675 1.00 . A A . 9 THR HG1 1 1 12 7970 1 1 9 THR HG21 H 6.413 -4.355 -7.932 1.00 . A A . 9 THR HG21 1 1 12 7971 1 1 9 THR HG22 H 7.033 -5.988 -7.692 1.00 . A A . 9 THR HG22 1 1 12 7972 1 1 9 THR HG23 H 8.115 -4.603 -7.543 1.00 . A A . 9 THR HG23 1 1 12 7973 1 1 9 THR N N 4.320 -4.856 -6.079 1.00 . A A . 9 THR N 1 1 12 7974 1 1 9 THR O O 6.307 -5.623 -3.325 1.00 . A A . 9 THR O 1 1 12 7975 1 1 9 THR OG1 O 6.707 -3.484 -5.498 1.00 . A A . 9 THR OG1 1 1 12 7976 1 1 10 TRP C C 3.236 -7.816 -2.021 1.00 . A A . 10 TRP C 1 1 12 7977 1 1 10 TRP CA C 3.934 -6.477 -2.212 1.00 . A A . 10 TRP CA 1 1 12 7978 1 1 10 TRP CB C 3.081 -5.363 -1.599 1.00 . A A . 10 TRP CB 1 1 12 7979 1 1 10 TRP CD1 C 2.197 -5.953 0.736 1.00 . A A . 10 TRP CD1 1 1 12 7980 1 1 10 TRP CD2 C 4.058 -4.705 0.738 1.00 . A A . 10 TRP CD2 1 1 12 7981 1 1 10 TRP CE2 C 3.695 -4.965 2.073 1.00 . A A . 10 TRP CE2 1 1 12 7982 1 1 10 TRP CE3 C 5.195 -3.933 0.487 1.00 . A A . 10 TRP CE3 1 1 12 7983 1 1 10 TRP CG C 3.099 -5.359 -0.101 1.00 . A A . 10 TRP CG 1 1 12 7984 1 1 10 TRP CH2 C 5.536 -3.721 2.873 1.00 . A A . 10 TRP CH2 1 1 12 7985 1 1 10 TRP CZ2 C 4.432 -4.475 3.152 1.00 . A A . 10 TRP CZ2 1 1 12 7986 1 1 10 TRP CZ3 C 5.919 -3.447 1.557 1.00 . A A . 10 TRP CZ3 1 1 12 7987 1 1 10 TRP H H 3.430 -6.369 -4.261 1.00 . A A . 10 TRP H 1 1 12 7988 1 1 10 TRP HA H 4.892 -6.505 -1.715 1.00 . A A . 10 TRP HA 1 1 12 7989 1 1 10 TRP HB2 H 3.450 -4.407 -1.939 1.00 . A A . 10 TRP HB2 1 1 12 7990 1 1 10 TRP HB3 H 2.057 -5.483 -1.921 1.00 . A A . 10 TRP HB3 1 1 12 7991 1 1 10 TRP HD1 H 1.337 -6.521 0.404 1.00 . A A . 10 TRP HD1 1 1 12 7992 1 1 10 TRP HE1 H 2.080 -6.075 2.834 1.00 . A A . 10 TRP HE1 1 1 12 7993 1 1 10 TRP HE3 H 5.507 -3.711 -0.522 1.00 . A A . 10 TRP HE3 1 1 12 7994 1 1 10 TRP HH2 H 6.133 -3.319 3.679 1.00 . A A . 10 TRP HH2 1 1 12 7995 1 1 10 TRP HZ2 H 4.156 -4.674 4.175 1.00 . A A . 10 TRP HZ2 1 1 12 7996 1 1 10 TRP HZ3 H 6.795 -2.841 1.382 1.00 . A A . 10 TRP HZ3 1 1 12 7997 1 1 10 TRP N N 4.165 -6.227 -3.623 1.00 . A A . 10 TRP N 1 1 12 7998 1 1 10 TRP NE1 N 2.558 -5.734 2.046 1.00 . A A . 10 TRP NE1 1 1 12 7999 1 1 10 TRP O O 2.153 -8.040 -2.554 1.00 . A A . 10 TRP O 1 1 12 8000 1 1 11 ASP C C 3.735 -10.422 0.436 1.00 . A A . 11 ASP C 1 1 12 8001 1 1 11 ASP CA C 3.307 -10.008 -0.965 1.00 . A A . 11 ASP CA 1 1 12 8002 1 1 11 ASP CB C 3.783 -11.037 -1.998 1.00 . A A . 11 ASP CB 1 1 12 8003 1 1 11 ASP CG C 2.873 -12.254 -2.077 1.00 . A A . 11 ASP CG 1 1 12 8004 1 1 11 ASP H H 4.718 -8.441 -0.848 1.00 . A A . 11 ASP H 1 1 12 8005 1 1 11 ASP HA H 2.229 -9.936 -0.998 1.00 . A A . 11 ASP HA 1 1 12 8006 1 1 11 ASP HB2 H 3.814 -10.572 -2.971 1.00 . A A . 11 ASP HB2 1 1 12 8007 1 1 11 ASP HB3 H 4.776 -11.370 -1.732 1.00 . A A . 11 ASP HB3 1 1 12 8008 1 1 11 ASP N N 3.860 -8.689 -1.248 1.00 . A A . 11 ASP N 1 1 12 8009 1 1 11 ASP O O 4.420 -11.425 0.635 1.00 . A A . 11 ASP O 1 1 12 8010 1 1 11 ASP OD1 O 2.622 -12.888 -1.031 1.00 . A A . 11 ASP OD1 1 1 12 8011 1 1 11 ASP OD2 O 2.414 -12.576 -3.193 1.00 . A A . 11 ASP OD2 1 1 12 8012 1 1 12 SER C C 2.777 -9.059 3.718 1.00 . A A . 12 SER C 1 1 12 8013 1 1 12 SER CA C 3.706 -9.843 2.800 1.00 . A A . 12 SER CA 1 1 12 8014 1 1 12 SER CB C 5.160 -9.430 3.069 1.00 . A A . 12 SER CB 1 1 12 8015 1 1 12 SER H H 2.835 -8.809 1.181 1.00 . A A . 12 SER H 1 1 12 8016 1 1 12 SER HA H 3.593 -10.898 3.000 1.00 . A A . 12 SER HA 1 1 12 8017 1 1 12 SER HB2 H 5.283 -8.384 2.830 1.00 . A A . 12 SER HB2 1 1 12 8018 1 1 12 SER HB3 H 5.387 -9.588 4.113 1.00 . A A . 12 SER HB3 1 1 12 8019 1 1 12 SER HG H 5.576 -10.773 1.695 1.00 . A A . 12 SER HG 1 1 12 8020 1 1 12 SER N N 3.355 -9.606 1.408 1.00 . A A . 12 SER N 1 1 12 8021 1 1 12 SER O O 2.018 -8.198 3.266 1.00 . A A . 12 SER O 1 1 12 8022 1 1 12 SER OG O 6.071 -10.182 2.286 1.00 . A A . 12 SER OG 1 1 12 8023 1 1 13 VAL C C 2.632 -7.299 6.296 1.00 . A A . 13 VAL C 1 1 12 8024 1 1 13 VAL CA C 2.030 -8.669 5.991 1.00 . A A . 13 VAL CA 1 1 12 8025 1 1 13 VAL CB C 1.929 -9.497 7.293 1.00 . A A . 13 VAL CB 1 1 12 8026 1 1 13 VAL CG1 C 1.104 -8.773 8.344 1.00 . A A . 13 VAL CG1 1 1 12 8027 1 1 13 VAL CG2 C 1.341 -10.871 7.006 1.00 . A A . 13 VAL CG2 1 1 12 8028 1 1 13 VAL H H 3.479 -10.038 5.304 1.00 . A A . 13 VAL H 1 1 12 8029 1 1 13 VAL HA H 1.033 -8.540 5.579 1.00 . A A . 13 VAL HA 1 1 12 8030 1 1 13 VAL HB H 2.926 -9.634 7.684 1.00 . A A . 13 VAL HB 1 1 12 8031 1 1 13 VAL HG11 H 0.054 -8.939 8.155 1.00 . A A . 13 VAL HG11 1 1 12 8032 1 1 13 VAL HG12 H 1.315 -7.715 8.301 1.00 . A A . 13 VAL HG12 1 1 12 8033 1 1 13 VAL HG13 H 1.358 -9.151 9.324 1.00 . A A . 13 VAL HG13 1 1 12 8034 1 1 13 VAL HG21 H 1.606 -11.174 6.003 1.00 . A A . 13 VAL HG21 1 1 12 8035 1 1 13 VAL HG22 H 0.266 -10.829 7.097 1.00 . A A . 13 VAL HG22 1 1 12 8036 1 1 13 VAL HG23 H 1.734 -11.586 7.713 1.00 . A A . 13 VAL HG23 1 1 12 8037 1 1 13 VAL N N 2.849 -9.352 5.006 1.00 . A A . 13 VAL N 1 1 12 8038 1 1 13 VAL O O 3.813 -7.188 6.623 1.00 . A A . 13 VAL O 1 1 12 8039 1 1 14 CYS C C 2.440 -4.673 7.914 1.00 . A A . 14 CYS C 1 1 12 8040 1 1 14 CYS CA C 2.260 -4.901 6.417 1.00 . A A . 14 CYS CA 1 1 12 8041 1 1 14 CYS CB C 1.229 -3.919 5.852 1.00 . A A . 14 CYS CB 1 1 12 8042 1 1 14 CYS H H 0.886 -6.421 5.897 1.00 . A A . 14 CYS H 1 1 12 8043 1 1 14 CYS HA H 3.206 -4.754 5.918 1.00 . A A . 14 CYS HA 1 1 12 8044 1 1 14 CYS HB2 H 0.805 -4.337 4.952 1.00 . A A . 14 CYS HB2 1 1 12 8045 1 1 14 CYS HB3 H 0.442 -3.781 6.580 1.00 . A A . 14 CYS HB3 1 1 12 8046 1 1 14 CYS N N 1.818 -6.264 6.170 1.00 . A A . 14 CYS N 1 1 12 8047 1 1 14 CYS O O 1.485 -4.765 8.684 1.00 . A A . 14 CYS O 1 1 12 8048 1 1 14 CYS SG S 1.886 -2.272 5.432 1.00 . A A . 14 CYS SG 1 1 12 8049 1 1 15 ILE C C 3.979 -2.671 10.042 1.00 . A A . 15 ILE C 1 1 12 8050 1 1 15 ILE CA C 3.940 -4.163 9.737 1.00 . A A . 15 ILE CA 1 1 12 8051 1 1 15 ILE CB C 5.281 -4.807 10.154 1.00 . A A . 15 ILE CB 1 1 12 8052 1 1 15 ILE CD1 C 6.604 -6.989 10.077 1.00 . A A . 15 ILE CD1 1 1 12 8053 1 1 15 ILE CG1 C 5.283 -6.300 9.807 1.00 . A A . 15 ILE CG1 1 1 12 8054 1 1 15 ILE CG2 C 5.532 -4.604 11.643 1.00 . A A . 15 ILE CG2 1 1 12 8055 1 1 15 ILE H H 4.389 -4.335 7.677 1.00 . A A . 15 ILE H 1 1 12 8056 1 1 15 ILE HA H 3.148 -4.620 10.313 1.00 . A A . 15 ILE HA 1 1 12 8057 1 1 15 ILE HB H 6.075 -4.317 9.610 1.00 . A A . 15 ILE HB 1 1 12 8058 1 1 15 ILE HD11 H 6.867 -6.868 11.117 1.00 . A A . 15 ILE HD11 1 1 12 8059 1 1 15 ILE HD12 H 7.373 -6.549 9.458 1.00 . A A . 15 ILE HD12 1 1 12 8060 1 1 15 ILE HD13 H 6.515 -8.040 9.848 1.00 . A A . 15 ILE HD13 1 1 12 8061 1 1 15 ILE HG12 H 4.526 -6.799 10.392 1.00 . A A . 15 ILE HG12 1 1 12 8062 1 1 15 ILE HG13 H 5.055 -6.418 8.757 1.00 . A A . 15 ILE HG13 1 1 12 8063 1 1 15 ILE HG21 H 5.000 -5.357 12.204 1.00 . A A . 15 ILE HG21 1 1 12 8064 1 1 15 ILE HG22 H 5.184 -3.624 11.936 1.00 . A A . 15 ILE HG22 1 1 12 8065 1 1 15 ILE HG23 H 6.590 -4.685 11.845 1.00 . A A . 15 ILE HG23 1 1 12 8066 1 1 15 ILE N N 3.660 -4.387 8.328 1.00 . A A . 15 ILE N 1 1 12 8067 1 1 15 ILE O O 3.280 -2.188 10.935 1.00 . A A . 15 ILE O 1 1 12 8068 1 1 16 ASN C C 4.458 0.214 8.203 1.00 . A A . 16 ASN C 1 1 12 8069 1 1 16 ASN CA C 4.921 -0.511 9.463 1.00 . A A . 16 ASN CA 1 1 12 8070 1 1 16 ASN CB C 6.378 -0.158 9.798 1.00 . A A . 16 ASN CB 1 1 12 8071 1 1 16 ASN CG C 6.558 1.276 10.269 1.00 . A A . 16 ASN CG 1 1 12 8072 1 1 16 ASN H H 5.305 -2.390 8.584 1.00 . A A . 16 ASN H 1 1 12 8073 1 1 16 ASN HA H 4.288 -0.218 10.287 1.00 . A A . 16 ASN HA 1 1 12 8074 1 1 16 ASN HB2 H 6.727 -0.816 10.579 1.00 . A A . 16 ASN HB2 1 1 12 8075 1 1 16 ASN HB3 H 6.985 -0.305 8.916 1.00 . A A . 16 ASN HB3 1 1 12 8076 1 1 16 ASN HD21 H 6.998 0.645 12.100 1.00 . A A . 16 ASN HD21 1 1 12 8077 1 1 16 ASN HD22 H 7.005 2.358 11.872 1.00 . A A . 16 ASN HD22 1 1 12 8078 1 1 16 ASN N N 4.788 -1.948 9.286 1.00 . A A . 16 ASN N 1 1 12 8079 1 1 16 ASN ND2 N 6.888 1.443 11.540 1.00 . A A . 16 ASN ND2 1 1 12 8080 1 1 16 ASN O O 4.516 -0.341 7.105 1.00 . A A . 16 ASN O 1 1 12 8081 1 1 16 ASN OD1 O 6.404 2.225 9.501 1.00 . A A . 16 ASN OD1 1 1 12 8082 1 1 17 LYS C C 4.620 2.594 6.273 1.00 . A A . 17 LYS C 1 1 12 8083 1 1 17 LYS CA C 3.502 2.252 7.264 1.00 . A A . 17 LYS CA 1 1 12 8084 1 1 17 LYS CB C 2.859 3.536 7.804 1.00 . A A . 17 LYS CB 1 1 12 8085 1 1 17 LYS CD C 1.769 5.753 7.323 1.00 . A A . 17 LYS CD 1 1 12 8086 1 1 17 LYS CE C 1.580 6.849 6.283 1.00 . A A . 17 LYS CE 1 1 12 8087 1 1 17 LYS CG C 2.410 4.510 6.724 1.00 . A A . 17 LYS CG 1 1 12 8088 1 1 17 LYS H H 3.965 1.816 9.278 1.00 . A A . 17 LYS H 1 1 12 8089 1 1 17 LYS HA H 2.748 1.679 6.746 1.00 . A A . 17 LYS HA 1 1 12 8090 1 1 17 LYS HB2 H 1.996 3.269 8.395 1.00 . A A . 17 LYS HB2 1 1 12 8091 1 1 17 LYS HB3 H 3.573 4.041 8.437 1.00 . A A . 17 LYS HB3 1 1 12 8092 1 1 17 LYS HD2 H 0.805 5.488 7.729 1.00 . A A . 17 LYS HD2 1 1 12 8093 1 1 17 LYS HD3 H 2.404 6.126 8.114 1.00 . A A . 17 LYS HD3 1 1 12 8094 1 1 17 LYS HE2 H 1.130 7.706 6.762 1.00 . A A . 17 LYS HE2 1 1 12 8095 1 1 17 LYS HE3 H 2.548 7.126 5.892 1.00 . A A . 17 LYS HE3 1 1 12 8096 1 1 17 LYS HG2 H 3.269 4.806 6.140 1.00 . A A . 17 LYS HG2 1 1 12 8097 1 1 17 LYS HG3 H 1.691 4.018 6.085 1.00 . A A . 17 LYS HG3 1 1 12 8098 1 1 17 LYS HZ1 H -0.290 6.488 5.421 1.00 . A A . 17 LYS HZ1 1 1 12 8099 1 1 17 LYS HZ2 H 0.918 5.436 4.884 1.00 . A A . 17 LYS HZ2 1 1 12 8100 1 1 17 LYS HZ3 H 0.873 7.033 4.320 1.00 . A A . 17 LYS HZ3 1 1 12 8101 1 1 17 LYS N N 3.989 1.442 8.373 1.00 . A A . 17 LYS N 1 1 12 8102 1 1 17 LYS NZ N 0.710 6.418 5.156 1.00 . A A . 17 LYS NZ 1 1 12 8103 1 1 17 LYS O O 4.383 2.645 5.068 1.00 . A A . 17 LYS O 1 1 12 8104 1 1 18 LYS C C 7.173 2.214 4.773 1.00 . A A . 18 LYS C 1 1 12 8105 1 1 18 LYS CA C 6.977 3.195 5.942 1.00 . A A . 18 LYS CA 1 1 12 8106 1 1 18 LYS CB C 8.259 3.302 6.778 1.00 . A A . 18 LYS CB 1 1 12 8107 1 1 18 LYS CD C 9.514 4.487 8.612 1.00 . A A . 18 LYS CD 1 1 12 8108 1 1 18 LYS CE C 10.689 4.863 7.722 1.00 . A A . 18 LYS CE 1 1 12 8109 1 1 18 LYS CG C 8.214 4.406 7.824 1.00 . A A . 18 LYS CG 1 1 12 8110 1 1 18 LYS H H 5.950 2.786 7.762 1.00 . A A . 18 LYS H 1 1 12 8111 1 1 18 LYS HA H 6.766 4.168 5.524 1.00 . A A . 18 LYS HA 1 1 12 8112 1 1 18 LYS HB2 H 8.424 2.363 7.284 1.00 . A A . 18 LYS HB2 1 1 12 8113 1 1 18 LYS HB3 H 9.090 3.496 6.116 1.00 . A A . 18 LYS HB3 1 1 12 8114 1 1 18 LYS HD2 H 9.408 5.234 9.385 1.00 . A A . 18 LYS HD2 1 1 12 8115 1 1 18 LYS HD3 H 9.709 3.525 9.064 1.00 . A A . 18 LYS HD3 1 1 12 8116 1 1 18 LYS HE2 H 10.793 4.115 6.951 1.00 . A A . 18 LYS HE2 1 1 12 8117 1 1 18 LYS HE3 H 10.487 5.822 7.268 1.00 . A A . 18 LYS HE3 1 1 12 8118 1 1 18 LYS HG2 H 8.047 5.350 7.329 1.00 . A A . 18 LYS HG2 1 1 12 8119 1 1 18 LYS HG3 H 7.401 4.207 8.507 1.00 . A A . 18 LYS HG3 1 1 12 8120 1 1 18 LYS HZ1 H 12.686 4.346 8.047 1.00 . A A . 18 LYS HZ1 1 1 12 8121 1 1 18 LYS HZ2 H 11.813 4.630 9.467 1.00 . A A . 18 LYS HZ2 1 1 12 8122 1 1 18 LYS HZ3 H 12.305 5.930 8.504 1.00 . A A . 18 LYS HZ3 1 1 12 8123 1 1 18 LYS N N 5.829 2.838 6.788 1.00 . A A . 18 LYS N 1 1 12 8124 1 1 18 LYS NZ N 11.962 4.948 8.489 1.00 . A A . 18 LYS NZ 1 1 12 8125 1 1 18 LYS O O 7.169 2.643 3.619 1.00 . A A . 18 LYS O 1 1 12 8126 1 1 19 PRO C C 6.435 -0.009 2.898 1.00 . A A . 19 PRO C 1 1 12 8127 1 1 19 PRO CA C 7.522 -0.105 3.963 1.00 . A A . 19 PRO CA 1 1 12 8128 1 1 19 PRO CB C 7.401 -1.438 4.705 1.00 . A A . 19 PRO CB 1 1 12 8129 1 1 19 PRO CD C 7.376 0.259 6.367 1.00 . A A . 19 PRO CD 1 1 12 8130 1 1 19 PRO CG C 7.861 -1.134 6.083 1.00 . A A . 19 PRO CG 1 1 12 8131 1 1 19 PRO HA H 8.495 -0.028 3.502 1.00 . A A . 19 PRO HA 1 1 12 8132 1 1 19 PRO HB2 H 6.370 -1.763 4.696 1.00 . A A . 19 PRO HB2 1 1 12 8133 1 1 19 PRO HB3 H 8.021 -2.184 4.233 1.00 . A A . 19 PRO HB3 1 1 12 8134 1 1 19 PRO HD2 H 6.389 0.233 6.806 1.00 . A A . 19 PRO HD2 1 1 12 8135 1 1 19 PRO HD3 H 8.066 0.774 7.019 1.00 . A A . 19 PRO HD3 1 1 12 8136 1 1 19 PRO HG2 H 7.427 -1.835 6.781 1.00 . A A . 19 PRO HG2 1 1 12 8137 1 1 19 PRO HG3 H 8.939 -1.172 6.129 1.00 . A A . 19 PRO HG3 1 1 12 8138 1 1 19 PRO N N 7.341 0.892 5.033 1.00 . A A . 19 PRO N 1 1 12 8139 1 1 19 PRO O O 6.711 -0.073 1.698 1.00 . A A . 19 PRO O 1 1 12 8140 1 1 20 CYS C C 4.157 1.523 1.610 1.00 . A A . 20 CYS C 1 1 12 8141 1 1 20 CYS CA C 4.057 0.259 2.461 1.00 . A A . 20 CYS CA 1 1 12 8142 1 1 20 CYS CB C 2.760 0.265 3.276 1.00 . A A . 20 CYS CB 1 1 12 8143 1 1 20 CYS H H 5.053 0.199 4.322 1.00 . A A . 20 CYS H 1 1 12 8144 1 1 20 CYS HA H 4.064 -0.603 1.809 1.00 . A A . 20 CYS HA 1 1 12 8145 1 1 20 CYS HB2 H 2.736 -0.612 3.903 1.00 . A A . 20 CYS HB2 1 1 12 8146 1 1 20 CYS HB3 H 2.744 1.146 3.901 1.00 . A A . 20 CYS HB3 1 1 12 8147 1 1 20 CYS N N 5.200 0.151 3.354 1.00 . A A . 20 CYS N 1 1 12 8148 1 1 20 CYS O O 4.054 1.465 0.386 1.00 . A A . 20 CYS O 1 1 12 8149 1 1 20 CYS SG S 1.235 0.267 2.279 1.00 . A A . 20 CYS SG 1 1 12 8150 1 1 21 VAL C C 5.616 3.885 0.524 1.00 . A A . 21 VAL C 1 1 12 8151 1 1 21 VAL CA C 4.505 3.939 1.568 1.00 . A A . 21 VAL CA 1 1 12 8152 1 1 21 VAL CB C 4.776 5.096 2.554 1.00 . A A . 21 VAL CB 1 1 12 8153 1 1 21 VAL CG1 C 5.005 6.403 1.814 1.00 . A A . 21 VAL CG1 1 1 12 8154 1 1 21 VAL CG2 C 3.622 5.244 3.528 1.00 . A A . 21 VAL CG2 1 1 12 8155 1 1 21 VAL H H 4.468 2.640 3.243 1.00 . A A . 21 VAL H 1 1 12 8156 1 1 21 VAL HA H 3.567 4.135 1.064 1.00 . A A . 21 VAL HA 1 1 12 8157 1 1 21 VAL HB H 5.667 4.864 3.118 1.00 . A A . 21 VAL HB 1 1 12 8158 1 1 21 VAL HG11 H 4.294 7.140 2.156 1.00 . A A . 21 VAL HG11 1 1 12 8159 1 1 21 VAL HG12 H 4.876 6.244 0.754 1.00 . A A . 21 VAL HG12 1 1 12 8160 1 1 21 VAL HG13 H 6.008 6.755 2.007 1.00 . A A . 21 VAL HG13 1 1 12 8161 1 1 21 VAL HG21 H 2.688 5.101 3.004 1.00 . A A . 21 VAL HG21 1 1 12 8162 1 1 21 VAL HG22 H 3.642 6.233 3.963 1.00 . A A . 21 VAL HG22 1 1 12 8163 1 1 21 VAL HG23 H 3.713 4.505 4.309 1.00 . A A . 21 VAL HG23 1 1 12 8164 1 1 21 VAL N N 4.379 2.661 2.263 1.00 . A A . 21 VAL N 1 1 12 8165 1 1 21 VAL O O 5.450 4.377 -0.593 1.00 . A A . 21 VAL O 1 1 12 8166 1 1 22 ALA C C 7.453 2.340 -1.260 1.00 . A A . 22 ALA C 1 1 12 8167 1 1 22 ALA CA C 7.864 3.139 -0.027 1.00 . A A . 22 ALA CA 1 1 12 8168 1 1 22 ALA CB C 9.041 2.475 0.672 1.00 . A A . 22 ALA CB 1 1 12 8169 1 1 22 ALA H H 6.804 2.887 1.791 1.00 . A A . 22 ALA H 1 1 12 8170 1 1 22 ALA HA H 8.165 4.130 -0.334 1.00 . A A . 22 ALA HA 1 1 12 8171 1 1 22 ALA HB1 H 9.527 3.191 1.317 1.00 . A A . 22 ALA HB1 1 1 12 8172 1 1 22 ALA HB2 H 9.744 2.119 -0.066 1.00 . A A . 22 ALA HB2 1 1 12 8173 1 1 22 ALA HB3 H 8.686 1.642 1.262 1.00 . A A . 22 ALA HB3 1 1 12 8174 1 1 22 ALA N N 6.737 3.271 0.887 1.00 . A A . 22 ALA N 1 1 12 8175 1 1 22 ALA O O 7.724 2.744 -2.394 1.00 . A A . 22 ALA O 1 1 12 8176 1 1 23 CYS C C 5.330 1.129 -2.987 1.00 . A A . 23 CYS C 1 1 12 8177 1 1 23 CYS CA C 6.293 0.357 -2.095 1.00 . A A . 23 CYS CA 1 1 12 8178 1 1 23 CYS CB C 5.581 -0.864 -1.502 1.00 . A A . 23 CYS CB 1 1 12 8179 1 1 23 CYS H H 6.578 0.972 -0.090 1.00 . A A . 23 CYS H 1 1 12 8180 1 1 23 CYS HA H 7.141 0.032 -2.678 1.00 . A A . 23 CYS HA 1 1 12 8181 1 1 23 CYS HB2 H 6.106 -1.176 -0.614 1.00 . A A . 23 CYS HB2 1 1 12 8182 1 1 23 CYS HB3 H 4.573 -0.582 -1.232 1.00 . A A . 23 CYS HB3 1 1 12 8183 1 1 23 CYS N N 6.774 1.220 -1.021 1.00 . A A . 23 CYS N 1 1 12 8184 1 1 23 CYS O O 5.364 1.027 -4.213 1.00 . A A . 23 CYS O 1 1 12 8185 1 1 23 CYS SG S 5.472 -2.305 -2.620 1.00 . A A . 23 CYS SG 1 1 12 8186 1 1 24 CYS C C 4.120 3.781 -3.910 1.00 . A A . 24 CYS C 1 1 12 8187 1 1 24 CYS CA C 3.481 2.690 -3.058 1.00 . A A . 24 CYS CA 1 1 12 8188 1 1 24 CYS CB C 2.510 3.301 -2.054 1.00 . A A . 24 CYS CB 1 1 12 8189 1 1 24 CYS H H 4.492 1.923 -1.369 1.00 . A A . 24 CYS H 1 1 12 8190 1 1 24 CYS HA H 2.932 2.026 -3.707 1.00 . A A . 24 CYS HA 1 1 12 8191 1 1 24 CYS HB2 H 3.066 3.877 -1.325 1.00 . A A . 24 CYS HB2 1 1 12 8192 1 1 24 CYS HB3 H 1.822 3.950 -2.572 1.00 . A A . 24 CYS HB3 1 1 12 8193 1 1 24 CYS N N 4.470 1.897 -2.353 1.00 . A A . 24 CYS N 1 1 12 8194 1 1 24 CYS O O 3.748 3.963 -5.064 1.00 . A A . 24 CYS O 1 1 12 8195 1 1 24 CYS SG S 1.536 2.053 -1.160 1.00 . A A . 24 CYS SG 1 1 12 8196 1 1 25 LYS C C 6.480 5.071 -5.299 1.00 . A A . 25 LYS C 1 1 12 8197 1 1 25 LYS CA C 5.727 5.590 -4.078 1.00 . A A . 25 LYS CA 1 1 12 8198 1 1 25 LYS CB C 6.638 6.398 -3.156 1.00 . A A . 25 LYS CB 1 1 12 8199 1 1 25 LYS CD C 6.736 8.135 -1.329 1.00 . A A . 25 LYS CD 1 1 12 8200 1 1 25 LYS CE C 5.917 8.924 -0.320 1.00 . A A . 25 LYS CE 1 1 12 8201 1 1 25 LYS CG C 5.852 7.198 -2.130 1.00 . A A . 25 LYS CG 1 1 12 8202 1 1 25 LYS H H 5.331 4.333 -2.413 1.00 . A A . 25 LYS H 1 1 12 8203 1 1 25 LYS HA H 4.944 6.245 -4.432 1.00 . A A . 25 LYS HA 1 1 12 8204 1 1 25 LYS HB2 H 7.301 5.723 -2.634 1.00 . A A . 25 LYS HB2 1 1 12 8205 1 1 25 LYS HB3 H 7.224 7.085 -3.749 1.00 . A A . 25 LYS HB3 1 1 12 8206 1 1 25 LYS HD2 H 7.479 7.554 -0.803 1.00 . A A . 25 LYS HD2 1 1 12 8207 1 1 25 LYS HD3 H 7.223 8.824 -2.004 1.00 . A A . 25 LYS HD3 1 1 12 8208 1 1 25 LYS HE2 H 5.411 8.226 0.332 1.00 . A A . 25 LYS HE2 1 1 12 8209 1 1 25 LYS HE3 H 6.584 9.542 0.263 1.00 . A A . 25 LYS HE3 1 1 12 8210 1 1 25 LYS HG2 H 5.105 7.783 -2.644 1.00 . A A . 25 LYS HG2 1 1 12 8211 1 1 25 LYS HG3 H 5.367 6.511 -1.453 1.00 . A A . 25 LYS HG3 1 1 12 8212 1 1 25 LYS HZ1 H 3.966 9.319 -0.977 1.00 . A A . 25 LYS HZ1 1 1 12 8213 1 1 25 LYS HZ2 H 5.174 9.987 -1.959 1.00 . A A . 25 LYS HZ2 1 1 12 8214 1 1 25 LYS HZ3 H 4.815 10.693 -0.466 1.00 . A A . 25 LYS HZ3 1 1 12 8215 1 1 25 LYS N N 5.072 4.513 -3.345 1.00 . A A . 25 LYS N 1 1 12 8216 1 1 25 LYS NZ N 4.899 9.792 -0.976 1.00 . A A . 25 LYS NZ 1 1 12 8217 1 1 25 LYS O O 6.417 5.682 -6.371 1.00 . A A . 25 LYS O 1 1 12 8218 1 1 26 LYS C C 6.860 2.883 -7.349 1.00 . A A . 26 LYS C 1 1 12 8219 1 1 26 LYS CA C 7.870 3.361 -6.304 1.00 . A A . 26 LYS CA 1 1 12 8220 1 1 26 LYS CB C 8.799 2.212 -5.887 1.00 . A A . 26 LYS CB 1 1 12 8221 1 1 26 LYS CD C 8.890 -0.134 -4.967 1.00 . A A . 26 LYS CD 1 1 12 8222 1 1 26 LYS CE C 8.731 -0.882 -6.280 1.00 . A A . 26 LYS CE 1 1 12 8223 1 1 26 LYS CG C 8.139 1.185 -4.990 1.00 . A A . 26 LYS CG 1 1 12 8224 1 1 26 LYS H H 7.162 3.467 -4.300 1.00 . A A . 26 LYS H 1 1 12 8225 1 1 26 LYS HA H 8.465 4.150 -6.743 1.00 . A A . 26 LYS HA 1 1 12 8226 1 1 26 LYS HB2 H 9.149 1.708 -6.776 1.00 . A A . 26 LYS HB2 1 1 12 8227 1 1 26 LYS HB3 H 9.648 2.625 -5.362 1.00 . A A . 26 LYS HB3 1 1 12 8228 1 1 26 LYS HD2 H 9.938 0.062 -4.800 1.00 . A A . 26 LYS HD2 1 1 12 8229 1 1 26 LYS HD3 H 8.501 -0.744 -4.165 1.00 . A A . 26 LYS HD3 1 1 12 8230 1 1 26 LYS HE2 H 7.697 -0.833 -6.585 1.00 . A A . 26 LYS HE2 1 1 12 8231 1 1 26 LYS HE3 H 9.350 -0.407 -7.027 1.00 . A A . 26 LYS HE3 1 1 12 8232 1 1 26 LYS HG2 H 8.099 1.577 -3.985 1.00 . A A . 26 LYS HG2 1 1 12 8233 1 1 26 LYS HG3 H 7.134 1.009 -5.347 1.00 . A A . 26 LYS HG3 1 1 12 8234 1 1 26 LYS HZ1 H 9.838 -2.415 -5.399 1.00 . A A . 26 LYS HZ1 1 1 12 8235 1 1 26 LYS HZ2 H 9.538 -2.647 -7.046 1.00 . A A . 26 LYS HZ2 1 1 12 8236 1 1 26 LYS HZ3 H 8.296 -2.891 -5.918 1.00 . A A . 26 LYS HZ3 1 1 12 8237 1 1 26 LYS N N 7.160 3.936 -5.164 1.00 . A A . 26 LYS N 1 1 12 8238 1 1 26 LYS NZ N 9.132 -2.307 -6.153 1.00 . A A . 26 LYS NZ 1 1 12 8239 1 1 26 LYS O O 7.117 2.953 -8.550 1.00 . A A . 26 LYS O 1 1 12 8240 1 1 27 ALA C C 3.823 3.128 -8.313 1.00 . A A . 27 ALA C 1 1 12 8241 1 1 27 ALA CA C 4.630 1.953 -7.756 1.00 . A A . 27 ALA CA 1 1 12 8242 1 1 27 ALA CB C 3.720 0.988 -7.012 1.00 . A A . 27 ALA CB 1 1 12 8243 1 1 27 ALA H H 5.552 2.413 -5.905 1.00 . A A . 27 ALA H 1 1 12 8244 1 1 27 ALA HA H 5.086 1.421 -8.578 1.00 . A A . 27 ALA HA 1 1 12 8245 1 1 27 ALA HB1 H 4.134 0.783 -6.036 1.00 . A A . 27 ALA HB1 1 1 12 8246 1 1 27 ALA HB2 H 3.639 0.067 -7.570 1.00 . A A . 27 ALA HB2 1 1 12 8247 1 1 27 ALA HB3 H 2.741 1.430 -6.902 1.00 . A A . 27 ALA HB3 1 1 12 8248 1 1 27 ALA N N 5.700 2.423 -6.876 1.00 . A A . 27 ALA N 1 1 12 8249 1 1 27 ALA O O 2.817 2.938 -9.000 1.00 . A A . 27 ALA O 1 1 12 8250 1 1 28 LYS C C 2.347 5.862 -7.758 1.00 . A A . 28 LYS C 1 1 12 8251 1 1 28 LYS CA C 3.676 5.581 -8.467 1.00 . A A . 28 LYS CA 1 1 12 8252 1 1 28 LYS CB C 3.490 5.578 -9.990 1.00 . A A . 28 LYS CB 1 1 12 8253 1 1 28 LYS CD C 4.899 7.636 -10.274 1.00 . A A . 28 LYS CD 1 1 12 8254 1 1 28 LYS CE C 6.087 6.799 -10.730 1.00 . A A . 28 LYS CE 1 1 12 8255 1 1 28 LYS CG C 3.575 6.963 -10.613 1.00 . A A . 28 LYS CG 1 1 12 8256 1 1 28 LYS H H 5.105 4.392 -7.465 1.00 . A A . 28 LYS H 1 1 12 8257 1 1 28 LYS HA H 4.359 6.378 -8.214 1.00 . A A . 28 LYS HA 1 1 12 8258 1 1 28 LYS HB2 H 4.256 4.959 -10.434 1.00 . A A . 28 LYS HB2 1 1 12 8259 1 1 28 LYS HB3 H 2.522 5.160 -10.222 1.00 . A A . 28 LYS HB3 1 1 12 8260 1 1 28 LYS HD2 H 4.939 8.596 -10.766 1.00 . A A . 28 LYS HD2 1 1 12 8261 1 1 28 LYS HD3 H 4.957 7.774 -9.205 1.00 . A A . 28 LYS HD3 1 1 12 8262 1 1 28 LYS HE2 H 5.946 5.783 -10.393 1.00 . A A . 28 LYS HE2 1 1 12 8263 1 1 28 LYS HE3 H 6.130 6.816 -11.810 1.00 . A A . 28 LYS HE3 1 1 12 8264 1 1 28 LYS HG2 H 3.491 6.872 -11.686 1.00 . A A . 28 LYS HG2 1 1 12 8265 1 1 28 LYS HG3 H 2.765 7.569 -10.235 1.00 . A A . 28 LYS HG3 1 1 12 8266 1 1 28 LYS HZ1 H 7.725 6.676 -9.443 1.00 . A A . 28 LYS HZ1 1 1 12 8267 1 1 28 LYS HZ2 H 7.235 8.260 -9.777 1.00 . A A . 28 LYS HZ2 1 1 12 8268 1 1 28 LYS HZ3 H 8.083 7.375 -10.942 1.00 . A A . 28 LYS HZ3 1 1 12 8269 1 1 28 LYS N N 4.294 4.337 -8.013 1.00 . A A . 28 LYS N 1 1 12 8270 1 1 28 LYS NZ N 7.372 7.314 -10.186 1.00 . A A . 28 LYS NZ 1 1 12 8271 1 1 28 LYS O O 1.310 6.050 -8.401 1.00 . A A . 28 LYS O 1 1 12 8272 1 1 29 PHE C C 1.609 7.308 -4.607 1.00 . A A . 29 PHE C 1 1 12 8273 1 1 29 PHE CA C 1.239 6.215 -5.602 1.00 . A A . 29 PHE CA 1 1 12 8274 1 1 29 PHE CB C 0.733 4.977 -4.848 1.00 . A A . 29 PHE CB 1 1 12 8275 1 1 29 PHE CD1 C 0.705 3.129 -6.554 1.00 . A A . 29 PHE CD1 1 1 12 8276 1 1 29 PHE CD2 C -1.374 3.882 -5.666 1.00 . A A . 29 PHE CD2 1 1 12 8277 1 1 29 PHE CE1 C 0.038 2.208 -7.340 1.00 . A A . 29 PHE CE1 1 1 12 8278 1 1 29 PHE CE2 C -2.046 2.964 -6.449 1.00 . A A . 29 PHE CE2 1 1 12 8279 1 1 29 PHE CG C 0.009 3.976 -5.709 1.00 . A A . 29 PHE CG 1 1 12 8280 1 1 29 PHE CZ C -1.339 2.125 -7.287 1.00 . A A . 29 PHE CZ 1 1 12 8281 1 1 29 PHE H H 3.268 5.775 -5.990 1.00 . A A . 29 PHE H 1 1 12 8282 1 1 29 PHE HA H 0.455 6.583 -6.249 1.00 . A A . 29 PHE HA 1 1 12 8283 1 1 29 PHE HB2 H 1.575 4.474 -4.398 1.00 . A A . 29 PHE HB2 1 1 12 8284 1 1 29 PHE HB3 H 0.055 5.296 -4.067 1.00 . A A . 29 PHE HB3 1 1 12 8285 1 1 29 PHE HD1 H 1.783 3.192 -6.597 1.00 . A A . 29 PHE HD1 1 1 12 8286 1 1 29 PHE HD2 H -1.929 4.538 -5.011 1.00 . A A . 29 PHE HD2 1 1 12 8287 1 1 29 PHE HE1 H 0.595 1.554 -7.995 1.00 . A A . 29 PHE HE1 1 1 12 8288 1 1 29 PHE HE2 H -3.123 2.902 -6.406 1.00 . A A . 29 PHE HE2 1 1 12 8289 1 1 29 PHE HZ H -1.861 1.406 -7.900 1.00 . A A . 29 PHE HZ 1 1 12 8290 1 1 29 PHE N N 2.402 5.918 -6.433 1.00 . A A . 29 PHE N 1 1 12 8291 1 1 29 PHE O O 2.765 7.410 -4.192 1.00 . A A . 29 PHE O 1 1 12 8292 1 1 30 SER C C 1.283 8.762 -1.939 1.00 . A A . 30 SER C 1 1 12 8293 1 1 30 SER CA C 0.871 9.244 -3.333 1.00 . A A . 30 SER CA 1 1 12 8294 1 1 30 SER CB C -0.390 10.104 -3.244 1.00 . A A . 30 SER CB 1 1 12 8295 1 1 30 SER H H -0.254 8.022 -4.634 1.00 . A A . 30 SER H 1 1 12 8296 1 1 30 SER HA H 1.669 9.843 -3.737 1.00 . A A . 30 SER HA 1 1 12 8297 1 1 30 SER HB2 H -1.144 9.578 -2.677 1.00 . A A . 30 SER HB2 1 1 12 8298 1 1 30 SER HB3 H -0.155 11.037 -2.754 1.00 . A A . 30 SER HB3 1 1 12 8299 1 1 30 SER HG H -0.731 11.307 -4.764 1.00 . A A . 30 SER HG 1 1 12 8300 1 1 30 SER N N 0.641 8.139 -4.252 1.00 . A A . 30 SER N 1 1 12 8301 1 1 30 SER O O 2.256 9.264 -1.364 1.00 . A A . 30 SER O 1 1 12 8302 1 1 30 SER OG O -0.901 10.383 -4.539 1.00 . A A . 30 SER OG 1 1 12 8303 1 1 31 ASP C C 0.167 5.911 0.141 1.00 . A A . 31 ASP C 1 1 12 8304 1 1 31 ASP CA C 0.829 7.270 -0.062 1.00 . A A . 31 ASP CA 1 1 12 8305 1 1 31 ASP CB C 0.351 8.264 1.008 1.00 . A A . 31 ASP CB 1 1 12 8306 1 1 31 ASP CG C 0.433 7.708 2.417 1.00 . A A . 31 ASP CG 1 1 12 8307 1 1 31 ASP H H -0.220 7.439 -1.904 1.00 . A A . 31 ASP H 1 1 12 8308 1 1 31 ASP HA H 1.899 7.151 0.025 1.00 . A A . 31 ASP HA 1 1 12 8309 1 1 31 ASP HB2 H 0.962 9.153 0.960 1.00 . A A . 31 ASP HB2 1 1 12 8310 1 1 31 ASP HB3 H -0.676 8.530 0.805 1.00 . A A . 31 ASP HB3 1 1 12 8311 1 1 31 ASP N N 0.545 7.799 -1.398 1.00 . A A . 31 ASP N 1 1 12 8312 1 1 31 ASP O O -0.897 5.646 -0.412 1.00 . A A . 31 ASP O 1 1 12 8313 1 1 31 ASP OD1 O -0.490 6.976 2.832 1.00 . A A . 31 ASP OD1 1 1 12 8314 1 1 31 ASP OD2 O 1.435 7.975 3.112 1.00 . A A . 31 ASP OD2 1 1 12 8315 1 1 32 GLY C C -0.129 3.530 2.633 1.00 . A A . 32 GLY C 1 1 12 8316 1 1 32 GLY CA C 0.263 3.734 1.185 1.00 . A A . 32 GLY CA 1 1 12 8317 1 1 32 GLY H H 1.648 5.321 1.343 1.00 . A A . 32 GLY H 1 1 12 8318 1 1 32 GLY HA2 H -0.615 3.592 0.567 1.00 . A A . 32 GLY HA2 1 1 12 8319 1 1 32 GLY HA3 H 1.002 2.995 0.915 1.00 . A A . 32 GLY HA3 1 1 12 8320 1 1 32 GLY N N 0.804 5.054 0.929 1.00 . A A . 32 GLY N 1 1 12 8321 1 1 32 GLY O O 0.421 4.162 3.540 1.00 . A A . 32 GLY O 1 1 12 8322 1 1 33 HIS C C -1.813 0.846 4.347 1.00 . A A . 33 HIS C 1 1 12 8323 1 1 33 HIS CA C -1.572 2.341 4.183 1.00 . A A . 33 HIS CA 1 1 12 8324 1 1 33 HIS CB C -2.875 3.102 4.466 1.00 . A A . 33 HIS CB 1 1 12 8325 1 1 33 HIS CD2 C -5.046 2.077 3.465 1.00 . A A . 33 HIS CD2 1 1 12 8326 1 1 33 HIS CE1 C -4.989 3.044 1.501 1.00 . A A . 33 HIS CE1 1 1 12 8327 1 1 33 HIS CG C -3.951 2.874 3.438 1.00 . A A . 33 HIS CG 1 1 12 8328 1 1 33 HIS H H -1.478 2.168 2.077 1.00 . A A . 33 HIS H 1 1 12 8329 1 1 33 HIS HA H -0.820 2.655 4.891 1.00 . A A . 33 HIS HA 1 1 12 8330 1 1 33 HIS HB2 H -3.263 2.790 5.424 1.00 . A A . 33 HIS HB2 1 1 12 8331 1 1 33 HIS HB3 H -2.661 4.158 4.499 1.00 . A A . 33 HIS HB3 1 1 12 8332 1 1 33 HIS HD1 H -3.283 4.112 1.859 1.00 . A A . 33 HIS HD1 1 1 12 8333 1 1 33 HIS HD2 H -5.359 1.446 4.282 1.00 . A A . 33 HIS HD2 1 1 12 8334 1 1 33 HIS HE1 H -5.231 3.323 0.487 1.00 . A A . 33 HIS HE1 1 1 12 8335 1 1 33 HIS N N -1.085 2.642 2.848 1.00 . A A . 33 HIS N 1 1 12 8336 1 1 33 HIS ND1 N -3.947 3.467 2.191 1.00 . A A . 33 HIS ND1 1 1 12 8337 1 1 33 HIS NE2 N -5.673 2.202 2.251 1.00 . A A . 33 HIS NE2 1 1 12 8338 1 1 33 HIS O O -2.409 0.203 3.482 1.00 . A A . 33 HIS O 1 1 12 8339 1 1 34 CYS C C -3.022 -1.367 6.088 1.00 . A A . 34 CYS C 1 1 12 8340 1 1 34 CYS CA C -1.558 -1.109 5.748 1.00 . A A . 34 CYS CA 1 1 12 8341 1 1 34 CYS CB C -0.680 -1.551 6.923 1.00 . A A . 34 CYS CB 1 1 12 8342 1 1 34 CYS H H -0.915 0.868 6.124 1.00 . A A . 34 CYS H 1 1 12 8343 1 1 34 CYS HA H -1.291 -1.672 4.866 1.00 . A A . 34 CYS HA 1 1 12 8344 1 1 34 CYS HB2 H -1.084 -1.139 7.835 1.00 . A A . 34 CYS HB2 1 1 12 8345 1 1 34 CYS HB3 H -0.697 -2.629 6.986 1.00 . A A . 34 CYS HB3 1 1 12 8346 1 1 34 CYS N N -1.368 0.304 5.466 1.00 . A A . 34 CYS N 1 1 12 8347 1 1 34 CYS O O -3.580 -0.711 6.968 1.00 . A A . 34 CYS O 1 1 12 8348 1 1 34 CYS SG S 1.067 -1.032 6.816 1.00 . A A . 34 CYS SG 1 1 12 8349 1 1 35 SER C C -5.174 -3.344 7.008 1.00 . A A . 35 SER C 1 1 12 8350 1 1 35 SER CA C -5.041 -2.635 5.661 1.00 . A A . 35 SER CA 1 1 12 8351 1 1 35 SER CB C -5.630 -3.486 4.532 1.00 . A A . 35 SER CB 1 1 12 8352 1 1 35 SER H H -3.157 -2.809 4.707 1.00 . A A . 35 SER H 1 1 12 8353 1 1 35 SER HA H -5.581 -1.700 5.709 1.00 . A A . 35 SER HA 1 1 12 8354 1 1 35 SER HB2 H -6.593 -3.866 4.837 1.00 . A A . 35 SER HB2 1 1 12 8355 1 1 35 SER HB3 H -5.749 -2.875 3.649 1.00 . A A . 35 SER HB3 1 1 12 8356 1 1 35 SER HG H -4.016 -4.256 3.733 1.00 . A A . 35 SER HG 1 1 12 8357 1 1 35 SER N N -3.646 -2.314 5.399 1.00 . A A . 35 SER N 1 1 12 8358 1 1 35 SER O O -4.201 -3.886 7.528 1.00 . A A . 35 SER O 1 1 12 8359 1 1 35 SER OG O -4.789 -4.579 4.219 1.00 . A A . 35 SER OG 1 1 12 8360 1 1 36 LYS C C -6.995 -5.400 8.762 1.00 . A A . 36 LYS C 1 1 12 8361 1 1 36 LYS CA C -6.591 -3.930 8.886 1.00 . A A . 36 LYS CA 1 1 12 8362 1 1 36 LYS CB C -7.670 -3.158 9.655 1.00 . A A . 36 LYS CB 1 1 12 8363 1 1 36 LYS CD C -9.023 -2.928 11.774 1.00 . A A . 36 LYS CD 1 1 12 8364 1 1 36 LYS CE C -10.384 -2.967 11.095 1.00 . A A . 36 LYS CE 1 1 12 8365 1 1 36 LYS CG C -7.989 -3.751 11.019 1.00 . A A . 36 LYS CG 1 1 12 8366 1 1 36 LYS H H -7.100 -2.842 7.142 1.00 . A A . 36 LYS H 1 1 12 8367 1 1 36 LYS HA H -5.667 -3.874 9.440 1.00 . A A . 36 LYS HA 1 1 12 8368 1 1 36 LYS HB2 H -7.336 -2.141 9.797 1.00 . A A . 36 LYS HB2 1 1 12 8369 1 1 36 LYS HB3 H -8.577 -3.150 9.069 1.00 . A A . 36 LYS HB3 1 1 12 8370 1 1 36 LYS HD2 H -9.122 -3.323 12.774 1.00 . A A . 36 LYS HD2 1 1 12 8371 1 1 36 LYS HD3 H -8.685 -1.903 11.823 1.00 . A A . 36 LYS HD3 1 1 12 8372 1 1 36 LYS HE2 H -10.293 -2.533 10.111 1.00 . A A . 36 LYS HE2 1 1 12 8373 1 1 36 LYS HE3 H -10.699 -3.996 11.007 1.00 . A A . 36 LYS HE3 1 1 12 8374 1 1 36 LYS HG2 H -8.374 -4.751 10.879 1.00 . A A . 36 LYS HG2 1 1 12 8375 1 1 36 LYS HG3 H -7.080 -3.794 11.601 1.00 . A A . 36 LYS HG3 1 1 12 8376 1 1 36 LYS HZ1 H -11.119 -1.216 11.968 1.00 . A A . 36 LYS HZ1 1 1 12 8377 1 1 36 LYS HZ2 H -11.525 -2.625 12.811 1.00 . A A . 36 LYS HZ2 1 1 12 8378 1 1 36 LYS HZ3 H -12.325 -2.243 11.370 1.00 . A A . 36 LYS HZ3 1 1 12 8379 1 1 36 LYS N N -6.365 -3.311 7.586 1.00 . A A . 36 LYS N 1 1 12 8380 1 1 36 LYS NZ N -11.410 -2.209 11.865 1.00 . A A . 36 LYS NZ 1 1 12 8381 1 1 36 LYS O O -6.649 -6.211 9.613 1.00 . A A . 36 LYS O 1 1 12 8382 1 1 37 ILE C C -7.112 -8.079 7.209 1.00 . A A . 37 ILE C 1 1 12 8383 1 1 37 ILE CA C -8.240 -7.090 7.528 1.00 . A A . 37 ILE CA 1 1 12 8384 1 1 37 ILE CB C -9.302 -7.143 6.409 1.00 . A A . 37 ILE CB 1 1 12 8385 1 1 37 ILE CD1 C -11.472 -6.062 5.611 1.00 . A A . 37 ILE CD1 1 1 12 8386 1 1 37 ILE CG1 C -10.439 -6.162 6.714 1.00 . A A . 37 ILE CG1 1 1 12 8387 1 1 37 ILE CG2 C -9.846 -8.559 6.252 1.00 . A A . 37 ILE CG2 1 1 12 8388 1 1 37 ILE H H -8.024 -5.028 7.095 1.00 . A A . 37 ILE H 1 1 12 8389 1 1 37 ILE HA H -8.713 -7.400 8.447 1.00 . A A . 37 ILE HA 1 1 12 8390 1 1 37 ILE HB H -8.830 -6.858 5.483 1.00 . A A . 37 ILE HB 1 1 12 8391 1 1 37 ILE HD11 H -11.903 -7.036 5.431 1.00 . A A . 37 ILE HD11 1 1 12 8392 1 1 37 ILE HD12 H -11.001 -5.704 4.708 1.00 . A A . 37 ILE HD12 1 1 12 8393 1 1 37 ILE HD13 H -12.250 -5.374 5.908 1.00 . A A . 37 ILE HD13 1 1 12 8394 1 1 37 ILE HG12 H -10.947 -6.479 7.613 1.00 . A A . 37 ILE HG12 1 1 12 8395 1 1 37 ILE HG13 H -10.023 -5.177 6.871 1.00 . A A . 37 ILE HG13 1 1 12 8396 1 1 37 ILE HG21 H -9.414 -9.016 5.374 1.00 . A A . 37 ILE HG21 1 1 12 8397 1 1 37 ILE HG22 H -10.921 -8.522 6.147 1.00 . A A . 37 ILE HG22 1 1 12 8398 1 1 37 ILE HG23 H -9.590 -9.142 7.125 1.00 . A A . 37 ILE HG23 1 1 12 8399 1 1 37 ILE N N -7.757 -5.724 7.725 1.00 . A A . 37 ILE N 1 1 12 8400 1 1 37 ILE O O -6.723 -8.874 8.057 1.00 . A A . 37 ILE O 1 1 12 8401 1 1 38 LEU C C -4.169 -8.398 5.916 1.00 . A A . 38 LEU C 1 1 12 8402 1 1 38 LEU CA C -5.541 -8.966 5.576 1.00 . A A . 38 LEU CA 1 1 12 8403 1 1 38 LEU CB C -5.631 -9.272 4.080 1.00 . A A . 38 LEU CB 1 1 12 8404 1 1 38 LEU CD1 C -5.134 -11.716 4.357 1.00 . A A . 38 LEU CD1 1 1 12 8405 1 1 38 LEU CD2 C -4.901 -10.649 2.111 1.00 . A A . 38 LEU CD2 1 1 12 8406 1 1 38 LEU CG C -4.763 -10.442 3.611 1.00 . A A . 38 LEU CG 1 1 12 8407 1 1 38 LEU H H -6.958 -7.406 5.333 1.00 . A A . 38 LEU H 1 1 12 8408 1 1 38 LEU HA H -5.679 -9.884 6.127 1.00 . A A . 38 LEU HA 1 1 12 8409 1 1 38 LEU HB2 H -6.660 -9.488 3.838 1.00 . A A . 38 LEU HB2 1 1 12 8410 1 1 38 LEU HB3 H -5.329 -8.390 3.535 1.00 . A A . 38 LEU HB3 1 1 12 8411 1 1 38 LEU HD11 H -4.831 -12.574 3.776 1.00 . A A . 38 LEU HD11 1 1 12 8412 1 1 38 LEU HD12 H -6.202 -11.745 4.512 1.00 . A A . 38 LEU HD12 1 1 12 8413 1 1 38 LEU HD13 H -4.631 -11.733 5.312 1.00 . A A . 38 LEU HD13 1 1 12 8414 1 1 38 LEU HD21 H -4.051 -11.207 1.746 1.00 . A A . 38 LEU HD21 1 1 12 8415 1 1 38 LEU HD22 H -4.942 -9.690 1.618 1.00 . A A . 38 LEU HD22 1 1 12 8416 1 1 38 LEU HD23 H -5.808 -11.199 1.906 1.00 . A A . 38 LEU HD23 1 1 12 8417 1 1 38 LEU HG H -3.729 -10.217 3.827 1.00 . A A . 38 LEU HG 1 1 12 8418 1 1 38 LEU N N -6.604 -8.045 5.980 1.00 . A A . 38 LEU N 1 1 12 8419 1 1 38 LEU O O -3.154 -9.084 5.814 1.00 . A A . 38 LEU O 1 1 12 8420 1 1 39 ARG C C -1.990 -6.292 5.500 1.00 . A A . 39 ARG C 1 1 12 8421 1 1 39 ARG CA C -2.944 -6.431 6.694 1.00 . A A . 39 ARG CA 1 1 12 8422 1 1 39 ARG CB C -2.263 -7.139 7.874 1.00 . A A . 39 ARG CB 1 1 12 8423 1 1 39 ARG CD C -1.884 -5.060 9.239 1.00 . A A . 39 ARG CD 1 1 12 8424 1 1 39 ARG CG C -1.244 -6.282 8.603 1.00 . A A . 39 ARG CG 1 1 12 8425 1 1 39 ARG CZ C -1.162 -3.027 10.446 1.00 . A A . 39 ARG CZ 1 1 12 8426 1 1 39 ARG H H -5.015 -6.664 6.376 1.00 . A A . 39 ARG H 1 1 12 8427 1 1 39 ARG HA H -3.233 -5.440 7.011 1.00 . A A . 39 ARG HA 1 1 12 8428 1 1 39 ARG HB2 H -3.020 -7.439 8.583 1.00 . A A . 39 ARG HB2 1 1 12 8429 1 1 39 ARG HB3 H -1.760 -8.022 7.505 1.00 . A A . 39 ARG HB3 1 1 12 8430 1 1 39 ARG HD2 H -2.442 -4.526 8.484 1.00 . A A . 39 ARG HD2 1 1 12 8431 1 1 39 ARG HD3 H -2.555 -5.386 10.020 1.00 . A A . 39 ARG HD3 1 1 12 8432 1 1 39 ARG HE H 0.067 -4.436 9.719 1.00 . A A . 39 ARG HE 1 1 12 8433 1 1 39 ARG HG2 H -0.778 -6.874 9.376 1.00 . A A . 39 ARG HG2 1 1 12 8434 1 1 39 ARG HG3 H -0.493 -5.956 7.897 1.00 . A A . 39 ARG HG3 1 1 12 8435 1 1 39 ARG HH11 H -3.163 -3.180 10.174 1.00 . A A . 39 ARG HH11 1 1 12 8436 1 1 39 ARG HH12 H -2.641 -1.772 11.037 1.00 . A A . 39 ARG HH12 1 1 12 8437 1 1 39 ARG HH21 H 0.778 -2.580 10.852 1.00 . A A . 39 ARG HH21 1 1 12 8438 1 1 39 ARG HH22 H -0.383 -1.430 11.426 1.00 . A A . 39 ARG HH22 1 1 12 8439 1 1 39 ARG N N -4.164 -7.137 6.320 1.00 . A A . 39 ARG N 1 1 12 8440 1 1 39 ARG NE N -0.880 -4.165 9.814 1.00 . A A . 39 ARG NE 1 1 12 8441 1 1 39 ARG NH1 N -2.423 -2.626 10.563 1.00 . A A . 39 ARG NH1 1 1 12 8442 1 1 39 ARG NH2 N -0.178 -2.285 10.948 1.00 . A A . 39 ARG NH2 1 1 12 8443 1 1 39 ARG O O -0.774 -6.253 5.655 1.00 . A A . 39 ARG O 1 1 12 8444 1 1 40 ARG C C -1.591 -4.507 2.812 1.00 . A A . 40 ARG C 1 1 12 8445 1 1 40 ARG CA C -1.771 -5.997 3.091 1.00 . A A . 40 ARG CA 1 1 12 8446 1 1 40 ARG CB C -2.431 -6.696 1.901 1.00 . A A . 40 ARG CB 1 1 12 8447 1 1 40 ARG CD C -4.547 -7.386 0.752 1.00 . A A . 40 ARG CD 1 1 12 8448 1 1 40 ARG CG C -3.938 -6.821 2.023 1.00 . A A . 40 ARG CG 1 1 12 8449 1 1 40 ARG CZ C -6.752 -8.041 -0.142 1.00 . A A . 40 ARG CZ 1 1 12 8450 1 1 40 ARG H H -3.538 -6.189 4.250 1.00 . A A . 40 ARG H 1 1 12 8451 1 1 40 ARG HA H -0.796 -6.435 3.258 1.00 . A A . 40 ARG HA 1 1 12 8452 1 1 40 ARG HB2 H -2.210 -6.138 1.004 1.00 . A A . 40 ARG HB2 1 1 12 8453 1 1 40 ARG HB3 H -2.016 -7.689 1.808 1.00 . A A . 40 ARG HB3 1 1 12 8454 1 1 40 ARG HD2 H -4.380 -6.686 -0.052 1.00 . A A . 40 ARG HD2 1 1 12 8455 1 1 40 ARG HD3 H -4.055 -8.320 0.520 1.00 . A A . 40 ARG HD3 1 1 12 8456 1 1 40 ARG HE H -6.393 -7.495 1.752 1.00 . A A . 40 ARG HE 1 1 12 8457 1 1 40 ARG HG2 H -4.164 -7.482 2.848 1.00 . A A . 40 ARG HG2 1 1 12 8458 1 1 40 ARG HG3 H -4.357 -5.845 2.214 1.00 . A A . 40 ARG HG3 1 1 12 8459 1 1 40 ARG HH11 H -5.253 -7.957 -1.519 1.00 . A A . 40 ARG HH11 1 1 12 8460 1 1 40 ARG HH12 H -6.802 -8.465 -2.123 1.00 . A A . 40 ARG HH12 1 1 12 8461 1 1 40 ARG HH21 H -8.450 -8.180 0.958 1.00 . A A . 40 ARG HH21 1 1 12 8462 1 1 40 ARG HH22 H -8.616 -8.598 -0.713 1.00 . A A . 40 ARG HH22 1 1 12 8463 1 1 40 ARG N N -2.558 -6.179 4.310 1.00 . A A . 40 ARG N 1 1 12 8464 1 1 40 ARG NE N -5.987 -7.628 0.873 1.00 . A A . 40 ARG NE 1 1 12 8465 1 1 40 ARG NH1 N -6.234 -8.173 -1.354 1.00 . A A . 40 ARG NH1 1 1 12 8466 1 1 40 ARG NH2 N -8.044 -8.294 0.053 1.00 . A A . 40 ARG NH2 1 1 12 8467 1 1 40 ARG O O -2.391 -3.687 3.270 1.00 . A A . 40 ARG O 1 1 12 8468 1 1 41 CYS C C -1.160 -2.210 0.692 1.00 . A A . 41 CYS C 1 1 12 8469 1 1 41 CYS CA C -0.242 -2.763 1.779 1.00 . A A . 41 CYS CA 1 1 12 8470 1 1 41 CYS CB C 1.217 -2.620 1.342 1.00 . A A . 41 CYS CB 1 1 12 8471 1 1 41 CYS H H 0.075 -4.855 1.770 1.00 . A A . 41 CYS H 1 1 12 8472 1 1 41 CYS HA H -0.390 -2.188 2.680 1.00 . A A . 41 CYS HA 1 1 12 8473 1 1 41 CYS HB2 H 1.858 -2.840 2.183 1.00 . A A . 41 CYS HB2 1 1 12 8474 1 1 41 CYS HB3 H 1.417 -3.329 0.552 1.00 . A A . 41 CYS HB3 1 1 12 8475 1 1 41 CYS N N -0.535 -4.159 2.092 1.00 . A A . 41 CYS N 1 1 12 8476 1 1 41 CYS O O -1.002 -2.522 -0.491 1.00 . A A . 41 CYS O 1 1 12 8477 1 1 41 CYS SG S 1.668 -0.966 0.729 1.00 . A A . 41 CYS SG 1 1 12 8478 1 1 42 LEU C C -2.489 0.670 -0.173 1.00 . A A . 42 LEU C 1 1 12 8479 1 1 42 LEU CA C -3.009 -0.716 0.168 1.00 . A A . 42 LEU CA 1 1 12 8480 1 1 42 LEU CB C -4.421 -0.621 0.762 1.00 . A A . 42 LEU CB 1 1 12 8481 1 1 42 LEU CD1 C -4.792 -3.103 0.990 1.00 . A A . 42 LEU CD1 1 1 12 8482 1 1 42 LEU CD2 C -6.739 -1.539 1.017 1.00 . A A . 42 LEU CD2 1 1 12 8483 1 1 42 LEU CG C -5.353 -1.798 0.449 1.00 . A A . 42 LEU CG 1 1 12 8484 1 1 42 LEU H H -2.146 -1.123 2.054 1.00 . A A . 42 LEU H 1 1 12 8485 1 1 42 LEU HA H -3.037 -1.312 -0.734 1.00 . A A . 42 LEU HA 1 1 12 8486 1 1 42 LEU HB2 H -4.326 -0.547 1.836 1.00 . A A . 42 LEU HB2 1 1 12 8487 1 1 42 LEU HB3 H -4.885 0.287 0.401 1.00 . A A . 42 LEU HB3 1 1 12 8488 1 1 42 LEU HD11 H -3.717 -3.031 1.062 1.00 . A A . 42 LEU HD11 1 1 12 8489 1 1 42 LEU HD12 H -5.055 -3.912 0.324 1.00 . A A . 42 LEU HD12 1 1 12 8490 1 1 42 LEU HD13 H -5.206 -3.295 1.969 1.00 . A A . 42 LEU HD13 1 1 12 8491 1 1 42 LEU HD21 H -6.997 -0.500 0.878 1.00 . A A . 42 LEU HD21 1 1 12 8492 1 1 42 LEU HD22 H -6.746 -1.774 2.071 1.00 . A A . 42 LEU HD22 1 1 12 8493 1 1 42 LEU HD23 H -7.460 -2.160 0.505 1.00 . A A . 42 LEU HD23 1 1 12 8494 1 1 42 LEU HG H -5.445 -1.897 -0.623 1.00 . A A . 42 LEU HG 1 1 12 8495 1 1 42 LEU N N -2.093 -1.356 1.099 1.00 . A A . 42 LEU N 1 1 12 8496 1 1 42 LEU O O -2.284 1.499 0.713 1.00 . A A . 42 LEU O 1 1 12 8497 1 1 43 CYS C C -2.879 3.137 -2.280 1.00 . A A . 43 CYS C 1 1 12 8498 1 1 43 CYS CA C -1.753 2.197 -1.889 1.00 . A A . 43 CYS CA 1 1 12 8499 1 1 43 CYS CB C -0.795 1.996 -3.058 1.00 . A A . 43 CYS CB 1 1 12 8500 1 1 43 CYS H H -2.440 0.217 -2.115 1.00 . A A . 43 CYS H 1 1 12 8501 1 1 43 CYS HA H -1.208 2.635 -1.066 1.00 . A A . 43 CYS HA 1 1 12 8502 1 1 43 CYS HB2 H -1.317 1.508 -3.866 1.00 . A A . 43 CYS HB2 1 1 12 8503 1 1 43 CYS HB3 H -0.442 2.960 -3.394 1.00 . A A . 43 CYS HB3 1 1 12 8504 1 1 43 CYS N N -2.265 0.917 -1.446 1.00 . A A . 43 CYS N 1 1 12 8505 1 1 43 CYS O O -3.887 2.717 -2.849 1.00 . A A . 43 CYS O 1 1 12 8506 1 1 43 CYS SG S 0.660 0.988 -2.645 1.00 . A A . 43 CYS SG 1 1 12 8507 1 1 44 THR C C -3.056 6.555 -3.071 1.00 . A A . 44 THR C 1 1 12 8508 1 1 44 THR CA C -3.683 5.426 -2.269 1.00 . A A . 44 THR CA 1 1 12 8509 1 1 44 THR CB C -4.284 6.026 -0.990 1.00 . A A . 44 THR CB 1 1 12 8510 1 1 44 THR CG2 C -5.744 5.651 -0.836 1.00 . A A . 44 THR CG2 1 1 12 8511 1 1 44 THR H H -1.872 4.674 -1.504 1.00 . A A . 44 THR H 1 1 12 8512 1 1 44 THR HA H -4.477 4.973 -2.845 1.00 . A A . 44 THR HA 1 1 12 8513 1 1 44 THR HB H -4.214 7.102 -1.066 1.00 . A A . 44 THR HB 1 1 12 8514 1 1 44 THR HG1 H -2.623 5.874 0.078 1.00 . A A . 44 THR HG1 1 1 12 8515 1 1 44 THR HG21 H -6.240 5.737 -1.792 1.00 . A A . 44 THR HG21 1 1 12 8516 1 1 44 THR HG22 H -6.214 6.315 -0.126 1.00 . A A . 44 THR HG22 1 1 12 8517 1 1 44 THR HG23 H -5.819 4.633 -0.482 1.00 . A A . 44 THR HG23 1 1 12 8518 1 1 44 THR N N -2.700 4.407 -1.964 1.00 . A A . 44 THR N 1 1 12 8519 1 1 44 THR O O -1.918 6.958 -2.814 1.00 . A A . 44 THR O 1 1 12 8520 1 1 44 THR OG1 O -3.543 5.581 0.159 1.00 . A A . 44 THR OG1 1 1 12 8521 1 1 45 LYS C C -4.488 8.865 -5.546 1.00 . A A . 45 LYS C 1 1 12 8522 1 1 45 LYS CA C -3.332 8.179 -4.843 1.00 . A A . 45 LYS CA 1 1 12 8523 1 1 45 LYS CB C -2.279 7.728 -5.862 1.00 . A A . 45 LYS CB 1 1 12 8524 1 1 45 LYS CD C -1.681 6.549 -7.967 1.00 . A A . 45 LYS CD 1 1 12 8525 1 1 45 LYS CE C -2.081 5.534 -9.022 1.00 . A A . 45 LYS CE 1 1 12 8526 1 1 45 LYS CG C -2.791 6.823 -6.968 1.00 . A A . 45 LYS CG 1 1 12 8527 1 1 45 LYS H H -4.710 6.720 -4.164 1.00 . A A . 45 LYS H 1 1 12 8528 1 1 45 LYS HA H -2.875 8.895 -4.175 1.00 . A A . 45 LYS HA 1 1 12 8529 1 1 45 LYS HB2 H -1.854 8.606 -6.324 1.00 . A A . 45 LYS HB2 1 1 12 8530 1 1 45 LYS HB3 H -1.496 7.203 -5.335 1.00 . A A . 45 LYS HB3 1 1 12 8531 1 1 45 LYS HD2 H -1.422 7.473 -8.460 1.00 . A A . 45 LYS HD2 1 1 12 8532 1 1 45 LYS HD3 H -0.819 6.175 -7.433 1.00 . A A . 45 LYS HD3 1 1 12 8533 1 1 45 LYS HE2 H -2.465 4.652 -8.530 1.00 . A A . 45 LYS HE2 1 1 12 8534 1 1 45 LYS HE3 H -2.850 5.964 -9.647 1.00 . A A . 45 LYS HE3 1 1 12 8535 1 1 45 LYS HG2 H -3.123 5.888 -6.538 1.00 . A A . 45 LYS HG2 1 1 12 8536 1 1 45 LYS HG3 H -3.613 7.307 -7.474 1.00 . A A . 45 LYS HG3 1 1 12 8537 1 1 45 LYS HZ1 H -0.882 4.120 -9.987 1.00 . A A . 45 LYS HZ1 1 1 12 8538 1 1 45 LYS HZ2 H -0.030 5.471 -9.424 1.00 . A A . 45 LYS HZ2 1 1 12 8539 1 1 45 LYS HZ3 H -0.999 5.595 -10.808 1.00 . A A . 45 LYS HZ3 1 1 12 8540 1 1 45 LYS N N -3.804 7.074 -4.024 1.00 . A A . 45 LYS N 1 1 12 8541 1 1 45 LYS NZ N -0.919 5.152 -9.872 1.00 . A A . 45 LYS NZ 1 1 12 8542 1 1 45 LYS O O -5.618 8.369 -5.537 1.00 . A A . 45 LYS O 1 1 12 8543 1 1 46 GLU C C -5.452 10.191 -8.242 1.00 . A A . 46 GLU C 1 1 12 8544 1 1 46 GLU CA C -5.179 10.784 -6.863 1.00 . A A . 46 GLU CA 1 1 12 8545 1 1 46 GLU CB C -4.697 12.231 -6.980 1.00 . A A . 46 GLU CB 1 1 12 8546 1 1 46 GLU CD C -2.680 13.741 -7.226 1.00 . A A . 46 GLU CD 1 1 12 8547 1 1 46 GLU CG C -3.248 12.350 -7.431 1.00 . A A . 46 GLU CG 1 1 12 8548 1 1 46 GLU H H -3.268 10.331 -6.109 1.00 . A A . 46 GLU H 1 1 12 8549 1 1 46 GLU HA H -6.094 10.766 -6.291 1.00 . A A . 46 GLU HA 1 1 12 8550 1 1 46 GLU HB2 H -5.319 12.750 -7.695 1.00 . A A . 46 GLU HB2 1 1 12 8551 1 1 46 GLU HB3 H -4.793 12.710 -6.017 1.00 . A A . 46 GLU HB3 1 1 12 8552 1 1 46 GLU HG2 H -2.651 11.649 -6.868 1.00 . A A . 46 GLU HG2 1 1 12 8553 1 1 46 GLU HG3 H -3.191 12.106 -8.482 1.00 . A A . 46 GLU HG3 1 1 12 8554 1 1 46 GLU N N -4.191 10.001 -6.146 1.00 . A A . 46 GLU N 1 1 12 8555 1 1 46 GLU O O -4.583 9.551 -8.844 1.00 . A A . 46 GLU O 1 1 12 8556 1 1 46 GLU OE1 O -3.431 14.633 -6.783 1.00 . A A . 46 GLU OE1 1 1 12 8557 1 1 46 GLU OE2 O -1.477 13.933 -7.500 1.00 . A A . 46 GLU OE2 1 1 12 8558 1 1 47 CYS C C -8.457 10.526 -10.350 1.00 . A A . 47 CYS C 1 1 12 8559 1 1 47 CYS CA C -7.104 9.914 -10.018 1.00 . A A . 47 CYS CA 1 1 12 8560 1 1 47 CYS CB C -7.204 8.386 -10.026 1.00 . A A . 47 CYS CB 1 1 12 8561 1 1 47 CYS H H -7.301 10.920 -8.184 1.00 . A A . 47 CYS H 1 1 12 8562 1 1 47 CYS HA H -6.381 10.227 -10.755 1.00 . A A . 47 CYS HA 1 1 12 8563 1 1 47 CYS HB2 H -7.498 8.058 -11.012 1.00 . A A . 47 CYS HB2 1 1 12 8564 1 1 47 CYS HB3 H -6.236 7.969 -9.789 1.00 . A A . 47 CYS HB3 1 1 12 8565 1 1 47 CYS N N -6.667 10.406 -8.721 1.00 . A A . 47 CYS N 1 1 12 8566 1 1 47 CYS O O -9.115 11.025 -9.407 1.00 . A A . 47 CYS O 1 1 12 8567 1 1 47 CYS OXT O -8.850 10.514 -11.530 1.00 . A A . 47 CYS OXT 1 1 12 8568 1 1 47 CYS SG S -8.408 7.705 -8.838 1.00 . A A . 47 CYS SG 1 1 13 8569 1 1 1 ALA C C -8.661 11.606 -6.609 1.00 . A A . 1 ALA C 1 1 13 8570 1 1 1 ALA CA C -9.793 12.299 -7.352 1.00 . A A . 1 ALA CA 1 1 13 8571 1 1 1 ALA CB C -10.676 11.280 -8.061 1.00 . A A . 1 ALA CB 1 1 13 8572 1 1 1 ALA H1 H -8.779 12.759 -9.110 1.00 . A A . 1 ALA H1 1 1 13 8573 1 1 1 ALA H2 H -8.547 13.879 -7.862 1.00 . A A . 1 ALA H2 1 1 13 8574 1 1 1 ALA H3 H -10.008 13.859 -8.712 1.00 . A A . 1 ALA H3 1 1 13 8575 1 1 1 ALA HA H -10.397 12.830 -6.638 1.00 . A A . 1 ALA HA 1 1 13 8576 1 1 1 ALA HB1 H -11.623 11.204 -7.547 1.00 . A A . 1 ALA HB1 1 1 13 8577 1 1 1 ALA HB2 H -10.187 10.317 -8.059 1.00 . A A . 1 ALA HB2 1 1 13 8578 1 1 1 ALA HB3 H -10.844 11.597 -9.080 1.00 . A A . 1 ALA HB3 1 1 13 8579 1 1 1 ALA N N -9.250 13.271 -8.323 1.00 . A A . 1 ALA N 1 1 13 8580 1 1 1 ALA O O -7.546 12.125 -6.547 1.00 . A A . 1 ALA O 1 1 13 8581 1 1 2 THR C C -8.224 8.181 -5.504 1.00 . A A . 2 THR C 1 1 13 8582 1 1 2 THR CA C -7.961 9.670 -5.322 1.00 . A A . 2 THR CA 1 1 13 8583 1 1 2 THR CB C -7.982 10.023 -3.819 1.00 . A A . 2 THR CB 1 1 13 8584 1 1 2 THR CG2 C -6.865 9.305 -3.072 1.00 . A A . 2 THR CG2 1 1 13 8585 1 1 2 THR H H -9.856 10.079 -6.145 1.00 . A A . 2 THR H 1 1 13 8586 1 1 2 THR HA H -6.985 9.909 -5.719 1.00 . A A . 2 THR HA 1 1 13 8587 1 1 2 THR HB H -8.930 9.714 -3.404 1.00 . A A . 2 THR HB 1 1 13 8588 1 1 2 THR HG1 H -7.120 11.756 -4.211 1.00 . A A . 2 THR HG1 1 1 13 8589 1 1 2 THR HG21 H -7.251 8.905 -2.146 1.00 . A A . 2 THR HG21 1 1 13 8590 1 1 2 THR HG22 H -6.068 10.002 -2.859 1.00 . A A . 2 THR HG22 1 1 13 8591 1 1 2 THR HG23 H -6.485 8.499 -3.682 1.00 . A A . 2 THR HG23 1 1 13 8592 1 1 2 THR N N -8.949 10.439 -6.056 1.00 . A A . 2 THR N 1 1 13 8593 1 1 2 THR O O -9.285 7.674 -5.140 1.00 . A A . 2 THR O 1 1 13 8594 1 1 2 THR OG1 O -7.837 11.441 -3.651 1.00 . A A . 2 THR OG1 1 1 13 8595 1 1 3 CYS C C -6.699 5.288 -5.212 1.00 . A A . 3 CYS C 1 1 13 8596 1 1 3 CYS CA C -7.353 6.078 -6.337 1.00 . A A . 3 CYS CA 1 1 13 8597 1 1 3 CYS CB C -6.707 5.751 -7.687 1.00 . A A . 3 CYS CB 1 1 13 8598 1 1 3 CYS H H -6.438 7.974 -6.352 1.00 . A A . 3 CYS H 1 1 13 8599 1 1 3 CYS HA H -8.401 5.822 -6.379 1.00 . A A . 3 CYS HA 1 1 13 8600 1 1 3 CYS HB2 H -5.750 6.254 -7.754 1.00 . A A . 3 CYS HB2 1 1 13 8601 1 1 3 CYS HB3 H -6.555 4.684 -7.759 1.00 . A A . 3 CYS HB3 1 1 13 8602 1 1 3 CYS N N -7.255 7.500 -6.081 1.00 . A A . 3 CYS N 1 1 13 8603 1 1 3 CYS O O -5.629 5.657 -4.721 1.00 . A A . 3 CYS O 1 1 13 8604 1 1 3 CYS SG S -7.698 6.272 -9.126 1.00 . A A . 3 CYS SG 1 1 13 8605 1 1 4 LYS C C -6.958 1.899 -4.092 1.00 . A A . 4 LYS C 1 1 13 8606 1 1 4 LYS CA C -6.846 3.372 -3.724 1.00 . A A . 4 LYS CA 1 1 13 8607 1 1 4 LYS CB C -7.629 3.644 -2.437 1.00 . A A . 4 LYS CB 1 1 13 8608 1 1 4 LYS CD C -8.080 3.009 -0.046 1.00 . A A . 4 LYS CD 1 1 13 8609 1 1 4 LYS CE C -9.509 2.572 -0.341 1.00 . A A . 4 LYS CE 1 1 13 8610 1 1 4 LYS CG C -7.178 2.802 -1.252 1.00 . A A . 4 LYS CG 1 1 13 8611 1 1 4 LYS H H -8.201 3.974 -5.227 1.00 . A A . 4 LYS H 1 1 13 8612 1 1 4 LYS HA H -5.807 3.617 -3.564 1.00 . A A . 4 LYS HA 1 1 13 8613 1 1 4 LYS HB2 H -7.516 4.685 -2.174 1.00 . A A . 4 LYS HB2 1 1 13 8614 1 1 4 LYS HB3 H -8.675 3.440 -2.617 1.00 . A A . 4 LYS HB3 1 1 13 8615 1 1 4 LYS HD2 H -7.698 2.429 0.781 1.00 . A A . 4 LYS HD2 1 1 13 8616 1 1 4 LYS HD3 H -8.079 4.057 0.216 1.00 . A A . 4 LYS HD3 1 1 13 8617 1 1 4 LYS HE2 H -9.871 3.124 -1.195 1.00 . A A . 4 LYS HE2 1 1 13 8618 1 1 4 LYS HE3 H -9.508 1.516 -0.570 1.00 . A A . 4 LYS HE3 1 1 13 8619 1 1 4 LYS HG2 H -7.202 1.760 -1.532 1.00 . A A . 4 LYS HG2 1 1 13 8620 1 1 4 LYS HG3 H -6.168 3.083 -0.987 1.00 . A A . 4 LYS HG3 1 1 13 8621 1 1 4 LYS HZ1 H -11.270 3.325 0.493 1.00 . A A . 4 LYS HZ1 1 1 13 8622 1 1 4 LYS HZ2 H -9.939 3.387 1.535 1.00 . A A . 4 LYS HZ2 1 1 13 8623 1 1 4 LYS HZ3 H -10.710 1.911 1.236 1.00 . A A . 4 LYS HZ3 1 1 13 8624 1 1 4 LYS N N -7.351 4.210 -4.800 1.00 . A A . 4 LYS N 1 1 13 8625 1 1 4 LYS NZ N -10.420 2.816 0.812 1.00 . A A . 4 LYS NZ 1 1 13 8626 1 1 4 LYS O O -8.015 1.441 -4.523 1.00 . A A . 4 LYS O 1 1 13 8627 1 1 5 ALA C C -4.520 -0.825 -3.618 1.00 . A A . 5 ALA C 1 1 13 8628 1 1 5 ALA CA C -5.800 -0.249 -4.201 1.00 . A A . 5 ALA CA 1 1 13 8629 1 1 5 ALA CB C -5.852 -0.494 -5.704 1.00 . A A . 5 ALA CB 1 1 13 8630 1 1 5 ALA H H -5.060 1.618 -3.552 1.00 . A A . 5 ALA H 1 1 13 8631 1 1 5 ALA HA H -6.651 -0.730 -3.742 1.00 . A A . 5 ALA HA 1 1 13 8632 1 1 5 ALA HB1 H -6.553 0.192 -6.156 1.00 . A A . 5 ALA HB1 1 1 13 8633 1 1 5 ALA HB2 H -6.168 -1.509 -5.893 1.00 . A A . 5 ALA HB2 1 1 13 8634 1 1 5 ALA HB3 H -4.871 -0.337 -6.128 1.00 . A A . 5 ALA HB3 1 1 13 8635 1 1 5 ALA N N -5.864 1.177 -3.907 1.00 . A A . 5 ALA N 1 1 13 8636 1 1 5 ALA O O -3.502 -0.131 -3.562 1.00 . A A . 5 ALA O 1 1 13 8637 1 1 6 GLU C C -2.304 -2.866 -3.608 1.00 . A A . 6 GLU C 1 1 13 8638 1 1 6 GLU CA C -3.412 -2.716 -2.579 1.00 . A A . 6 GLU CA 1 1 13 8639 1 1 6 GLU CB C -3.760 -4.094 -2.003 1.00 . A A . 6 GLU CB 1 1 13 8640 1 1 6 GLU CD C -6.264 -4.366 -1.727 1.00 . A A . 6 GLU CD 1 1 13 8641 1 1 6 GLU CG C -4.939 -4.091 -1.044 1.00 . A A . 6 GLU CG 1 1 13 8642 1 1 6 GLU H H -5.421 -2.571 -3.221 1.00 . A A . 6 GLU H 1 1 13 8643 1 1 6 GLU HA H -3.055 -2.084 -1.779 1.00 . A A . 6 GLU HA 1 1 13 8644 1 1 6 GLU HB2 H -3.987 -4.766 -2.816 1.00 . A A . 6 GLU HB2 1 1 13 8645 1 1 6 GLU HB3 H -2.899 -4.472 -1.473 1.00 . A A . 6 GLU HB3 1 1 13 8646 1 1 6 GLU HG2 H -4.776 -4.850 -0.294 1.00 . A A . 6 GLU HG2 1 1 13 8647 1 1 6 GLU HG3 H -4.992 -3.123 -0.566 1.00 . A A . 6 GLU HG3 1 1 13 8648 1 1 6 GLU N N -4.573 -2.070 -3.167 1.00 . A A . 6 GLU N 1 1 13 8649 1 1 6 GLU O O -2.564 -3.116 -4.786 1.00 . A A . 6 GLU O 1 1 13 8650 1 1 6 GLU OE1 O -6.681 -3.555 -2.576 1.00 . A A . 6 GLU OE1 1 1 13 8651 1 1 6 GLU OE2 O -6.884 -5.405 -1.409 1.00 . A A . 6 GLU OE2 1 1 13 8652 1 1 7 CYS C C 0.111 -4.187 -4.704 1.00 . A A . 7 CYS C 1 1 13 8653 1 1 7 CYS CA C 0.092 -2.822 -4.020 1.00 . A A . 7 CYS CA 1 1 13 8654 1 1 7 CYS CB C 1.385 -2.625 -3.223 1.00 . A A . 7 CYS CB 1 1 13 8655 1 1 7 CYS H H -0.949 -2.501 -2.198 1.00 . A A . 7 CYS H 1 1 13 8656 1 1 7 CYS HA H 0.021 -2.053 -4.774 1.00 . A A . 7 CYS HA 1 1 13 8657 1 1 7 CYS HB2 H 1.354 -1.664 -2.731 1.00 . A A . 7 CYS HB2 1 1 13 8658 1 1 7 CYS HB3 H 1.463 -3.403 -2.478 1.00 . A A . 7 CYS HB3 1 1 13 8659 1 1 7 CYS N N -1.073 -2.706 -3.150 1.00 . A A . 7 CYS N 1 1 13 8660 1 1 7 CYS O O 0.019 -5.222 -4.044 1.00 . A A . 7 CYS O 1 1 13 8661 1 1 7 CYS SG S 2.900 -2.677 -4.243 1.00 . A A . 7 CYS SG 1 1 13 8662 1 1 8 PRO C C 1.360 -6.378 -6.418 1.00 . A A . 8 PRO C 1 1 13 8663 1 1 8 PRO CA C 0.230 -5.440 -6.830 1.00 . A A . 8 PRO CA 1 1 13 8664 1 1 8 PRO CB C 0.440 -4.954 -8.268 1.00 . A A . 8 PRO CB 1 1 13 8665 1 1 8 PRO CD C 0.305 -3.006 -6.899 1.00 . A A . 8 PRO CD 1 1 13 8666 1 1 8 PRO CG C -0.022 -3.539 -8.264 1.00 . A A . 8 PRO CG 1 1 13 8667 1 1 8 PRO HA H -0.712 -5.963 -6.758 1.00 . A A . 8 PRO HA 1 1 13 8668 1 1 8 PRO HB2 H 1.486 -5.029 -8.527 1.00 . A A . 8 PRO HB2 1 1 13 8669 1 1 8 PRO HB3 H -0.147 -5.558 -8.944 1.00 . A A . 8 PRO HB3 1 1 13 8670 1 1 8 PRO HD2 H 1.303 -2.593 -6.883 1.00 . A A . 8 PRO HD2 1 1 13 8671 1 1 8 PRO HD3 H -0.419 -2.263 -6.600 1.00 . A A . 8 PRO HD3 1 1 13 8672 1 1 8 PRO HG2 H 0.504 -2.978 -9.022 1.00 . A A . 8 PRO HG2 1 1 13 8673 1 1 8 PRO HG3 H -1.087 -3.499 -8.437 1.00 . A A . 8 PRO HG3 1 1 13 8674 1 1 8 PRO N N 0.215 -4.201 -6.044 1.00 . A A . 8 PRO N 1 1 13 8675 1 1 8 PRO O O 1.170 -7.586 -6.308 1.00 . A A . 8 PRO O 1 1 13 8676 1 1 9 THR C C 3.751 -6.754 -4.267 1.00 . A A . 9 THR C 1 1 13 8677 1 1 9 THR CA C 3.690 -6.604 -5.784 1.00 . A A . 9 THR CA 1 1 13 8678 1 1 9 THR CB C 5.001 -5.971 -6.288 1.00 . A A . 9 THR CB 1 1 13 8679 1 1 9 THR CG2 C 5.064 -5.992 -7.808 1.00 . A A . 9 THR CG2 1 1 13 8680 1 1 9 THR H H 2.629 -4.845 -6.284 1.00 . A A . 9 THR H 1 1 13 8681 1 1 9 THR HA H 3.594 -7.584 -6.228 1.00 . A A . 9 THR HA 1 1 13 8682 1 1 9 THR HB H 5.831 -6.544 -5.901 1.00 . A A . 9 THR HB 1 1 13 8683 1 1 9 THR HG1 H 4.421 -4.450 -5.160 1.00 . A A . 9 THR HG1 1 1 13 8684 1 1 9 THR HG21 H 4.086 -6.220 -8.205 1.00 . A A . 9 THR HG21 1 1 13 8685 1 1 9 THR HG22 H 5.768 -6.746 -8.129 1.00 . A A . 9 THR HG22 1 1 13 8686 1 1 9 THR HG23 H 5.382 -5.025 -8.169 1.00 . A A . 9 THR HG23 1 1 13 8687 1 1 9 THR N N 2.536 -5.814 -6.186 1.00 . A A . 9 THR N 1 1 13 8688 1 1 9 THR O O 4.812 -6.583 -3.659 1.00 . A A . 9 THR O 1 1 13 8689 1 1 9 THR OG1 O 5.110 -4.617 -5.820 1.00 . A A . 9 THR OG1 1 1 13 8690 1 1 10 TRP C C 1.793 -8.487 -1.847 1.00 . A A . 10 TRP C 1 1 13 8691 1 1 10 TRP CA C 2.555 -7.223 -2.217 1.00 . A A . 10 TRP CA 1 1 13 8692 1 1 10 TRP CB C 1.878 -6.011 -1.573 1.00 . A A . 10 TRP CB 1 1 13 8693 1 1 10 TRP CD1 C 1.113 -6.433 0.833 1.00 . A A . 10 TRP CD1 1 1 13 8694 1 1 10 TRP CD2 C 3.119 -5.455 0.659 1.00 . A A . 10 TRP CD2 1 1 13 8695 1 1 10 TRP CE2 C 2.830 -5.638 2.024 1.00 . A A . 10 TRP CE2 1 1 13 8696 1 1 10 TRP CE3 C 4.326 -4.853 0.300 1.00 . A A . 10 TRP CE3 1 1 13 8697 1 1 10 TRP CG C 2.016 -5.982 -0.084 1.00 . A A . 10 TRP CG 1 1 13 8698 1 1 10 TRP CH2 C 4.880 -4.649 2.646 1.00 . A A . 10 TRP CH2 1 1 13 8699 1 1 10 TRP CZ2 C 3.709 -5.237 3.029 1.00 . A A . 10 TRP CZ2 1 1 13 8700 1 1 10 TRP CZ3 C 5.193 -4.455 1.297 1.00 . A A . 10 TRP CZ3 1 1 13 8701 1 1 10 TRP H H 1.799 -7.186 -4.189 1.00 . A A . 10 TRP H 1 1 13 8702 1 1 10 TRP HA H 3.566 -7.301 -1.845 1.00 . A A . 10 TRP HA 1 1 13 8703 1 1 10 TRP HB2 H 2.321 -5.108 -1.967 1.00 . A A . 10 TRP HB2 1 1 13 8704 1 1 10 TRP HB3 H 0.825 -6.025 -1.812 1.00 . A A . 10 TRP HB3 1 1 13 8705 1 1 10 TRP HD1 H 0.163 -6.884 0.580 1.00 . A A . 10 TRP HD1 1 1 13 8706 1 1 10 TRP HE1 H 1.142 -6.500 2.936 1.00 . A A . 10 TRP HE1 1 1 13 8707 1 1 10 TRP HE3 H 4.585 -4.695 -0.737 1.00 . A A . 10 TRP HE3 1 1 13 8708 1 1 10 TRP HH2 H 5.589 -4.320 3.392 1.00 . A A . 10 TRP HH2 1 1 13 8709 1 1 10 TRP HZ2 H 3.489 -5.377 4.075 1.00 . A A . 10 TRP HZ2 1 1 13 8710 1 1 10 TRP HZ3 H 6.128 -3.982 1.039 1.00 . A A . 10 TRP HZ3 1 1 13 8711 1 1 10 TRP N N 2.618 -7.063 -3.657 1.00 . A A . 10 TRP N 1 1 13 8712 1 1 10 TRP NE1 N 1.601 -6.242 2.105 1.00 . A A . 10 TRP NE1 1 1 13 8713 1 1 10 TRP O O 0.664 -8.693 -2.289 1.00 . A A . 10 TRP O 1 1 13 8714 1 1 11 ASP C C 2.357 -10.888 0.821 1.00 . A A . 11 ASP C 1 1 13 8715 1 1 11 ASP CA C 1.815 -10.558 -0.563 1.00 . A A . 11 ASP CA 1 1 13 8716 1 1 11 ASP CB C 2.106 -11.705 -1.537 1.00 . A A . 11 ASP CB 1 1 13 8717 1 1 11 ASP CG C 1.279 -12.945 -1.240 1.00 . A A . 11 ASP CG 1 1 13 8718 1 1 11 ASP H H 3.310 -9.078 -0.703 1.00 . A A . 11 ASP H 1 1 13 8719 1 1 11 ASP HA H 0.747 -10.407 -0.496 1.00 . A A . 11 ASP HA 1 1 13 8720 1 1 11 ASP HB2 H 1.885 -11.380 -2.542 1.00 . A A . 11 ASP HB2 1 1 13 8721 1 1 11 ASP HB3 H 3.152 -11.967 -1.470 1.00 . A A . 11 ASP HB3 1 1 13 8722 1 1 11 ASP N N 2.417 -9.313 -1.023 1.00 . A A . 11 ASP N 1 1 13 8723 1 1 11 ASP O O 3.130 -11.830 1.001 1.00 . A A . 11 ASP O 1 1 13 8724 1 1 11 ASP OD1 O 0.390 -12.877 -0.361 1.00 . A A . 11 ASP OD1 1 1 13 8725 1 1 11 ASP OD2 O 1.509 -13.982 -1.898 1.00 . A A . 11 ASP OD2 1 1 13 8726 1 1 12 SER C C 1.645 -9.337 4.101 1.00 . A A . 12 SER C 1 1 13 8727 1 1 12 SER CA C 2.428 -10.254 3.164 1.00 . A A . 12 SER CA 1 1 13 8728 1 1 12 SER CB C 3.931 -9.961 3.266 1.00 . A A . 12 SER CB 1 1 13 8729 1 1 12 SER H H 1.376 -9.330 1.588 1.00 . A A . 12 SER H 1 1 13 8730 1 1 12 SER HA H 2.247 -11.281 3.446 1.00 . A A . 12 SER HA 1 1 13 8731 1 1 12 SER HB2 H 4.448 -10.459 2.459 1.00 . A A . 12 SER HB2 1 1 13 8732 1 1 12 SER HB3 H 4.092 -8.895 3.192 1.00 . A A . 12 SER HB3 1 1 13 8733 1 1 12 SER HG H 5.028 -11.181 4.337 1.00 . A A . 12 SER HG 1 1 13 8734 1 1 12 SER N N 1.972 -10.076 1.797 1.00 . A A . 12 SER N 1 1 13 8735 1 1 12 SER O O 0.882 -8.476 3.651 1.00 . A A . 12 SER O 1 1 13 8736 1 1 12 SER OG O 4.465 -10.418 4.498 1.00 . A A . 12 SER OG 1 1 13 8737 1 1 13 VAL C C 1.844 -7.362 6.542 1.00 . A A . 13 VAL C 1 1 13 8738 1 1 13 VAL CA C 1.160 -8.717 6.397 1.00 . A A . 13 VAL CA 1 1 13 8739 1 1 13 VAL CB C 1.137 -9.430 7.767 1.00 . A A . 13 VAL CB 1 1 13 8740 1 1 13 VAL CG1 C 0.418 -8.586 8.810 1.00 . A A . 13 VAL CG1 1 1 13 8741 1 1 13 VAL CG2 C 0.486 -10.800 7.647 1.00 . A A . 13 VAL CG2 1 1 13 8742 1 1 13 VAL H H 2.466 -10.219 5.689 1.00 . A A . 13 VAL H 1 1 13 8743 1 1 13 VAL HA H 0.141 -8.566 6.072 1.00 . A A . 13 VAL HA 1 1 13 8744 1 1 13 VAL HB H 2.157 -9.570 8.094 1.00 . A A . 13 VAL HB 1 1 13 8745 1 1 13 VAL HG11 H -0.046 -9.232 9.539 1.00 . A A . 13 VAL HG11 1 1 13 8746 1 1 13 VAL HG12 H -0.339 -7.986 8.327 1.00 . A A . 13 VAL HG12 1 1 13 8747 1 1 13 VAL HG13 H 1.130 -7.940 9.302 1.00 . A A . 13 VAL HG13 1 1 13 8748 1 1 13 VAL HG21 H -0.487 -10.780 8.115 1.00 . A A . 13 VAL HG21 1 1 13 8749 1 1 13 VAL HG22 H 1.105 -11.538 8.136 1.00 . A A . 13 VAL HG22 1 1 13 8750 1 1 13 VAL HG23 H 0.377 -11.057 6.603 1.00 . A A . 13 VAL HG23 1 1 13 8751 1 1 13 VAL N N 1.840 -9.523 5.397 1.00 . A A . 13 VAL N 1 1 13 8752 1 1 13 VAL O O 3.016 -7.280 6.910 1.00 . A A . 13 VAL O 1 1 13 8753 1 1 14 CYS C C 1.672 -4.531 7.824 1.00 . A A . 14 CYS C 1 1 13 8754 1 1 14 CYS CA C 1.637 -4.953 6.360 1.00 . A A . 14 CYS CA 1 1 13 8755 1 1 14 CYS CB C 0.771 -3.989 5.542 1.00 . A A . 14 CYS CB 1 1 13 8756 1 1 14 CYS H H 0.174 -6.428 5.968 1.00 . A A . 14 CYS H 1 1 13 8757 1 1 14 CYS HA H 2.642 -4.954 5.966 1.00 . A A . 14 CYS HA 1 1 13 8758 1 1 14 CYS HB2 H 0.599 -4.417 4.567 1.00 . A A . 14 CYS HB2 1 1 13 8759 1 1 14 CYS HB3 H -0.179 -3.865 6.043 1.00 . A A . 14 CYS HB3 1 1 13 8760 1 1 14 CYS N N 1.105 -6.302 6.255 1.00 . A A . 14 CYS N 1 1 13 8761 1 1 14 CYS O O 0.635 -4.248 8.423 1.00 . A A . 14 CYS O 1 1 13 8762 1 1 14 CYS SG S 1.484 -2.330 5.291 1.00 . A A . 14 CYS SG 1 1 13 8763 1 1 15 ILE C C 3.440 -2.678 9.926 1.00 . A A . 15 ILE C 1 1 13 8764 1 1 15 ILE CA C 3.011 -4.135 9.802 1.00 . A A . 15 ILE CA 1 1 13 8765 1 1 15 ILE CB C 4.041 -5.038 10.516 1.00 . A A . 15 ILE CB 1 1 13 8766 1 1 15 ILE CD1 C 4.654 -7.479 10.948 1.00 . A A . 15 ILE CD1 1 1 13 8767 1 1 15 ILE CG1 C 3.645 -6.511 10.366 1.00 . A A . 15 ILE CG1 1 1 13 8768 1 1 15 ILE CG2 C 4.152 -4.663 11.989 1.00 . A A . 15 ILE CG2 1 1 13 8769 1 1 15 ILE H H 3.651 -4.759 7.884 1.00 . A A . 15 ILE H 1 1 13 8770 1 1 15 ILE HA H 2.054 -4.261 10.286 1.00 . A A . 15 ILE HA 1 1 13 8771 1 1 15 ILE HB H 5.005 -4.883 10.055 1.00 . A A . 15 ILE HB 1 1 13 8772 1 1 15 ILE HD11 H 5.590 -6.967 11.112 1.00 . A A . 15 ILE HD11 1 1 13 8773 1 1 15 ILE HD12 H 4.806 -8.297 10.260 1.00 . A A . 15 ILE HD12 1 1 13 8774 1 1 15 ILE HD13 H 4.284 -7.862 11.888 1.00 . A A . 15 ILE HD13 1 1 13 8775 1 1 15 ILE HG12 H 2.703 -6.675 10.867 1.00 . A A . 15 ILE HG12 1 1 13 8776 1 1 15 ILE HG13 H 3.532 -6.740 9.316 1.00 . A A . 15 ILE HG13 1 1 13 8777 1 1 15 ILE HG21 H 5.190 -4.678 12.287 1.00 . A A . 15 ILE HG21 1 1 13 8778 1 1 15 ILE HG22 H 3.596 -5.372 12.584 1.00 . A A . 15 ILE HG22 1 1 13 8779 1 1 15 ILE HG23 H 3.749 -3.672 12.138 1.00 . A A . 15 ILE HG23 1 1 13 8780 1 1 15 ILE N N 2.861 -4.507 8.404 1.00 . A A . 15 ILE N 1 1 13 8781 1 1 15 ILE O O 2.869 -1.915 10.705 1.00 . A A . 15 ILE O 1 1 13 8782 1 1 16 ASN C C 4.661 -0.269 7.806 1.00 . A A . 16 ASN C 1 1 13 8783 1 1 16 ASN CA C 4.944 -0.936 9.147 1.00 . A A . 16 ASN CA 1 1 13 8784 1 1 16 ASN CB C 6.445 -0.929 9.465 1.00 . A A . 16 ASN CB 1 1 13 8785 1 1 16 ASN CG C 7.041 0.468 9.492 1.00 . A A . 16 ASN CG 1 1 13 8786 1 1 16 ASN H H 4.837 -2.953 8.535 1.00 . A A . 16 ASN H 1 1 13 8787 1 1 16 ASN HA H 4.419 -0.393 9.920 1.00 . A A . 16 ASN HA 1 1 13 8788 1 1 16 ASN HB2 H 6.602 -1.383 10.432 1.00 . A A . 16 ASN HB2 1 1 13 8789 1 1 16 ASN HB3 H 6.966 -1.507 8.714 1.00 . A A . 16 ASN HB3 1 1 13 8790 1 1 16 ASN HD21 H 8.745 -0.215 8.737 1.00 . A A . 16 ASN HD21 1 1 13 8791 1 1 16 ASN HD22 H 8.696 1.479 9.075 1.00 . A A . 16 ASN HD22 1 1 13 8792 1 1 16 ASN N N 4.437 -2.300 9.141 1.00 . A A . 16 ASN N 1 1 13 8793 1 1 16 ASN ND2 N 8.284 0.590 9.052 1.00 . A A . 16 ASN ND2 1 1 13 8794 1 1 16 ASN O O 4.616 -0.937 6.772 1.00 . A A . 16 ASN O 1 1 13 8795 1 1 16 ASN OD1 O 6.402 1.423 9.925 1.00 . A A . 16 ASN OD1 1 1 13 8796 1 1 17 LYS C C 5.298 1.827 5.630 1.00 . A A . 17 LYS C 1 1 13 8797 1 1 17 LYS CA C 4.135 1.795 6.621 1.00 . A A . 17 LYS CA 1 1 13 8798 1 1 17 LYS CB C 3.722 3.229 6.962 1.00 . A A . 17 LYS CB 1 1 13 8799 1 1 17 LYS CD C 1.970 5.014 6.634 1.00 . A A . 17 LYS CD 1 1 13 8800 1 1 17 LYS CE C 2.725 5.681 5.491 1.00 . A A . 17 LYS CE 1 1 13 8801 1 1 17 LYS CG C 2.253 3.517 6.691 1.00 . A A . 17 LYS CG 1 1 13 8802 1 1 17 LYS H H 4.476 1.510 8.693 1.00 . A A . 17 LYS H 1 1 13 8803 1 1 17 LYS HA H 3.300 1.306 6.144 1.00 . A A . 17 LYS HA 1 1 13 8804 1 1 17 LYS HB2 H 3.914 3.407 8.010 1.00 . A A . 17 LYS HB2 1 1 13 8805 1 1 17 LYS HB3 H 4.316 3.912 6.373 1.00 . A A . 17 LYS HB3 1 1 13 8806 1 1 17 LYS HD2 H 0.911 5.165 6.487 1.00 . A A . 17 LYS HD2 1 1 13 8807 1 1 17 LYS HD3 H 2.274 5.465 7.567 1.00 . A A . 17 LYS HD3 1 1 13 8808 1 1 17 LYS HE2 H 3.783 5.628 5.698 1.00 . A A . 17 LYS HE2 1 1 13 8809 1 1 17 LYS HE3 H 2.513 5.145 4.577 1.00 . A A . 17 LYS HE3 1 1 13 8810 1 1 17 LYS HG2 H 1.978 3.075 5.744 1.00 . A A . 17 LYS HG2 1 1 13 8811 1 1 17 LYS HG3 H 1.659 3.078 7.480 1.00 . A A . 17 LYS HG3 1 1 13 8812 1 1 17 LYS HZ1 H 3.158 7.723 5.485 1.00 . A A . 17 LYS HZ1 1 1 13 8813 1 1 17 LYS HZ2 H 1.583 7.363 5.971 1.00 . A A . 17 LYS HZ2 1 1 13 8814 1 1 17 LYS HZ3 H 2.003 7.271 4.332 1.00 . A A . 17 LYS HZ3 1 1 13 8815 1 1 17 LYS N N 4.444 1.040 7.831 1.00 . A A . 17 LYS N 1 1 13 8816 1 1 17 LYS NZ N 2.342 7.107 5.314 1.00 . A A . 17 LYS NZ 1 1 13 8817 1 1 17 LYS O O 5.067 1.833 4.427 1.00 . A A . 17 LYS O 1 1 13 8818 1 1 18 LYS C C 7.672 0.922 4.120 1.00 . A A . 18 LYS C 1 1 13 8819 1 1 18 LYS CA C 7.722 1.955 5.263 1.00 . A A . 18 LYS CA 1 1 13 8820 1 1 18 LYS CB C 9.010 1.800 6.092 1.00 . A A . 18 LYS CB 1 1 13 8821 1 1 18 LYS CD C 10.753 1.639 4.257 1.00 . A A . 18 LYS CD 1 1 13 8822 1 1 18 LYS CE C 11.955 2.311 3.612 1.00 . A A . 18 LYS CE 1 1 13 8823 1 1 18 LYS CG C 10.250 2.428 5.458 1.00 . A A . 18 LYS CG 1 1 13 8824 1 1 18 LYS H H 6.651 1.899 7.104 1.00 . A A . 18 LYS H 1 1 13 8825 1 1 18 LYS HA H 7.723 2.938 4.818 1.00 . A A . 18 LYS HA 1 1 13 8826 1 1 18 LYS HB2 H 8.857 2.261 7.056 1.00 . A A . 18 LYS HB2 1 1 13 8827 1 1 18 LYS HB3 H 9.202 0.747 6.237 1.00 . A A . 18 LYS HB3 1 1 13 8828 1 1 18 LYS HD2 H 11.039 0.650 4.583 1.00 . A A . 18 LYS HD2 1 1 13 8829 1 1 18 LYS HD3 H 9.959 1.565 3.529 1.00 . A A . 18 LYS HD3 1 1 13 8830 1 1 18 LYS HE2 H 11.675 3.309 3.311 1.00 . A A . 18 LYS HE2 1 1 13 8831 1 1 18 LYS HE3 H 12.753 2.366 4.338 1.00 . A A . 18 LYS HE3 1 1 13 8832 1 1 18 LYS HG2 H 10.006 3.428 5.136 1.00 . A A . 18 LYS HG2 1 1 13 8833 1 1 18 LYS HG3 H 11.034 2.472 6.201 1.00 . A A . 18 LYS HG3 1 1 13 8834 1 1 18 LYS HZ1 H 13.213 0.923 2.685 1.00 . A A . 18 LYS HZ1 1 1 13 8835 1 1 18 LYS HZ2 H 12.784 2.227 1.697 1.00 . A A . 18 LYS HZ2 1 1 13 8836 1 1 18 LYS HZ3 H 11.663 1.001 2.011 1.00 . A A . 18 LYS HZ3 1 1 13 8837 1 1 18 LYS N N 6.534 1.882 6.131 1.00 . A A . 18 LYS N 1 1 13 8838 1 1 18 LYS NZ N 12.437 1.563 2.418 1.00 . A A . 18 LYS NZ 1 1 13 8839 1 1 18 LYS O O 7.752 1.307 2.951 1.00 . A A . 18 LYS O 1 1 13 8840 1 1 19 PRO C C 6.344 -1.160 2.376 1.00 . A A . 19 PRO C 1 1 13 8841 1 1 19 PRO CA C 7.474 -1.428 3.369 1.00 . A A . 19 PRO CA 1 1 13 8842 1 1 19 PRO CB C 7.183 -2.710 4.156 1.00 . A A . 19 PRO CB 1 1 13 8843 1 1 19 PRO CD C 7.449 -0.986 5.764 1.00 . A A . 19 PRO CD 1 1 13 8844 1 1 19 PRO CG C 7.714 -2.442 5.517 1.00 . A A . 19 PRO CG 1 1 13 8845 1 1 19 PRO HA H 8.410 -1.524 2.839 1.00 . A A . 19 PRO HA 1 1 13 8846 1 1 19 PRO HB2 H 6.117 -2.885 4.177 1.00 . A A . 19 PRO HB2 1 1 13 8847 1 1 19 PRO HB3 H 7.679 -3.549 3.693 1.00 . A A . 19 PRO HB3 1 1 13 8848 1 1 19 PRO HD2 H 6.463 -0.847 6.182 1.00 . A A . 19 PRO HD2 1 1 13 8849 1 1 19 PRO HD3 H 8.201 -0.571 6.419 1.00 . A A . 19 PRO HD3 1 1 13 8850 1 1 19 PRO HG2 H 7.194 -3.050 6.243 1.00 . A A . 19 PRO HG2 1 1 13 8851 1 1 19 PRO HG3 H 8.775 -2.641 5.546 1.00 . A A . 19 PRO HG3 1 1 13 8852 1 1 19 PRO N N 7.540 -0.393 4.415 1.00 . A A . 19 PRO N 1 1 13 8853 1 1 19 PRO O O 6.514 -1.302 1.160 1.00 . A A . 19 PRO O 1 1 13 8854 1 1 20 CYS C C 4.291 0.711 1.177 1.00 . A A . 20 CYS C 1 1 13 8855 1 1 20 CYS CA C 4.024 -0.472 2.107 1.00 . A A . 20 CYS CA 1 1 13 8856 1 1 20 CYS CB C 2.828 -0.178 3.020 1.00 . A A . 20 CYS CB 1 1 13 8857 1 1 20 CYS H H 5.140 -0.667 3.888 1.00 . A A . 20 CYS H 1 1 13 8858 1 1 20 CYS HA H 3.806 -1.346 1.509 1.00 . A A . 20 CYS HA 1 1 13 8859 1 1 20 CYS HB2 H 2.742 -0.970 3.749 1.00 . A A . 20 CYS HB2 1 1 13 8860 1 1 20 CYS HB3 H 3.001 0.757 3.533 1.00 . A A . 20 CYS HB3 1 1 13 8861 1 1 20 CYS N N 5.198 -0.767 2.914 1.00 . A A . 20 CYS N 1 1 13 8862 1 1 20 CYS O O 4.047 0.628 -0.025 1.00 . A A . 20 CYS O 1 1 13 8863 1 1 20 CYS SG S 1.228 -0.050 2.159 1.00 . A A . 20 CYS SG 1 1 13 8864 1 1 21 VAL C C 6.067 2.671 -0.191 1.00 . A A . 21 VAL C 1 1 13 8865 1 1 21 VAL CA C 5.129 2.999 0.965 1.00 . A A . 21 VAL CA 1 1 13 8866 1 1 21 VAL CB C 5.772 4.092 1.849 1.00 . A A . 21 VAL CB 1 1 13 8867 1 1 21 VAL CG1 C 6.164 5.306 1.022 1.00 . A A . 21 VAL CG1 1 1 13 8868 1 1 21 VAL CG2 C 4.826 4.500 2.964 1.00 . A A . 21 VAL CG2 1 1 13 8869 1 1 21 VAL H H 4.999 1.795 2.705 1.00 . A A . 21 VAL H 1 1 13 8870 1 1 21 VAL HA H 4.203 3.388 0.563 1.00 . A A . 21 VAL HA 1 1 13 8871 1 1 21 VAL HB H 6.667 3.685 2.297 1.00 . A A . 21 VAL HB 1 1 13 8872 1 1 21 VAL HG11 H 5.726 6.193 1.455 1.00 . A A . 21 VAL HG11 1 1 13 8873 1 1 21 VAL HG12 H 5.804 5.184 0.011 1.00 . A A . 21 VAL HG12 1 1 13 8874 1 1 21 VAL HG13 H 7.239 5.403 1.012 1.00 . A A . 21 VAL HG13 1 1 13 8875 1 1 21 VAL HG21 H 5.224 5.363 3.476 1.00 . A A . 21 VAL HG21 1 1 13 8876 1 1 21 VAL HG22 H 4.720 3.684 3.664 1.00 . A A . 21 VAL HG22 1 1 13 8877 1 1 21 VAL HG23 H 3.860 4.743 2.546 1.00 . A A . 21 VAL HG23 1 1 13 8878 1 1 21 VAL N N 4.814 1.800 1.739 1.00 . A A . 21 VAL N 1 1 13 8879 1 1 21 VAL O O 5.874 3.144 -1.311 1.00 . A A . 21 VAL O 1 1 13 8880 1 1 22 ALA C C 7.317 0.704 -2.070 1.00 . A A . 22 ALA C 1 1 13 8881 1 1 22 ALA CA C 8.028 1.444 -0.941 1.00 . A A . 22 ALA CA 1 1 13 8882 1 1 22 ALA CB C 9.121 0.576 -0.336 1.00 . A A . 22 ALA CB 1 1 13 8883 1 1 22 ALA H H 7.165 1.492 0.995 1.00 . A A . 22 ALA H 1 1 13 8884 1 1 22 ALA HA H 8.486 2.338 -1.341 1.00 . A A . 22 ALA HA 1 1 13 8885 1 1 22 ALA HB1 H 10.088 0.969 -0.613 1.00 . A A . 22 ALA HB1 1 1 13 8886 1 1 22 ALA HB2 H 9.024 -0.434 -0.704 1.00 . A A . 22 ALA HB2 1 1 13 8887 1 1 22 ALA HB3 H 9.027 0.577 0.740 1.00 . A A . 22 ALA HB3 1 1 13 8888 1 1 22 ALA N N 7.072 1.846 0.083 1.00 . A A . 22 ALA N 1 1 13 8889 1 1 22 ALA O O 7.570 0.950 -3.252 1.00 . A A . 22 ALA O 1 1 13 8890 1 1 23 CYS C C 4.735 -0.023 -3.459 1.00 . A A . 23 CYS C 1 1 13 8891 1 1 23 CYS CA C 5.645 -0.956 -2.665 1.00 . A A . 23 CYS CA 1 1 13 8892 1 1 23 CYS CB C 4.807 -2.020 -1.951 1.00 . A A . 23 CYS CB 1 1 13 8893 1 1 23 CYS H H 6.244 -0.329 -0.735 1.00 . A A . 23 CYS H 1 1 13 8894 1 1 23 CYS HA H 6.337 -1.437 -3.340 1.00 . A A . 23 CYS HA 1 1 13 8895 1 1 23 CYS HB2 H 5.372 -2.412 -1.120 1.00 . A A . 23 CYS HB2 1 1 13 8896 1 1 23 CYS HB3 H 3.902 -1.561 -1.578 1.00 . A A . 23 CYS HB3 1 1 13 8897 1 1 23 CYS N N 6.411 -0.190 -1.694 1.00 . A A . 23 CYS N 1 1 13 8898 1 1 23 CYS O O 4.668 -0.084 -4.688 1.00 . A A . 23 CYS O 1 1 13 8899 1 1 23 CYS SG S 4.319 -3.431 -3.002 1.00 . A A . 23 CYS SG 1 1 13 8900 1 1 24 CYS C C 3.817 2.723 -4.310 1.00 . A A . 24 CYS C 1 1 13 8901 1 1 24 CYS CA C 3.121 1.786 -3.335 1.00 . A A . 24 CYS CA 1 1 13 8902 1 1 24 CYS CB C 2.430 2.580 -2.233 1.00 . A A . 24 CYS CB 1 1 13 8903 1 1 24 CYS H H 4.141 0.826 -1.757 1.00 . A A . 24 CYS H 1 1 13 8904 1 1 24 CYS HA H 2.374 1.223 -3.873 1.00 . A A . 24 CYS HA 1 1 13 8905 1 1 24 CYS HB2 H 3.177 3.035 -1.598 1.00 . A A . 24 CYS HB2 1 1 13 8906 1 1 24 CYS HB3 H 1.819 3.351 -2.676 1.00 . A A . 24 CYS HB3 1 1 13 8907 1 1 24 CYS N N 4.040 0.835 -2.738 1.00 . A A . 24 CYS N 1 1 13 8908 1 1 24 CYS O O 3.338 2.932 -5.421 1.00 . A A . 24 CYS O 1 1 13 8909 1 1 24 CYS SG S 1.360 1.550 -1.188 1.00 . A A . 24 CYS SG 1 1 13 8910 1 1 25 LYS C C 6.218 3.508 -5.998 1.00 . A A . 25 LYS C 1 1 13 8911 1 1 25 LYS CA C 5.670 4.209 -4.761 1.00 . A A . 25 LYS CA 1 1 13 8912 1 1 25 LYS CB C 6.764 4.935 -3.982 1.00 . A A . 25 LYS CB 1 1 13 8913 1 1 25 LYS CD C 7.233 6.826 -2.374 1.00 . A A . 25 LYS CD 1 1 13 8914 1 1 25 LYS CE C 6.584 7.869 -1.478 1.00 . A A . 25 LYS CE 1 1 13 8915 1 1 25 LYS CG C 6.183 5.911 -2.973 1.00 . A A . 25 LYS CG 1 1 13 8916 1 1 25 LYS H H 5.285 3.093 -3.001 1.00 . A A . 25 LYS H 1 1 13 8917 1 1 25 LYS HA H 4.955 4.947 -5.097 1.00 . A A . 25 LYS HA 1 1 13 8918 1 1 25 LYS HB2 H 7.365 4.208 -3.455 1.00 . A A . 25 LYS HB2 1 1 13 8919 1 1 25 LYS HB3 H 7.388 5.484 -4.671 1.00 . A A . 25 LYS HB3 1 1 13 8920 1 1 25 LYS HD2 H 7.923 6.237 -1.788 1.00 . A A . 25 LYS HD2 1 1 13 8921 1 1 25 LYS HD3 H 7.764 7.326 -3.171 1.00 . A A . 25 LYS HD3 1 1 13 8922 1 1 25 LYS HE2 H 5.882 8.442 -2.065 1.00 . A A . 25 LYS HE2 1 1 13 8923 1 1 25 LYS HE3 H 6.056 7.363 -0.683 1.00 . A A . 25 LYS HE3 1 1 13 8924 1 1 25 LYS HG2 H 5.439 6.518 -3.466 1.00 . A A . 25 LYS HG2 1 1 13 8925 1 1 25 LYS HG3 H 5.716 5.349 -2.177 1.00 . A A . 25 LYS HG3 1 1 13 8926 1 1 25 LYS HZ1 H 7.148 9.730 -0.727 1.00 . A A . 25 LYS HZ1 1 1 13 8927 1 1 25 LYS HZ2 H 8.395 8.905 -1.517 1.00 . A A . 25 LYS HZ2 1 1 13 8928 1 1 25 LYS HZ3 H 7.912 8.425 0.031 1.00 . A A . 25 LYS HZ3 1 1 13 8929 1 1 25 LYS N N 4.941 3.290 -3.902 1.00 . A A . 25 LYS N 1 1 13 8930 1 1 25 LYS NZ N 7.580 8.797 -0.881 1.00 . A A . 25 LYS NZ 1 1 13 8931 1 1 25 LYS O O 6.260 4.105 -7.073 1.00 . A A . 25 LYS O 1 1 13 8932 1 1 26 LYS C C 5.951 1.314 -8.022 1.00 . A A . 26 LYS C 1 1 13 8933 1 1 26 LYS CA C 7.100 1.498 -7.026 1.00 . A A . 26 LYS CA 1 1 13 8934 1 1 26 LYS CB C 7.684 0.127 -6.634 1.00 . A A . 26 LYS CB 1 1 13 8935 1 1 26 LYS CD C 7.300 -2.365 -6.404 1.00 . A A . 26 LYS CD 1 1 13 8936 1 1 26 LYS CE C 7.623 -2.560 -4.935 1.00 . A A . 26 LYS CE 1 1 13 8937 1 1 26 LYS CG C 6.671 -1.009 -6.668 1.00 . A A . 26 LYS CG 1 1 13 8938 1 1 26 LYS H H 6.526 1.792 -4.999 1.00 . A A . 26 LYS H 1 1 13 8939 1 1 26 LYS HA H 7.871 2.095 -7.493 1.00 . A A . 26 LYS HA 1 1 13 8940 1 1 26 LYS HB2 H 8.486 -0.116 -7.315 1.00 . A A . 26 LYS HB2 1 1 13 8941 1 1 26 LYS HB3 H 8.084 0.194 -5.632 1.00 . A A . 26 LYS HB3 1 1 13 8942 1 1 26 LYS HD2 H 6.612 -3.136 -6.715 1.00 . A A . 26 LYS HD2 1 1 13 8943 1 1 26 LYS HD3 H 8.213 -2.444 -6.977 1.00 . A A . 26 LYS HD3 1 1 13 8944 1 1 26 LYS HE2 H 8.597 -2.139 -4.733 1.00 . A A . 26 LYS HE2 1 1 13 8945 1 1 26 LYS HE3 H 6.879 -2.048 -4.342 1.00 . A A . 26 LYS HE3 1 1 13 8946 1 1 26 LYS HG2 H 5.921 -0.826 -5.913 1.00 . A A . 26 LYS HG2 1 1 13 8947 1 1 26 LYS HG3 H 6.201 -1.025 -7.641 1.00 . A A . 26 LYS HG3 1 1 13 8948 1 1 26 LYS HZ1 H 7.674 -4.108 -3.534 1.00 . A A . 26 LYS HZ1 1 1 13 8949 1 1 26 LYS HZ2 H 8.451 -4.476 -4.989 1.00 . A A . 26 LYS HZ2 1 1 13 8950 1 1 26 LYS HZ3 H 6.759 -4.460 -4.915 1.00 . A A . 26 LYS HZ3 1 1 13 8951 1 1 26 LYS N N 6.602 2.238 -5.869 1.00 . A A . 26 LYS N 1 1 13 8952 1 1 26 LYS NZ N 7.630 -4.001 -4.566 1.00 . A A . 26 LYS NZ 1 1 13 8953 1 1 26 LYS O O 6.153 1.309 -9.235 1.00 . A A . 26 LYS O 1 1 13 8954 1 1 27 ALA C C 2.946 2.345 -8.702 1.00 . A A . 27 ALA C 1 1 13 8955 1 1 27 ALA CA C 3.541 0.995 -8.297 1.00 . A A . 27 ALA CA 1 1 13 8956 1 1 27 ALA CB C 2.516 0.159 -7.544 1.00 . A A . 27 ALA CB 1 1 13 8957 1 1 27 ALA H H 4.646 1.191 -6.505 1.00 . A A . 27 ALA H 1 1 13 8958 1 1 27 ALA HA H 3.824 0.456 -9.190 1.00 . A A . 27 ALA HA 1 1 13 8959 1 1 27 ALA HB1 H 2.973 -0.256 -6.658 1.00 . A A . 27 ALA HB1 1 1 13 8960 1 1 27 ALA HB2 H 2.168 -0.642 -8.179 1.00 . A A . 27 ALA HB2 1 1 13 8961 1 1 27 ALA HB3 H 1.681 0.783 -7.261 1.00 . A A . 27 ALA HB3 1 1 13 8962 1 1 27 ALA N N 4.737 1.172 -7.482 1.00 . A A . 27 ALA N 1 1 13 8963 1 1 27 ALA O O 1.810 2.420 -9.183 1.00 . A A . 27 ALA O 1 1 13 8964 1 1 28 LYS C C 2.189 5.274 -7.981 1.00 . A A . 28 LYS C 1 1 13 8965 1 1 28 LYS CA C 3.339 4.763 -8.862 1.00 . A A . 28 LYS CA 1 1 13 8966 1 1 28 LYS CB C 2.975 4.850 -10.352 1.00 . A A . 28 LYS CB 1 1 13 8967 1 1 28 LYS CD C 2.706 6.278 -12.404 1.00 . A A . 28 LYS CD 1 1 13 8968 1 1 28 LYS CE C 3.877 5.622 -13.123 1.00 . A A . 28 LYS CE 1 1 13 8969 1 1 28 LYS CG C 2.902 6.270 -10.895 1.00 . A A . 28 LYS CG 1 1 13 8970 1 1 28 LYS H H 4.629 3.255 -8.136 1.00 . A A . 28 LYS H 1 1 13 8971 1 1 28 LYS HA H 4.197 5.395 -8.687 1.00 . A A . 28 LYS HA 1 1 13 8972 1 1 28 LYS HB2 H 3.717 4.310 -10.921 1.00 . A A . 28 LYS HB2 1 1 13 8973 1 1 28 LYS HB3 H 2.013 4.381 -10.500 1.00 . A A . 28 LYS HB3 1 1 13 8974 1 1 28 LYS HD2 H 1.802 5.739 -12.643 1.00 . A A . 28 LYS HD2 1 1 13 8975 1 1 28 LYS HD3 H 2.616 7.301 -12.740 1.00 . A A . 28 LYS HD3 1 1 13 8976 1 1 28 LYS HE2 H 4.780 6.161 -12.879 1.00 . A A . 28 LYS HE2 1 1 13 8977 1 1 28 LYS HE3 H 3.965 4.601 -12.780 1.00 . A A . 28 LYS HE3 1 1 13 8978 1 1 28 LYS HG2 H 2.071 6.780 -10.432 1.00 . A A . 28 LYS HG2 1 1 13 8979 1 1 28 LYS HG3 H 3.821 6.784 -10.657 1.00 . A A . 28 LYS HG3 1 1 13 8980 1 1 28 LYS HZ1 H 3.035 6.374 -14.881 1.00 . A A . 28 LYS HZ1 1 1 13 8981 1 1 28 LYS HZ2 H 3.319 4.707 -14.917 1.00 . A A . 28 LYS HZ2 1 1 13 8982 1 1 28 LYS HZ3 H 4.611 5.788 -15.071 1.00 . A A . 28 LYS HZ3 1 1 13 8983 1 1 28 LYS N N 3.734 3.401 -8.515 1.00 . A A . 28 LYS N 1 1 13 8984 1 1 28 LYS NZ N 3.697 5.623 -14.601 1.00 . A A . 28 LYS NZ 1 1 13 8985 1 1 28 LYS O O 1.136 5.681 -8.479 1.00 . A A . 28 LYS O 1 1 13 8986 1 1 29 PHE C C 2.102 6.770 -4.782 1.00 . A A . 29 PHE C 1 1 13 8987 1 1 29 PHE CA C 1.426 5.767 -5.710 1.00 . A A . 29 PHE CA 1 1 13 8988 1 1 29 PHE CB C 0.790 4.638 -4.888 1.00 . A A . 29 PHE CB 1 1 13 8989 1 1 29 PHE CD1 C 0.226 2.765 -6.471 1.00 . A A . 29 PHE CD1 1 1 13 8990 1 1 29 PHE CD2 C -1.559 4.025 -5.523 1.00 . A A . 29 PHE CD2 1 1 13 8991 1 1 29 PHE CE1 C -0.687 1.985 -7.157 1.00 . A A . 29 PHE CE1 1 1 13 8992 1 1 29 PHE CE2 C -2.476 3.250 -6.207 1.00 . A A . 29 PHE CE2 1 1 13 8993 1 1 29 PHE CG C -0.199 3.792 -5.647 1.00 . A A . 29 PHE CG 1 1 13 8994 1 1 29 PHE CZ C -2.039 2.229 -7.025 1.00 . A A . 29 PHE CZ 1 1 13 8995 1 1 29 PHE H H 3.277 4.951 -6.338 1.00 . A A . 29 PHE H 1 1 13 8996 1 1 29 PHE HA H 0.653 6.279 -6.266 1.00 . A A . 29 PHE HA 1 1 13 8997 1 1 29 PHE HB2 H 1.570 3.987 -4.528 1.00 . A A . 29 PHE HB2 1 1 13 8998 1 1 29 PHE HB3 H 0.273 5.069 -4.041 1.00 . A A . 29 PHE HB3 1 1 13 8999 1 1 29 PHE HD1 H 1.284 2.573 -6.576 1.00 . A A . 29 PHE HD1 1 1 13 9000 1 1 29 PHE HD2 H -1.903 4.824 -4.883 1.00 . A A . 29 PHE HD2 1 1 13 9001 1 1 29 PHE HE1 H -0.341 1.187 -7.798 1.00 . A A . 29 PHE HE1 1 1 13 9002 1 1 29 PHE HE2 H -3.533 3.444 -6.101 1.00 . A A . 29 PHE HE2 1 1 13 9003 1 1 29 PHE HZ H -2.753 1.621 -7.560 1.00 . A A . 29 PHE HZ 1 1 13 9004 1 1 29 PHE N N 2.410 5.273 -6.672 1.00 . A A . 29 PHE N 1 1 13 9005 1 1 29 PHE O O 3.290 6.639 -4.485 1.00 . A A . 29 PHE O 1 1 13 9006 1 1 30 SER C C 2.257 8.304 -2.109 1.00 . A A . 30 SER C 1 1 13 9007 1 1 30 SER CA C 1.888 8.827 -3.496 1.00 . A A . 30 SER CA 1 1 13 9008 1 1 30 SER CB C 0.854 9.944 -3.377 1.00 . A A . 30 SER CB 1 1 13 9009 1 1 30 SER H H 0.423 7.840 -4.651 1.00 . A A . 30 SER H 1 1 13 9010 1 1 30 SER HA H 2.773 9.222 -3.963 1.00 . A A . 30 SER HA 1 1 13 9011 1 1 30 SER HB2 H 0.387 9.901 -2.404 1.00 . A A . 30 SER HB2 1 1 13 9012 1 1 30 SER HB3 H 1.338 10.901 -3.506 1.00 . A A . 30 SER HB3 1 1 13 9013 1 1 30 SER HG H -0.203 10.607 -4.913 1.00 . A A . 30 SER HG 1 1 13 9014 1 1 30 SER N N 1.357 7.778 -4.358 1.00 . A A . 30 SER N 1 1 13 9015 1 1 30 SER O O 3.325 8.627 -1.579 1.00 . A A . 30 SER O 1 1 13 9016 1 1 30 SER OG O -0.144 9.795 -4.373 1.00 . A A . 30 SER OG 1 1 13 9017 1 1 31 ASP C C 0.840 5.658 0.009 1.00 . A A . 31 ASP C 1 1 13 9018 1 1 31 ASP CA C 1.608 6.961 -0.186 1.00 . A A . 31 ASP CA 1 1 13 9019 1 1 31 ASP CB C 1.188 7.976 0.886 1.00 . A A . 31 ASP CB 1 1 13 9020 1 1 31 ASP CG C 1.683 7.612 2.278 1.00 . A A . 31 ASP CG 1 1 13 9021 1 1 31 ASP H H 0.537 7.290 -1.991 1.00 . A A . 31 ASP H 1 1 13 9022 1 1 31 ASP HA H 2.665 6.762 -0.089 1.00 . A A . 31 ASP HA 1 1 13 9023 1 1 31 ASP HB2 H 1.587 8.945 0.629 1.00 . A A . 31 ASP HB2 1 1 13 9024 1 1 31 ASP HB3 H 0.110 8.033 0.913 1.00 . A A . 31 ASP HB3 1 1 13 9025 1 1 31 ASP N N 1.373 7.508 -1.521 1.00 . A A . 31 ASP N 1 1 13 9026 1 1 31 ASP O O -0.162 5.403 -0.667 1.00 . A A . 31 ASP O 1 1 13 9027 1 1 31 ASP OD1 O 2.574 6.745 2.400 1.00 . A A . 31 ASP OD1 1 1 13 9028 1 1 31 ASP OD2 O 1.197 8.206 3.262 1.00 . A A . 31 ASP OD2 1 1 13 9029 1 1 32 GLY C C 0.291 3.473 2.694 1.00 . A A . 32 GLY C 1 1 13 9030 1 1 32 GLY CA C 0.679 3.580 1.237 1.00 . A A . 32 GLY CA 1 1 13 9031 1 1 32 GLY H H 2.109 5.124 1.452 1.00 . A A . 32 GLY H 1 1 13 9032 1 1 32 GLY HA2 H -0.211 3.482 0.629 1.00 . A A . 32 GLY HA2 1 1 13 9033 1 1 32 GLY HA3 H 1.361 2.779 0.996 1.00 . A A . 32 GLY HA3 1 1 13 9034 1 1 32 GLY N N 1.313 4.846 0.941 1.00 . A A . 32 GLY N 1 1 13 9035 1 1 32 GLY O O 0.788 4.224 3.532 1.00 . A A . 32 GLY O 1 1 13 9036 1 1 33 HIS C C -1.602 0.959 4.582 1.00 . A A . 33 HIS C 1 1 13 9037 1 1 33 HIS CA C -1.065 2.366 4.370 1.00 . A A . 33 HIS CA 1 1 13 9038 1 1 33 HIS CB C -2.152 3.393 4.725 1.00 . A A . 33 HIS CB 1 1 13 9039 1 1 33 HIS CD2 C -4.574 2.963 3.882 1.00 . A A . 33 HIS CD2 1 1 13 9040 1 1 33 HIS CE1 C -4.376 3.825 1.877 1.00 . A A . 33 HIS CE1 1 1 13 9041 1 1 33 HIS CG C -3.306 3.426 3.761 1.00 . A A . 33 HIS CG 1 1 13 9042 1 1 33 HIS H H -0.976 1.983 2.287 1.00 . A A . 33 HIS H 1 1 13 9043 1 1 33 HIS HA H -0.219 2.515 5.024 1.00 . A A . 33 HIS HA 1 1 13 9044 1 1 33 HIS HB2 H -2.546 3.162 5.703 1.00 . A A . 33 HIS HB2 1 1 13 9045 1 1 33 HIS HB3 H -1.708 4.376 4.747 1.00 . A A . 33 HIS HB3 1 1 13 9046 1 1 33 HIS HD1 H -2.422 4.376 2.097 1.00 . A A . 33 HIS HD1 1 1 13 9047 1 1 33 HIS HD2 H -4.997 2.468 4.743 1.00 . A A . 33 HIS HD2 1 1 13 9048 1 1 33 HIS HE1 H -4.596 4.139 0.868 1.00 . A A . 33 HIS HE1 1 1 13 9049 1 1 33 HIS N N -0.606 2.553 3.002 1.00 . A A . 33 HIS N 1 1 13 9050 1 1 33 HIS ND1 N -3.218 3.960 2.491 1.00 . A A . 33 HIS ND1 1 1 13 9051 1 1 33 HIS NE2 N -5.217 3.224 2.697 1.00 . A A . 33 HIS NE2 1 1 13 9052 1 1 33 HIS O O -2.385 0.450 3.778 1.00 . A A . 33 HIS O 1 1 13 9053 1 1 34 CYS C C -3.100 -0.970 6.420 1.00 . A A . 34 CYS C 1 1 13 9054 1 1 34 CYS CA C -1.628 -0.997 6.017 1.00 . A A . 34 CYS CA 1 1 13 9055 1 1 34 CYS CB C -0.789 -1.550 7.171 1.00 . A A . 34 CYS CB 1 1 13 9056 1 1 34 CYS H H -0.570 0.810 6.277 1.00 . A A . 34 CYS H 1 1 13 9057 1 1 34 CYS HA H -1.506 -1.627 5.149 1.00 . A A . 34 CYS HA 1 1 13 9058 1 1 34 CYS HB2 H -1.088 -1.062 8.086 1.00 . A A . 34 CYS HB2 1 1 13 9059 1 1 34 CYS HB3 H -0.973 -2.611 7.260 1.00 . A A . 34 CYS HB3 1 1 13 9060 1 1 34 CYS N N -1.186 0.345 5.675 1.00 . A A . 34 CYS N 1 1 13 9061 1 1 34 CYS O O -3.523 -0.088 7.165 1.00 . A A . 34 CYS O 1 1 13 9062 1 1 34 CYS SG S 1.011 -1.314 6.984 1.00 . A A . 34 CYS SG 1 1 13 9063 1 1 35 SER C C -5.524 -2.649 7.610 1.00 . A A . 35 SER C 1 1 13 9064 1 1 35 SER CA C -5.296 -1.986 6.251 1.00 . A A . 35 SER CA 1 1 13 9065 1 1 35 SER CB C -6.058 -2.725 5.150 1.00 . A A . 35 SER CB 1 1 13 9066 1 1 35 SER H H -3.490 -2.601 5.331 1.00 . A A . 35 SER H 1 1 13 9067 1 1 35 SER HA H -5.665 -0.975 6.304 1.00 . A A . 35 SER HA 1 1 13 9068 1 1 35 SER HB2 H -7.052 -2.962 5.500 1.00 . A A . 35 SER HB2 1 1 13 9069 1 1 35 SER HB3 H -6.125 -2.094 4.276 1.00 . A A . 35 SER HB3 1 1 13 9070 1 1 35 SER HG H -4.693 -3.730 4.169 1.00 . A A . 35 SER HG 1 1 13 9071 1 1 35 SER N N -3.877 -1.925 5.926 1.00 . A A . 35 SER N 1 1 13 9072 1 1 35 SER O O -4.647 -2.635 8.477 1.00 . A A . 35 SER O 1 1 13 9073 1 1 35 SER OG O -5.404 -3.928 4.795 1.00 . A A . 35 SER OG 1 1 13 9074 1 1 36 LYS C C -7.463 -5.328 8.851 1.00 . A A . 36 LYS C 1 1 13 9075 1 1 36 LYS CA C -7.053 -3.869 9.052 1.00 . A A . 36 LYS CA 1 1 13 9076 1 1 36 LYS CB C -8.186 -3.102 9.743 1.00 . A A . 36 LYS CB 1 1 13 9077 1 1 36 LYS CD C -9.793 -2.961 11.674 1.00 . A A . 36 LYS CD 1 1 13 9078 1 1 36 LYS CE C -10.273 -3.622 12.956 1.00 . A A . 36 LYS CE 1 1 13 9079 1 1 36 LYS CG C -8.671 -3.756 11.027 1.00 . A A . 36 LYS CG 1 1 13 9080 1 1 36 LYS H H -7.363 -3.186 7.073 1.00 . A A . 36 LYS H 1 1 13 9081 1 1 36 LYS HA H -6.181 -3.841 9.686 1.00 . A A . 36 LYS HA 1 1 13 9082 1 1 36 LYS HB2 H -7.839 -2.107 9.981 1.00 . A A . 36 LYS HB2 1 1 13 9083 1 1 36 LYS HB3 H -9.022 -3.029 9.064 1.00 . A A . 36 LYS HB3 1 1 13 9084 1 1 36 LYS HD2 H -9.432 -1.969 11.905 1.00 . A A . 36 LYS HD2 1 1 13 9085 1 1 36 LYS HD3 H -10.619 -2.894 10.982 1.00 . A A . 36 LYS HD3 1 1 13 9086 1 1 36 LYS HE2 H -10.622 -4.616 12.724 1.00 . A A . 36 LYS HE2 1 1 13 9087 1 1 36 LYS HE3 H -9.444 -3.684 13.646 1.00 . A A . 36 LYS HE3 1 1 13 9088 1 1 36 LYS HG2 H -9.033 -4.747 10.797 1.00 . A A . 36 LYS HG2 1 1 13 9089 1 1 36 LYS HG3 H -7.844 -3.825 11.719 1.00 . A A . 36 LYS HG3 1 1 13 9090 1 1 36 LYS HZ1 H -11.399 -1.883 13.232 1.00 . A A . 36 LYS HZ1 1 1 13 9091 1 1 36 LYS HZ2 H -11.245 -2.828 14.626 1.00 . A A . 36 LYS HZ2 1 1 13 9092 1 1 36 LYS HZ3 H -12.293 -3.311 13.390 1.00 . A A . 36 LYS HZ3 1 1 13 9093 1 1 36 LYS N N -6.707 -3.218 7.794 1.00 . A A . 36 LYS N 1 1 13 9094 1 1 36 LYS NZ N -11.380 -2.857 13.596 1.00 . A A . 36 LYS NZ 1 1 13 9095 1 1 36 LYS O O -7.126 -6.179 9.664 1.00 . A A . 36 LYS O 1 1 13 9096 1 1 37 ILE C C -7.550 -7.940 7.297 1.00 . A A . 37 ILE C 1 1 13 9097 1 1 37 ILE CA C -8.703 -6.950 7.498 1.00 . A A . 37 ILE CA 1 1 13 9098 1 1 37 ILE CB C -9.604 -6.962 6.243 1.00 . A A . 37 ILE CB 1 1 13 9099 1 1 37 ILE CD1 C -11.482 -5.705 5.066 1.00 . A A . 37 ILE CD1 1 1 13 9100 1 1 37 ILE CG1 C -10.654 -5.850 6.325 1.00 . A A . 37 ILE CG1 1 1 13 9101 1 1 37 ILE CG2 C -10.283 -8.319 6.087 1.00 . A A . 37 ILE CG2 1 1 13 9102 1 1 37 ILE H H -8.472 -4.867 7.190 1.00 . A A . 37 ILE H 1 1 13 9103 1 1 37 ILE HA H -9.296 -7.274 8.341 1.00 . A A . 37 ILE HA 1 1 13 9104 1 1 37 ILE HB H -8.980 -6.796 5.380 1.00 . A A . 37 ILE HB 1 1 13 9105 1 1 37 ILE HD11 H -11.331 -4.721 4.647 1.00 . A A . 37 ILE HD11 1 1 13 9106 1 1 37 ILE HD12 H -12.527 -5.839 5.304 1.00 . A A . 37 ILE HD12 1 1 13 9107 1 1 37 ILE HD13 H -11.178 -6.452 4.347 1.00 . A A . 37 ILE HD13 1 1 13 9108 1 1 37 ILE HG12 H -11.328 -6.060 7.142 1.00 . A A . 37 ILE HG12 1 1 13 9109 1 1 37 ILE HG13 H -10.157 -4.908 6.508 1.00 . A A . 37 ILE HG13 1 1 13 9110 1 1 37 ILE HG21 H -11.344 -8.212 6.253 1.00 . A A . 37 ILE HG21 1 1 13 9111 1 1 37 ILE HG22 H -9.873 -9.011 6.808 1.00 . A A . 37 ILE HG22 1 1 13 9112 1 1 37 ILE HG23 H -10.110 -8.696 5.089 1.00 . A A . 37 ILE HG23 1 1 13 9113 1 1 37 ILE N N -8.216 -5.597 7.785 1.00 . A A . 37 ILE N 1 1 13 9114 1 1 37 ILE O O -7.090 -8.571 8.242 1.00 . A A . 37 ILE O 1 1 13 9115 1 1 38 LEU C C -4.659 -8.287 5.931 1.00 . A A . 38 LEU C 1 1 13 9116 1 1 38 LEU CA C -5.995 -8.990 5.748 1.00 . A A . 38 LEU CA 1 1 13 9117 1 1 38 LEU CB C -6.118 -9.500 4.313 1.00 . A A . 38 LEU CB 1 1 13 9118 1 1 38 LEU CD1 C -5.525 -11.885 4.813 1.00 . A A . 38 LEU CD1 1 1 13 9119 1 1 38 LEU CD2 C -5.265 -10.997 2.489 1.00 . A A . 38 LEU CD2 1 1 13 9120 1 1 38 LEU CG C -5.189 -10.663 3.970 1.00 . A A . 38 LEU CG 1 1 13 9121 1 1 38 LEU H H -7.496 -7.552 5.338 1.00 . A A . 38 LEU H 1 1 13 9122 1 1 38 LEU HA H -6.052 -9.826 6.429 1.00 . A A . 38 LEU HA 1 1 13 9123 1 1 38 LEU HB2 H -7.136 -9.808 4.147 1.00 . A A . 38 LEU HB2 1 1 13 9124 1 1 38 LEU HB3 H -5.894 -8.683 3.644 1.00 . A A . 38 LEU HB3 1 1 13 9125 1 1 38 LEU HD11 H -6.362 -12.406 4.373 1.00 . A A . 38 LEU HD11 1 1 13 9126 1 1 38 LEU HD12 H -5.781 -11.572 5.814 1.00 . A A . 38 LEU HD12 1 1 13 9127 1 1 38 LEU HD13 H -4.670 -12.544 4.849 1.00 . A A . 38 LEU HD13 1 1 13 9128 1 1 38 LEU HD21 H -6.173 -11.545 2.290 1.00 . A A . 38 LEU HD21 1 1 13 9129 1 1 38 LEU HD22 H -4.412 -11.600 2.212 1.00 . A A . 38 LEU HD22 1 1 13 9130 1 1 38 LEU HD23 H -5.262 -10.083 1.914 1.00 . A A . 38 LEU HD23 1 1 13 9131 1 1 38 LEU HG H -4.175 -10.369 4.199 1.00 . A A . 38 LEU HG 1 1 13 9132 1 1 38 LEU N N -7.090 -8.075 6.058 1.00 . A A . 38 LEU N 1 1 13 9133 1 1 38 LEU O O -3.599 -8.824 5.615 1.00 . A A . 38 LEU O 1 1 13 9134 1 1 39 ARG C C -2.815 -5.983 5.379 1.00 . A A . 39 ARG C 1 1 13 9135 1 1 39 ARG CA C -3.583 -6.226 6.679 1.00 . A A . 39 ARG CA 1 1 13 9136 1 1 39 ARG CB C -2.670 -6.847 7.742 1.00 . A A . 39 ARG CB 1 1 13 9137 1 1 39 ARG CD C -2.986 -5.137 9.551 1.00 . A A . 39 ARG CD 1 1 13 9138 1 1 39 ARG CG C -1.989 -5.812 8.619 1.00 . A A . 39 ARG CG 1 1 13 9139 1 1 39 ARG CZ C -1.481 -3.549 10.733 1.00 . A A . 39 ARG CZ 1 1 13 9140 1 1 39 ARG H H -5.628 -6.724 6.651 1.00 . A A . 39 ARG H 1 1 13 9141 1 1 39 ARG HA H -3.945 -5.276 7.044 1.00 . A A . 39 ARG HA 1 1 13 9142 1 1 39 ARG HB2 H -3.258 -7.495 8.374 1.00 . A A . 39 ARG HB2 1 1 13 9143 1 1 39 ARG HB3 H -1.906 -7.430 7.250 1.00 . A A . 39 ARG HB3 1 1 13 9144 1 1 39 ARG HD2 H -3.932 -5.049 9.039 1.00 . A A . 39 ARG HD2 1 1 13 9145 1 1 39 ARG HD3 H -3.110 -5.754 10.429 1.00 . A A . 39 ARG HD3 1 1 13 9146 1 1 39 ARG HE H -3.088 -3.040 9.641 1.00 . A A . 39 ARG HE 1 1 13 9147 1 1 39 ARG HG2 H -1.229 -6.299 9.212 1.00 . A A . 39 ARG HG2 1 1 13 9148 1 1 39 ARG HG3 H -1.533 -5.062 7.989 1.00 . A A . 39 ARG HG3 1 1 13 9149 1 1 39 ARG HH11 H -1.008 -5.497 11.033 1.00 . A A . 39 ARG HH11 1 1 13 9150 1 1 39 ARG HH12 H 0.046 -4.355 11.797 1.00 . A A . 39 ARG HH12 1 1 13 9151 1 1 39 ARG HH21 H -1.701 -1.535 10.658 1.00 . A A . 39 ARG HH21 1 1 13 9152 1 1 39 ARG HH22 H -0.345 -2.096 11.579 1.00 . A A . 39 ARG HH22 1 1 13 9153 1 1 39 ARG N N -4.744 -7.069 6.436 1.00 . A A . 39 ARG N 1 1 13 9154 1 1 39 ARG NE N -2.550 -3.800 9.969 1.00 . A A . 39 ARG NE 1 1 13 9155 1 1 39 ARG NH1 N -0.756 -4.548 11.230 1.00 . A A . 39 ARG NH1 1 1 13 9156 1 1 39 ARG NH2 N -1.151 -2.293 11.015 1.00 . A A . 39 ARG NH2 1 1 13 9157 1 1 39 ARG O O -1.593 -5.855 5.376 1.00 . A A . 39 ARG O 1 1 13 9158 1 1 40 ARG C C -2.418 -4.244 2.876 1.00 . A A . 40 ARG C 1 1 13 9159 1 1 40 ARG CA C -2.976 -5.661 2.962 1.00 . A A . 40 ARG CA 1 1 13 9160 1 1 40 ARG CB C -4.024 -5.833 1.862 1.00 . A A . 40 ARG CB 1 1 13 9161 1 1 40 ARG CD C -5.550 -7.295 0.543 1.00 . A A . 40 ARG CD 1 1 13 9162 1 1 40 ARG CG C -4.538 -7.248 1.676 1.00 . A A . 40 ARG CG 1 1 13 9163 1 1 40 ARG CZ C -6.924 -8.930 -0.687 1.00 . A A . 40 ARG CZ 1 1 13 9164 1 1 40 ARG H H -4.531 -6.014 4.356 1.00 . A A . 40 ARG H 1 1 13 9165 1 1 40 ARG HA H -2.176 -6.369 2.806 1.00 . A A . 40 ARG HA 1 1 13 9166 1 1 40 ARG HB2 H -4.869 -5.202 2.093 1.00 . A A . 40 ARG HB2 1 1 13 9167 1 1 40 ARG HB3 H -3.595 -5.506 0.926 1.00 . A A . 40 ARG HB3 1 1 13 9168 1 1 40 ARG HD2 H -6.386 -6.663 0.802 1.00 . A A . 40 ARG HD2 1 1 13 9169 1 1 40 ARG HD3 H -5.081 -6.913 -0.353 1.00 . A A . 40 ARG HD3 1 1 13 9170 1 1 40 ARG HE H -5.703 -9.367 0.841 1.00 . A A . 40 ARG HE 1 1 13 9171 1 1 40 ARG HG2 H -3.709 -7.899 1.439 1.00 . A A . 40 ARG HG2 1 1 13 9172 1 1 40 ARG HG3 H -5.013 -7.577 2.589 1.00 . A A . 40 ARG HG3 1 1 13 9173 1 1 40 ARG HH11 H -7.116 -6.994 -1.325 1.00 . A A . 40 ARG HH11 1 1 13 9174 1 1 40 ARG HH12 H -8.065 -8.173 -2.186 1.00 . A A . 40 ARG HH12 1 1 13 9175 1 1 40 ARG HH21 H -6.953 -10.921 -0.302 1.00 . A A . 40 ARG HH21 1 1 13 9176 1 1 40 ARG HH22 H -7.975 -10.404 -1.601 1.00 . A A . 40 ARG HH22 1 1 13 9177 1 1 40 ARG N N -3.558 -5.908 4.278 1.00 . A A . 40 ARG N 1 1 13 9178 1 1 40 ARG NE N -6.047 -8.643 0.277 1.00 . A A . 40 ARG NE 1 1 13 9179 1 1 40 ARG NH1 N -7.410 -7.963 -1.462 1.00 . A A . 40 ARG NH1 1 1 13 9180 1 1 40 ARG NH2 N -7.315 -10.187 -0.878 1.00 . A A . 40 ARG NH2 1 1 13 9181 1 1 40 ARG O O -2.912 -3.334 3.548 1.00 . A A . 40 ARG O 1 1 13 9182 1 1 41 CYS C C -1.634 -1.944 0.838 1.00 . A A . 41 CYS C 1 1 13 9183 1 1 41 CYS CA C -0.803 -2.754 1.830 1.00 . A A . 41 CYS CA 1 1 13 9184 1 1 41 CYS CB C 0.633 -2.915 1.318 1.00 . A A . 41 CYS CB 1 1 13 9185 1 1 41 CYS H H -1.080 -4.823 1.515 1.00 . A A . 41 CYS H 1 1 13 9186 1 1 41 CYS HA H -0.788 -2.239 2.779 1.00 . A A . 41 CYS HA 1 1 13 9187 1 1 41 CYS HB2 H 1.257 -3.256 2.130 1.00 . A A . 41 CYS HB2 1 1 13 9188 1 1 41 CYS HB3 H 0.642 -3.658 0.533 1.00 . A A . 41 CYS HB3 1 1 13 9189 1 1 41 CYS N N -1.412 -4.062 2.034 1.00 . A A . 41 CYS N 1 1 13 9190 1 1 41 CYS O O -1.474 -2.082 -0.374 1.00 . A A . 41 CYS O 1 1 13 9191 1 1 41 CYS SG S 1.386 -1.396 0.651 1.00 . A A . 41 CYS SG 1 1 13 9192 1 1 42 LEU C C -2.625 0.956 0.056 1.00 . A A . 42 LEU C 1 1 13 9193 1 1 42 LEU CA C -3.376 -0.280 0.518 1.00 . A A . 42 LEU CA 1 1 13 9194 1 1 42 LEU CB C -4.645 0.139 1.272 1.00 . A A . 42 LEU CB 1 1 13 9195 1 1 42 LEU CD1 C -5.538 -2.160 1.758 1.00 . A A . 42 LEU CD1 1 1 13 9196 1 1 42 LEU CD2 C -7.075 -0.193 1.782 1.00 . A A . 42 LEU CD2 1 1 13 9197 1 1 42 LEU CG C -5.842 -0.807 1.138 1.00 . A A . 42 LEU CG 1 1 13 9198 1 1 42 LEU H H -2.607 -1.043 2.334 1.00 . A A . 42 LEU H 1 1 13 9199 1 1 42 LEU HA H -3.653 -0.864 -0.349 1.00 . A A . 42 LEU HA 1 1 13 9200 1 1 42 LEU HB2 H -4.397 0.218 2.320 1.00 . A A . 42 LEU HB2 1 1 13 9201 1 1 42 LEU HB3 H -4.943 1.117 0.920 1.00 . A A . 42 LEU HB3 1 1 13 9202 1 1 42 LEU HD11 H -5.884 -2.174 2.781 1.00 . A A . 42 LEU HD11 1 1 13 9203 1 1 42 LEU HD12 H -4.473 -2.335 1.736 1.00 . A A . 42 LEU HD12 1 1 13 9204 1 1 42 LEU HD13 H -6.042 -2.934 1.198 1.00 . A A . 42 LEU HD13 1 1 13 9205 1 1 42 LEU HD21 H -7.711 0.225 1.016 1.00 . A A . 42 LEU HD21 1 1 13 9206 1 1 42 LEU HD22 H -6.774 0.586 2.466 1.00 . A A . 42 LEU HD22 1 1 13 9207 1 1 42 LEU HD23 H -7.617 -0.956 2.322 1.00 . A A . 42 LEU HD23 1 1 13 9208 1 1 42 LEU HG H -6.055 -0.962 0.091 1.00 . A A . 42 LEU HG 1 1 13 9209 1 1 42 LEU N N -2.524 -1.109 1.359 1.00 . A A . 42 LEU N 1 1 13 9210 1 1 42 LEU O O -2.106 1.717 0.872 1.00 . A A . 42 LEU O 1 1 13 9211 1 1 43 CYS C C -2.870 3.364 -2.241 1.00 . A A . 43 CYS C 1 1 13 9212 1 1 43 CYS CA C -1.880 2.297 -1.806 1.00 . A A . 43 CYS CA 1 1 13 9213 1 1 43 CYS CB C -1.018 1.859 -2.981 1.00 . A A . 43 CYS CB 1 1 13 9214 1 1 43 CYS H H -3.003 0.512 -1.851 1.00 . A A . 43 CYS H 1 1 13 9215 1 1 43 CYS HA H -1.242 2.708 -1.038 1.00 . A A . 43 CYS HA 1 1 13 9216 1 1 43 CYS HB2 H -1.648 1.464 -3.761 1.00 . A A . 43 CYS HB2 1 1 13 9217 1 1 43 CYS HB3 H -0.479 2.715 -3.361 1.00 . A A . 43 CYS HB3 1 1 13 9218 1 1 43 CYS N N -2.569 1.154 -1.244 1.00 . A A . 43 CYS N 1 1 13 9219 1 1 43 CYS O O -3.958 3.054 -2.727 1.00 . A A . 43 CYS O 1 1 13 9220 1 1 43 CYS SG S 0.203 0.589 -2.543 1.00 . A A . 43 CYS SG 1 1 13 9221 1 1 44 THR C C -2.570 6.756 -3.246 1.00 . A A . 44 THR C 1 1 13 9222 1 1 44 THR CA C -3.338 5.735 -2.419 1.00 . A A . 44 THR CA 1 1 13 9223 1 1 44 THR CB C -3.908 6.426 -1.169 1.00 . A A . 44 THR CB 1 1 13 9224 1 1 44 THR CG2 C -5.310 5.929 -0.859 1.00 . A A . 44 THR CG2 1 1 13 9225 1 1 44 THR H H -1.609 4.797 -1.655 1.00 . A A . 44 THR H 1 1 13 9226 1 1 44 THR HA H -4.162 5.356 -3.004 1.00 . A A . 44 THR HA 1 1 13 9227 1 1 44 THR HB H -3.955 7.489 -1.361 1.00 . A A . 44 THR HB 1 1 13 9228 1 1 44 THR HG1 H -2.149 6.473 -0.264 1.00 . A A . 44 THR HG1 1 1 13 9229 1 1 44 THR HG21 H -5.250 4.989 -0.330 1.00 . A A . 44 THR HG21 1 1 13 9230 1 1 44 THR HG22 H -5.854 5.788 -1.781 1.00 . A A . 44 THR HG22 1 1 13 9231 1 1 44 THR HG23 H -5.823 6.655 -0.245 1.00 . A A . 44 THR HG23 1 1 13 9232 1 1 44 THR N N -2.490 4.616 -2.056 1.00 . A A . 44 THR N 1 1 13 9233 1 1 44 THR O O -1.395 7.022 -2.985 1.00 . A A . 44 THR O 1 1 13 9234 1 1 44 THR OG1 O -3.046 6.190 -0.043 1.00 . A A . 44 THR OG1 1 1 13 9235 1 1 45 LYS C C -3.733 9.132 -5.791 1.00 . A A . 45 LYS C 1 1 13 9236 1 1 45 LYS CA C -2.646 8.335 -5.094 1.00 . A A . 45 LYS CA 1 1 13 9237 1 1 45 LYS CB C -1.710 7.717 -6.141 1.00 . A A . 45 LYS CB 1 1 13 9238 1 1 45 LYS CD C -1.758 7.119 -8.571 1.00 . A A . 45 LYS CD 1 1 13 9239 1 1 45 LYS CE C -2.055 5.983 -9.534 1.00 . A A . 45 LYS CE 1 1 13 9240 1 1 45 LYS CG C -2.409 6.899 -7.214 1.00 . A A . 45 LYS CG 1 1 13 9241 1 1 45 LYS H H -4.183 7.073 -4.376 1.00 . A A . 45 LYS H 1 1 13 9242 1 1 45 LYS HA H -2.077 9.005 -4.467 1.00 . A A . 45 LYS HA 1 1 13 9243 1 1 45 LYS HB2 H -1.166 8.512 -6.629 1.00 . A A . 45 LYS HB2 1 1 13 9244 1 1 45 LYS HB3 H -1.004 7.075 -5.634 1.00 . A A . 45 LYS HB3 1 1 13 9245 1 1 45 LYS HD2 H -2.134 8.039 -8.993 1.00 . A A . 45 LYS HD2 1 1 13 9246 1 1 45 LYS HD3 H -0.689 7.195 -8.436 1.00 . A A . 45 LYS HD3 1 1 13 9247 1 1 45 LYS HE2 H -3.114 5.774 -9.512 1.00 . A A . 45 LYS HE2 1 1 13 9248 1 1 45 LYS HE3 H -1.769 6.288 -10.530 1.00 . A A . 45 LYS HE3 1 1 13 9249 1 1 45 LYS HG2 H -2.346 5.852 -6.958 1.00 . A A . 45 LYS HG2 1 1 13 9250 1 1 45 LYS HG3 H -3.445 7.199 -7.267 1.00 . A A . 45 LYS HG3 1 1 13 9251 1 1 45 LYS HZ1 H -1.299 4.086 -9.972 1.00 . A A . 45 LYS HZ1 1 1 13 9252 1 1 45 LYS HZ2 H -1.758 4.284 -8.358 1.00 . A A . 45 LYS HZ2 1 1 13 9253 1 1 45 LYS HZ3 H -0.323 4.988 -8.920 1.00 . A A . 45 LYS HZ3 1 1 13 9254 1 1 45 LYS N N -3.244 7.327 -4.231 1.00 . A A . 45 LYS N 1 1 13 9255 1 1 45 LYS NZ N -1.310 4.747 -9.172 1.00 . A A . 45 LYS NZ 1 1 13 9256 1 1 45 LYS O O -4.882 8.696 -5.860 1.00 . A A . 45 LYS O 1 1 13 9257 1 1 46 GLU C C -4.548 10.607 -8.416 1.00 . A A . 46 GLU C 1 1 13 9258 1 1 46 GLU CA C -4.300 11.140 -7.007 1.00 . A A . 46 GLU CA 1 1 13 9259 1 1 46 GLU CB C -3.785 12.589 -7.055 1.00 . A A . 46 GLU CB 1 1 13 9260 1 1 46 GLU CD C -1.257 12.567 -6.682 1.00 . A A . 46 GLU CD 1 1 13 9261 1 1 46 GLU CG C -2.397 12.760 -7.674 1.00 . A A . 46 GLU CG 1 1 13 9262 1 1 46 GLU H H -2.422 10.576 -6.223 1.00 . A A . 46 GLU H 1 1 13 9263 1 1 46 GLU HA H -5.233 11.119 -6.462 1.00 . A A . 46 GLU HA 1 1 13 9264 1 1 46 GLU HB2 H -4.479 13.182 -7.630 1.00 . A A . 46 GLU HB2 1 1 13 9265 1 1 46 GLU HB3 H -3.751 12.976 -6.047 1.00 . A A . 46 GLU HB3 1 1 13 9266 1 1 46 GLU HG2 H -2.283 12.038 -8.468 1.00 . A A . 46 GLU HG2 1 1 13 9267 1 1 46 GLU HG3 H -2.327 13.756 -8.088 1.00 . A A . 46 GLU HG3 1 1 13 9268 1 1 46 GLU N N -3.366 10.285 -6.308 1.00 . A A . 46 GLU N 1 1 13 9269 1 1 46 GLU O O -3.653 10.038 -9.045 1.00 . A A . 46 GLU O 1 1 13 9270 1 1 46 GLU OE1 O -1.065 11.431 -6.195 1.00 . A A . 46 GLU OE1 1 1 13 9271 1 1 46 GLU OE2 O -0.557 13.554 -6.385 1.00 . A A . 46 GLU OE2 1 1 13 9272 1 1 47 CYS C C -7.357 11.092 -10.703 1.00 . A A . 47 CYS C 1 1 13 9273 1 1 47 CYS CA C -6.143 10.316 -10.223 1.00 . A A . 47 CYS CA 1 1 13 9274 1 1 47 CYS CB C -6.438 8.812 -10.213 1.00 . A A . 47 CYS CB 1 1 13 9275 1 1 47 CYS H H -6.445 11.233 -8.348 1.00 . A A . 47 CYS H 1 1 13 9276 1 1 47 CYS HA H -5.315 10.507 -10.887 1.00 . A A . 47 CYS HA 1 1 13 9277 1 1 47 CYS HB2 H -6.773 8.514 -11.195 1.00 . A A . 47 CYS HB2 1 1 13 9278 1 1 47 CYS HB3 H -5.530 8.278 -9.972 1.00 . A A . 47 CYS HB3 1 1 13 9279 1 1 47 CYS N N -5.768 10.780 -8.897 1.00 . A A . 47 CYS N 1 1 13 9280 1 1 47 CYS O O -7.820 10.855 -11.831 1.00 . A A . 47 CYS O 1 1 13 9281 1 1 47 CYS OXT O -7.837 11.950 -9.928 1.00 . A A . 47 CYS OXT 1 1 13 9282 1 1 47 CYS SG S -7.715 8.302 -9.017 1.00 . A A . 47 CYS SG 1 1 14 9283 1 1 1 ALA C C -10.044 9.782 -6.702 1.00 . A A . 1 ALA C 1 1 14 9284 1 1 1 ALA CA C -11.031 10.403 -7.687 1.00 . A A . 1 ALA CA 1 1 14 9285 1 1 1 ALA CB C -11.067 11.916 -7.526 1.00 . A A . 1 ALA CB 1 1 14 9286 1 1 1 ALA H1 H -12.461 9.421 -6.546 1.00 . A A . 1 ALA H1 1 1 14 9287 1 1 1 ALA H2 H -12.563 9.101 -8.205 1.00 . A A . 1 ALA H2 1 1 14 9288 1 1 1 ALA H3 H -13.097 10.584 -7.597 1.00 . A A . 1 ALA H3 1 1 14 9289 1 1 1 ALA HA H -10.711 10.179 -8.694 1.00 . A A . 1 ALA HA 1 1 14 9290 1 1 1 ALA HB1 H -10.834 12.385 -8.471 1.00 . A A . 1 ALA HB1 1 1 14 9291 1 1 1 ALA HB2 H -10.340 12.217 -6.786 1.00 . A A . 1 ALA HB2 1 1 14 9292 1 1 1 ALA HB3 H -12.053 12.221 -7.206 1.00 . A A . 1 ALA HB3 1 1 14 9293 1 1 1 ALA N N -12.383 9.837 -7.495 1.00 . A A . 1 ALA N 1 1 14 9294 1 1 1 ALA O O -9.200 10.471 -6.130 1.00 . A A . 1 ALA O 1 1 14 9295 1 1 2 THR C C -9.135 6.310 -6.020 1.00 . A A . 2 THR C 1 1 14 9296 1 1 2 THR CA C -9.277 7.764 -5.584 1.00 . A A . 2 THR CA 1 1 14 9297 1 1 2 THR CB C -9.812 7.815 -4.139 1.00 . A A . 2 THR CB 1 1 14 9298 1 1 2 THR CG2 C -8.761 7.324 -3.153 1.00 . A A . 2 THR CG2 1 1 14 9299 1 1 2 THR H H -10.842 7.969 -6.979 1.00 . A A . 2 THR H 1 1 14 9300 1 1 2 THR HA H -8.307 8.238 -5.611 1.00 . A A . 2 THR HA 1 1 14 9301 1 1 2 THR HB H -10.680 7.175 -4.067 1.00 . A A . 2 THR HB 1 1 14 9302 1 1 2 THR HG1 H -9.562 9.774 -4.205 1.00 . A A . 2 THR HG1 1 1 14 9303 1 1 2 THR HG21 H -7.776 7.532 -3.544 1.00 . A A . 2 THR HG21 1 1 14 9304 1 1 2 THR HG22 H -8.873 6.260 -3.007 1.00 . A A . 2 THR HG22 1 1 14 9305 1 1 2 THR HG23 H -8.888 7.833 -2.208 1.00 . A A . 2 THR HG23 1 1 14 9306 1 1 2 THR N N -10.158 8.474 -6.498 1.00 . A A . 2 THR N 1 1 14 9307 1 1 2 THR O O -10.105 5.549 -5.995 1.00 . A A . 2 THR O 1 1 14 9308 1 1 2 THR OG1 O -10.189 9.158 -3.806 1.00 . A A . 2 THR OG1 1 1 14 9309 1 1 3 CYS C C -6.794 3.843 -5.875 1.00 . A A . 3 CYS C 1 1 14 9310 1 1 3 CYS CA C -7.672 4.578 -6.874 1.00 . A A . 3 CYS CA 1 1 14 9311 1 1 3 CYS CB C -7.012 4.602 -8.255 1.00 . A A . 3 CYS CB 1 1 14 9312 1 1 3 CYS H H -7.202 6.591 -6.427 1.00 . A A . 3 CYS H 1 1 14 9313 1 1 3 CYS HA H -8.618 4.064 -6.948 1.00 . A A . 3 CYS HA 1 1 14 9314 1 1 3 CYS HB2 H -6.189 5.303 -8.242 1.00 . A A . 3 CYS HB2 1 1 14 9315 1 1 3 CYS HB3 H -6.637 3.615 -8.486 1.00 . A A . 3 CYS HB3 1 1 14 9316 1 1 3 CYS N N -7.937 5.934 -6.424 1.00 . A A . 3 CYS N 1 1 14 9317 1 1 3 CYS O O -5.875 4.426 -5.300 1.00 . A A . 3 CYS O 1 1 14 9318 1 1 3 CYS SG S -8.135 5.103 -9.599 1.00 . A A . 3 CYS SG 1 1 14 9319 1 1 4 LYS C C -6.290 0.299 -5.145 1.00 . A A . 4 LYS C 1 1 14 9320 1 1 4 LYS CA C -6.310 1.760 -4.731 1.00 . A A . 4 LYS CA 1 1 14 9321 1 1 4 LYS CB C -6.857 1.893 -3.308 1.00 . A A . 4 LYS CB 1 1 14 9322 1 1 4 LYS CD C -8.758 1.604 -1.705 1.00 . A A . 4 LYS CD 1 1 14 9323 1 1 4 LYS CE C -10.207 1.175 -1.535 1.00 . A A . 4 LYS CE 1 1 14 9324 1 1 4 LYS CG C -8.299 1.451 -3.145 1.00 . A A . 4 LYS CG 1 1 14 9325 1 1 4 LYS H H -7.823 2.149 -6.152 1.00 . A A . 4 LYS H 1 1 14 9326 1 1 4 LYS HA H -5.295 2.129 -4.745 1.00 . A A . 4 LYS HA 1 1 14 9327 1 1 4 LYS HB2 H -6.247 1.297 -2.646 1.00 . A A . 4 LYS HB2 1 1 14 9328 1 1 4 LYS HB3 H -6.787 2.928 -3.007 1.00 . A A . 4 LYS HB3 1 1 14 9329 1 1 4 LYS HD2 H -8.130 0.992 -1.072 1.00 . A A . 4 LYS HD2 1 1 14 9330 1 1 4 LYS HD3 H -8.659 2.641 -1.415 1.00 . A A . 4 LYS HD3 1 1 14 9331 1 1 4 LYS HE2 H -10.291 0.128 -1.787 1.00 . A A . 4 LYS HE2 1 1 14 9332 1 1 4 LYS HE3 H -10.493 1.320 -0.503 1.00 . A A . 4 LYS HE3 1 1 14 9333 1 1 4 LYS HG2 H -8.927 2.057 -3.780 1.00 . A A . 4 LYS HG2 1 1 14 9334 1 1 4 LYS HG3 H -8.384 0.414 -3.433 1.00 . A A . 4 LYS HG3 1 1 14 9335 1 1 4 LYS HZ1 H -11.910 2.346 -1.845 1.00 . A A . 4 LYS HZ1 1 1 14 9336 1 1 4 LYS HZ2 H -11.518 1.347 -3.152 1.00 . A A . 4 LYS HZ2 1 1 14 9337 1 1 4 LYS HZ3 H -10.612 2.744 -2.855 1.00 . A A . 4 LYS HZ3 1 1 14 9338 1 1 4 LYS N N -7.080 2.563 -5.665 1.00 . A A . 4 LYS N 1 1 14 9339 1 1 4 LYS NZ N -11.126 1.958 -2.407 1.00 . A A . 4 LYS NZ 1 1 14 9340 1 1 4 LYS O O -7.286 -0.236 -5.634 1.00 . A A . 4 LYS O 1 1 14 9341 1 1 5 ALA C C -3.638 -2.185 -4.592 1.00 . A A . 5 ALA C 1 1 14 9342 1 1 5 ALA CA C -4.920 -1.723 -5.263 1.00 . A A . 5 ALA CA 1 1 14 9343 1 1 5 ALA CB C -4.833 -1.922 -6.771 1.00 . A A . 5 ALA CB 1 1 14 9344 1 1 5 ALA H H -4.399 0.188 -4.540 1.00 . A A . 5 ALA H 1 1 14 9345 1 1 5 ALA HA H -5.752 -2.298 -4.883 1.00 . A A . 5 ALA HA 1 1 14 9346 1 1 5 ALA HB1 H -5.215 -2.899 -7.028 1.00 . A A . 5 ALA HB1 1 1 14 9347 1 1 5 ALA HB2 H -3.802 -1.845 -7.085 1.00 . A A . 5 ALA HB2 1 1 14 9348 1 1 5 ALA HB3 H -5.418 -1.163 -7.269 1.00 . A A . 5 ALA HB3 1 1 14 9349 1 1 5 ALA N N -5.141 -0.322 -4.937 1.00 . A A . 5 ALA N 1 1 14 9350 1 1 5 ALA O O -2.721 -1.381 -4.400 1.00 . A A . 5 ALA O 1 1 14 9351 1 1 6 GLU C C -1.179 -3.864 -4.448 1.00 . A A . 6 GLU C 1 1 14 9352 1 1 6 GLU CA C -2.399 -3.989 -3.551 1.00 . A A . 6 GLU CA 1 1 14 9353 1 1 6 GLU CB C -2.589 -5.458 -3.157 1.00 . A A . 6 GLU CB 1 1 14 9354 1 1 6 GLU CD C -5.024 -6.143 -3.226 1.00 . A A . 6 GLU CD 1 1 14 9355 1 1 6 GLU CG C -3.852 -5.732 -2.359 1.00 . A A . 6 GLU CG 1 1 14 9356 1 1 6 GLU H H -4.347 -4.049 -4.377 1.00 . A A . 6 GLU H 1 1 14 9357 1 1 6 GLU HA H -2.232 -3.406 -2.658 1.00 . A A . 6 GLU HA 1 1 14 9358 1 1 6 GLU HB2 H -2.617 -6.059 -4.052 1.00 . A A . 6 GLU HB2 1 1 14 9359 1 1 6 GLU HB3 H -1.742 -5.765 -2.560 1.00 . A A . 6 GLU HB3 1 1 14 9360 1 1 6 GLU HG2 H -3.651 -6.525 -1.656 1.00 . A A . 6 GLU HG2 1 1 14 9361 1 1 6 GLU HG3 H -4.120 -4.835 -1.819 1.00 . A A . 6 GLU HG3 1 1 14 9362 1 1 6 GLU N N -3.576 -3.454 -4.214 1.00 . A A . 6 GLU N 1 1 14 9363 1 1 6 GLU O O -1.262 -4.085 -5.657 1.00 . A A . 6 GLU O 1 1 14 9364 1 1 6 GLU OE1 O -5.454 -5.336 -4.073 1.00 . A A . 6 GLU OE1 1 1 14 9365 1 1 6 GLU OE2 O -5.512 -7.283 -3.054 1.00 . A A . 6 GLU OE2 1 1 14 9366 1 1 7 CYS C C 1.507 -4.650 -5.321 1.00 . A A . 7 CYS C 1 1 14 9367 1 1 7 CYS CA C 1.193 -3.351 -4.583 1.00 . A A . 7 CYS CA 1 1 14 9368 1 1 7 CYS CB C 2.345 -2.988 -3.633 1.00 . A A . 7 CYS CB 1 1 14 9369 1 1 7 CYS H H -0.072 -3.338 -2.878 1.00 . A A . 7 CYS H 1 1 14 9370 1 1 7 CYS HA H 1.060 -2.559 -5.304 1.00 . A A . 7 CYS HA 1 1 14 9371 1 1 7 CYS HB2 H 2.031 -2.177 -2.993 1.00 . A A . 7 CYS HB2 1 1 14 9372 1 1 7 CYS HB3 H 2.584 -3.848 -3.024 1.00 . A A . 7 CYS HB3 1 1 14 9373 1 1 7 CYS N N -0.056 -3.504 -3.845 1.00 . A A . 7 CYS N 1 1 14 9374 1 1 7 CYS O O 1.554 -5.718 -4.712 1.00 . A A . 7 CYS O 1 1 14 9375 1 1 7 CYS SG S 3.878 -2.462 -4.480 1.00 . A A . 7 CYS SG 1 1 14 9376 1 1 8 PRO C C 3.148 -6.574 -6.962 1.00 . A A . 8 PRO C 1 1 14 9377 1 1 8 PRO CA C 1.977 -5.752 -7.486 1.00 . A A . 8 PRO CA 1 1 14 9378 1 1 8 PRO CB C 2.316 -5.146 -8.849 1.00 . A A . 8 PRO CB 1 1 14 9379 1 1 8 PRO CD C 1.617 -3.339 -7.450 1.00 . A A . 8 PRO CD 1 1 14 9380 1 1 8 PRO CG C 1.605 -3.838 -8.868 1.00 . A A . 8 PRO CG 1 1 14 9381 1 1 8 PRO HA H 1.108 -6.387 -7.579 1.00 . A A . 8 PRO HA 1 1 14 9382 1 1 8 PRO HB2 H 3.386 -5.017 -8.933 1.00 . A A . 8 PRO HB2 1 1 14 9383 1 1 8 PRO HB3 H 1.964 -5.797 -9.635 1.00 . A A . 8 PRO HB3 1 1 14 9384 1 1 8 PRO HD2 H 2.481 -2.714 -7.277 1.00 . A A . 8 PRO HD2 1 1 14 9385 1 1 8 PRO HD3 H 0.708 -2.798 -7.232 1.00 . A A . 8 PRO HD3 1 1 14 9386 1 1 8 PRO HG2 H 2.126 -3.146 -9.513 1.00 . A A . 8 PRO HG2 1 1 14 9387 1 1 8 PRO HG3 H 0.589 -3.977 -9.208 1.00 . A A . 8 PRO HG3 1 1 14 9388 1 1 8 PRO N N 1.696 -4.576 -6.652 1.00 . A A . 8 PRO N 1 1 14 9389 1 1 8 PRO O O 3.118 -7.803 -6.974 1.00 . A A . 8 PRO O 1 1 14 9390 1 1 9 THR C C 5.221 -6.725 -4.445 1.00 . A A . 9 THR C 1 1 14 9391 1 1 9 THR CA C 5.348 -6.543 -5.954 1.00 . A A . 9 THR CA 1 1 14 9392 1 1 9 THR CB C 6.614 -5.727 -6.263 1.00 . A A . 9 THR CB 1 1 14 9393 1 1 9 THR CG2 C 6.954 -5.788 -7.745 1.00 . A A . 9 THR CG2 1 1 14 9394 1 1 9 THR H H 4.133 -4.909 -6.501 1.00 . A A . 9 THR H 1 1 14 9395 1 1 9 THR HA H 5.441 -7.511 -6.423 1.00 . A A . 9 THR HA 1 1 14 9396 1 1 9 THR HB H 7.439 -6.141 -5.701 1.00 . A A . 9 THR HB 1 1 14 9397 1 1 9 THR HG1 H 5.925 -4.344 -5.028 1.00 . A A . 9 THR HG1 1 1 14 9398 1 1 9 THR HG21 H 7.757 -6.493 -7.902 1.00 . A A . 9 THR HG21 1 1 14 9399 1 1 9 THR HG22 H 7.262 -4.810 -8.085 1.00 . A A . 9 THR HG22 1 1 14 9400 1 1 9 THR HG23 H 6.083 -6.105 -8.301 1.00 . A A . 9 THR HG23 1 1 14 9401 1 1 9 THR N N 4.173 -5.886 -6.494 1.00 . A A . 9 THR N 1 1 14 9402 1 1 9 THR O O 6.144 -6.407 -3.696 1.00 . A A . 9 THR O 1 1 14 9403 1 1 9 THR OG1 O 6.414 -4.362 -5.868 1.00 . A A . 9 THR OG1 1 1 14 9404 1 1 10 TRP C C 2.983 -8.645 -2.331 1.00 . A A . 10 TRP C 1 1 14 9405 1 1 10 TRP CA C 3.845 -7.417 -2.581 1.00 . A A . 10 TRP CA 1 1 14 9406 1 1 10 TRP CB C 3.158 -6.189 -1.976 1.00 . A A . 10 TRP CB 1 1 14 9407 1 1 10 TRP CD1 C 2.173 -6.825 0.305 1.00 . A A . 10 TRP CD1 1 1 14 9408 1 1 10 TRP CD2 C 4.029 -5.579 0.412 1.00 . A A . 10 TRP CD2 1 1 14 9409 1 1 10 TRP CE2 C 3.607 -5.862 1.724 1.00 . A A . 10 TRP CE2 1 1 14 9410 1 1 10 TRP CE3 C 5.175 -4.803 0.224 1.00 . A A . 10 TRP CE3 1 1 14 9411 1 1 10 TRP CG C 3.110 -6.214 -0.479 1.00 . A A . 10 TRP CG 1 1 14 9412 1 1 10 TRP CH2 C 5.411 -4.636 2.626 1.00 . A A . 10 TRP CH2 1 1 14 9413 1 1 10 TRP CZ2 C 4.295 -5.394 2.842 1.00 . A A . 10 TRP CZ2 1 1 14 9414 1 1 10 TRP CZ3 C 5.852 -4.339 1.332 1.00 . A A . 10 TRP CZ3 1 1 14 9415 1 1 10 TRP H H 3.362 -7.446 -4.639 1.00 . A A . 10 TRP H 1 1 14 9416 1 1 10 TRP HA H 4.802 -7.555 -2.103 1.00 . A A . 10 TRP HA 1 1 14 9417 1 1 10 TRP HB2 H 3.693 -5.300 -2.277 1.00 . A A . 10 TRP HB2 1 1 14 9418 1 1 10 TRP HB3 H 2.143 -6.135 -2.343 1.00 . A A . 10 TRP HB3 1 1 14 9419 1 1 10 TRP HD1 H 1.332 -7.388 -0.078 1.00 . A A . 10 TRP HD1 1 1 14 9420 1 1 10 TRP HE1 H 1.957 -6.985 2.393 1.00 . A A . 10 TRP HE1 1 1 14 9421 1 1 10 TRP HE3 H 5.531 -4.563 -0.767 1.00 . A A . 10 TRP HE3 1 1 14 9422 1 1 10 TRP HH2 H 5.972 -4.249 3.463 1.00 . A A . 10 TRP HH2 1 1 14 9423 1 1 10 TRP HZ2 H 3.974 -5.611 3.848 1.00 . A A . 10 TRP HZ2 1 1 14 9424 1 1 10 TRP HZ3 H 6.736 -3.732 1.206 1.00 . A A . 10 TRP HZ3 1 1 14 9425 1 1 10 TRP N N 4.075 -7.218 -4.000 1.00 . A A . 10 TRP N 1 1 14 9426 1 1 10 TRP NE1 N 2.473 -6.631 1.633 1.00 . A A . 10 TRP NE1 1 1 14 9427 1 1 10 TRP O O 1.874 -8.753 -2.849 1.00 . A A . 10 TRP O 1 1 14 9428 1 1 11 ASP C C 3.231 -11.176 0.253 1.00 . A A . 11 ASP C 1 1 14 9429 1 1 11 ASP CA C 2.788 -10.761 -1.143 1.00 . A A . 11 ASP CA 1 1 14 9430 1 1 11 ASP CB C 3.043 -11.884 -2.154 1.00 . A A . 11 ASP CB 1 1 14 9431 1 1 11 ASP CG C 2.141 -13.084 -1.920 1.00 . A A . 11 ASP CG 1 1 14 9432 1 1 11 ASP H H 4.379 -9.378 -1.119 1.00 . A A . 11 ASP H 1 1 14 9433 1 1 11 ASP HA H 1.731 -10.535 -1.120 1.00 . A A . 11 ASP HA 1 1 14 9434 1 1 11 ASP HB2 H 2.863 -11.510 -3.152 1.00 . A A . 11 ASP HB2 1 1 14 9435 1 1 11 ASP HB3 H 4.070 -12.207 -2.075 1.00 . A A . 11 ASP HB3 1 1 14 9436 1 1 11 ASP N N 3.497 -9.544 -1.510 1.00 . A A . 11 ASP N 1 1 14 9437 1 1 11 ASP O O 3.845 -12.221 0.457 1.00 . A A . 11 ASP O 1 1 14 9438 1 1 11 ASP OD1 O 0.904 -12.897 -1.861 1.00 . A A . 11 ASP OD1 1 1 14 9439 1 1 11 ASP OD2 O 2.666 -14.212 -1.809 1.00 . A A . 11 ASP OD2 1 1 14 9440 1 1 12 SER C C 2.395 -9.799 3.537 1.00 . A A . 12 SER C 1 1 14 9441 1 1 12 SER CA C 3.335 -10.543 2.595 1.00 . A A . 12 SER CA 1 1 14 9442 1 1 12 SER CB C 4.781 -10.091 2.826 1.00 . A A . 12 SER CB 1 1 14 9443 1 1 12 SER H H 2.488 -9.480 0.985 1.00 . A A . 12 SER H 1 1 14 9444 1 1 12 SER HA H 3.260 -11.603 2.789 1.00 . A A . 12 SER HA 1 1 14 9445 1 1 12 SER HB2 H 4.859 -9.031 2.633 1.00 . A A . 12 SER HB2 1 1 14 9446 1 1 12 SER HB3 H 5.059 -10.291 3.850 1.00 . A A . 12 SER HB3 1 1 14 9447 1 1 12 SER HG H 5.181 -11.423 1.439 1.00 . A A . 12 SER HG 1 1 14 9448 1 1 12 SER N N 2.951 -10.310 1.214 1.00 . A A . 12 SER N 1 1 14 9449 1 1 12 SER O O 1.573 -8.989 3.097 1.00 . A A . 12 SER O 1 1 14 9450 1 1 12 SER OG O 5.675 -10.777 1.967 1.00 . A A . 12 SER OG 1 1 14 9451 1 1 13 VAL C C 2.150 -8.022 6.109 1.00 . A A . 13 VAL C 1 1 14 9452 1 1 13 VAL CA C 1.675 -9.443 5.827 1.00 . A A . 13 VAL CA 1 1 14 9453 1 1 13 VAL CB C 1.674 -10.255 7.143 1.00 . A A . 13 VAL CB 1 1 14 9454 1 1 13 VAL CG1 C 0.793 -9.597 8.194 1.00 . A A . 13 VAL CG1 1 1 14 9455 1 1 13 VAL CG2 C 1.222 -11.685 6.886 1.00 . A A . 13 VAL CG2 1 1 14 9456 1 1 13 VAL H H 3.188 -10.730 5.113 1.00 . A A . 13 VAL H 1 1 14 9457 1 1 13 VAL HA H 0.666 -9.409 5.445 1.00 . A A . 13 VAL HA 1 1 14 9458 1 1 13 VAL HB H 2.684 -10.285 7.523 1.00 . A A . 13 VAL HB 1 1 14 9459 1 1 13 VAL HG11 H 1.239 -8.663 8.504 1.00 . A A . 13 VAL HG11 1 1 14 9460 1 1 13 VAL HG12 H 0.701 -10.252 9.048 1.00 . A A . 13 VAL HG12 1 1 14 9461 1 1 13 VAL HG13 H -0.185 -9.408 7.778 1.00 . A A . 13 VAL HG13 1 1 14 9462 1 1 13 VAL HG21 H 1.749 -12.081 6.031 1.00 . A A . 13 VAL HG21 1 1 14 9463 1 1 13 VAL HG22 H 0.160 -11.698 6.691 1.00 . A A . 13 VAL HG22 1 1 14 9464 1 1 13 VAL HG23 H 1.436 -12.292 7.754 1.00 . A A . 13 VAL HG23 1 1 14 9465 1 1 13 VAL N N 2.517 -10.077 4.826 1.00 . A A . 13 VAL N 1 1 14 9466 1 1 13 VAL O O 3.278 -7.804 6.550 1.00 . A A . 13 VAL O 1 1 14 9467 1 1 14 CYS C C 1.518 -5.337 7.554 1.00 . A A . 14 CYS C 1 1 14 9468 1 1 14 CYS CA C 1.589 -5.657 6.064 1.00 . A A . 14 CYS CA 1 1 14 9469 1 1 14 CYS CB C 0.605 -4.781 5.281 1.00 . A A . 14 CYS CB 1 1 14 9470 1 1 14 CYS H H 0.394 -7.303 5.488 1.00 . A A . 14 CYS H 1 1 14 9471 1 1 14 CYS HA H 2.592 -5.474 5.709 1.00 . A A . 14 CYS HA 1 1 14 9472 1 1 14 CYS HB2 H 0.539 -5.149 4.269 1.00 . A A . 14 CYS HB2 1 1 14 9473 1 1 14 CYS HB3 H -0.369 -4.852 5.744 1.00 . A A . 14 CYS HB3 1 1 14 9474 1 1 14 CYS N N 1.278 -7.061 5.844 1.00 . A A . 14 CYS N 1 1 14 9475 1 1 14 CYS O O 0.436 -5.136 8.108 1.00 . A A . 14 CYS O 1 1 14 9476 1 1 14 CYS SG S 1.043 -3.014 5.190 1.00 . A A . 14 CYS SG 1 1 14 9477 1 1 15 ILE C C 3.063 -3.548 9.845 1.00 . A A . 15 ILE C 1 1 14 9478 1 1 15 ILE CA C 2.726 -5.015 9.628 1.00 . A A . 15 ILE CA 1 1 14 9479 1 1 15 ILE CB C 3.773 -5.898 10.342 1.00 . A A . 15 ILE CB 1 1 14 9480 1 1 15 ILE CD1 C 4.520 -8.318 10.661 1.00 . A A . 15 ILE CD1 1 1 14 9481 1 1 15 ILE CG1 C 3.475 -7.380 10.093 1.00 . A A . 15 ILE CG1 1 1 14 9482 1 1 15 ILE CG2 C 3.794 -5.599 11.837 1.00 . A A . 15 ILE CG2 1 1 14 9483 1 1 15 ILE H H 3.500 -5.482 7.715 1.00 . A A . 15 ILE H 1 1 14 9484 1 1 15 ILE HA H 1.753 -5.221 10.052 1.00 . A A . 15 ILE HA 1 1 14 9485 1 1 15 ILE HB H 4.746 -5.660 9.939 1.00 . A A . 15 ILE HB 1 1 14 9486 1 1 15 ILE HD11 H 4.983 -8.870 9.856 1.00 . A A . 15 ILE HD11 1 1 14 9487 1 1 15 ILE HD12 H 4.051 -9.006 11.347 1.00 . A A . 15 ILE HD12 1 1 14 9488 1 1 15 ILE HD13 H 5.272 -7.745 11.183 1.00 . A A . 15 ILE HD13 1 1 14 9489 1 1 15 ILE HG12 H 2.527 -7.630 10.545 1.00 . A A . 15 ILE HG12 1 1 14 9490 1 1 15 ILE HG13 H 3.417 -7.553 9.028 1.00 . A A . 15 ILE HG13 1 1 14 9491 1 1 15 ILE HG21 H 3.506 -6.484 12.385 1.00 . A A . 15 ILE HG21 1 1 14 9492 1 1 15 ILE HG22 H 3.100 -4.800 12.054 1.00 . A A . 15 ILE HG22 1 1 14 9493 1 1 15 ILE HG23 H 4.790 -5.301 12.131 1.00 . A A . 15 ILE HG23 1 1 14 9494 1 1 15 ILE N N 2.670 -5.303 8.203 1.00 . A A . 15 ILE N 1 1 14 9495 1 1 15 ILE O O 2.342 -2.827 10.533 1.00 . A A . 15 ILE O 1 1 14 9496 1 1 16 ASN C C 4.142 -0.979 8.068 1.00 . A A . 16 ASN C 1 1 14 9497 1 1 16 ASN CA C 4.570 -1.722 9.328 1.00 . A A . 16 ASN CA 1 1 14 9498 1 1 16 ASN CB C 6.087 -1.634 9.536 1.00 . A A . 16 ASN CB 1 1 14 9499 1 1 16 ASN CG C 6.546 -0.248 9.956 1.00 . A A . 16 ASN CG 1 1 14 9500 1 1 16 ASN H H 4.666 -3.725 8.676 1.00 . A A . 16 ASN H 1 1 14 9501 1 1 16 ASN HA H 4.069 -1.283 10.179 1.00 . A A . 16 ASN HA 1 1 14 9502 1 1 16 ASN HB2 H 6.379 -2.335 10.303 1.00 . A A . 16 ASN HB2 1 1 14 9503 1 1 16 ASN HB3 H 6.584 -1.893 8.612 1.00 . A A . 16 ASN HB3 1 1 14 9504 1 1 16 ASN HD21 H 7.028 -0.927 11.760 1.00 . A A . 16 ASN HD21 1 1 14 9505 1 1 16 ASN HD22 H 7.300 0.759 11.492 1.00 . A A . 16 ASN HD22 1 1 14 9506 1 1 16 ASN N N 4.148 -3.108 9.229 1.00 . A A . 16 ASN N 1 1 14 9507 1 1 16 ASN ND2 N 7.007 -0.127 11.192 1.00 . A A . 16 ASN ND2 1 1 14 9508 1 1 16 ASN O O 4.191 -1.534 6.969 1.00 . A A . 16 ASN O 1 1 14 9509 1 1 16 ASN OD1 O 6.485 0.706 9.183 1.00 . A A . 16 ASN OD1 1 1 14 9510 1 1 17 LYS C C 4.352 1.442 6.154 1.00 . A A . 17 LYS C 1 1 14 9511 1 1 17 LYS CA C 3.220 1.061 7.114 1.00 . A A . 17 LYS CA 1 1 14 9512 1 1 17 LYS CB C 2.529 2.326 7.632 1.00 . A A . 17 LYS CB 1 1 14 9513 1 1 17 LYS CD C 1.051 4.303 7.140 1.00 . A A . 17 LYS CD 1 1 14 9514 1 1 17 LYS CE C -0.028 4.856 6.220 1.00 . A A . 17 LYS CE 1 1 14 9515 1 1 17 LYS CG C 1.646 3.011 6.598 1.00 . A A . 17 LYS CG 1 1 14 9516 1 1 17 LYS H H 3.656 0.630 9.138 1.00 . A A . 17 LYS H 1 1 14 9517 1 1 17 LYS HA H 2.497 0.472 6.572 1.00 . A A . 17 LYS HA 1 1 14 9518 1 1 17 LYS HB2 H 1.914 2.064 8.480 1.00 . A A . 17 LYS HB2 1 1 14 9519 1 1 17 LYS HB3 H 3.283 3.030 7.951 1.00 . A A . 17 LYS HB3 1 1 14 9520 1 1 17 LYS HD2 H 0.617 4.108 8.109 1.00 . A A . 17 LYS HD2 1 1 14 9521 1 1 17 LYS HD3 H 1.839 5.036 7.238 1.00 . A A . 17 LYS HD3 1 1 14 9522 1 1 17 LYS HE2 H -0.840 4.146 6.172 1.00 . A A . 17 LYS HE2 1 1 14 9523 1 1 17 LYS HE3 H -0.390 5.787 6.633 1.00 . A A . 17 LYS HE3 1 1 14 9524 1 1 17 LYS HG2 H 2.240 3.238 5.726 1.00 . A A . 17 LYS HG2 1 1 14 9525 1 1 17 LYS HG3 H 0.843 2.342 6.325 1.00 . A A . 17 LYS HG3 1 1 14 9526 1 1 17 LYS HZ1 H 1.431 5.510 4.872 1.00 . A A . 17 LYS HZ1 1 1 14 9527 1 1 17 LYS HZ2 H -0.153 5.768 4.336 1.00 . A A . 17 LYS HZ2 1 1 14 9528 1 1 17 LYS HZ3 H 0.509 4.209 4.306 1.00 . A A . 17 LYS HZ3 1 1 14 9529 1 1 17 LYS N N 3.694 0.256 8.234 1.00 . A A . 17 LYS N 1 1 14 9530 1 1 17 LYS NZ N 0.477 5.101 4.846 1.00 . A A . 17 LYS NZ 1 1 14 9531 1 1 17 LYS O O 4.135 1.525 4.947 1.00 . A A . 17 LYS O 1 1 14 9532 1 1 18 LYS C C 6.943 1.158 4.683 1.00 . A A . 18 LYS C 1 1 14 9533 1 1 18 LYS CA C 6.704 2.092 5.883 1.00 . A A . 18 LYS CA 1 1 14 9534 1 1 18 LYS CB C 7.968 2.193 6.746 1.00 . A A . 18 LYS CB 1 1 14 9535 1 1 18 LYS CD C 10.408 2.815 6.882 1.00 . A A . 18 LYS CD 1 1 14 9536 1 1 18 LYS CE C 10.854 1.449 7.382 1.00 . A A . 18 LYS CE 1 1 14 9537 1 1 18 LYS CG C 9.180 2.717 5.989 1.00 . A A . 18 LYS CG 1 1 14 9538 1 1 18 LYS H H 5.652 1.616 7.670 1.00 . A A . 18 LYS H 1 1 14 9539 1 1 18 LYS HA H 6.484 3.076 5.495 1.00 . A A . 18 LYS HA 1 1 14 9540 1 1 18 LYS HB2 H 7.773 2.857 7.575 1.00 . A A . 18 LYS HB2 1 1 14 9541 1 1 18 LYS HB3 H 8.207 1.212 7.130 1.00 . A A . 18 LYS HB3 1 1 14 9542 1 1 18 LYS HD2 H 11.215 3.260 6.319 1.00 . A A . 18 LYS HD2 1 1 14 9543 1 1 18 LYS HD3 H 10.173 3.440 7.731 1.00 . A A . 18 LYS HD3 1 1 14 9544 1 1 18 LYS HE2 H 10.060 1.021 7.975 1.00 . A A . 18 LYS HE2 1 1 14 9545 1 1 18 LYS HE3 H 11.049 0.814 6.530 1.00 . A A . 18 LYS HE3 1 1 14 9546 1 1 18 LYS HG2 H 9.397 2.046 5.171 1.00 . A A . 18 LYS HG2 1 1 14 9547 1 1 18 LYS HG3 H 8.951 3.698 5.599 1.00 . A A . 18 LYS HG3 1 1 14 9548 1 1 18 LYS HZ1 H 12.333 0.599 8.587 1.00 . A A . 18 LYS HZ1 1 1 14 9549 1 1 18 LYS HZ2 H 11.935 2.187 9.010 1.00 . A A . 18 LYS HZ2 1 1 14 9550 1 1 18 LYS HZ3 H 12.880 1.889 7.640 1.00 . A A . 18 LYS HZ3 1 1 14 9551 1 1 18 LYS N N 5.547 1.690 6.696 1.00 . A A . 18 LYS N 1 1 14 9552 1 1 18 LYS NZ N 12.086 1.537 8.213 1.00 . A A . 18 LYS NZ 1 1 14 9553 1 1 18 LYS O O 6.982 1.633 3.547 1.00 . A A . 18 LYS O 1 1 14 9554 1 1 19 PRO C C 6.268 -1.004 2.706 1.00 . A A . 19 PRO C 1 1 14 9555 1 1 19 PRO CA C 7.331 -1.124 3.793 1.00 . A A . 19 PRO CA 1 1 14 9556 1 1 19 PRO CB C 7.221 -2.487 4.481 1.00 . A A . 19 PRO CB 1 1 14 9557 1 1 19 PRO CD C 7.094 -0.859 6.202 1.00 . A A . 19 PRO CD 1 1 14 9558 1 1 19 PRO CG C 7.631 -2.224 5.882 1.00 . A A . 19 PRO CG 1 1 14 9559 1 1 19 PRO HA H 8.313 -1.010 3.358 1.00 . A A . 19 PRO HA 1 1 14 9560 1 1 19 PRO HB2 H 6.200 -2.837 4.428 1.00 . A A . 19 PRO HB2 1 1 14 9561 1 1 19 PRO HB3 H 7.875 -3.199 4.001 1.00 . A A . 19 PRO HB3 1 1 14 9562 1 1 19 PRO HD2 H 6.089 -0.930 6.591 1.00 . A A . 19 PRO HD2 1 1 14 9563 1 1 19 PRO HD3 H 7.739 -0.355 6.907 1.00 . A A . 19 PRO HD3 1 1 14 9564 1 1 19 PRO HG2 H 7.198 -2.964 6.539 1.00 . A A . 19 PRO HG2 1 1 14 9565 1 1 19 PRO HG3 H 8.708 -2.232 5.960 1.00 . A A . 19 PRO HG3 1 1 14 9566 1 1 19 PRO N N 7.106 -0.172 4.895 1.00 . A A . 19 PRO N 1 1 14 9567 1 1 19 PRO O O 6.574 -1.005 1.509 1.00 . A A . 19 PRO O 1 1 14 9568 1 1 20 CYS C C 4.020 0.519 1.406 1.00 . A A . 20 CYS C 1 1 14 9569 1 1 20 CYS CA C 3.897 -0.763 2.226 1.00 . A A . 20 CYS CA 1 1 14 9570 1 1 20 CYS CB C 2.583 -0.773 3.016 1.00 . A A . 20 CYS CB 1 1 14 9571 1 1 20 CYS H H 4.851 -0.887 4.105 1.00 . A A . 20 CYS H 1 1 14 9572 1 1 20 CYS HA H 3.916 -1.611 1.556 1.00 . A A . 20 CYS HA 1 1 14 9573 1 1 20 CYS HB2 H 2.541 -1.670 3.614 1.00 . A A . 20 CYS HB2 1 1 14 9574 1 1 20 CYS HB3 H 2.561 0.088 3.669 1.00 . A A . 20 CYS HB3 1 1 14 9575 1 1 20 CYS N N 5.020 -0.891 3.139 1.00 . A A . 20 CYS N 1 1 14 9576 1 1 20 CYS O O 3.957 0.489 0.176 1.00 . A A . 20 CYS O 1 1 14 9577 1 1 20 CYS SG S 1.079 -0.728 1.990 1.00 . A A . 20 CYS SG 1 1 14 9578 1 1 21 VAL C C 5.532 2.898 0.440 1.00 . A A . 21 VAL C 1 1 14 9579 1 1 21 VAL CA C 4.372 2.932 1.432 1.00 . A A . 21 VAL CA 1 1 14 9580 1 1 21 VAL CB C 4.595 4.074 2.450 1.00 . A A . 21 VAL CB 1 1 14 9581 1 1 21 VAL CG1 C 4.699 5.419 1.748 1.00 . A A . 21 VAL CG1 1 1 14 9582 1 1 21 VAL CG2 C 3.477 4.101 3.477 1.00 . A A . 21 VAL CG2 1 1 14 9583 1 1 21 VAL H H 4.282 1.595 3.075 1.00 . A A . 21 VAL H 1 1 14 9584 1 1 21 VAL HA H 3.458 3.135 0.889 1.00 . A A . 21 VAL HA 1 1 14 9585 1 1 21 VAL HB H 5.525 3.890 2.968 1.00 . A A . 21 VAL HB 1 1 14 9586 1 1 21 VAL HG11 H 3.717 5.863 1.673 1.00 . A A . 21 VAL HG11 1 1 14 9587 1 1 21 VAL HG12 H 5.107 5.278 0.758 1.00 . A A . 21 VAL HG12 1 1 14 9588 1 1 21 VAL HG13 H 5.347 6.072 2.314 1.00 . A A . 21 VAL HG13 1 1 14 9589 1 1 21 VAL HG21 H 2.854 4.967 3.307 1.00 . A A . 21 VAL HG21 1 1 14 9590 1 1 21 VAL HG22 H 3.900 4.151 4.469 1.00 . A A . 21 VAL HG22 1 1 14 9591 1 1 21 VAL HG23 H 2.881 3.205 3.384 1.00 . A A . 21 VAL HG23 1 1 14 9592 1 1 21 VAL N N 4.222 1.641 2.094 1.00 . A A . 21 VAL N 1 1 14 9593 1 1 21 VAL O O 5.448 3.472 -0.643 1.00 . A A . 21 VAL O 1 1 14 9594 1 1 22 ALA C C 7.400 1.396 -1.365 1.00 . A A . 22 ALA C 1 1 14 9595 1 1 22 ALA CA C 7.773 2.093 -0.059 1.00 . A A . 22 ALA CA 1 1 14 9596 1 1 22 ALA CB C 8.890 1.341 0.648 1.00 . A A . 22 ALA CB 1 1 14 9597 1 1 22 ALA H H 6.613 1.762 1.686 1.00 . A A . 22 ALA H 1 1 14 9598 1 1 22 ALA HA H 8.125 3.091 -0.282 1.00 . A A . 22 ALA HA 1 1 14 9599 1 1 22 ALA HB1 H 9.518 2.042 1.177 1.00 . A A . 22 ALA HB1 1 1 14 9600 1 1 22 ALA HB2 H 9.481 0.806 -0.080 1.00 . A A . 22 ALA HB2 1 1 14 9601 1 1 22 ALA HB3 H 8.463 0.640 1.350 1.00 . A A . 22 ALA HB3 1 1 14 9602 1 1 22 ALA N N 6.608 2.211 0.809 1.00 . A A . 22 ALA N 1 1 14 9603 1 1 22 ALA O O 7.739 1.874 -2.455 1.00 . A A . 22 ALA O 1 1 14 9604 1 1 23 CYS C C 5.339 0.384 -3.278 1.00 . A A . 23 CYS C 1 1 14 9605 1 1 23 CYS CA C 6.244 -0.480 -2.412 1.00 . A A . 23 CYS CA 1 1 14 9606 1 1 23 CYS CB C 5.486 -1.738 -1.970 1.00 . A A . 23 CYS CB 1 1 14 9607 1 1 23 CYS H H 6.434 -0.036 -0.348 1.00 . A A . 23 CYS H 1 1 14 9608 1 1 23 CYS HA H 7.116 -0.767 -2.981 1.00 . A A . 23 CYS HA 1 1 14 9609 1 1 23 CYS HB2 H 5.977 -2.157 -1.107 1.00 . A A . 23 CYS HB2 1 1 14 9610 1 1 23 CYS HB3 H 4.477 -1.461 -1.700 1.00 . A A . 23 CYS HB3 1 1 14 9611 1 1 23 CYS N N 6.684 0.280 -1.247 1.00 . A A . 23 CYS N 1 1 14 9612 1 1 23 CYS O O 5.479 0.433 -4.501 1.00 . A A . 23 CYS O 1 1 14 9613 1 1 23 CYS SG S 5.379 -3.051 -3.240 1.00 . A A . 23 CYS SG 1 1 14 9614 1 1 24 CYS C C 4.123 3.091 -4.002 1.00 . A A . 24 CYS C 1 1 14 9615 1 1 24 CYS CA C 3.453 1.920 -3.290 1.00 . A A . 24 CYS CA 1 1 14 9616 1 1 24 CYS CB C 2.440 2.426 -2.271 1.00 . A A . 24 CYS CB 1 1 14 9617 1 1 24 CYS H H 4.358 0.958 -1.643 1.00 . A A . 24 CYS H 1 1 14 9618 1 1 24 CYS HA H 2.933 1.325 -4.024 1.00 . A A . 24 CYS HA 1 1 14 9619 1 1 24 CYS HB2 H 2.959 2.966 -1.492 1.00 . A A . 24 CYS HB2 1 1 14 9620 1 1 24 CYS HB3 H 1.740 3.086 -2.758 1.00 . A A . 24 CYS HB3 1 1 14 9621 1 1 24 CYS N N 4.411 1.056 -2.622 1.00 . A A . 24 CYS N 1 1 14 9622 1 1 24 CYS O O 3.811 3.371 -5.156 1.00 . A A . 24 CYS O 1 1 14 9623 1 1 24 CYS SG S 1.494 1.087 -1.487 1.00 . A A . 24 CYS SG 1 1 14 9624 1 1 25 LYS C C 6.494 4.522 -5.162 1.00 . A A . 25 LYS C 1 1 14 9625 1 1 25 LYS CA C 5.721 4.920 -3.912 1.00 . A A . 25 LYS CA 1 1 14 9626 1 1 25 LYS CB C 6.660 5.580 -2.902 1.00 . A A . 25 LYS CB 1 1 14 9627 1 1 25 LYS CD C 6.900 7.047 -0.869 1.00 . A A . 25 LYS CD 1 1 14 9628 1 1 25 LYS CE C 7.780 6.049 -0.133 1.00 . A A . 25 LYS CE 1 1 14 9629 1 1 25 LYS CG C 5.931 6.352 -1.813 1.00 . A A . 25 LYS CG 1 1 14 9630 1 1 25 LYS H H 5.242 3.512 -2.396 1.00 . A A . 25 LYS H 1 1 14 9631 1 1 25 LYS HA H 4.965 5.637 -4.196 1.00 . A A . 25 LYS HA 1 1 14 9632 1 1 25 LYS HB2 H 7.260 4.815 -2.431 1.00 . A A . 25 LYS HB2 1 1 14 9633 1 1 25 LYS HB3 H 7.310 6.265 -3.425 1.00 . A A . 25 LYS HB3 1 1 14 9634 1 1 25 LYS HD2 H 7.529 7.712 -1.441 1.00 . A A . 25 LYS HD2 1 1 14 9635 1 1 25 LYS HD3 H 6.335 7.617 -0.146 1.00 . A A . 25 LYS HD3 1 1 14 9636 1 1 25 LYS HE2 H 7.148 5.349 0.391 1.00 . A A . 25 LYS HE2 1 1 14 9637 1 1 25 LYS HE3 H 8.383 5.519 -0.856 1.00 . A A . 25 LYS HE3 1 1 14 9638 1 1 25 LYS HG2 H 5.300 7.097 -2.275 1.00 . A A . 25 LYS HG2 1 1 14 9639 1 1 25 LYS HG3 H 5.321 5.664 -1.246 1.00 . A A . 25 LYS HG3 1 1 14 9640 1 1 25 LYS HZ1 H 9.665 6.653 0.532 1.00 . A A . 25 LYS HZ1 1 1 14 9641 1 1 25 LYS HZ2 H 8.589 6.267 1.779 1.00 . A A . 25 LYS HZ2 1 1 14 9642 1 1 25 LYS HZ3 H 8.418 7.724 0.937 1.00 . A A . 25 LYS HZ3 1 1 14 9643 1 1 25 LYS N N 5.033 3.776 -3.320 1.00 . A A . 25 LYS N 1 1 14 9644 1 1 25 LYS NZ N 8.676 6.720 0.847 1.00 . A A . 25 LYS NZ 1 1 14 9645 1 1 25 LYS O O 6.419 5.205 -6.183 1.00 . A A . 25 LYS O 1 1 14 9646 1 1 26 LYS C C 7.057 2.480 -7.359 1.00 . A A . 26 LYS C 1 1 14 9647 1 1 26 LYS CA C 7.994 2.958 -6.245 1.00 . A A . 26 LYS CA 1 1 14 9648 1 1 26 LYS CB C 8.992 1.860 -5.856 1.00 . A A . 26 LYS CB 1 1 14 9649 1 1 26 LYS CD C 9.393 -0.502 -5.117 1.00 . A A . 26 LYS CD 1 1 14 9650 1 1 26 LYS CE C 8.760 -1.870 -4.947 1.00 . A A . 26 LYS CE 1 1 14 9651 1 1 26 LYS CG C 8.350 0.543 -5.470 1.00 . A A . 26 LYS CG 1 1 14 9652 1 1 26 LYS H H 7.248 2.898 -4.257 1.00 . A A . 26 LYS H 1 1 14 9653 1 1 26 LYS HA H 8.547 3.809 -6.616 1.00 . A A . 26 LYS HA 1 1 14 9654 1 1 26 LYS HB2 H 9.651 1.680 -6.692 1.00 . A A . 26 LYS HB2 1 1 14 9655 1 1 26 LYS HB3 H 9.578 2.208 -5.018 1.00 . A A . 26 LYS HB3 1 1 14 9656 1 1 26 LYS HD2 H 10.126 -0.550 -5.908 1.00 . A A . 26 LYS HD2 1 1 14 9657 1 1 26 LYS HD3 H 9.874 -0.219 -4.192 1.00 . A A . 26 LYS HD3 1 1 14 9658 1 1 26 LYS HE2 H 9.536 -2.590 -4.732 1.00 . A A . 26 LYS HE2 1 1 14 9659 1 1 26 LYS HE3 H 8.064 -1.833 -4.121 1.00 . A A . 26 LYS HE3 1 1 14 9660 1 1 26 LYS HG2 H 7.711 0.702 -4.614 1.00 . A A . 26 LYS HG2 1 1 14 9661 1 1 26 LYS HG3 H 7.760 0.183 -6.301 1.00 . A A . 26 LYS HG3 1 1 14 9662 1 1 26 LYS HZ1 H 7.480 -3.156 -5.987 1.00 . A A . 26 LYS HZ1 1 1 14 9663 1 1 26 LYS HZ2 H 8.707 -2.483 -6.942 1.00 . A A . 26 LYS HZ2 1 1 14 9664 1 1 26 LYS HZ3 H 7.383 -1.538 -6.480 1.00 . A A . 26 LYS HZ3 1 1 14 9665 1 1 26 LYS N N 7.227 3.414 -5.091 1.00 . A A . 26 LYS N 1 1 14 9666 1 1 26 LYS NZ N 8.034 -2.290 -6.175 1.00 . A A . 26 LYS NZ 1 1 14 9667 1 1 26 LYS O O 7.414 2.508 -8.534 1.00 . A A . 26 LYS O 1 1 14 9668 1 1 27 ALA C C 4.012 2.767 -8.453 1.00 . A A . 27 ALA C 1 1 14 9669 1 1 27 ALA CA C 4.859 1.596 -7.949 1.00 . A A . 27 ALA CA 1 1 14 9670 1 1 27 ALA CB C 3.974 0.520 -7.335 1.00 . A A . 27 ALA CB 1 1 14 9671 1 1 27 ALA H H 5.616 2.068 -6.027 1.00 . A A . 27 ALA H 1 1 14 9672 1 1 27 ALA HA H 5.388 1.161 -8.785 1.00 . A A . 27 ALA HA 1 1 14 9673 1 1 27 ALA HB1 H 2.951 0.866 -7.313 1.00 . A A . 27 ALA HB1 1 1 14 9674 1 1 27 ALA HB2 H 4.306 0.312 -6.329 1.00 . A A . 27 ALA HB2 1 1 14 9675 1 1 27 ALA HB3 H 4.037 -0.380 -7.929 1.00 . A A . 27 ALA HB3 1 1 14 9676 1 1 27 ALA N N 5.851 2.056 -6.980 1.00 . A A . 27 ALA N 1 1 14 9677 1 1 27 ALA O O 3.008 2.576 -9.144 1.00 . A A . 27 ALA O 1 1 14 9678 1 1 28 LYS C C 2.396 5.364 -7.846 1.00 . A A . 28 LYS C 1 1 14 9679 1 1 28 LYS CA C 3.779 5.214 -8.495 1.00 . A A . 28 LYS CA 1 1 14 9680 1 1 28 LYS CB C 3.681 5.325 -10.024 1.00 . A A . 28 LYS CB 1 1 14 9681 1 1 28 LYS CD C 4.412 7.733 -10.052 1.00 . A A . 28 LYS CD 1 1 14 9682 1 1 28 LYS CE C 4.077 9.148 -10.499 1.00 . A A . 28 LYS CE 1 1 14 9683 1 1 28 LYS CG C 3.363 6.732 -10.516 1.00 . A A . 28 LYS CG 1 1 14 9684 1 1 28 LYS H H 5.256 4.038 -7.552 1.00 . A A . 28 LYS H 1 1 14 9685 1 1 28 LYS HA H 4.397 6.025 -8.139 1.00 . A A . 28 LYS HA 1 1 14 9686 1 1 28 LYS HB2 H 4.624 5.021 -10.456 1.00 . A A . 28 LYS HB2 1 1 14 9687 1 1 28 LYS HB3 H 2.905 4.661 -10.373 1.00 . A A . 28 LYS HB3 1 1 14 9688 1 1 28 LYS HD2 H 4.463 7.711 -8.974 1.00 . A A . 28 LYS HD2 1 1 14 9689 1 1 28 LYS HD3 H 5.370 7.452 -10.465 1.00 . A A . 28 LYS HD3 1 1 14 9690 1 1 28 LYS HE2 H 3.099 9.409 -10.121 1.00 . A A . 28 LYS HE2 1 1 14 9691 1 1 28 LYS HE3 H 4.812 9.824 -10.088 1.00 . A A . 28 LYS HE3 1 1 14 9692 1 1 28 LYS HG2 H 3.336 6.728 -11.596 1.00 . A A . 28 LYS HG2 1 1 14 9693 1 1 28 LYS HG3 H 2.399 7.028 -10.131 1.00 . A A . 28 LYS HG3 1 1 14 9694 1 1 28 LYS HZ1 H 4.870 9.871 -12.291 1.00 . A A . 28 LYS HZ1 1 1 14 9695 1 1 28 LYS HZ2 H 3.185 9.721 -12.299 1.00 . A A . 28 LYS HZ2 1 1 14 9696 1 1 28 LYS HZ3 H 4.158 8.342 -12.425 1.00 . A A . 28 LYS HZ3 1 1 14 9697 1 1 28 LYS N N 4.444 3.976 -8.100 1.00 . A A . 28 LYS N 1 1 14 9698 1 1 28 LYS NZ N 4.072 9.280 -11.982 1.00 . A A . 28 LYS NZ 1 1 14 9699 1 1 28 LYS O O 1.380 5.516 -8.533 1.00 . A A . 28 LYS O 1 1 14 9700 1 1 29 PHE C C 1.423 6.598 -4.671 1.00 . A A . 29 PHE C 1 1 14 9701 1 1 29 PHE CA C 1.158 5.544 -5.738 1.00 . A A . 29 PHE CA 1 1 14 9702 1 1 29 PHE CB C 0.674 4.246 -5.073 1.00 . A A . 29 PHE CB 1 1 14 9703 1 1 29 PHE CD1 C 0.884 2.446 -6.818 1.00 . A A . 29 PHE CD1 1 1 14 9704 1 1 29 PHE CD2 C -1.298 3.084 -6.105 1.00 . A A . 29 PHE CD2 1 1 14 9705 1 1 29 PHE CE1 C 0.333 1.517 -7.680 1.00 . A A . 29 PHE CE1 1 1 14 9706 1 1 29 PHE CE2 C -1.855 2.157 -6.966 1.00 . A A . 29 PHE CE2 1 1 14 9707 1 1 29 PHE CG C 0.078 3.240 -6.021 1.00 . A A . 29 PHE CG 1 1 14 9708 1 1 29 PHE CZ C -1.038 1.373 -7.754 1.00 . A A . 29 PHE CZ 1 1 14 9709 1 1 29 PHE H H 3.232 5.262 -6.037 1.00 . A A . 29 PHE H 1 1 14 9710 1 1 29 PHE HA H 0.391 5.911 -6.406 1.00 . A A . 29 PHE HA 1 1 14 9711 1 1 29 PHE HB2 H 1.506 3.774 -4.575 1.00 . A A . 29 PHE HB2 1 1 14 9712 1 1 29 PHE HB3 H -0.079 4.491 -4.336 1.00 . A A . 29 PHE HB3 1 1 14 9713 1 1 29 PHE HD1 H 1.957 2.557 -6.762 1.00 . A A . 29 PHE HD1 1 1 14 9714 1 1 29 PHE HD2 H -1.940 3.697 -5.489 1.00 . A A . 29 PHE HD2 1 1 14 9715 1 1 29 PHE HE1 H 0.975 0.905 -8.296 1.00 . A A . 29 PHE HE1 1 1 14 9716 1 1 29 PHE HE2 H -2.928 2.047 -7.021 1.00 . A A . 29 PHE HE2 1 1 14 9717 1 1 29 PHE HZ H -1.470 0.647 -8.427 1.00 . A A . 29 PHE HZ 1 1 14 9718 1 1 29 PHE N N 2.380 5.361 -6.518 1.00 . A A . 29 PHE N 1 1 14 9719 1 1 29 PHE O O 2.548 6.721 -4.192 1.00 . A A . 29 PHE O 1 1 14 9720 1 1 30 SER C C 0.902 7.904 -1.958 1.00 . A A . 30 SER C 1 1 14 9721 1 1 30 SER CA C 0.540 8.438 -3.345 1.00 . A A . 30 SER CA 1 1 14 9722 1 1 30 SER CB C -0.757 9.244 -3.277 1.00 . A A . 30 SER CB 1 1 14 9723 1 1 30 SER H H -0.463 7.241 -4.765 1.00 . A A . 30 SER H 1 1 14 9724 1 1 30 SER HA H 1.332 9.087 -3.677 1.00 . A A . 30 SER HA 1 1 14 9725 1 1 30 SER HB2 H -1.524 8.649 -2.804 1.00 . A A . 30 SER HB2 1 1 14 9726 1 1 30 SER HB3 H -0.591 10.143 -2.702 1.00 . A A . 30 SER HB3 1 1 14 9727 1 1 30 SER HG H -0.883 10.496 -4.788 1.00 . A A . 30 SER HG 1 1 14 9728 1 1 30 SER N N 0.403 7.372 -4.330 1.00 . A A . 30 SER N 1 1 14 9729 1 1 30 SER O O 1.797 8.434 -1.302 1.00 . A A . 30 SER O 1 1 14 9730 1 1 30 SER OG O -1.195 9.606 -4.579 1.00 . A A . 30 SER OG 1 1 14 9731 1 1 31 ASP C C -0.164 4.900 -0.067 1.00 . A A . 31 ASP C 1 1 14 9732 1 1 31 ASP CA C 0.460 6.284 -0.193 1.00 . A A . 31 ASP CA 1 1 14 9733 1 1 31 ASP CB C -0.088 7.195 0.910 1.00 . A A . 31 ASP CB 1 1 14 9734 1 1 31 ASP CG C 0.136 6.619 2.293 1.00 . A A . 31 ASP CG 1 1 14 9735 1 1 31 ASP H H -0.502 6.482 -2.079 1.00 . A A . 31 ASP H 1 1 14 9736 1 1 31 ASP HA H 1.529 6.195 -0.073 1.00 . A A . 31 ASP HA 1 1 14 9737 1 1 31 ASP HB2 H 0.404 8.154 0.855 1.00 . A A . 31 ASP HB2 1 1 14 9738 1 1 31 ASP HB3 H -1.150 7.330 0.763 1.00 . A A . 31 ASP HB3 1 1 14 9739 1 1 31 ASP N N 0.204 6.864 -1.513 1.00 . A A . 31 ASP N 1 1 14 9740 1 1 31 ASP O O -1.244 4.648 -0.597 1.00 . A A . 31 ASP O 1 1 14 9741 1 1 31 ASP OD1 O 1.301 6.334 2.642 1.00 . A A . 31 ASP OD1 1 1 14 9742 1 1 31 ASP OD2 O -0.851 6.435 3.040 1.00 . A A . 31 ASP OD2 1 1 14 9743 1 1 32 GLY C C -0.454 2.418 2.245 1.00 . A A . 32 GLY C 1 1 14 9744 1 1 32 GLY CA C 0.022 2.662 0.830 1.00 . A A . 32 GLY CA 1 1 14 9745 1 1 32 GLY H H 1.370 4.275 1.044 1.00 . A A . 32 GLY H 1 1 14 9746 1 1 32 GLY HA2 H -0.806 2.495 0.152 1.00 . A A . 32 GLY HA2 1 1 14 9747 1 1 32 GLY HA3 H 0.809 1.961 0.600 1.00 . A A . 32 GLY HA3 1 1 14 9748 1 1 32 GLY N N 0.519 4.010 0.639 1.00 . A A . 32 GLY N 1 1 14 9749 1 1 32 GLY O O 0.036 3.035 3.192 1.00 . A A . 32 GLY O 1 1 14 9750 1 1 33 HIS C C -2.296 -0.277 3.816 1.00 . A A . 33 HIS C 1 1 14 9751 1 1 33 HIS CA C -1.970 1.208 3.698 1.00 . A A . 33 HIS CA 1 1 14 9752 1 1 33 HIS CB C -3.230 2.047 3.951 1.00 . A A . 33 HIS CB 1 1 14 9753 1 1 33 HIS CD2 C -4.728 2.344 1.842 1.00 . A A . 33 HIS CD2 1 1 14 9754 1 1 33 HIS CE1 C -6.108 0.680 2.195 1.00 . A A . 33 HIS CE1 1 1 14 9755 1 1 33 HIS CG C -4.363 1.752 3.006 1.00 . A A . 33 HIS CG 1 1 14 9756 1 1 33 HIS H H -1.768 1.065 1.593 1.00 . A A . 33 HIS H 1 1 14 9757 1 1 33 HIS HA H -1.228 1.460 4.441 1.00 . A A . 33 HIS HA 1 1 14 9758 1 1 33 HIS HB2 H -3.581 1.857 4.954 1.00 . A A . 33 HIS HB2 1 1 14 9759 1 1 33 HIS HB3 H -2.979 3.090 3.857 1.00 . A A . 33 HIS HB3 1 1 14 9760 1 1 33 HIS HD1 H -5.247 0.088 3.953 1.00 . A A . 33 HIS HD1 1 1 14 9761 1 1 33 HIS HD2 H -4.241 3.179 1.367 1.00 . A A . 33 HIS HD2 1 1 14 9762 1 1 33 HIS HE1 H -6.900 -0.041 2.065 1.00 . A A . 33 HIS HE1 1 1 14 9763 1 1 33 HIS N N -1.416 1.524 2.392 1.00 . A A . 33 HIS N 1 1 14 9764 1 1 33 HIS ND1 N -5.251 0.713 3.197 1.00 . A A . 33 HIS ND1 1 1 14 9765 1 1 33 HIS NE2 N -5.816 1.658 1.362 1.00 . A A . 33 HIS NE2 1 1 14 9766 1 1 33 HIS O O -2.797 -0.894 2.875 1.00 . A A . 33 HIS O 1 1 14 9767 1 1 34 CYS C C -3.803 -2.478 5.292 1.00 . A A . 34 CYS C 1 1 14 9768 1 1 34 CYS CA C -2.294 -2.241 5.240 1.00 . A A . 34 CYS CA 1 1 14 9769 1 1 34 CYS CB C -1.660 -2.668 6.566 1.00 . A A . 34 CYS CB 1 1 14 9770 1 1 34 CYS H H -1.631 -0.286 5.690 1.00 . A A . 34 CYS H 1 1 14 9771 1 1 34 CYS HA H -1.870 -2.823 4.436 1.00 . A A . 34 CYS HA 1 1 14 9772 1 1 34 CYS HB2 H -2.219 -2.228 7.378 1.00 . A A . 34 CYS HB2 1 1 14 9773 1 1 34 CYS HB3 H -1.709 -3.744 6.647 1.00 . A A . 34 CYS HB3 1 1 14 9774 1 1 34 CYS N N -2.021 -0.835 4.980 1.00 . A A . 34 CYS N 1 1 14 9775 1 1 34 CYS O O -4.544 -1.664 5.847 1.00 . A A . 34 CYS O 1 1 14 9776 1 1 34 CYS SG S 0.086 -2.176 6.772 1.00 . A A . 34 CYS SG 1 1 14 9777 1 1 35 SER C C -6.055 -4.734 5.932 1.00 . A A . 35 SER C 1 1 14 9778 1 1 35 SER CA C -5.681 -3.897 4.710 1.00 . A A . 35 SER CA 1 1 14 9779 1 1 35 SER CB C -6.069 -4.625 3.423 1.00 . A A . 35 SER CB 1 1 14 9780 1 1 35 SER H H -3.630 -4.192 4.277 1.00 . A A . 35 SER H 1 1 14 9781 1 1 35 SER HA H -6.222 -2.963 4.756 1.00 . A A . 35 SER HA 1 1 14 9782 1 1 35 SER HB2 H -7.078 -4.998 3.514 1.00 . A A . 35 SER HB2 1 1 14 9783 1 1 35 SER HB3 H -6.013 -3.937 2.593 1.00 . A A . 35 SER HB3 1 1 14 9784 1 1 35 SER HG H -4.397 -5.387 2.750 1.00 . A A . 35 SER HG 1 1 14 9785 1 1 35 SER N N -4.260 -3.579 4.712 1.00 . A A . 35 SER N 1 1 14 9786 1 1 35 SER O O -5.185 -5.199 6.670 1.00 . A A . 35 SER O 1 1 14 9787 1 1 35 SER OG O -5.204 -5.714 3.172 1.00 . A A . 35 SER OG 1 1 14 9788 1 1 36 LYS C C -7.989 -7.160 6.948 1.00 . A A . 36 LYS C 1 1 14 9789 1 1 36 LYS CA C -7.849 -5.675 7.282 1.00 . A A . 36 LYS CA 1 1 14 9790 1 1 36 LYS CB C -9.209 -5.130 7.731 1.00 . A A . 36 LYS CB 1 1 14 9791 1 1 36 LYS CD C -11.249 -5.480 9.174 1.00 . A A . 36 LYS CD 1 1 14 9792 1 1 36 LYS CE C -12.254 -6.025 8.172 1.00 . A A . 36 LYS CE 1 1 14 9793 1 1 36 LYS CG C -9.836 -5.941 8.853 1.00 . A A . 36 LYS CG 1 1 14 9794 1 1 36 LYS H H -7.994 -4.502 5.530 1.00 . A A . 36 LYS H 1 1 14 9795 1 1 36 LYS HA H -7.144 -5.564 8.092 1.00 . A A . 36 LYS HA 1 1 14 9796 1 1 36 LYS HB2 H -9.082 -4.114 8.075 1.00 . A A . 36 LYS HB2 1 1 14 9797 1 1 36 LYS HB3 H -9.884 -5.137 6.889 1.00 . A A . 36 LYS HB3 1 1 14 9798 1 1 36 LYS HD2 H -11.515 -5.828 10.161 1.00 . A A . 36 LYS HD2 1 1 14 9799 1 1 36 LYS HD3 H -11.279 -4.400 9.150 1.00 . A A . 36 LYS HD3 1 1 14 9800 1 1 36 LYS HE2 H -13.230 -5.627 8.407 1.00 . A A . 36 LYS HE2 1 1 14 9801 1 1 36 LYS HE3 H -11.965 -5.706 7.181 1.00 . A A . 36 LYS HE3 1 1 14 9802 1 1 36 LYS HG2 H -9.869 -6.978 8.544 1.00 . A A . 36 LYS HG2 1 1 14 9803 1 1 36 LYS HG3 H -9.223 -5.848 9.737 1.00 . A A . 36 LYS HG3 1 1 14 9804 1 1 36 LYS HZ1 H -11.356 -7.910 8.285 1.00 . A A . 36 LYS HZ1 1 1 14 9805 1 1 36 LYS HZ2 H -12.756 -7.874 7.336 1.00 . A A . 36 LYS HZ2 1 1 14 9806 1 1 36 LYS HZ3 H -12.877 -7.830 9.021 1.00 . A A . 36 LYS HZ3 1 1 14 9807 1 1 36 LYS N N -7.352 -4.909 6.146 1.00 . A A . 36 LYS N 1 1 14 9808 1 1 36 LYS NZ N -12.315 -7.513 8.205 1.00 . A A . 36 LYS NZ 1 1 14 9809 1 1 36 LYS O O -7.953 -8.007 7.835 1.00 . A A . 36 LYS O 1 1 14 9810 1 1 37 ILE C C -7.082 -9.650 5.309 1.00 . A A . 37 ILE C 1 1 14 9811 1 1 37 ILE CA C -8.383 -8.840 5.231 1.00 . A A . 37 ILE CA 1 1 14 9812 1 1 37 ILE CB C -8.938 -8.886 3.793 1.00 . A A . 37 ILE CB 1 1 14 9813 1 1 37 ILE CD1 C -10.532 -7.729 2.183 1.00 . A A . 37 ILE CD1 1 1 14 9814 1 1 37 ILE CG1 C -10.068 -7.869 3.617 1.00 . A A . 37 ILE CG1 1 1 14 9815 1 1 37 ILE CG2 C -9.438 -10.288 3.454 1.00 . A A . 37 ILE CG2 1 1 14 9816 1 1 37 ILE H H -8.242 -6.740 5.017 1.00 . A A . 37 ILE H 1 1 14 9817 1 1 37 ILE HA H -9.109 -9.296 5.886 1.00 . A A . 37 ILE HA 1 1 14 9818 1 1 37 ILE HB H -8.136 -8.639 3.123 1.00 . A A . 37 ILE HB 1 1 14 9819 1 1 37 ILE HD11 H -9.763 -8.100 1.518 1.00 . A A . 37 ILE HD11 1 1 14 9820 1 1 37 ILE HD12 H -10.725 -6.689 1.966 1.00 . A A . 37 ILE HD12 1 1 14 9821 1 1 37 ILE HD13 H -11.437 -8.302 2.040 1.00 . A A . 37 ILE HD13 1 1 14 9822 1 1 37 ILE HG12 H -10.915 -8.175 4.212 1.00 . A A . 37 ILE HG12 1 1 14 9823 1 1 37 ILE HG13 H -9.728 -6.900 3.953 1.00 . A A . 37 ILE HG13 1 1 14 9824 1 1 37 ILE HG21 H -10.071 -10.242 2.580 1.00 . A A . 37 ILE HG21 1 1 14 9825 1 1 37 ILE HG22 H -10.002 -10.680 4.287 1.00 . A A . 37 ILE HG22 1 1 14 9826 1 1 37 ILE HG23 H -8.595 -10.932 3.255 1.00 . A A . 37 ILE HG23 1 1 14 9827 1 1 37 ILE N N -8.194 -7.461 5.674 1.00 . A A . 37 ILE N 1 1 14 9828 1 1 37 ILE O O -6.643 -10.028 6.389 1.00 . A A . 37 ILE O 1 1 14 9829 1 1 38 LEU C C -4.033 -9.856 4.487 1.00 . A A . 38 LEU C 1 1 14 9830 1 1 38 LEU CA C -5.239 -10.705 4.095 1.00 . A A . 38 LEU CA 1 1 14 9831 1 1 38 LEU CB C -5.038 -11.257 2.686 1.00 . A A . 38 LEU CB 1 1 14 9832 1 1 38 LEU CD1 C -4.333 -13.571 3.347 1.00 . A A . 38 LEU CD1 1 1 14 9833 1 1 38 LEU CD2 C -3.677 -12.657 1.112 1.00 . A A . 38 LEU CD2 1 1 14 9834 1 1 38 LEU CG C -3.950 -12.321 2.569 1.00 . A A . 38 LEU CG 1 1 14 9835 1 1 38 LEU H H -6.877 -9.608 3.320 1.00 . A A . 38 LEU H 1 1 14 9836 1 1 38 LEU HA H -5.329 -11.528 4.787 1.00 . A A . 38 LEU HA 1 1 14 9837 1 1 38 LEU HB2 H -5.970 -11.676 2.350 1.00 . A A . 38 LEU HB2 1 1 14 9838 1 1 38 LEU HB3 H -4.778 -10.436 2.035 1.00 . A A . 38 LEU HB3 1 1 14 9839 1 1 38 LEU HD11 H -3.895 -14.438 2.875 1.00 . A A . 38 LEU HD11 1 1 14 9840 1 1 38 LEU HD12 H -5.408 -13.672 3.359 1.00 . A A . 38 LEU HD12 1 1 14 9841 1 1 38 LEU HD13 H -3.968 -13.489 4.361 1.00 . A A . 38 LEU HD13 1 1 14 9842 1 1 38 LEU HD21 H -3.584 -11.743 0.543 1.00 . A A . 38 LEU HD21 1 1 14 9843 1 1 38 LEU HD22 H -4.494 -13.244 0.719 1.00 . A A . 38 LEU HD22 1 1 14 9844 1 1 38 LEU HD23 H -2.760 -13.222 1.038 1.00 . A A . 38 LEU HD23 1 1 14 9845 1 1 38 LEU HG H -3.041 -11.926 3.001 1.00 . A A . 38 LEU HG 1 1 14 9846 1 1 38 LEU N N -6.476 -9.925 4.154 1.00 . A A . 38 LEU N 1 1 14 9847 1 1 38 LEU O O -2.884 -10.248 4.290 1.00 . A A . 38 LEU O 1 1 14 9848 1 1 39 ARG C C -2.406 -7.344 4.303 1.00 . A A . 39 ARG C 1 1 14 9849 1 1 39 ARG CA C -3.303 -7.751 5.475 1.00 . A A . 39 ARG CA 1 1 14 9850 1 1 39 ARG CB C -2.477 -8.353 6.617 1.00 . A A . 39 ARG CB 1 1 14 9851 1 1 39 ARG CD C -2.788 -6.438 8.210 1.00 . A A . 39 ARG CD 1 1 14 9852 1 1 39 ARG CG C -1.785 -7.316 7.481 1.00 . A A . 39 ARG CG 1 1 14 9853 1 1 39 ARG CZ C -2.765 -4.457 9.687 1.00 . A A . 39 ARG CZ 1 1 14 9854 1 1 39 ARG H H -5.258 -8.462 5.159 1.00 . A A . 39 ARG H 1 1 14 9855 1 1 39 ARG HA H -3.810 -6.870 5.840 1.00 . A A . 39 ARG HA 1 1 14 9856 1 1 39 ARG HB2 H -3.129 -8.939 7.247 1.00 . A A . 39 ARG HB2 1 1 14 9857 1 1 39 ARG HB3 H -1.722 -9.001 6.195 1.00 . A A . 39 ARG HB3 1 1 14 9858 1 1 39 ARG HD2 H -3.470 -6.014 7.487 1.00 . A A . 39 ARG HD2 1 1 14 9859 1 1 39 ARG HD3 H -3.340 -7.047 8.910 1.00 . A A . 39 ARG HD3 1 1 14 9860 1 1 39 ARG HE H -1.143 -5.294 8.855 1.00 . A A . 39 ARG HE 1 1 14 9861 1 1 39 ARG HG2 H -1.169 -7.821 8.209 1.00 . A A . 39 ARG HG2 1 1 14 9862 1 1 39 ARG HG3 H -1.165 -6.694 6.852 1.00 . A A . 39 ARG HG3 1 1 14 9863 1 1 39 ARG HH11 H -4.610 -5.206 9.312 1.00 . A A . 39 ARG HH11 1 1 14 9864 1 1 39 ARG HH12 H -4.571 -3.830 10.363 1.00 . A A . 39 ARG HH12 1 1 14 9865 1 1 39 ARG HH21 H -1.075 -3.471 10.225 1.00 . A A . 39 ARG HH21 1 1 14 9866 1 1 39 ARG HH22 H -2.546 -2.834 10.885 1.00 . A A . 39 ARG HH22 1 1 14 9867 1 1 39 ARG N N -4.320 -8.693 5.039 1.00 . A A . 39 ARG N 1 1 14 9868 1 1 39 ARG NE N -2.128 -5.353 8.937 1.00 . A A . 39 ARG NE 1 1 14 9869 1 1 39 ARG NH1 N -4.089 -4.499 9.797 1.00 . A A . 39 ARG NH1 1 1 14 9870 1 1 39 ARG NH2 N -2.075 -3.510 10.316 1.00 . A A . 39 ARG NH2 1 1 14 9871 1 1 39 ARG O O -1.229 -7.031 4.477 1.00 . A A . 39 ARG O 1 1 14 9872 1 1 40 ARG C C -1.968 -5.456 1.907 1.00 . A A . 40 ARG C 1 1 14 9873 1 1 40 ARG CA C -2.272 -6.952 1.897 1.00 . A A . 40 ARG CA 1 1 14 9874 1 1 40 ARG CB C -3.098 -7.274 0.652 1.00 . A A . 40 ARG CB 1 1 14 9875 1 1 40 ARG CD C -4.063 -8.953 -0.920 1.00 . A A . 40 ARG CD 1 1 14 9876 1 1 40 ARG CG C -3.255 -8.754 0.352 1.00 . A A . 40 ARG CG 1 1 14 9877 1 1 40 ARG CZ C -4.768 -10.769 -2.430 1.00 . A A . 40 ARG CZ 1 1 14 9878 1 1 40 ARG H H -3.936 -7.591 3.042 1.00 . A A . 40 ARG H 1 1 14 9879 1 1 40 ARG HA H -1.344 -7.503 1.862 1.00 . A A . 40 ARG HA 1 1 14 9880 1 1 40 ARG HB2 H -4.085 -6.854 0.776 1.00 . A A . 40 ARG HB2 1 1 14 9881 1 1 40 ARG HB3 H -2.628 -6.807 -0.202 1.00 . A A . 40 ARG HB3 1 1 14 9882 1 1 40 ARG HD2 H -5.063 -8.580 -0.755 1.00 . A A . 40 ARG HD2 1 1 14 9883 1 1 40 ARG HD3 H -3.599 -8.388 -1.715 1.00 . A A . 40 ARG HD3 1 1 14 9884 1 1 40 ARG HE H -3.710 -11.015 -0.745 1.00 . A A . 40 ARG HE 1 1 14 9885 1 1 40 ARG HG2 H -2.278 -9.195 0.225 1.00 . A A . 40 ARG HG2 1 1 14 9886 1 1 40 ARG HG3 H -3.768 -9.229 1.175 1.00 . A A . 40 ARG HG3 1 1 14 9887 1 1 40 ARG HH11 H -5.361 -8.897 -3.006 1.00 . A A . 40 ARG HH11 1 1 14 9888 1 1 40 ARG HH12 H -5.832 -10.199 -4.061 1.00 . A A . 40 ARG HH12 1 1 14 9889 1 1 40 ARG HH21 H -4.320 -12.727 -2.146 1.00 . A A . 40 ARG HH21 1 1 14 9890 1 1 40 ARG HH22 H -5.240 -12.377 -3.571 1.00 . A A . 40 ARG HH22 1 1 14 9891 1 1 40 ARG N N -2.988 -7.337 3.108 1.00 . A A . 40 ARG N 1 1 14 9892 1 1 40 ARG NE N -4.147 -10.354 -1.323 1.00 . A A . 40 ARG NE 1 1 14 9893 1 1 40 ARG NH1 N -5.370 -9.893 -3.231 1.00 . A A . 40 ARG NH1 1 1 14 9894 1 1 40 ARG NH2 N -4.778 -12.062 -2.740 1.00 . A A . 40 ARG NH2 1 1 14 9895 1 1 40 ARG O O -2.712 -4.670 2.501 1.00 . A A . 40 ARG O 1 1 14 9896 1 1 41 CYS C C -1.300 -2.969 0.049 1.00 . A A . 41 CYS C 1 1 14 9897 1 1 41 CYS CA C -0.507 -3.667 1.149 1.00 . A A . 41 CYS CA 1 1 14 9898 1 1 41 CYS CB C 0.994 -3.551 0.873 1.00 . A A . 41 CYS CB 1 1 14 9899 1 1 41 CYS H H -0.353 -5.740 0.773 1.00 . A A . 41 CYS H 1 1 14 9900 1 1 41 CYS HA H -0.731 -3.198 2.096 1.00 . A A . 41 CYS HA 1 1 14 9901 1 1 41 CYS HB2 H 1.538 -3.833 1.762 1.00 . A A . 41 CYS HB2 1 1 14 9902 1 1 41 CYS HB3 H 1.256 -4.227 0.071 1.00 . A A . 41 CYS HB3 1 1 14 9903 1 1 41 CYS N N -0.893 -5.070 1.238 1.00 . A A . 41 CYS N 1 1 14 9904 1 1 41 CYS O O -0.956 -3.065 -1.129 1.00 . A A . 41 CYS O 1 1 14 9905 1 1 41 CYS SG S 1.553 -1.885 0.395 1.00 . A A . 41 CYS SG 1 1 14 9906 1 1 42 LEU C C -2.615 -0.180 -0.811 1.00 . A A . 42 LEU C 1 1 14 9907 1 1 42 LEU CA C -3.193 -1.552 -0.519 1.00 . A A . 42 LEU CA 1 1 14 9908 1 1 42 LEU CB C -4.628 -1.410 0.005 1.00 . A A . 42 LEU CB 1 1 14 9909 1 1 42 LEU CD1 C -5.175 -3.855 0.203 1.00 . A A . 42 LEU CD1 1 1 14 9910 1 1 42 LEU CD2 C -7.015 -2.177 0.013 1.00 . A A . 42 LEU CD2 1 1 14 9911 1 1 42 LEU CG C -5.594 -2.527 -0.402 1.00 . A A . 42 LEU CG 1 1 14 9912 1 1 42 LEU H H -2.581 -2.227 1.392 1.00 . A A . 42 LEU H 1 1 14 9913 1 1 42 LEU HA H -3.208 -2.124 -1.436 1.00 . A A . 42 LEU HA 1 1 14 9914 1 1 42 LEU HB2 H -4.584 -1.385 1.085 1.00 . A A . 42 LEU HB2 1 1 14 9915 1 1 42 LEU HB3 H -5.030 -0.465 -0.338 1.00 . A A . 42 LEU HB3 1 1 14 9916 1 1 42 LEU HD11 H -5.803 -4.078 1.052 1.00 . A A . 42 LEU HD11 1 1 14 9917 1 1 42 LEU HD12 H -4.145 -3.796 0.523 1.00 . A A . 42 LEU HD12 1 1 14 9918 1 1 42 LEU HD13 H -5.278 -4.636 -0.536 1.00 . A A . 42 LEU HD13 1 1 14 9919 1 1 42 LEU HD21 H -7.459 -3.020 0.522 1.00 . A A . 42 LEU HD21 1 1 14 9920 1 1 42 LEU HD22 H -7.598 -1.938 -0.864 1.00 . A A . 42 LEU HD22 1 1 14 9921 1 1 42 LEU HD23 H -6.997 -1.325 0.677 1.00 . A A . 42 LEU HD23 1 1 14 9922 1 1 42 LEU HG H -5.577 -2.632 -1.477 1.00 . A A . 42 LEU HG 1 1 14 9923 1 1 42 LEU N N -2.359 -2.270 0.436 1.00 . A A . 42 LEU N 1 1 14 9924 1 1 42 LEU O O -2.514 0.663 0.080 1.00 . A A . 42 LEU O 1 1 14 9925 1 1 43 CYS C C -2.778 2.240 -2.959 1.00 . A A . 43 CYS C 1 1 14 9926 1 1 43 CYS CA C -1.683 1.305 -2.475 1.00 . A A . 43 CYS CA 1 1 14 9927 1 1 43 CYS CB C -0.658 1.074 -3.578 1.00 . A A . 43 CYS CB 1 1 14 9928 1 1 43 CYS H H -2.360 -0.676 -2.725 1.00 . A A . 43 CYS H 1 1 14 9929 1 1 43 CYS HA H -1.191 1.750 -1.623 1.00 . A A . 43 CYS HA 1 1 14 9930 1 1 43 CYS HB2 H -1.137 0.583 -4.411 1.00 . A A . 43 CYS HB2 1 1 14 9931 1 1 43 CYS HB3 H -0.272 2.029 -3.905 1.00 . A A . 43 CYS HB3 1 1 14 9932 1 1 43 CYS N N -2.246 0.038 -2.057 1.00 . A A . 43 CYS N 1 1 14 9933 1 1 43 CYS O O -3.603 1.861 -3.784 1.00 . A A . 43 CYS O 1 1 14 9934 1 1 43 CYS SG S 0.752 0.054 -3.063 1.00 . A A . 43 CYS SG 1 1 14 9935 1 1 44 THR C C -3.136 5.628 -3.528 1.00 . A A . 44 THR C 1 1 14 9936 1 1 44 THR CA C -3.777 4.447 -2.814 1.00 . A A . 44 THR CA 1 1 14 9937 1 1 44 THR CB C -4.524 4.981 -1.579 1.00 . A A . 44 THR CB 1 1 14 9938 1 1 44 THR CG2 C -6.006 4.653 -1.641 1.00 . A A . 44 THR CG2 1 1 14 9939 1 1 44 THR H H -2.091 3.699 -1.784 1.00 . A A . 44 THR H 1 1 14 9940 1 1 44 THR HA H -4.494 3.976 -3.472 1.00 . A A . 44 THR HA 1 1 14 9941 1 1 44 THR HB H -4.413 6.056 -1.562 1.00 . A A . 44 THR HB 1 1 14 9942 1 1 44 THR HG1 H -3.034 4.708 -0.307 1.00 . A A . 44 THR HG1 1 1 14 9943 1 1 44 THR HG21 H -6.246 3.929 -0.877 1.00 . A A . 44 THR HG21 1 1 14 9944 1 1 44 THR HG22 H -6.243 4.244 -2.612 1.00 . A A . 44 THR HG22 1 1 14 9945 1 1 44 THR HG23 H -6.581 5.553 -1.479 1.00 . A A . 44 THR HG23 1 1 14 9946 1 1 44 THR N N -2.782 3.456 -2.442 1.00 . A A . 44 THR N 1 1 14 9947 1 1 44 THR O O -2.009 6.017 -3.215 1.00 . A A . 44 THR O 1 1 14 9948 1 1 44 THR OG1 O -3.957 4.428 -0.382 1.00 . A A . 44 THR OG1 1 1 14 9949 1 1 45 LYS C C -4.525 8.085 -5.893 1.00 . A A . 45 LYS C 1 1 14 9950 1 1 45 LYS CA C -3.380 7.359 -5.208 1.00 . A A . 45 LYS CA 1 1 14 9951 1 1 45 LYS CB C -2.306 6.974 -6.232 1.00 . A A . 45 LYS CB 1 1 14 9952 1 1 45 LYS CD C -1.634 5.799 -8.317 1.00 . A A . 45 LYS CD 1 1 14 9953 1 1 45 LYS CE C -1.977 4.746 -9.354 1.00 . A A . 45 LYS CE 1 1 14 9954 1 1 45 LYS CG C -2.777 6.064 -7.353 1.00 . A A . 45 LYS CG 1 1 14 9955 1 1 45 LYS H H -4.763 5.855 -4.657 1.00 . A A . 45 LYS H 1 1 14 9956 1 1 45 LYS HA H -2.938 8.033 -4.489 1.00 . A A . 45 LYS HA 1 1 14 9957 1 1 45 LYS HB2 H -1.921 7.877 -6.679 1.00 . A A . 45 LYS HB2 1 1 14 9958 1 1 45 LYS HB3 H -1.501 6.475 -5.712 1.00 . A A . 45 LYS HB3 1 1 14 9959 1 1 45 LYS HD2 H -1.391 6.718 -8.827 1.00 . A A . 45 LYS HD2 1 1 14 9960 1 1 45 LYS HD3 H -0.775 5.465 -7.752 1.00 . A A . 45 LYS HD3 1 1 14 9961 1 1 45 LYS HE2 H -2.409 3.891 -8.855 1.00 . A A . 45 LYS HE2 1 1 14 9962 1 1 45 LYS HE3 H -2.693 5.160 -10.049 1.00 . A A . 45 LYS HE3 1 1 14 9963 1 1 45 LYS HG2 H -3.114 5.127 -6.933 1.00 . A A . 45 LYS HG2 1 1 14 9964 1 1 45 LYS HG3 H -3.586 6.542 -7.884 1.00 . A A . 45 LYS HG3 1 1 14 9965 1 1 45 LYS HZ1 H 0.093 4.701 -9.649 1.00 . A A . 45 LYS HZ1 1 1 14 9966 1 1 45 LYS HZ2 H -0.808 4.652 -11.083 1.00 . A A . 45 LYS HZ2 1 1 14 9967 1 1 45 LYS HZ3 H -0.698 3.275 -10.109 1.00 . A A . 45 LYS HZ3 1 1 14 9968 1 1 45 LYS N N -3.863 6.204 -4.469 1.00 . A A . 45 LYS N 1 1 14 9969 1 1 45 LYS NZ N -0.765 4.313 -10.103 1.00 . A A . 45 LYS NZ 1 1 14 9970 1 1 45 LYS O O -5.659 7.598 -5.924 1.00 . A A . 45 LYS O 1 1 14 9971 1 1 46 GLU C C -5.437 9.549 -8.538 1.00 . A A . 46 GLU C 1 1 14 9972 1 1 46 GLU CA C -5.177 10.076 -7.128 1.00 . A A . 46 GLU CA 1 1 14 9973 1 1 46 GLU CB C -4.667 11.517 -7.175 1.00 . A A . 46 GLU CB 1 1 14 9974 1 1 46 GLU CD C -2.622 12.997 -7.384 1.00 . A A . 46 GLU CD 1 1 14 9975 1 1 46 GLU CG C -3.221 11.628 -7.636 1.00 . A A . 46 GLU CG 1 1 14 9976 1 1 46 GLU H H -3.284 9.564 -6.368 1.00 . A A . 46 GLU H 1 1 14 9977 1 1 46 GLU HA H -6.100 10.047 -6.570 1.00 . A A . 46 GLU HA 1 1 14 9978 1 1 46 GLU HB2 H -5.286 12.085 -7.854 1.00 . A A . 46 GLU HB2 1 1 14 9979 1 1 46 GLU HB3 H -4.742 11.947 -6.187 1.00 . A A . 46 GLU HB3 1 1 14 9980 1 1 46 GLU HG2 H -2.632 10.894 -7.107 1.00 . A A . 46 GLU HG2 1 1 14 9981 1 1 46 GLU HG3 H -3.180 11.422 -8.696 1.00 . A A . 46 GLU HG3 1 1 14 9982 1 1 46 GLU N N -4.209 9.246 -6.435 1.00 . A A . 46 GLU N 1 1 14 9983 1 1 46 GLU O O -4.565 8.926 -9.153 1.00 . A A . 46 GLU O 1 1 14 9984 1 1 46 GLU OE1 O -3.346 13.883 -6.883 1.00 . A A . 46 GLU OE1 1 1 14 9985 1 1 46 GLU OE2 O -1.423 13.179 -7.680 1.00 . A A . 46 GLU OE2 1 1 14 9986 1 1 47 CYS C C -8.411 9.989 -10.673 1.00 . A A . 47 CYS C 1 1 14 9987 1 1 47 CYS CA C -7.057 9.372 -10.355 1.00 . A A . 47 CYS CA 1 1 14 9988 1 1 47 CYS CB C -7.145 7.845 -10.441 1.00 . A A . 47 CYS CB 1 1 14 9989 1 1 47 CYS H H -7.280 10.299 -8.481 1.00 . A A . 47 CYS H 1 1 14 9990 1 1 47 CYS HA H -6.329 9.728 -11.067 1.00 . A A . 47 CYS HA 1 1 14 9991 1 1 47 CYS HB2 H -7.412 7.565 -11.449 1.00 . A A . 47 CYS HB2 1 1 14 9992 1 1 47 CYS HB3 H -6.180 7.424 -10.200 1.00 . A A . 47 CYS HB3 1 1 14 9993 1 1 47 CYS N N -6.640 9.801 -9.029 1.00 . A A . 47 CYS N 1 1 14 9994 1 1 47 CYS O O -8.810 9.991 -11.851 1.00 . A A . 47 CYS O 1 1 14 9995 1 1 47 CYS OXT O -9.066 10.471 -9.721 1.00 . A A . 47 CYS OXT 1 1 14 9996 1 1 47 CYS SG S -8.373 7.099 -9.318 1.00 . A A . 47 CYS SG 1 1 15 9997 1 1 1 ALA C C -9.339 12.852 -5.626 1.00 . A A . 1 ALA C 1 1 15 9998 1 1 1 ALA CA C -10.372 13.705 -6.344 1.00 . A A . 1 ALA CA 1 1 15 9999 1 1 1 ALA CB C -11.107 12.890 -7.401 1.00 . A A . 1 ALA CB 1 1 15 10000 1 1 1 ALA H1 H -9.008 15.270 -6.314 1.00 . A A . 1 ALA H1 1 1 15 10001 1 1 1 ALA H2 H -10.417 15.610 -7.184 1.00 . A A . 1 ALA H2 1 1 15 10002 1 1 1 ALA H3 H -9.235 14.591 -7.848 1.00 . A A . 1 ALA H3 1 1 15 10003 1 1 1 ALA HA H -11.091 14.052 -5.625 1.00 . A A . 1 ALA HA 1 1 15 10004 1 1 1 ALA HB1 H -10.451 12.124 -7.787 1.00 . A A . 1 ALA HB1 1 1 15 10005 1 1 1 ALA HB2 H -11.415 13.540 -8.206 1.00 . A A . 1 ALA HB2 1 1 15 10006 1 1 1 ALA HB3 H -11.978 12.428 -6.958 1.00 . A A . 1 ALA HB3 1 1 15 10007 1 1 1 ALA N N -9.718 14.879 -6.962 1.00 . A A . 1 ALA N 1 1 15 10008 1 1 1 ALA O O -8.263 13.340 -5.281 1.00 . A A . 1 ALA O 1 1 15 10009 1 1 2 THR C C -8.934 9.262 -5.262 1.00 . A A . 2 THR C 1 1 15 10010 1 1 2 THR CA C -8.753 10.678 -4.731 1.00 . A A . 2 THR CA 1 1 15 10011 1 1 2 THR CB C -8.977 10.694 -3.206 1.00 . A A . 2 THR CB 1 1 15 10012 1 1 2 THR CG2 C -7.931 9.848 -2.492 1.00 . A A . 2 THR CG2 1 1 15 10013 1 1 2 THR H H -10.531 11.255 -5.705 1.00 . A A . 2 THR H 1 1 15 10014 1 1 2 THR HA H -7.741 11.002 -4.931 1.00 . A A . 2 THR HA 1 1 15 10015 1 1 2 THR HB H -9.955 10.287 -2.995 1.00 . A A . 2 THR HB 1 1 15 10016 1 1 2 THR HG1 H -8.286 12.542 -3.255 1.00 . A A . 2 THR HG1 1 1 15 10017 1 1 2 THR HG21 H -7.885 8.872 -2.951 1.00 . A A . 2 THR HG21 1 1 15 10018 1 1 2 THR HG22 H -8.201 9.745 -1.452 1.00 . A A . 2 THR HG22 1 1 15 10019 1 1 2 THR HG23 H -6.967 10.328 -2.569 1.00 . A A . 2 THR HG23 1 1 15 10020 1 1 2 THR N N -9.660 11.589 -5.405 1.00 . A A . 2 THR N 1 1 15 10021 1 1 2 THR O O -9.970 8.629 -5.056 1.00 . A A . 2 THR O 1 1 15 10022 1 1 2 THR OG1 O -8.914 12.042 -2.723 1.00 . A A . 2 THR OG1 1 1 15 10023 1 1 3 CYS C C -7.335 6.454 -5.549 1.00 . A A . 3 CYS C 1 1 15 10024 1 1 3 CYS CA C -7.924 7.459 -6.529 1.00 . A A . 3 CYS CA 1 1 15 10025 1 1 3 CYS CB C -7.150 7.466 -7.851 1.00 . A A . 3 CYS CB 1 1 15 10026 1 1 3 CYS H H -7.123 9.350 -6.075 1.00 . A A . 3 CYS H 1 1 15 10027 1 1 3 CYS HA H -8.952 7.191 -6.726 1.00 . A A . 3 CYS HA 1 1 15 10028 1 1 3 CYS HB2 H -6.219 8.000 -7.713 1.00 . A A . 3 CYS HB2 1 1 15 10029 1 1 3 CYS HB3 H -6.940 6.448 -8.145 1.00 . A A . 3 CYS HB3 1 1 15 10030 1 1 3 CYS N N -7.917 8.785 -5.951 1.00 . A A . 3 CYS N 1 1 15 10031 1 1 3 CYS O O -6.340 6.736 -4.877 1.00 . A A . 3 CYS O 1 1 15 10032 1 1 3 CYS SG S -8.040 8.273 -9.222 1.00 . A A . 3 CYS SG 1 1 15 10033 1 1 4 LYS C C -7.563 2.889 -5.229 1.00 . A A . 4 LYS C 1 1 15 10034 1 1 4 LYS CA C -7.516 4.247 -4.550 1.00 . A A . 4 LYS CA 1 1 15 10035 1 1 4 LYS CB C -8.398 4.232 -3.301 1.00 . A A . 4 LYS CB 1 1 15 10036 1 1 4 LYS CD C -9.031 3.074 -1.149 1.00 . A A . 4 LYS CD 1 1 15 10037 1 1 4 LYS CE C -10.343 2.404 -1.558 1.00 . A A . 4 LYS CE 1 1 15 10038 1 1 4 LYS CG C -8.034 3.146 -2.299 1.00 . A A . 4 LYS CG 1 1 15 10039 1 1 4 LYS H H -8.754 5.133 -6.014 1.00 . A A . 4 LYS H 1 1 15 10040 1 1 4 LYS HA H -6.495 4.457 -4.260 1.00 . A A . 4 LYS HA 1 1 15 10041 1 1 4 LYS HB2 H -8.315 5.188 -2.806 1.00 . A A . 4 LYS HB2 1 1 15 10042 1 1 4 LYS HB3 H -9.425 4.083 -3.602 1.00 . A A . 4 LYS HB3 1 1 15 10043 1 1 4 LYS HD2 H -8.589 2.507 -0.343 1.00 . A A . 4 LYS HD2 1 1 15 10044 1 1 4 LYS HD3 H -9.242 4.077 -0.809 1.00 . A A . 4 LYS HD3 1 1 15 10045 1 1 4 LYS HE2 H -10.115 1.456 -2.021 1.00 . A A . 4 LYS HE2 1 1 15 10046 1 1 4 LYS HE3 H -10.933 2.233 -0.669 1.00 . A A . 4 LYS HE3 1 1 15 10047 1 1 4 LYS HG2 H -8.020 2.194 -2.808 1.00 . A A . 4 LYS HG2 1 1 15 10048 1 1 4 LYS HG3 H -7.053 3.356 -1.899 1.00 . A A . 4 LYS HG3 1 1 15 10049 1 1 4 LYS HZ1 H -10.849 4.223 -2.457 1.00 . A A . 4 LYS HZ1 1 1 15 10050 1 1 4 LYS HZ2 H -12.151 3.158 -2.289 1.00 . A A . 4 LYS HZ2 1 1 15 10051 1 1 4 LYS HZ3 H -10.989 2.888 -3.487 1.00 . A A . 4 LYS HZ3 1 1 15 10052 1 1 4 LYS N N -7.962 5.291 -5.459 1.00 . A A . 4 LYS N 1 1 15 10053 1 1 4 LYS NZ N -11.139 3.226 -2.514 1.00 . A A . 4 LYS NZ 1 1 15 10054 1 1 4 LYS O O -8.589 2.498 -5.786 1.00 . A A . 4 LYS O 1 1 15 10055 1 1 5 ALA C C -5.109 0.172 -5.143 1.00 . A A . 5 ALA C 1 1 15 10056 1 1 5 ALA CA C -6.315 0.862 -5.750 1.00 . A A . 5 ALA CA 1 1 15 10057 1 1 5 ALA CB C -6.172 0.957 -7.263 1.00 . A A . 5 ALA CB 1 1 15 10058 1 1 5 ALA H H -5.675 2.566 -4.685 1.00 . A A . 5 ALA H 1 1 15 10059 1 1 5 ALA HA H -7.206 0.294 -5.521 1.00 . A A . 5 ALA HA 1 1 15 10060 1 1 5 ALA HB1 H -6.816 1.739 -7.637 1.00 . A A . 5 ALA HB1 1 1 15 10061 1 1 5 ALA HB2 H -6.452 0.015 -7.711 1.00 . A A . 5 ALA HB2 1 1 15 10062 1 1 5 ALA HB3 H -5.146 1.184 -7.514 1.00 . A A . 5 ALA HB3 1 1 15 10063 1 1 5 ALA N N -6.449 2.184 -5.161 1.00 . A A . 5 ALA N 1 1 15 10064 1 1 5 ALA O O -4.106 0.823 -4.858 1.00 . A A . 5 ALA O 1 1 15 10065 1 1 6 GLU C C -2.925 -1.919 -5.265 1.00 . A A . 6 GLU C 1 1 15 10066 1 1 6 GLU CA C -4.120 -1.879 -4.330 1.00 . A A . 6 GLU CA 1 1 15 10067 1 1 6 GLU CB C -4.562 -3.298 -3.989 1.00 . A A . 6 GLU CB 1 1 15 10068 1 1 6 GLU CD C -6.264 -4.761 -2.852 1.00 . A A . 6 GLU CD 1 1 15 10069 1 1 6 GLU CG C -5.892 -3.356 -3.262 1.00 . A A . 6 GLU CG 1 1 15 10070 1 1 6 GLU H H -6.036 -1.591 -5.154 1.00 . A A . 6 GLU H 1 1 15 10071 1 1 6 GLU HA H -3.830 -1.375 -3.420 1.00 . A A . 6 GLU HA 1 1 15 10072 1 1 6 GLU HB2 H -4.641 -3.873 -4.899 1.00 . A A . 6 GLU HB2 1 1 15 10073 1 1 6 GLU HB3 H -3.813 -3.750 -3.356 1.00 . A A . 6 GLU HB3 1 1 15 10074 1 1 6 GLU HG2 H -5.831 -2.743 -2.375 1.00 . A A . 6 GLU HG2 1 1 15 10075 1 1 6 GLU HG3 H -6.662 -2.970 -3.914 1.00 . A A . 6 GLU HG3 1 1 15 10076 1 1 6 GLU N N -5.210 -1.127 -4.923 1.00 . A A . 6 GLU N 1 1 15 10077 1 1 6 GLU O O -3.080 -1.989 -6.487 1.00 . A A . 6 GLU O 1 1 15 10078 1 1 6 GLU OE1 O -5.480 -5.692 -3.134 1.00 . A A . 6 GLU OE1 1 1 15 10079 1 1 6 GLU OE2 O -7.331 -4.939 -2.234 1.00 . A A . 6 GLU OE2 1 1 15 10080 1 1 7 CYS C C -0.430 -3.170 -6.278 1.00 . A A . 7 CYS C 1 1 15 10081 1 1 7 CYS CA C -0.503 -1.890 -5.448 1.00 . A A . 7 CYS CA 1 1 15 10082 1 1 7 CYS CB C 0.710 -1.796 -4.516 1.00 . A A . 7 CYS CB 1 1 15 10083 1 1 7 CYS H H -1.702 -1.798 -3.701 1.00 . A A . 7 CYS H 1 1 15 10084 1 1 7 CYS HA H -0.506 -1.040 -6.114 1.00 . A A . 7 CYS HA 1 1 15 10085 1 1 7 CYS HB2 H 0.575 -0.963 -3.843 1.00 . A A . 7 CYS HB2 1 1 15 10086 1 1 7 CYS HB3 H 0.784 -2.708 -3.941 1.00 . A A . 7 CYS HB3 1 1 15 10087 1 1 7 CYS N N -1.741 -1.863 -4.681 1.00 . A A . 7 CYS N 1 1 15 10088 1 1 7 CYS O O -0.592 -4.270 -5.749 1.00 . A A . 7 CYS O 1 1 15 10089 1 1 7 CYS SG S 2.298 -1.555 -5.384 1.00 . A A . 7 CYS SG 1 1 15 10090 1 1 8 PRO C C 0.958 -5.177 -8.105 1.00 . A A . 8 PRO C 1 1 15 10091 1 1 8 PRO CA C -0.128 -4.187 -8.509 1.00 . A A . 8 PRO CA 1 1 15 10092 1 1 8 PRO CB C 0.204 -3.552 -9.865 1.00 . A A . 8 PRO CB 1 1 15 10093 1 1 8 PRO CD C -0.028 -1.760 -8.305 1.00 . A A . 8 PRO CD 1 1 15 10094 1 1 8 PRO CG C -0.237 -2.134 -9.744 1.00 . A A . 8 PRO CG 1 1 15 10095 1 1 8 PRO HA H -1.075 -4.703 -8.573 1.00 . A A . 8 PRO HA 1 1 15 10096 1 1 8 PRO HB2 H 1.267 -3.622 -10.046 1.00 . A A . 8 PRO HB2 1 1 15 10097 1 1 8 PRO HB3 H -0.334 -4.066 -10.647 1.00 . A A . 8 PRO HB3 1 1 15 10098 1 1 8 PRO HD2 H 0.968 -1.370 -8.156 1.00 . A A . 8 PRO HD2 1 1 15 10099 1 1 8 PRO HD3 H -0.769 -1.040 -7.989 1.00 . A A . 8 PRO HD3 1 1 15 10100 1 1 8 PRO HG2 H 0.364 -1.506 -10.385 1.00 . A A . 8 PRO HG2 1 1 15 10101 1 1 8 PRO HG3 H -1.281 -2.050 -10.005 1.00 . A A . 8 PRO HG3 1 1 15 10102 1 1 8 PRO N N -0.205 -3.039 -7.597 1.00 . A A . 8 PRO N 1 1 15 10103 1 1 8 PRO O O 0.766 -6.389 -8.168 1.00 . A A . 8 PRO O 1 1 15 10104 1 1 9 THR C C 3.106 -5.834 -5.780 1.00 . A A . 9 THR C 1 1 15 10105 1 1 9 THR CA C 3.214 -5.474 -7.261 1.00 . A A . 9 THR CA 1 1 15 10106 1 1 9 THR CB C 4.549 -4.755 -7.528 1.00 . A A . 9 THR CB 1 1 15 10107 1 1 9 THR CG2 C 4.969 -4.914 -8.981 1.00 . A A . 9 THR CG2 1 1 15 10108 1 1 9 THR H H 2.186 -3.676 -7.648 1.00 . A A . 9 THR H 1 1 15 10109 1 1 9 THR HA H 3.197 -6.383 -7.844 1.00 . A A . 9 THR HA 1 1 15 10110 1 1 9 THR HB H 5.310 -5.193 -6.898 1.00 . A A . 9 THR HB 1 1 15 10111 1 1 9 THR HG1 H 4.153 -3.268 -6.285 1.00 . A A . 9 THR HG1 1 1 15 10112 1 1 9 THR HG21 H 5.081 -3.939 -9.432 1.00 . A A . 9 THR HG21 1 1 15 10113 1 1 9 THR HG22 H 4.215 -5.473 -9.515 1.00 . A A . 9 THR HG22 1 1 15 10114 1 1 9 THR HG23 H 5.910 -5.442 -9.029 1.00 . A A . 9 THR HG23 1 1 15 10115 1 1 9 THR N N 2.096 -4.650 -7.684 1.00 . A A . 9 THR N 1 1 15 10116 1 1 9 THR O O 4.056 -5.660 -5.018 1.00 . A A . 9 THR O 1 1 15 10117 1 1 9 THR OG1 O 4.424 -3.360 -7.211 1.00 . A A . 9 THR OG1 1 1 15 10118 1 1 10 TRP C C 0.914 -7.993 -3.910 1.00 . A A . 10 TRP C 1 1 15 10119 1 1 10 TRP CA C 1.719 -6.702 -3.991 1.00 . A A . 10 TRP CA 1 1 15 10120 1 1 10 TRP CB C 0.975 -5.583 -3.258 1.00 . A A . 10 TRP CB 1 1 15 10121 1 1 10 TRP CD1 C -0.045 -6.291 -1.018 1.00 . A A . 10 TRP CD1 1 1 15 10122 1 1 10 TRP CD2 C 1.984 -5.359 -0.855 1.00 . A A . 10 TRP CD2 1 1 15 10123 1 1 10 TRP CE2 C 1.546 -5.703 0.438 1.00 . A A . 10 TRP CE2 1 1 15 10124 1 1 10 TRP CE3 C 3.234 -4.756 -1.006 1.00 . A A . 10 TRP CE3 1 1 15 10125 1 1 10 TRP CG C 0.957 -5.753 -1.771 1.00 . A A . 10 TRP CG 1 1 15 10126 1 1 10 TRP CH2 C 3.537 -4.867 1.392 1.00 . A A . 10 TRP CH2 1 1 15 10127 1 1 10 TRP CZ2 C 2.320 -5.459 1.574 1.00 . A A . 10 TRP CZ2 1 1 15 10128 1 1 10 TRP CZ3 C 3.996 -4.515 0.118 1.00 . A A . 10 TRP CZ3 1 1 15 10129 1 1 10 TRP H H 1.217 -6.444 -6.028 1.00 . A A . 10 TRP H 1 1 15 10130 1 1 10 TRP HA H 2.680 -6.854 -3.524 1.00 . A A . 10 TRP HA 1 1 15 10131 1 1 10 TRP HB2 H 1.450 -4.639 -3.478 1.00 . A A . 10 TRP HB2 1 1 15 10132 1 1 10 TRP HB3 H -0.048 -5.554 -3.603 1.00 . A A . 10 TRP HB3 1 1 15 10133 1 1 10 TRP HD1 H -0.969 -6.678 -1.424 1.00 . A A . 10 TRP HD1 1 1 15 10134 1 1 10 TRP HE1 H -0.246 -6.612 1.051 1.00 . A A . 10 TRP HE1 1 1 15 10135 1 1 10 TRP HE3 H 3.605 -4.477 -1.982 1.00 . A A . 10 TRP HE3 1 1 15 10136 1 1 10 TRP HH2 H 4.168 -4.658 2.244 1.00 . A A . 10 TRP HH2 1 1 15 10137 1 1 10 TRP HZ2 H 1.986 -5.723 2.568 1.00 . A A . 10 TRP HZ2 1 1 15 10138 1 1 10 TRP HZ3 H 4.963 -4.045 0.021 1.00 . A A . 10 TRP HZ3 1 1 15 10139 1 1 10 TRP N N 1.943 -6.328 -5.377 1.00 . A A . 10 TRP N 1 1 15 10140 1 1 10 TRP NE1 N 0.304 -6.270 0.312 1.00 . A A . 10 TRP NE1 1 1 15 10141 1 1 10 TRP O O -0.235 -8.050 -4.351 1.00 . A A . 10 TRP O 1 1 15 10142 1 1 11 ASP C C 1.301 -10.970 -1.893 1.00 . A A . 11 ASP C 1 1 15 10143 1 1 11 ASP CA C 0.885 -10.324 -3.210 1.00 . A A . 11 ASP CA 1 1 15 10144 1 1 11 ASP CB C 1.277 -11.233 -4.383 1.00 . A A . 11 ASP CB 1 1 15 10145 1 1 11 ASP CG C 2.753 -11.602 -4.371 1.00 . A A . 11 ASP CG 1 1 15 10146 1 1 11 ASP H H 2.449 -8.914 -3.032 1.00 . A A . 11 ASP H 1 1 15 10147 1 1 11 ASP HA H -0.184 -10.177 -3.212 1.00 . A A . 11 ASP HA 1 1 15 10148 1 1 11 ASP HB2 H 0.699 -12.143 -4.333 1.00 . A A . 11 ASP HB2 1 1 15 10149 1 1 11 ASP HB3 H 1.060 -10.724 -5.311 1.00 . A A . 11 ASP HB3 1 1 15 10150 1 1 11 ASP N N 1.527 -9.022 -3.350 1.00 . A A . 11 ASP N 1 1 15 10151 1 1 11 ASP O O 1.350 -12.191 -1.762 1.00 . A A . 11 ASP O 1 1 15 10152 1 1 11 ASP OD1 O 3.598 -10.684 -4.274 1.00 . A A . 11 ASP OD1 1 1 15 10153 1 1 11 ASP OD2 O 3.065 -12.807 -4.464 1.00 . A A . 11 ASP OD2 1 1 15 10154 1 1 12 SER C C 1.226 -9.944 1.510 1.00 . A A . 12 SER C 1 1 15 10155 1 1 12 SER CA C 2.012 -10.622 0.394 1.00 . A A . 12 SER CA 1 1 15 10156 1 1 12 SER CB C 3.510 -10.381 0.586 1.00 . A A . 12 SER CB 1 1 15 10157 1 1 12 SER H H 1.531 -9.171 -1.065 1.00 . A A . 12 SER H 1 1 15 10158 1 1 12 SER HA H 1.821 -11.684 0.429 1.00 . A A . 12 SER HA 1 1 15 10159 1 1 12 SER HB2 H 3.710 -9.321 0.538 1.00 . A A . 12 SER HB2 1 1 15 10160 1 1 12 SER HB3 H 3.812 -10.761 1.551 1.00 . A A . 12 SER HB3 1 1 15 10161 1 1 12 SER HG H 3.696 -11.255 -1.166 1.00 . A A . 12 SER HG 1 1 15 10162 1 1 12 SER N N 1.595 -10.136 -0.910 1.00 . A A . 12 SER N 1 1 15 10163 1 1 12 SER O O 0.585 -8.914 1.297 1.00 . A A . 12 SER O 1 1 15 10164 1 1 12 SER OG O 4.268 -11.033 -0.419 1.00 . A A . 12 SER OG 1 1 15 10165 1 1 13 VAL C C 1.370 -8.801 4.422 1.00 . A A . 13 VAL C 1 1 15 10166 1 1 13 VAL CA C 0.586 -9.977 3.851 1.00 . A A . 13 VAL CA 1 1 15 10167 1 1 13 VAL CB C 0.384 -11.046 4.949 1.00 . A A . 13 VAL CB 1 1 15 10168 1 1 13 VAL CG1 C -0.373 -10.472 6.137 1.00 . A A . 13 VAL CG1 1 1 15 10169 1 1 13 VAL CG2 C -0.343 -12.259 4.386 1.00 . A A . 13 VAL CG2 1 1 15 10170 1 1 13 VAL H H 1.813 -11.341 2.808 1.00 . A A . 13 VAL H 1 1 15 10171 1 1 13 VAL HA H -0.384 -9.631 3.524 1.00 . A A . 13 VAL HA 1 1 15 10172 1 1 13 VAL HB H 1.357 -11.366 5.293 1.00 . A A . 13 VAL HB 1 1 15 10173 1 1 13 VAL HG11 H 0.331 -10.094 6.864 1.00 . A A . 13 VAL HG11 1 1 15 10174 1 1 13 VAL HG12 H -0.976 -11.246 6.588 1.00 . A A . 13 VAL HG12 1 1 15 10175 1 1 13 VAL HG13 H -1.011 -9.667 5.803 1.00 . A A . 13 VAL HG13 1 1 15 10176 1 1 13 VAL HG21 H -0.686 -12.882 5.199 1.00 . A A . 13 VAL HG21 1 1 15 10177 1 1 13 VAL HG22 H 0.332 -12.824 3.760 1.00 . A A . 13 VAL HG22 1 1 15 10178 1 1 13 VAL HG23 H -1.189 -11.932 3.801 1.00 . A A . 13 VAL HG23 1 1 15 10179 1 1 13 VAL N N 1.284 -10.526 2.700 1.00 . A A . 13 VAL N 1 1 15 10180 1 1 13 VAL O O 2.553 -8.923 4.738 1.00 . A A . 13 VAL O 1 1 15 10181 1 1 14 CYS C C 1.540 -6.543 6.561 1.00 . A A . 14 CYS C 1 1 15 10182 1 1 14 CYS CA C 1.330 -6.457 5.055 1.00 . A A . 14 CYS CA 1 1 15 10183 1 1 14 CYS CB C 0.476 -5.237 4.719 1.00 . A A . 14 CYS CB 1 1 15 10184 1 1 14 CYS H H -0.232 -7.630 4.255 1.00 . A A . 14 CYS H 1 1 15 10185 1 1 14 CYS HA H 2.292 -6.352 4.576 1.00 . A A . 14 CYS HA 1 1 15 10186 1 1 14 CYS HB2 H 0.537 -5.046 3.659 1.00 . A A . 14 CYS HB2 1 1 15 10187 1 1 14 CYS HB3 H -0.551 -5.443 4.984 1.00 . A A . 14 CYS HB3 1 1 15 10188 1 1 14 CYS N N 0.705 -7.663 4.535 1.00 . A A . 14 CYS N 1 1 15 10189 1 1 14 CYS O O 0.597 -6.770 7.322 1.00 . A A . 14 CYS O 1 1 15 10190 1 1 14 CYS SG S 0.976 -3.718 5.584 1.00 . A A . 14 CYS SG 1 1 15 10191 1 1 15 ILE C C 3.307 -4.974 8.930 1.00 . A A . 15 ILE C 1 1 15 10192 1 1 15 ILE CA C 3.139 -6.395 8.389 1.00 . A A . 15 ILE CA 1 1 15 10193 1 1 15 ILE CB C 4.447 -7.197 8.609 1.00 . A A . 15 ILE CB 1 1 15 10194 1 1 15 ILE CD1 C 3.212 -9.436 8.541 1.00 . A A . 15 ILE CD1 1 1 15 10195 1 1 15 ILE CG1 C 4.337 -8.590 7.976 1.00 . A A . 15 ILE CG1 1 1 15 10196 1 1 15 ILE CG2 C 4.773 -7.314 10.094 1.00 . A A . 15 ILE CG2 1 1 15 10197 1 1 15 ILE H H 3.481 -6.177 6.318 1.00 . A A . 15 ILE H 1 1 15 10198 1 1 15 ILE HA H 2.339 -6.887 8.925 1.00 . A A . 15 ILE HA 1 1 15 10199 1 1 15 ILE HB H 5.253 -6.659 8.133 1.00 . A A . 15 ILE HB 1 1 15 10200 1 1 15 ILE HD11 H 3.352 -9.556 9.605 1.00 . A A . 15 ILE HD11 1 1 15 10201 1 1 15 ILE HD12 H 3.218 -10.405 8.066 1.00 . A A . 15 ILE HD12 1 1 15 10202 1 1 15 ILE HD13 H 2.267 -8.948 8.355 1.00 . A A . 15 ILE HD13 1 1 15 10203 1 1 15 ILE HG12 H 4.166 -8.483 6.916 1.00 . A A . 15 ILE HG12 1 1 15 10204 1 1 15 ILE HG13 H 5.264 -9.122 8.134 1.00 . A A . 15 ILE HG13 1 1 15 10205 1 1 15 ILE HG21 H 5.827 -7.513 10.216 1.00 . A A . 15 ILE HG21 1 1 15 10206 1 1 15 ILE HG22 H 4.201 -8.123 10.525 1.00 . A A . 15 ILE HG22 1 1 15 10207 1 1 15 ILE HG23 H 4.520 -6.390 10.592 1.00 . A A . 15 ILE HG23 1 1 15 10208 1 1 15 ILE N N 2.782 -6.353 6.978 1.00 . A A . 15 ILE N 1 1 15 10209 1 1 15 ILE O O 3.168 -4.723 10.127 1.00 . A A . 15 ILE O 1 1 15 10210 1 1 16 ASN C C 3.435 -1.747 7.225 1.00 . A A . 16 ASN C 1 1 15 10211 1 1 16 ASN CA C 3.808 -2.650 8.399 1.00 . A A . 16 ASN CA 1 1 15 10212 1 1 16 ASN CB C 5.270 -2.427 8.818 1.00 . A A . 16 ASN CB 1 1 15 10213 1 1 16 ASN CG C 5.524 -1.061 9.437 1.00 . A A . 16 ASN CG 1 1 15 10214 1 1 16 ASN H H 3.703 -4.304 7.092 1.00 . A A . 16 ASN H 1 1 15 10215 1 1 16 ASN HA H 3.160 -2.428 9.234 1.00 . A A . 16 ASN HA 1 1 15 10216 1 1 16 ASN HB2 H 5.545 -3.179 9.542 1.00 . A A . 16 ASN HB2 1 1 15 10217 1 1 16 ASN HB3 H 5.903 -2.528 7.948 1.00 . A A . 16 ASN HB3 1 1 15 10218 1 1 16 ASN HD21 H 5.790 -1.893 11.220 1.00 . A A . 16 ASN HD21 1 1 15 10219 1 1 16 ASN HD22 H 5.947 -0.173 11.160 1.00 . A A . 16 ASN HD22 1 1 15 10220 1 1 16 ASN N N 3.610 -4.045 8.030 1.00 . A A . 16 ASN N 1 1 15 10221 1 1 16 ASN ND2 N 5.779 -1.040 10.735 1.00 . A A . 16 ASN ND2 1 1 15 10222 1 1 16 ASN O O 3.465 -2.180 6.076 1.00 . A A . 16 ASN O 1 1 15 10223 1 1 16 ASN OD1 O 5.491 -0.036 8.758 1.00 . A A . 16 ASN OD1 1 1 15 10224 1 1 17 LYS C C 3.845 0.774 5.547 1.00 . A A . 17 LYS C 1 1 15 10225 1 1 17 LYS CA C 2.681 0.460 6.495 1.00 . A A . 17 LYS CA 1 1 15 10226 1 1 17 LYS CB C 2.182 1.750 7.158 1.00 . A A . 17 LYS CB 1 1 15 10227 1 1 17 LYS CD C 1.035 3.977 6.922 1.00 . A A . 17 LYS CD 1 1 15 10228 1 1 17 LYS CE C 0.117 4.836 6.062 1.00 . A A . 17 LYS CE 1 1 15 10229 1 1 17 LYS CG C 1.438 2.688 6.216 1.00 . A A . 17 LYS CG 1 1 15 10230 1 1 17 LYS H H 3.062 -0.227 8.460 1.00 . A A . 17 LYS H 1 1 15 10231 1 1 17 LYS HA H 1.875 0.026 5.923 1.00 . A A . 17 LYS HA 1 1 15 10232 1 1 17 LYS HB2 H 1.517 1.488 7.966 1.00 . A A . 17 LYS HB2 1 1 15 10233 1 1 17 LYS HB3 H 3.031 2.281 7.562 1.00 . A A . 17 LYS HB3 1 1 15 10234 1 1 17 LYS HD2 H 0.520 3.727 7.837 1.00 . A A . 17 LYS HD2 1 1 15 10235 1 1 17 LYS HD3 H 1.927 4.541 7.153 1.00 . A A . 17 LYS HD3 1 1 15 10236 1 1 17 LYS HE2 H -0.783 4.277 5.852 1.00 . A A . 17 LYS HE2 1 1 15 10237 1 1 17 LYS HE3 H -0.137 5.729 6.614 1.00 . A A . 17 LYS HE3 1 1 15 10238 1 1 17 LYS HG2 H 2.081 2.931 5.383 1.00 . A A . 17 LYS HG2 1 1 15 10239 1 1 17 LYS HG3 H 0.549 2.192 5.856 1.00 . A A . 17 LYS HG3 1 1 15 10240 1 1 17 LYS HZ1 H 0.242 6.043 4.352 1.00 . A A . 17 LYS HZ1 1 1 15 10241 1 1 17 LYS HZ2 H 0.715 4.436 4.099 1.00 . A A . 17 LYS HZ2 1 1 15 10242 1 1 17 LYS HZ3 H 1.741 5.497 4.923 1.00 . A A . 17 LYS HZ3 1 1 15 10243 1 1 17 LYS N N 3.073 -0.505 7.521 1.00 . A A . 17 LYS N 1 1 15 10244 1 1 17 LYS NZ N 0.750 5.227 4.776 1.00 . A A . 17 LYS NZ 1 1 15 10245 1 1 17 LYS O O 3.627 1.077 4.374 1.00 . A A . 17 LYS O 1 1 15 10246 1 1 18 LYS C C 6.299 0.260 3.942 1.00 . A A . 18 LYS C 1 1 15 10247 1 1 18 LYS CA C 6.286 1.000 5.296 1.00 . A A . 18 LYS CA 1 1 15 10248 1 1 18 LYS CB C 7.533 0.654 6.125 1.00 . A A . 18 LYS CB 1 1 15 10249 1 1 18 LYS CD C 8.999 2.574 5.418 1.00 . A A . 18 LYS CD 1 1 15 10250 1 1 18 LYS CE C 10.397 2.976 4.974 1.00 . A A . 18 LYS CE 1 1 15 10251 1 1 18 LYS CG C 8.850 1.062 5.482 1.00 . A A . 18 LYS CG 1 1 15 10252 1 1 18 LYS H H 5.166 0.469 7.023 1.00 . A A . 18 LYS H 1 1 15 10253 1 1 18 LYS HA H 6.291 2.061 5.098 1.00 . A A . 18 LYS HA 1 1 15 10254 1 1 18 LYS HB2 H 7.461 1.149 7.081 1.00 . A A . 18 LYS HB2 1 1 15 10255 1 1 18 LYS HB3 H 7.555 -0.414 6.287 1.00 . A A . 18 LYS HB3 1 1 15 10256 1 1 18 LYS HD2 H 8.281 2.968 4.714 1.00 . A A . 18 LYS HD2 1 1 15 10257 1 1 18 LYS HD3 H 8.810 2.986 6.398 1.00 . A A . 18 LYS HD3 1 1 15 10258 1 1 18 LYS HE2 H 10.589 2.547 4.001 1.00 . A A . 18 LYS HE2 1 1 15 10259 1 1 18 LYS HE3 H 10.444 4.053 4.907 1.00 . A A . 18 LYS HE3 1 1 15 10260 1 1 18 LYS HG2 H 9.664 0.655 6.063 1.00 . A A . 18 LYS HG2 1 1 15 10261 1 1 18 LYS HG3 H 8.887 0.663 4.478 1.00 . A A . 18 LYS HG3 1 1 15 10262 1 1 18 LYS HZ1 H 12.361 2.925 5.688 1.00 . A A . 18 LYS HZ1 1 1 15 10263 1 1 18 LYS HZ2 H 11.526 1.467 5.879 1.00 . A A . 18 LYS HZ2 1 1 15 10264 1 1 18 LYS HZ3 H 11.188 2.774 6.898 1.00 . A A . 18 LYS HZ3 1 1 15 10265 1 1 18 LYS N N 5.073 0.710 6.074 1.00 . A A . 18 LYS N 1 1 15 10266 1 1 18 LYS NZ N 11.441 2.503 5.926 1.00 . A A . 18 LYS NZ 1 1 15 10267 1 1 18 LYS O O 6.361 0.912 2.896 1.00 . A A . 18 LYS O 1 1 15 10268 1 1 19 PRO C C 5.184 -1.396 1.682 1.00 . A A . 19 PRO C 1 1 15 10269 1 1 19 PRO CA C 6.236 -1.882 2.678 1.00 . A A . 19 PRO CA 1 1 15 10270 1 1 19 PRO CB C 5.868 -3.287 3.161 1.00 . A A . 19 PRO CB 1 1 15 10271 1 1 19 PRO CD C 6.186 -1.983 5.111 1.00 . A A . 19 PRO CD 1 1 15 10272 1 1 19 PRO CG C 6.416 -3.350 4.536 1.00 . A A . 19 PRO CG 1 1 15 10273 1 1 19 PRO HA H 7.207 -1.898 2.207 1.00 . A A . 19 PRO HA 1 1 15 10274 1 1 19 PRO HB2 H 4.792 -3.397 3.161 1.00 . A A . 19 PRO HB2 1 1 15 10275 1 1 19 PRO HB3 H 6.308 -4.033 2.519 1.00 . A A . 19 PRO HB3 1 1 15 10276 1 1 19 PRO HD2 H 5.217 -1.932 5.586 1.00 . A A . 19 PRO HD2 1 1 15 10277 1 1 19 PRO HD3 H 6.966 -1.733 5.814 1.00 . A A . 19 PRO HD3 1 1 15 10278 1 1 19 PRO HG2 H 5.888 -4.097 5.111 1.00 . A A . 19 PRO HG2 1 1 15 10279 1 1 19 PRO HG3 H 7.472 -3.572 4.504 1.00 . A A . 19 PRO HG3 1 1 15 10280 1 1 19 PRO N N 6.240 -1.097 3.927 1.00 . A A . 19 PRO N 1 1 15 10281 1 1 19 PRO O O 5.443 -1.293 0.480 1.00 . A A . 19 PRO O 1 1 15 10282 1 1 20 CYS C C 3.224 0.696 0.710 1.00 . A A . 20 CYS C 1 1 15 10283 1 1 20 CYS CA C 2.891 -0.639 1.373 1.00 . A A . 20 CYS CA 1 1 15 10284 1 1 20 CYS CB C 1.626 -0.508 2.225 1.00 . A A . 20 CYS CB 1 1 15 10285 1 1 20 CYS H H 3.860 -1.210 3.162 1.00 . A A . 20 CYS H 1 1 15 10286 1 1 20 CYS HA H 2.721 -1.378 0.603 1.00 . A A . 20 CYS HA 1 1 15 10287 1 1 20 CYS HB2 H 1.462 -1.434 2.755 1.00 . A A . 20 CYS HB2 1 1 15 10288 1 1 20 CYS HB3 H 1.767 0.288 2.941 1.00 . A A . 20 CYS HB3 1 1 15 10289 1 1 20 CYS N N 3.997 -1.105 2.197 1.00 . A A . 20 CYS N 1 1 15 10290 1 1 20 CYS O O 3.076 0.849 -0.503 1.00 . A A . 20 CYS O 1 1 15 10291 1 1 20 CYS SG S 0.114 -0.142 1.279 1.00 . A A . 20 CYS SG 1 1 15 10292 1 1 21 VAL C C 5.116 2.853 -0.096 1.00 . A A . 21 VAL C 1 1 15 10293 1 1 21 VAL CA C 4.051 2.974 0.990 1.00 . A A . 21 VAL CA 1 1 15 10294 1 1 21 VAL CB C 4.566 3.903 2.113 1.00 . A A . 21 VAL CB 1 1 15 10295 1 1 21 VAL CG1 C 4.881 5.290 1.572 1.00 . A A . 21 VAL CG1 1 1 15 10296 1 1 21 VAL CG2 C 3.552 3.992 3.241 1.00 . A A . 21 VAL CG2 1 1 15 10297 1 1 21 VAL H H 3.799 1.470 2.466 1.00 . A A . 21 VAL H 1 1 15 10298 1 1 21 VAL HA H 3.163 3.418 0.558 1.00 . A A . 21 VAL HA 1 1 15 10299 1 1 21 VAL HB H 5.478 3.481 2.511 1.00 . A A . 21 VAL HB 1 1 15 10300 1 1 21 VAL HG11 H 5.859 5.596 1.914 1.00 . A A . 21 VAL HG11 1 1 15 10301 1 1 21 VAL HG12 H 4.140 5.991 1.925 1.00 . A A . 21 VAL HG12 1 1 15 10302 1 1 21 VAL HG13 H 4.869 5.266 0.492 1.00 . A A . 21 VAL HG13 1 1 15 10303 1 1 21 VAL HG21 H 2.654 3.462 2.961 1.00 . A A . 21 VAL HG21 1 1 15 10304 1 1 21 VAL HG22 H 3.314 5.029 3.429 1.00 . A A . 21 VAL HG22 1 1 15 10305 1 1 21 VAL HG23 H 3.968 3.550 4.134 1.00 . A A . 21 VAL HG23 1 1 15 10306 1 1 21 VAL N N 3.690 1.655 1.506 1.00 . A A . 21 VAL N 1 1 15 10307 1 1 21 VAL O O 5.073 3.560 -1.103 1.00 . A A . 21 VAL O 1 1 15 10308 1 1 22 ALA C C 6.542 1.243 -2.192 1.00 . A A . 22 ALA C 1 1 15 10309 1 1 22 ALA CA C 7.124 1.720 -0.864 1.00 . A A . 22 ALA CA 1 1 15 10310 1 1 22 ALA CB C 8.130 0.712 -0.328 1.00 . A A . 22 ALA CB 1 1 15 10311 1 1 22 ALA H H 6.034 1.398 0.926 1.00 . A A . 22 ALA H 1 1 15 10312 1 1 22 ALA HA H 7.636 2.658 -1.021 1.00 . A A . 22 ALA HA 1 1 15 10313 1 1 22 ALA HB1 H 8.682 0.282 -1.150 1.00 . A A . 22 ALA HB1 1 1 15 10314 1 1 22 ALA HB2 H 7.607 -0.070 0.203 1.00 . A A . 22 ALA HB2 1 1 15 10315 1 1 22 ALA HB3 H 8.813 1.209 0.345 1.00 . A A . 22 ALA HB3 1 1 15 10316 1 1 22 ALA N N 6.061 1.943 0.107 1.00 . A A . 22 ALA N 1 1 15 10317 1 1 22 ALA O O 6.885 1.767 -3.257 1.00 . A A . 22 ALA O 1 1 15 10318 1 1 23 CYS C C 4.172 0.795 -3.991 1.00 . A A . 23 CYS C 1 1 15 10319 1 1 23 CYS CA C 4.995 -0.285 -3.298 1.00 . A A . 23 CYS CA 1 1 15 10320 1 1 23 CYS CB C 4.083 -1.451 -2.900 1.00 . A A . 23 CYS CB 1 1 15 10321 1 1 23 CYS H H 5.410 -0.097 -1.231 1.00 . A A . 23 CYS H 1 1 15 10322 1 1 23 CYS HA H 5.758 -0.641 -3.973 1.00 . A A . 23 CYS HA 1 1 15 10323 1 1 23 CYS HB2 H 4.574 -2.033 -2.137 1.00 . A A . 23 CYS HB2 1 1 15 10324 1 1 23 CYS HB3 H 3.162 -1.053 -2.499 1.00 . A A . 23 CYS HB3 1 1 15 10325 1 1 23 CYS N N 5.647 0.264 -2.114 1.00 . A A . 23 CYS N 1 1 15 10326 1 1 23 CYS O O 4.247 0.977 -5.206 1.00 . A A . 23 CYS O 1 1 15 10327 1 1 23 CYS SG S 3.648 -2.582 -4.266 1.00 . A A . 23 CYS SG 1 1 15 10328 1 1 24 CYS C C 3.342 3.657 -4.418 1.00 . A A . 24 CYS C 1 1 15 10329 1 1 24 CYS CA C 2.538 2.566 -3.720 1.00 . A A . 24 CYS CA 1 1 15 10330 1 1 24 CYS CB C 1.705 3.150 -2.588 1.00 . A A . 24 CYS CB 1 1 15 10331 1 1 24 CYS H H 3.372 1.307 -2.240 1.00 . A A . 24 CYS H 1 1 15 10332 1 1 24 CYS HA H 1.871 2.122 -4.443 1.00 . A A . 24 CYS HA 1 1 15 10333 1 1 24 CYS HB2 H 2.360 3.441 -1.779 1.00 . A A . 24 CYS HB2 1 1 15 10334 1 1 24 CYS HB3 H 1.171 4.016 -2.942 1.00 . A A . 24 CYS HB3 1 1 15 10335 1 1 24 CYS N N 3.388 1.507 -3.205 1.00 . A A . 24 CYS N 1 1 15 10336 1 1 24 CYS O O 2.967 4.110 -5.495 1.00 . A A . 24 CYS O 1 1 15 10337 1 1 24 CYS SG S 0.488 1.971 -1.926 1.00 . A A . 24 CYS SG 1 1 15 10338 1 1 25 LYS C C 5.888 4.637 -5.730 1.00 . A A . 25 LYS C 1 1 15 10339 1 1 25 LYS CA C 5.277 5.111 -4.417 1.00 . A A . 25 LYS CA 1 1 15 10340 1 1 25 LYS CB C 6.360 5.582 -3.450 1.00 . A A . 25 LYS CB 1 1 15 10341 1 1 25 LYS CD C 6.923 7.027 -1.469 1.00 . A A . 25 LYS CD 1 1 15 10342 1 1 25 LYS CE C 7.732 5.950 -0.772 1.00 . A A . 25 LYS CE 1 1 15 10343 1 1 25 LYS CG C 5.811 6.433 -2.316 1.00 . A A . 25 LYS CG 1 1 15 10344 1 1 25 LYS H H 4.713 3.678 -2.957 1.00 . A A . 25 LYS H 1 1 15 10345 1 1 25 LYS HA H 4.627 5.947 -4.635 1.00 . A A . 25 LYS HA 1 1 15 10346 1 1 25 LYS HB2 H 6.849 4.718 -3.024 1.00 . A A . 25 LYS HB2 1 1 15 10347 1 1 25 LYS HB3 H 7.086 6.167 -3.994 1.00 . A A . 25 LYS HB3 1 1 15 10348 1 1 25 LYS HD2 H 7.580 7.600 -2.107 1.00 . A A . 25 LYS HD2 1 1 15 10349 1 1 25 LYS HD3 H 6.486 7.677 -0.724 1.00 . A A . 25 LYS HD3 1 1 15 10350 1 1 25 LYS HE2 H 7.076 5.385 -0.125 1.00 . A A . 25 LYS HE2 1 1 15 10351 1 1 25 LYS HE3 H 8.154 5.293 -1.518 1.00 . A A . 25 LYS HE3 1 1 15 10352 1 1 25 LYS HG2 H 5.224 7.237 -2.734 1.00 . A A . 25 LYS HG2 1 1 15 10353 1 1 25 LYS HG3 H 5.184 5.816 -1.688 1.00 . A A . 25 LYS HG3 1 1 15 10354 1 1 25 LYS HZ1 H 9.605 5.845 0.143 1.00 . A A . 25 LYS HZ1 1 1 15 10355 1 1 25 LYS HZ2 H 8.481 6.788 0.986 1.00 . A A . 25 LYS HZ2 1 1 15 10356 1 1 25 LYS HZ3 H 9.202 7.388 -0.421 1.00 . A A . 25 LYS HZ3 1 1 15 10357 1 1 25 LYS N N 4.448 4.074 -3.817 1.00 . A A . 25 LYS N 1 1 15 10358 1 1 25 LYS NZ N 8.832 6.532 0.041 1.00 . A A . 25 LYS NZ 1 1 15 10359 1 1 25 LYS O O 5.914 5.384 -6.707 1.00 . A A . 25 LYS O 1 1 15 10360 1 1 26 LYS C C 5.827 2.644 -8.048 1.00 . A A . 26 LYS C 1 1 15 10361 1 1 26 LYS CA C 6.928 2.861 -7.010 1.00 . A A . 26 LYS CA 1 1 15 10362 1 1 26 LYS CB C 7.713 1.561 -6.784 1.00 . A A . 26 LYS CB 1 1 15 10363 1 1 26 LYS CD C 7.324 -0.927 -6.914 1.00 . A A . 26 LYS CD 1 1 15 10364 1 1 26 LYS CE C 6.670 -1.183 -8.270 1.00 . A A . 26 LYS CE 1 1 15 10365 1 1 26 LYS CG C 6.870 0.392 -6.304 1.00 . A A . 26 LYS CG 1 1 15 10366 1 1 26 LYS H H 6.294 2.816 -4.978 1.00 . A A . 26 LYS H 1 1 15 10367 1 1 26 LYS HA H 7.606 3.612 -7.392 1.00 . A A . 26 LYS HA 1 1 15 10368 1 1 26 LYS HB2 H 8.181 1.275 -7.714 1.00 . A A . 26 LYS HB2 1 1 15 10369 1 1 26 LYS HB3 H 8.483 1.746 -6.049 1.00 . A A . 26 LYS HB3 1 1 15 10370 1 1 26 LYS HD2 H 8.395 -0.902 -7.044 1.00 . A A . 26 LYS HD2 1 1 15 10371 1 1 26 LYS HD3 H 7.061 -1.731 -6.242 1.00 . A A . 26 LYS HD3 1 1 15 10372 1 1 26 LYS HE2 H 6.967 -2.160 -8.617 1.00 . A A . 26 LYS HE2 1 1 15 10373 1 1 26 LYS HE3 H 5.597 -1.161 -8.143 1.00 . A A . 26 LYS HE3 1 1 15 10374 1 1 26 LYS HG2 H 6.950 0.323 -5.229 1.00 . A A . 26 LYS HG2 1 1 15 10375 1 1 26 LYS HG3 H 5.840 0.569 -6.577 1.00 . A A . 26 LYS HG3 1 1 15 10376 1 1 26 LYS HZ1 H 8.042 0.122 -9.155 1.00 . A A . 26 LYS HZ1 1 1 15 10377 1 1 26 LYS HZ2 H 6.442 0.670 -9.221 1.00 . A A . 26 LYS HZ2 1 1 15 10378 1 1 26 LYS HZ3 H 6.956 -0.573 -10.248 1.00 . A A . 26 LYS HZ3 1 1 15 10379 1 1 26 LYS N N 6.355 3.389 -5.775 1.00 . A A . 26 LYS N 1 1 15 10380 1 1 26 LYS NZ N 7.056 -0.171 -9.295 1.00 . A A . 26 LYS NZ 1 1 15 10381 1 1 26 LYS O O 6.103 2.506 -9.241 1.00 . A A . 26 LYS O 1 1 15 10382 1 1 27 ALA C C 2.851 3.792 -8.851 1.00 . A A . 27 ALA C 1 1 15 10383 1 1 27 ALA CA C 3.431 2.432 -8.460 1.00 . A A . 27 ALA CA 1 1 15 10384 1 1 27 ALA CB C 2.372 1.571 -7.786 1.00 . A A . 27 ALA CB 1 1 15 10385 1 1 27 ALA H H 4.428 2.726 -6.618 1.00 . A A . 27 ALA H 1 1 15 10386 1 1 27 ALA HA H 3.767 1.923 -9.353 1.00 . A A . 27 ALA HA 1 1 15 10387 1 1 27 ALA HB1 H 2.035 0.809 -8.474 1.00 . A A . 27 ALA HB1 1 1 15 10388 1 1 27 ALA HB2 H 1.536 2.189 -7.496 1.00 . A A . 27 ALA HB2 1 1 15 10389 1 1 27 ALA HB3 H 2.795 1.102 -6.910 1.00 . A A . 27 ALA HB3 1 1 15 10390 1 1 27 ALA N N 4.581 2.614 -7.583 1.00 . A A . 27 ALA N 1 1 15 10391 1 1 27 ALA O O 1.827 3.874 -9.532 1.00 . A A . 27 ALA O 1 1 15 10392 1 1 28 LYS C C 1.880 6.630 -7.922 1.00 . A A . 28 LYS C 1 1 15 10393 1 1 28 LYS CA C 3.149 6.232 -8.687 1.00 . A A . 28 LYS CA 1 1 15 10394 1 1 28 LYS CB C 2.986 6.458 -10.198 1.00 . A A . 28 LYS CB 1 1 15 10395 1 1 28 LYS CD C 3.046 8.076 -12.122 1.00 . A A . 28 LYS CD 1 1 15 10396 1 1 28 LYS CE C 4.354 7.523 -12.673 1.00 . A A . 28 LYS CE 1 1 15 10397 1 1 28 LYS CG C 2.969 7.922 -10.610 1.00 . A A . 28 LYS CG 1 1 15 10398 1 1 28 LYS H H 4.345 4.691 -7.877 1.00 . A A . 28 LYS H 1 1 15 10399 1 1 28 LYS HA H 3.956 6.860 -8.337 1.00 . A A . 28 LYS HA 1 1 15 10400 1 1 28 LYS HB2 H 3.804 5.974 -10.711 1.00 . A A . 28 LYS HB2 1 1 15 10401 1 1 28 LYS HB3 H 2.058 6.006 -10.517 1.00 . A A . 28 LYS HB3 1 1 15 10402 1 1 28 LYS HD2 H 2.223 7.541 -12.572 1.00 . A A . 28 LYS HD2 1 1 15 10403 1 1 28 LYS HD3 H 2.975 9.125 -12.372 1.00 . A A . 28 LYS HD3 1 1 15 10404 1 1 28 LYS HE2 H 5.175 8.059 -12.221 1.00 . A A . 28 LYS HE2 1 1 15 10405 1 1 28 LYS HE3 H 4.423 6.477 -12.414 1.00 . A A . 28 LYS HE3 1 1 15 10406 1 1 28 LYS HG2 H 2.053 8.374 -10.259 1.00 . A A . 28 LYS HG2 1 1 15 10407 1 1 28 LYS HG3 H 3.815 8.423 -10.162 1.00 . A A . 28 LYS HG3 1 1 15 10408 1 1 28 LYS HZ1 H 3.509 7.507 -14.584 1.00 . A A . 28 LYS HZ1 1 1 15 10409 1 1 28 LYS HZ2 H 5.111 6.966 -14.539 1.00 . A A . 28 LYS HZ2 1 1 15 10410 1 1 28 LYS HZ3 H 4.773 8.618 -14.403 1.00 . A A . 28 LYS HZ3 1 1 15 10411 1 1 28 LYS N N 3.536 4.850 -8.411 1.00 . A A . 28 LYS N 1 1 15 10412 1 1 28 LYS NZ N 4.442 7.664 -14.153 1.00 . A A . 28 LYS NZ 1 1 15 10413 1 1 28 LYS O O 0.883 7.059 -8.513 1.00 . A A . 28 LYS O 1 1 15 10414 1 1 29 PHE C C 1.375 7.727 -4.573 1.00 . A A . 29 PHE C 1 1 15 10415 1 1 29 PHE CA C 0.837 6.864 -5.710 1.00 . A A . 29 PHE CA 1 1 15 10416 1 1 29 PHE CB C 0.132 5.627 -5.133 1.00 . A A . 29 PHE CB 1 1 15 10417 1 1 29 PHE CD1 C -0.249 4.118 -7.110 1.00 . A A . 29 PHE CD1 1 1 15 10418 1 1 29 PHE CD2 C -2.148 5.028 -5.994 1.00 . A A . 29 PHE CD2 1 1 15 10419 1 1 29 PHE CE1 C -1.082 3.454 -7.991 1.00 . A A . 29 PHE CE1 1 1 15 10420 1 1 29 PHE CE2 C -2.986 4.365 -6.871 1.00 . A A . 29 PHE CE2 1 1 15 10421 1 1 29 PHE CG C -0.771 4.914 -6.104 1.00 . A A . 29 PHE CG 1 1 15 10422 1 1 29 PHE CZ C -2.452 3.577 -7.871 1.00 . A A . 29 PHE CZ 1 1 15 10423 1 1 29 PHE H H 2.774 6.167 -6.197 1.00 . A A . 29 PHE H 1 1 15 10424 1 1 29 PHE HA H 0.127 7.444 -6.282 1.00 . A A . 29 PHE HA 1 1 15 10425 1 1 29 PHE HB2 H 0.879 4.922 -4.802 1.00 . A A . 29 PHE HB2 1 1 15 10426 1 1 29 PHE HB3 H -0.466 5.927 -4.283 1.00 . A A . 29 PHE HB3 1 1 15 10427 1 1 29 PHE HD1 H 0.822 4.020 -7.205 1.00 . A A . 29 PHE HD1 1 1 15 10428 1 1 29 PHE HD2 H -2.568 5.645 -5.214 1.00 . A A . 29 PHE HD2 1 1 15 10429 1 1 29 PHE HE1 H -0.661 2.839 -8.772 1.00 . A A . 29 PHE HE1 1 1 15 10430 1 1 29 PHE HE2 H -4.057 4.462 -6.774 1.00 . A A . 29 PHE HE2 1 1 15 10431 1 1 29 PHE HZ H -3.104 3.058 -8.558 1.00 . A A . 29 PHE HZ 1 1 15 10432 1 1 29 PHE N N 1.941 6.502 -6.599 1.00 . A A . 29 PHE N 1 1 15 10433 1 1 29 PHE O O 2.529 7.577 -4.179 1.00 . A A . 29 PHE O 1 1 15 10434 1 1 30 SER C C 1.305 8.793 -1.717 1.00 . A A . 30 SER C 1 1 15 10435 1 1 30 SER CA C 0.951 9.545 -3.001 1.00 . A A . 30 SER CA 1 1 15 10436 1 1 30 SER CB C -0.168 10.551 -2.729 1.00 . A A . 30 SER CB 1 1 15 10437 1 1 30 SER H H -0.352 8.722 -4.445 1.00 . A A . 30 SER H 1 1 15 10438 1 1 30 SER HA H 1.823 10.080 -3.336 1.00 . A A . 30 SER HA 1 1 15 10439 1 1 30 SER HB2 H -0.996 10.046 -2.254 1.00 . A A . 30 SER HB2 1 1 15 10440 1 1 30 SER HB3 H 0.200 11.330 -2.079 1.00 . A A . 30 SER HB3 1 1 15 10441 1 1 30 SER HG H -0.292 12.044 -4.001 1.00 . A A . 30 SER HG 1 1 15 10442 1 1 30 SER N N 0.548 8.639 -4.074 1.00 . A A . 30 SER N 1 1 15 10443 1 1 30 SER O O 2.344 9.048 -1.110 1.00 . A A . 30 SER O 1 1 15 10444 1 1 30 SER OG O -0.625 11.140 -3.938 1.00 . A A . 30 SER OG 1 1 15 10445 1 1 31 ASP C C -0.158 5.815 -0.116 1.00 . A A . 31 ASP C 1 1 15 10446 1 1 31 ASP CA C 0.664 7.095 -0.093 1.00 . A A . 31 ASP CA 1 1 15 10447 1 1 31 ASP CB C 0.317 7.915 1.157 1.00 . A A . 31 ASP CB 1 1 15 10448 1 1 31 ASP CG C 0.523 7.125 2.437 1.00 . A A . 31 ASP CG 1 1 15 10449 1 1 31 ASP H H -0.374 7.714 -1.836 1.00 . A A . 31 ASP H 1 1 15 10450 1 1 31 ASP HA H 1.712 6.833 -0.059 1.00 . A A . 31 ASP HA 1 1 15 10451 1 1 31 ASP HB2 H 0.945 8.792 1.191 1.00 . A A . 31 ASP HB2 1 1 15 10452 1 1 31 ASP HB3 H -0.718 8.219 1.105 1.00 . A A . 31 ASP HB3 1 1 15 10453 1 1 31 ASP N N 0.439 7.874 -1.309 1.00 . A A . 31 ASP N 1 1 15 10454 1 1 31 ASP O O -1.217 5.758 -0.742 1.00 . A A . 31 ASP O 1 1 15 10455 1 1 31 ASP OD1 O 1.634 6.592 2.641 1.00 . A A . 31 ASP OD1 1 1 15 10456 1 1 31 ASP OD2 O -0.427 7.016 3.243 1.00 . A A . 31 ASP OD2 1 1 15 10457 1 1 32 GLY C C -0.756 3.118 1.997 1.00 . A A . 32 GLY C 1 1 15 10458 1 1 32 GLY CA C -0.359 3.525 0.599 1.00 . A A . 32 GLY CA 1 1 15 10459 1 1 32 GLY H H 1.186 4.898 1.039 1.00 . A A . 32 GLY H 1 1 15 10460 1 1 32 GLY HA2 H -1.251 3.599 -0.007 1.00 . A A . 32 GLY HA2 1 1 15 10461 1 1 32 GLY HA3 H 0.282 2.762 0.182 1.00 . A A . 32 GLY HA3 1 1 15 10462 1 1 32 GLY N N 0.336 4.790 0.559 1.00 . A A . 32 GLY N 1 1 15 10463 1 1 32 GLY O O -0.046 3.401 2.965 1.00 . A A . 32 GLY O 1 1 15 10464 1 1 33 HIS C C -2.848 0.542 3.295 1.00 . A A . 33 HIS C 1 1 15 10465 1 1 33 HIS CA C -2.381 1.985 3.387 1.00 . A A . 33 HIS CA 1 1 15 10466 1 1 33 HIS CB C -3.515 2.890 3.884 1.00 . A A . 33 HIS CB 1 1 15 10467 1 1 33 HIS CD2 C -5.098 3.619 1.947 1.00 . A A . 33 HIS CD2 1 1 15 10468 1 1 33 HIS CE1 C -6.715 2.186 2.307 1.00 . A A . 33 HIS CE1 1 1 15 10469 1 1 33 HIS CG C -4.750 2.873 3.025 1.00 . A A . 33 HIS CG 1 1 15 10470 1 1 33 HIS H H -2.402 2.238 1.288 1.00 . A A . 33 HIS H 1 1 15 10471 1 1 33 HIS HA H -1.563 2.037 4.090 1.00 . A A . 33 HIS HA 1 1 15 10472 1 1 33 HIS HB2 H -3.803 2.574 4.876 1.00 . A A . 33 HIS HB2 1 1 15 10473 1 1 33 HIS HB3 H -3.152 3.900 3.931 1.00 . A A . 33 HIS HB3 1 1 15 10474 1 1 33 HIS HD1 H -5.830 1.300 3.922 1.00 . A A . 33 HIS HD1 1 1 15 10475 1 1 33 HIS HD2 H -4.511 4.395 1.487 1.00 . A A . 33 HIS HD2 1 1 15 10476 1 1 33 HIS HE1 H -7.631 1.624 2.201 1.00 . A A . 33 HIS HE1 1 1 15 10477 1 1 33 HIS N N -1.886 2.443 2.104 1.00 . A A . 33 HIS N 1 1 15 10478 1 1 33 HIS ND1 N -5.787 1.984 3.222 1.00 . A A . 33 HIS ND1 1 1 15 10479 1 1 33 HIS NE2 N -6.324 3.172 1.524 1.00 . A A . 33 HIS NE2 1 1 15 10480 1 1 33 HIS O O -3.627 0.174 2.417 1.00 . A A . 33 HIS O 1 1 15 10481 1 1 34 CYS C C -4.127 -1.852 4.794 1.00 . A A . 34 CYS C 1 1 15 10482 1 1 34 CYS CA C -2.719 -1.672 4.250 1.00 . A A . 34 CYS CA 1 1 15 10483 1 1 34 CYS CB C -1.721 -2.436 5.117 1.00 . A A . 34 CYS CB 1 1 15 10484 1 1 34 CYS H H -1.752 0.098 4.879 1.00 . A A . 34 CYS H 1 1 15 10485 1 1 34 CYS HA H -2.679 -2.057 3.243 1.00 . A A . 34 CYS HA 1 1 15 10486 1 1 34 CYS HB2 H -1.790 -2.078 6.134 1.00 . A A . 34 CYS HB2 1 1 15 10487 1 1 34 CYS HB3 H -1.964 -3.488 5.092 1.00 . A A . 34 CYS HB3 1 1 15 10488 1 1 34 CYS N N -2.365 -0.264 4.209 1.00 . A A . 34 CYS N 1 1 15 10489 1 1 34 CYS O O -4.539 -1.138 5.709 1.00 . A A . 34 CYS O 1 1 15 10490 1 1 34 CYS SG S 0.007 -2.250 4.579 1.00 . A A . 34 CYS SG 1 1 15 10491 1 1 35 SER C C -6.200 -3.867 5.987 1.00 . A A . 35 SER C 1 1 15 10492 1 1 35 SER CA C -6.221 -3.059 4.685 1.00 . A A . 35 SER CA 1 1 15 10493 1 1 35 SER CB C -7.020 -3.783 3.598 1.00 . A A . 35 SER CB 1 1 15 10494 1 1 35 SER H H -4.491 -3.338 3.502 1.00 . A A . 35 SER H 1 1 15 10495 1 1 35 SER HA H -6.683 -2.104 4.879 1.00 . A A . 35 SER HA 1 1 15 10496 1 1 35 SER HB2 H -7.948 -4.142 4.016 1.00 . A A . 35 SER HB2 1 1 15 10497 1 1 35 SER HB3 H -7.231 -3.095 2.792 1.00 . A A . 35 SER HB3 1 1 15 10498 1 1 35 SER HG H -5.908 -4.634 2.232 1.00 . A A . 35 SER HG 1 1 15 10499 1 1 35 SER N N -4.866 -2.800 4.233 1.00 . A A . 35 SER N 1 1 15 10500 1 1 35 SER O O -5.176 -3.929 6.675 1.00 . A A . 35 SER O 1 1 15 10501 1 1 35 SER OG O -6.299 -4.884 3.080 1.00 . A A . 35 SER OG 1 1 15 10502 1 1 36 LYS C C -7.469 -6.761 7.290 1.00 . A A . 36 LYS C 1 1 15 10503 1 1 36 LYS CA C -7.403 -5.259 7.561 1.00 . A A . 36 LYS CA 1 1 15 10504 1 1 36 LYS CB C -8.622 -4.829 8.381 1.00 . A A . 36 LYS CB 1 1 15 10505 1 1 36 LYS CD C -10.049 -5.209 10.429 1.00 . A A . 36 LYS CD 1 1 15 10506 1 1 36 LYS CE C -10.017 -3.755 10.877 1.00 . A A . 36 LYS CE 1 1 15 10507 1 1 36 LYS CG C -8.782 -5.603 9.681 1.00 . A A . 36 LYS CG 1 1 15 10508 1 1 36 LYS H H -8.109 -4.395 5.760 1.00 . A A . 36 LYS H 1 1 15 10509 1 1 36 LYS HA H -6.513 -5.054 8.137 1.00 . A A . 36 LYS HA 1 1 15 10510 1 1 36 LYS HB2 H -8.530 -3.780 8.620 1.00 . A A . 36 LYS HB2 1 1 15 10511 1 1 36 LYS HB3 H -9.512 -4.977 7.787 1.00 . A A . 36 LYS HB3 1 1 15 10512 1 1 36 LYS HD2 H -10.898 -5.353 9.777 1.00 . A A . 36 LYS HD2 1 1 15 10513 1 1 36 LYS HD3 H -10.152 -5.842 11.298 1.00 . A A . 36 LYS HD3 1 1 15 10514 1 1 36 LYS HE2 H -9.155 -3.606 11.510 1.00 . A A . 36 LYS HE2 1 1 15 10515 1 1 36 LYS HE3 H -9.935 -3.125 10.004 1.00 . A A . 36 LYS HE3 1 1 15 10516 1 1 36 LYS HG2 H -8.824 -6.658 9.452 1.00 . A A . 36 LYS HG2 1 1 15 10517 1 1 36 LYS HG3 H -7.926 -5.405 10.310 1.00 . A A . 36 LYS HG3 1 1 15 10518 1 1 36 LYS HZ1 H -10.986 -2.891 12.515 1.00 . A A . 36 LYS HZ1 1 1 15 10519 1 1 36 LYS HZ2 H -11.794 -4.230 11.871 1.00 . A A . 36 LYS HZ2 1 1 15 10520 1 1 36 LYS HZ3 H -11.838 -2.746 11.060 1.00 . A A . 36 LYS HZ3 1 1 15 10521 1 1 36 LYS N N -7.321 -4.479 6.333 1.00 . A A . 36 LYS N 1 1 15 10522 1 1 36 LYS NZ N -11.244 -3.379 11.633 1.00 . A A . 36 LYS NZ 1 1 15 10523 1 1 36 LYS O O -6.825 -7.542 7.982 1.00 . A A . 36 LYS O 1 1 15 10524 1 1 37 ILE C C -7.173 -9.248 5.531 1.00 . A A . 37 ILE C 1 1 15 10525 1 1 37 ILE CA C -8.473 -8.564 5.974 1.00 . A A . 37 ILE CA 1 1 15 10526 1 1 37 ILE CB C -9.543 -8.727 4.870 1.00 . A A . 37 ILE CB 1 1 15 10527 1 1 37 ILE CD1 C -11.870 -7.958 4.157 1.00 . A A . 37 ILE CD1 1 1 15 10528 1 1 37 ILE CG1 C -10.807 -7.942 5.236 1.00 . A A . 37 ILE CG1 1 1 15 10529 1 1 37 ILE CG2 C -9.877 -10.201 4.663 1.00 . A A . 37 ILE CG2 1 1 15 10530 1 1 37 ILE H H -8.786 -6.477 5.819 1.00 . A A . 37 ILE H 1 1 15 10531 1 1 37 ILE HA H -8.835 -9.061 6.862 1.00 . A A . 37 ILE HA 1 1 15 10532 1 1 37 ILE HB H -9.140 -8.339 3.949 1.00 . A A . 37 ILE HB 1 1 15 10533 1 1 37 ILE HD11 H -12.062 -6.948 3.826 1.00 . A A . 37 ILE HD11 1 1 15 10534 1 1 37 ILE HD12 H -12.779 -8.386 4.553 1.00 . A A . 37 ILE HD12 1 1 15 10535 1 1 37 ILE HD13 H -11.526 -8.551 3.322 1.00 . A A . 37 ILE HD13 1 1 15 10536 1 1 37 ILE HG12 H -11.239 -8.365 6.130 1.00 . A A . 37 ILE HG12 1 1 15 10537 1 1 37 ILE HG13 H -10.540 -6.912 5.425 1.00 . A A . 37 ILE HG13 1 1 15 10538 1 1 37 ILE HG21 H -10.121 -10.652 5.613 1.00 . A A . 37 ILE HG21 1 1 15 10539 1 1 37 ILE HG22 H -9.024 -10.706 4.233 1.00 . A A . 37 ILE HG22 1 1 15 10540 1 1 37 ILE HG23 H -10.721 -10.289 3.995 1.00 . A A . 37 ILE HG23 1 1 15 10541 1 1 37 ILE N N -8.280 -7.151 6.310 1.00 . A A . 37 ILE N 1 1 15 10542 1 1 37 ILE O O -6.463 -9.832 6.343 1.00 . A A . 37 ILE O 1 1 15 10543 1 1 38 LEU C C -4.471 -8.906 3.784 1.00 . A A . 38 LEU C 1 1 15 10544 1 1 38 LEU CA C -5.677 -9.835 3.703 1.00 . A A . 38 LEU CA 1 1 15 10545 1 1 38 LEU CB C -5.910 -10.248 2.250 1.00 . A A . 38 LEU CB 1 1 15 10546 1 1 38 LEU CD1 C -4.807 -12.495 2.394 1.00 . A A . 38 LEU CD1 1 1 15 10547 1 1 38 LEU CD2 C -5.055 -11.367 0.174 1.00 . A A . 38 LEU CD2 1 1 15 10548 1 1 38 LEU CG C -4.834 -11.160 1.664 1.00 . A A . 38 LEU CG 1 1 15 10549 1 1 38 LEU H H -7.485 -8.731 3.626 1.00 . A A . 38 LEU H 1 1 15 10550 1 1 38 LEU HA H -5.480 -10.717 4.292 1.00 . A A . 38 LEU HA 1 1 15 10551 1 1 38 LEU HB2 H -6.860 -10.751 2.188 1.00 . A A . 38 LEU HB2 1 1 15 10552 1 1 38 LEU HB3 H -5.956 -9.353 1.647 1.00 . A A . 38 LEU HB3 1 1 15 10553 1 1 38 LEU HD11 H -5.706 -13.049 2.165 1.00 . A A . 38 LEU HD11 1 1 15 10554 1 1 38 LEU HD12 H -4.751 -12.323 3.458 1.00 . A A . 38 LEU HD12 1 1 15 10555 1 1 38 LEU HD13 H -3.944 -13.062 2.075 1.00 . A A . 38 LEU HD13 1 1 15 10556 1 1 38 LEU HD21 H -5.215 -12.417 -0.023 1.00 . A A . 38 LEU HD21 1 1 15 10557 1 1 38 LEU HD22 H -4.186 -11.027 -0.369 1.00 . A A . 38 LEU HD22 1 1 15 10558 1 1 38 LEU HD23 H -5.921 -10.805 -0.143 1.00 . A A . 38 LEU HD23 1 1 15 10559 1 1 38 LEU HG H -3.873 -10.686 1.801 1.00 . A A . 38 LEU HG 1 1 15 10560 1 1 38 LEU N N -6.877 -9.193 4.237 1.00 . A A . 38 LEU N 1 1 15 10561 1 1 38 LEU O O -3.401 -9.204 3.255 1.00 . A A . 38 LEU O 1 1 15 10562 1 1 39 ARG C C -3.151 -6.273 3.227 1.00 . A A . 39 ARG C 1 1 15 10563 1 1 39 ARG CA C -3.619 -6.768 4.591 1.00 . A A . 39 ARG CA 1 1 15 10564 1 1 39 ARG CB C -2.431 -7.317 5.383 1.00 . A A . 39 ARG CB 1 1 15 10565 1 1 39 ARG CD C -3.203 -6.301 7.540 1.00 . A A . 39 ARG CD 1 1 15 10566 1 1 39 ARG CG C -2.723 -7.566 6.849 1.00 . A A . 39 ARG CG 1 1 15 10567 1 1 39 ARG CZ C -3.797 -5.538 9.808 1.00 . A A . 39 ARG CZ 1 1 15 10568 1 1 39 ARG H H -5.545 -7.604 4.821 1.00 . A A . 39 ARG H 1 1 15 10569 1 1 39 ARG HA H -4.043 -5.935 5.131 1.00 . A A . 39 ARG HA 1 1 15 10570 1 1 39 ARG HB2 H -2.122 -8.252 4.940 1.00 . A A . 39 ARG HB2 1 1 15 10571 1 1 39 ARG HB3 H -1.616 -6.613 5.317 1.00 . A A . 39 ARG HB3 1 1 15 10572 1 1 39 ARG HD2 H -2.469 -5.523 7.387 1.00 . A A . 39 ARG HD2 1 1 15 10573 1 1 39 ARG HD3 H -4.141 -6.000 7.098 1.00 . A A . 39 ARG HD3 1 1 15 10574 1 1 39 ARG HE H -3.192 -7.388 9.336 1.00 . A A . 39 ARG HE 1 1 15 10575 1 1 39 ARG HG2 H -3.485 -8.324 6.932 1.00 . A A . 39 ARG HG2 1 1 15 10576 1 1 39 ARG HG3 H -1.816 -7.906 7.328 1.00 . A A . 39 ARG HG3 1 1 15 10577 1 1 39 ARG HH11 H -4.078 -4.153 8.349 1.00 . A A . 39 ARG HH11 1 1 15 10578 1 1 39 ARG HH12 H -4.417 -3.612 9.961 1.00 . A A . 39 ARG HH12 1 1 15 10579 1 1 39 ARG HH21 H -3.667 -6.696 11.466 1.00 . A A . 39 ARG HH21 1 1 15 10580 1 1 39 ARG HH22 H -4.190 -5.069 11.740 1.00 . A A . 39 ARG HH22 1 1 15 10581 1 1 39 ARG N N -4.666 -7.773 4.438 1.00 . A A . 39 ARG N 1 1 15 10582 1 1 39 ARG NE N -3.394 -6.496 8.975 1.00 . A A . 39 ARG NE 1 1 15 10583 1 1 39 ARG NH1 N -4.127 -4.338 9.337 1.00 . A A . 39 ARG NH1 1 1 15 10584 1 1 39 ARG NH2 N -3.895 -5.788 11.110 1.00 . A A . 39 ARG NH2 1 1 15 10585 1 1 39 ARG O O -1.991 -5.900 3.050 1.00 . A A . 39 ARG O 1 1 15 10586 1 1 40 ARG C C -3.367 -4.335 0.958 1.00 . A A . 40 ARG C 1 1 15 10587 1 1 40 ARG CA C -3.782 -5.802 0.926 1.00 . A A . 40 ARG CA 1 1 15 10588 1 1 40 ARG CB C -5.003 -6.004 0.032 1.00 . A A . 40 ARG CB 1 1 15 10589 1 1 40 ARG CD C -6.578 -7.656 -1.038 1.00 . A A . 40 ARG CD 1 1 15 10590 1 1 40 ARG CG C -5.232 -7.456 -0.356 1.00 . A A . 40 ARG CG 1 1 15 10591 1 1 40 ARG CZ C -6.049 -9.218 -2.879 1.00 . A A . 40 ARG CZ 1 1 15 10592 1 1 40 ARG H H -4.978 -6.571 2.488 1.00 . A A . 40 ARG H 1 1 15 10593 1 1 40 ARG HA H -2.960 -6.389 0.542 1.00 . A A . 40 ARG HA 1 1 15 10594 1 1 40 ARG HB2 H -5.880 -5.649 0.552 1.00 . A A . 40 ARG HB2 1 1 15 10595 1 1 40 ARG HB3 H -4.873 -5.428 -0.873 1.00 . A A . 40 ARG HB3 1 1 15 10596 1 1 40 ARG HD2 H -7.357 -7.606 -0.291 1.00 . A A . 40 ARG HD2 1 1 15 10597 1 1 40 ARG HD3 H -6.722 -6.868 -1.761 1.00 . A A . 40 ARG HD3 1 1 15 10598 1 1 40 ARG HE H -7.162 -9.659 -1.273 1.00 . A A . 40 ARG HE 1 1 15 10599 1 1 40 ARG HG2 H -4.450 -7.764 -1.034 1.00 . A A . 40 ARG HG2 1 1 15 10600 1 1 40 ARG HG3 H -5.196 -8.065 0.536 1.00 . A A . 40 ARG HG3 1 1 15 10601 1 1 40 ARG HH11 H -5.453 -7.292 -3.212 1.00 . A A . 40 ARG HH11 1 1 15 10602 1 1 40 ARG HH12 H -4.986 -8.450 -4.427 1.00 . A A . 40 ARG HH12 1 1 15 10603 1 1 40 ARG HH21 H -6.565 -11.178 -2.889 1.00 . A A . 40 ARG HH21 1 1 15 10604 1 1 40 ARG HH22 H -5.627 -10.653 -4.246 1.00 . A A . 40 ARG HH22 1 1 15 10605 1 1 40 ARG N N -4.072 -6.264 2.273 1.00 . A A . 40 ARG N 1 1 15 10606 1 1 40 ARG NE N -6.658 -8.950 -1.721 1.00 . A A . 40 ARG NE 1 1 15 10607 1 1 40 ARG NH1 N -5.448 -8.251 -3.564 1.00 . A A . 40 ARG NH1 1 1 15 10608 1 1 40 ARG NH2 N -6.083 -10.450 -3.378 1.00 . A A . 40 ARG NH2 1 1 15 10609 1 1 40 ARG O O -3.965 -3.528 1.674 1.00 . A A . 40 ARG O 1 1 15 10610 1 1 41 CYS C C -2.623 -1.743 -0.722 1.00 . A A . 41 CYS C 1 1 15 10611 1 1 41 CYS CA C -1.793 -2.656 0.175 1.00 . A A . 41 CYS CA 1 1 15 10612 1 1 41 CYS CB C -0.342 -2.688 -0.310 1.00 . A A . 41 CYS CB 1 1 15 10613 1 1 41 CYS H H -1.879 -4.707 -0.310 1.00 . A A . 41 CYS H 1 1 15 10614 1 1 41 CYS HA H -1.813 -2.264 1.180 1.00 . A A . 41 CYS HA 1 1 15 10615 1 1 41 CYS HB2 H 0.252 -3.244 0.400 1.00 . A A . 41 CYS HB2 1 1 15 10616 1 1 41 CYS HB3 H -0.304 -3.186 -1.268 1.00 . A A . 41 CYS HB3 1 1 15 10617 1 1 41 CYS N N -2.323 -4.010 0.216 1.00 . A A . 41 CYS N 1 1 15 10618 1 1 41 CYS O O -2.374 -1.650 -1.924 1.00 . A A . 41 CYS O 1 1 15 10619 1 1 41 CYS SG S 0.428 -1.052 -0.506 1.00 . A A . 41 CYS SG 1 1 15 10620 1 1 42 LEU C C -3.691 1.200 -1.045 1.00 . A A . 42 LEU C 1 1 15 10621 1 1 42 LEU CA C -4.424 -0.122 -0.878 1.00 . A A . 42 LEU CA 1 1 15 10622 1 1 42 LEU CB C -5.759 0.116 -0.161 1.00 . A A . 42 LEU CB 1 1 15 10623 1 1 42 LEU CD1 C -6.549 -2.259 0.089 1.00 . A A . 42 LEU CD1 1 1 15 10624 1 1 42 LEU CD2 C -8.203 -0.390 0.075 1.00 . A A . 42 LEU CD2 1 1 15 10625 1 1 42 LEU CG C -6.875 -0.886 -0.475 1.00 . A A . 42 LEU CG 1 1 15 10626 1 1 42 LEU H H -3.729 -1.149 0.840 1.00 . A A . 42 LEU H 1 1 15 10627 1 1 42 LEU HA H -4.610 -0.549 -1.854 1.00 . A A . 42 LEU HA 1 1 15 10628 1 1 42 LEU HB2 H -5.571 0.082 0.903 1.00 . A A . 42 LEU HB2 1 1 15 10629 1 1 42 LEU HB3 H -6.109 1.110 -0.410 1.00 . A A . 42 LEU HB3 1 1 15 10630 1 1 42 LEU HD11 H -7.358 -2.589 0.724 1.00 . A A . 42 LEU HD11 1 1 15 10631 1 1 42 LEU HD12 H -5.637 -2.205 0.666 1.00 . A A . 42 LEU HD12 1 1 15 10632 1 1 42 LEU HD13 H -6.419 -2.960 -0.723 1.00 . A A . 42 LEU HD13 1 1 15 10633 1 1 42 LEU HD21 H -8.040 0.508 0.651 1.00 . A A . 42 LEU HD21 1 1 15 10634 1 1 42 LEU HD22 H -8.637 -1.150 0.708 1.00 . A A . 42 LEU HD22 1 1 15 10635 1 1 42 LEU HD23 H -8.874 -0.176 -0.743 1.00 . A A . 42 LEU HD23 1 1 15 10636 1 1 42 LEU HG H -6.972 -0.980 -1.547 1.00 . A A . 42 LEU HG 1 1 15 10637 1 1 42 LEU N N -3.590 -1.051 -0.130 1.00 . A A . 42 LEU N 1 1 15 10638 1 1 42 LEU O O -3.375 1.866 -0.060 1.00 . A A . 42 LEU O 1 1 15 10639 1 1 43 CYS C C -3.710 3.951 -2.785 1.00 . A A . 43 CYS C 1 1 15 10640 1 1 43 CYS CA C -2.724 2.818 -2.553 1.00 . A A . 43 CYS CA 1 1 15 10641 1 1 43 CYS CB C -1.809 2.653 -3.764 1.00 . A A . 43 CYS CB 1 1 15 10642 1 1 43 CYS H H -3.702 1.012 -3.032 1.00 . A A . 43 CYS H 1 1 15 10643 1 1 43 CYS HA H -2.121 3.055 -1.689 1.00 . A A . 43 CYS HA 1 1 15 10644 1 1 43 CYS HB2 H -2.405 2.398 -4.626 1.00 . A A . 43 CYS HB2 1 1 15 10645 1 1 43 CYS HB3 H -1.301 3.588 -3.950 1.00 . A A . 43 CYS HB3 1 1 15 10646 1 1 43 CYS N N -3.423 1.578 -2.278 1.00 . A A . 43 CYS N 1 1 15 10647 1 1 43 CYS O O -4.766 3.753 -3.390 1.00 . A A . 43 CYS O 1 1 15 10648 1 1 43 CYS SG S -0.540 1.365 -3.565 1.00 . A A . 43 CYS SG 1 1 15 10649 1 1 44 THR C C -3.426 7.484 -2.982 1.00 . A A . 44 THR C 1 1 15 10650 1 1 44 THR CA C -4.215 6.298 -2.442 1.00 . A A . 44 THR CA 1 1 15 10651 1 1 44 THR CB C -4.862 6.682 -1.099 1.00 . A A . 44 THR CB 1 1 15 10652 1 1 44 THR CG2 C -6.224 6.026 -0.941 1.00 . A A . 44 THR CG2 1 1 15 10653 1 1 44 THR H H -2.510 5.221 -1.820 1.00 . A A . 44 THR H 1 1 15 10654 1 1 44 THR HA H -5.003 6.054 -3.141 1.00 . A A . 44 THR HA 1 1 15 10655 1 1 44 THR HB H -4.993 7.755 -1.080 1.00 . A A . 44 THR HB 1 1 15 10656 1 1 44 THR HG1 H -3.089 6.468 -0.247 1.00 . A A . 44 THR HG1 1 1 15 10657 1 1 44 THR HG21 H -6.097 4.962 -0.805 1.00 . A A . 44 THR HG21 1 1 15 10658 1 1 44 THR HG22 H -6.817 6.208 -1.825 1.00 . A A . 44 THR HG22 1 1 15 10659 1 1 44 THR HG23 H -6.726 6.441 -0.079 1.00 . A A . 44 THR HG23 1 1 15 10660 1 1 44 THR N N -3.367 5.130 -2.298 1.00 . A A . 44 THR N 1 1 15 10661 1 1 44 THR O O -2.270 7.699 -2.609 1.00 . A A . 44 THR O 1 1 15 10662 1 1 44 THR OG1 O -4.009 6.294 -0.012 1.00 . A A . 44 THR OG1 1 1 15 10663 1 1 45 LYS C C -4.455 10.343 -5.042 1.00 . A A . 45 LYS C 1 1 15 10664 1 1 45 LYS CA C -3.413 9.412 -4.454 1.00 . A A . 45 LYS CA 1 1 15 10665 1 1 45 LYS CB C -2.410 9.007 -5.538 1.00 . A A . 45 LYS CB 1 1 15 10666 1 1 45 LYS CD C -1.972 8.052 -7.804 1.00 . A A . 45 LYS CD 1 1 15 10667 1 1 45 LYS CE C -2.540 7.298 -8.992 1.00 . A A . 45 LYS CE 1 1 15 10668 1 1 45 LYS CG C -3.033 8.362 -6.765 1.00 . A A . 45 LYS CG 1 1 15 10669 1 1 45 LYS H H -4.973 8.022 -4.121 1.00 . A A . 45 LYS H 1 1 15 10670 1 1 45 LYS HA H -2.888 9.933 -3.668 1.00 . A A . 45 LYS HA 1 1 15 10671 1 1 45 LYS HB2 H -1.874 9.887 -5.858 1.00 . A A . 45 LYS HB2 1 1 15 10672 1 1 45 LYS HB3 H -1.706 8.307 -5.111 1.00 . A A . 45 LYS HB3 1 1 15 10673 1 1 45 LYS HD2 H -1.544 8.980 -8.153 1.00 . A A . 45 LYS HD2 1 1 15 10674 1 1 45 LYS HD3 H -1.200 7.451 -7.344 1.00 . A A . 45 LYS HD3 1 1 15 10675 1 1 45 LYS HE2 H -3.092 6.443 -8.631 1.00 . A A . 45 LYS HE2 1 1 15 10676 1 1 45 LYS HE3 H -3.204 7.953 -9.536 1.00 . A A . 45 LYS HE3 1 1 15 10677 1 1 45 LYS HG2 H -3.521 7.444 -6.472 1.00 . A A . 45 LYS HG2 1 1 15 10678 1 1 45 LYS HG3 H -3.757 9.041 -7.191 1.00 . A A . 45 LYS HG3 1 1 15 10679 1 1 45 LYS HZ1 H -0.530 6.942 -9.446 1.00 . A A . 45 LYS HZ1 1 1 15 10680 1 1 45 LYS HZ2 H -1.472 7.384 -10.784 1.00 . A A . 45 LYS HZ2 1 1 15 10681 1 1 45 LYS HZ3 H -1.601 5.827 -10.139 1.00 . A A . 45 LYS HZ3 1 1 15 10682 1 1 45 LYS N N -4.051 8.246 -3.862 1.00 . A A . 45 LYS N 1 1 15 10683 1 1 45 LYS NZ N -1.463 6.830 -9.906 1.00 . A A . 45 LYS NZ 1 1 15 10684 1 1 45 LYS O O -5.594 9.943 -5.277 1.00 . A A . 45 LYS O 1 1 15 10685 1 1 46 GLU C C -5.072 12.341 -7.367 1.00 . A A . 46 GLU C 1 1 15 10686 1 1 46 GLU CA C -4.940 12.565 -5.865 1.00 . A A . 46 GLU CA 1 1 15 10687 1 1 46 GLU CB C -4.409 13.967 -5.566 1.00 . A A . 46 GLU CB 1 1 15 10688 1 1 46 GLU CD C -2.356 15.411 -5.254 1.00 . A A . 46 GLU CD 1 1 15 10689 1 1 46 GLU CG C -2.910 14.106 -5.786 1.00 . A A . 46 GLU CG 1 1 15 10690 1 1 46 GLU H H -3.128 11.824 -5.088 1.00 . A A . 46 GLU H 1 1 15 10691 1 1 46 GLU HA H -5.912 12.450 -5.408 1.00 . A A . 46 GLU HA 1 1 15 10692 1 1 46 GLU HB2 H -4.913 14.676 -6.206 1.00 . A A . 46 GLU HB2 1 1 15 10693 1 1 46 GLU HB3 H -4.624 14.210 -4.535 1.00 . A A . 46 GLU HB3 1 1 15 10694 1 1 46 GLU HG2 H -2.409 13.291 -5.286 1.00 . A A . 46 GLU HG2 1 1 15 10695 1 1 46 GLU HG3 H -2.710 14.052 -6.847 1.00 . A A . 46 GLU HG3 1 1 15 10696 1 1 46 GLU N N -4.055 11.573 -5.288 1.00 . A A . 46 GLU N 1 1 15 10697 1 1 46 GLU O O -4.129 11.888 -8.023 1.00 . A A . 46 GLU O 1 1 15 10698 1 1 46 GLU OE1 O -3.154 16.253 -4.791 1.00 . A A . 46 GLU OE1 1 1 15 10699 1 1 46 GLU OE2 O -1.120 15.589 -5.296 1.00 . A A . 46 GLU OE2 1 1 15 10700 1 1 47 CYS C C -7.699 13.324 -9.720 1.00 . A A . 47 CYS C 1 1 15 10701 1 1 47 CYS CA C -6.508 12.470 -9.322 1.00 . A A . 47 CYS CA 1 1 15 10702 1 1 47 CYS CB C -6.770 10.998 -9.655 1.00 . A A . 47 CYS CB 1 1 15 10703 1 1 47 CYS H H -6.962 12.989 -7.330 1.00 . A A . 47 CYS H 1 1 15 10704 1 1 47 CYS HA H -5.637 12.803 -9.863 1.00 . A A . 47 CYS HA 1 1 15 10705 1 1 47 CYS HB2 H -7.032 10.915 -10.699 1.00 . A A . 47 CYS HB2 1 1 15 10706 1 1 47 CYS HB3 H -5.868 10.431 -9.472 1.00 . A A . 47 CYS HB3 1 1 15 10707 1 1 47 CYS N N -6.244 12.642 -7.903 1.00 . A A . 47 CYS N 1 1 15 10708 1 1 47 CYS O O -8.285 13.957 -8.812 1.00 . A A . 47 CYS O 1 1 15 10709 1 1 47 CYS OXT O -8.040 13.369 -10.912 1.00 . A A . 47 CYS OXT 1 1 15 10710 1 1 47 CYS SG S -8.113 10.232 -8.688 1.00 . A A . 47 CYS SG 1 1 16 10711 1 1 1 ALA C C -7.593 9.892 -7.854 1.00 . A A . 1 ALA C 1 1 16 10712 1 1 1 ALA CA C -8.506 10.329 -8.998 1.00 . A A . 1 ALA CA 1 1 16 10713 1 1 1 ALA CB C -8.180 11.754 -9.424 1.00 . A A . 1 ALA CB 1 1 16 10714 1 1 1 ALA H1 H -10.340 9.359 -8.996 1.00 . A A . 1 ALA H1 1 1 16 10715 1 1 1 ALA H2 H -10.453 11.045 -8.971 1.00 . A A . 1 ALA H2 1 1 16 10716 1 1 1 ALA H3 H -10.009 10.209 -7.570 1.00 . A A . 1 ALA H3 1 1 16 10717 1 1 1 ALA HA H -8.348 9.680 -9.843 1.00 . A A . 1 ALA HA 1 1 16 10718 1 1 1 ALA HB1 H -7.573 11.734 -10.317 1.00 . A A . 1 ALA HB1 1 1 16 10719 1 1 1 ALA HB2 H -7.639 12.252 -8.632 1.00 . A A . 1 ALA HB2 1 1 16 10720 1 1 1 ALA HB3 H -9.097 12.289 -9.624 1.00 . A A . 1 ALA HB3 1 1 16 10721 1 1 1 ALA N N -9.927 10.228 -8.605 1.00 . A A . 1 ALA N 1 1 16 10722 1 1 1 ALA O O -6.549 10.495 -7.610 1.00 . A A . 1 ALA O 1 1 16 10723 1 1 2 THR C C -7.498 6.839 -5.842 1.00 . A A . 2 THR C 1 1 16 10724 1 1 2 THR CA C -7.219 8.329 -6.025 1.00 . A A . 2 THR CA 1 1 16 10725 1 1 2 THR CB C -7.555 9.081 -4.720 1.00 . A A . 2 THR CB 1 1 16 10726 1 1 2 THR CG2 C -6.491 8.835 -3.661 1.00 . A A . 2 THR CG2 1 1 16 10727 1 1 2 THR H H -8.834 8.399 -7.380 1.00 . A A . 2 THR H 1 1 16 10728 1 1 2 THR HA H -6.170 8.471 -6.250 1.00 . A A . 2 THR HA 1 1 16 10729 1 1 2 THR HB H -8.504 8.721 -4.348 1.00 . A A . 2 THR HB 1 1 16 10730 1 1 2 THR HG1 H -6.906 10.766 -5.521 1.00 . A A . 2 THR HG1 1 1 16 10731 1 1 2 THR HG21 H -6.050 9.776 -3.368 1.00 . A A . 2 THR HG21 1 1 16 10732 1 1 2 THR HG22 H -5.725 8.188 -4.063 1.00 . A A . 2 THR HG22 1 1 16 10733 1 1 2 THR HG23 H -6.942 8.366 -2.799 1.00 . A A . 2 THR HG23 1 1 16 10734 1 1 2 THR N N -7.997 8.844 -7.145 1.00 . A A . 2 THR N 1 1 16 10735 1 1 2 THR O O -8.409 6.453 -5.105 1.00 . A A . 2 THR O 1 1 16 10736 1 1 2 THR OG1 O -7.654 10.488 -4.977 1.00 . A A . 2 THR OG1 1 1 16 10737 1 1 3 CYS C C -6.115 3.934 -5.362 1.00 . A A . 3 CYS C 1 1 16 10738 1 1 3 CYS CA C -6.937 4.570 -6.466 1.00 . A A . 3 CYS CA 1 1 16 10739 1 1 3 CYS CB C -6.623 3.934 -7.815 1.00 . A A . 3 CYS CB 1 1 16 10740 1 1 3 CYS H H -6.042 6.370 -7.125 1.00 . A A . 3 CYS H 1 1 16 10741 1 1 3 CYS HA H -7.980 4.402 -6.247 1.00 . A A . 3 CYS HA 1 1 16 10742 1 1 3 CYS HB2 H -5.708 4.360 -8.207 1.00 . A A . 3 CYS HB2 1 1 16 10743 1 1 3 CYS HB3 H -6.504 2.868 -7.693 1.00 . A A . 3 CYS HB3 1 1 16 10744 1 1 3 CYS N N -6.740 6.009 -6.535 1.00 . A A . 3 CYS N 1 1 16 10745 1 1 3 CYS O O -4.992 4.349 -5.091 1.00 . A A . 3 CYS O 1 1 16 10746 1 1 3 CYS SG S -7.929 4.224 -9.041 1.00 . A A . 3 CYS SG 1 1 16 10747 1 1 4 LYS C C -6.098 0.706 -3.911 1.00 . A A . 4 LYS C 1 1 16 10748 1 1 4 LYS CA C -6.044 2.202 -3.650 1.00 . A A . 4 LYS CA 1 1 16 10749 1 1 4 LYS CB C -6.721 2.494 -2.308 1.00 . A A . 4 LYS CB 1 1 16 10750 1 1 4 LYS CD C -7.359 4.183 -0.559 1.00 . A A . 4 LYS CD 1 1 16 10751 1 1 4 LYS CE C -8.801 3.705 -0.465 1.00 . A A . 4 LYS CE 1 1 16 10752 1 1 4 LYS CG C -6.784 3.968 -1.950 1.00 . A A . 4 LYS CG 1 1 16 10753 1 1 4 LYS H H -7.593 2.645 -5.009 1.00 . A A . 4 LYS H 1 1 16 10754 1 1 4 LYS HA H -5.011 2.518 -3.607 1.00 . A A . 4 LYS HA 1 1 16 10755 1 1 4 LYS HB2 H -7.731 2.114 -2.339 1.00 . A A . 4 LYS HB2 1 1 16 10756 1 1 4 LYS HB3 H -6.179 1.981 -1.527 1.00 . A A . 4 LYS HB3 1 1 16 10757 1 1 4 LYS HD2 H -6.760 3.634 0.154 1.00 . A A . 4 LYS HD2 1 1 16 10758 1 1 4 LYS HD3 H -7.321 5.237 -0.325 1.00 . A A . 4 LYS HD3 1 1 16 10759 1 1 4 LYS HE2 H -8.833 2.651 -0.697 1.00 . A A . 4 LYS HE2 1 1 16 10760 1 1 4 LYS HE3 H -9.153 3.861 0.545 1.00 . A A . 4 LYS HE3 1 1 16 10761 1 1 4 LYS HG2 H -5.786 4.379 -1.983 1.00 . A A . 4 LYS HG2 1 1 16 10762 1 1 4 LYS HG3 H -7.408 4.476 -2.670 1.00 . A A . 4 LYS HG3 1 1 16 10763 1 1 4 LYS HZ1 H -9.130 4.913 -2.140 1.00 . A A . 4 LYS HZ1 1 1 16 10764 1 1 4 LYS HZ2 H -10.251 5.149 -0.895 1.00 . A A . 4 LYS HZ2 1 1 16 10765 1 1 4 LYS HZ3 H -10.348 3.770 -1.869 1.00 . A A . 4 LYS HZ3 1 1 16 10766 1 1 4 LYS N N -6.697 2.922 -4.732 1.00 . A A . 4 LYS N 1 1 16 10767 1 1 4 LYS NZ N -9.695 4.435 -1.408 1.00 . A A . 4 LYS NZ 1 1 16 10768 1 1 4 LYS O O -7.136 0.179 -4.308 1.00 . A A . 4 LYS O 1 1 16 10769 1 1 5 ALA C C -3.625 -1.884 -3.138 1.00 . A A . 5 ALA C 1 1 16 10770 1 1 5 ALA CA C -4.867 -1.396 -3.860 1.00 . A A . 5 ALA CA 1 1 16 10771 1 1 5 ALA CB C -4.797 -1.749 -5.341 1.00 . A A . 5 ALA CB 1 1 16 10772 1 1 5 ALA H H -4.196 0.537 -3.356 1.00 . A A . 5 ALA H 1 1 16 10773 1 1 5 ALA HA H -5.740 -1.866 -3.431 1.00 . A A . 5 ALA HA 1 1 16 10774 1 1 5 ALA HB1 H -4.429 -2.758 -5.453 1.00 . A A . 5 ALA HB1 1 1 16 10775 1 1 5 ALA HB2 H -4.130 -1.064 -5.843 1.00 . A A . 5 ALA HB2 1 1 16 10776 1 1 5 ALA HB3 H -5.783 -1.674 -5.776 1.00 . A A . 5 ALA HB3 1 1 16 10777 1 1 5 ALA N N -4.982 0.042 -3.676 1.00 . A A . 5 ALA N 1 1 16 10778 1 1 5 ALA O O -2.556 -1.286 -3.275 1.00 . A A . 5 ALA O 1 1 16 10779 1 1 6 GLU C C -1.554 -3.982 -2.515 1.00 . A A . 6 GLU C 1 1 16 10780 1 1 6 GLU CA C -2.639 -3.457 -1.592 1.00 . A A . 6 GLU CA 1 1 16 10781 1 1 6 GLU CB C -3.057 -4.564 -0.610 1.00 . A A . 6 GLU CB 1 1 16 10782 1 1 6 GLU CD C -5.494 -4.056 -0.170 1.00 . A A . 6 GLU CD 1 1 16 10783 1 1 6 GLU CG C -4.098 -4.129 0.409 1.00 . A A . 6 GLU CG 1 1 16 10784 1 1 6 GLU H H -4.645 -3.356 -2.250 1.00 . A A . 6 GLU H 1 1 16 10785 1 1 6 GLU HA H -2.228 -2.635 -1.024 1.00 . A A . 6 GLU HA 1 1 16 10786 1 1 6 GLU HB2 H -3.452 -5.398 -1.165 1.00 . A A . 6 GLU HB2 1 1 16 10787 1 1 6 GLU HB3 H -2.180 -4.891 -0.071 1.00 . A A . 6 GLU HB3 1 1 16 10788 1 1 6 GLU HG2 H -4.102 -4.838 1.224 1.00 . A A . 6 GLU HG2 1 1 16 10789 1 1 6 GLU HG3 H -3.829 -3.153 0.785 1.00 . A A . 6 GLU HG3 1 1 16 10790 1 1 6 GLU N N -3.764 -2.935 -2.347 1.00 . A A . 6 GLU N 1 1 16 10791 1 1 6 GLU O O -1.838 -4.598 -3.544 1.00 . A A . 6 GLU O 1 1 16 10792 1 1 6 GLU OE1 O -6.063 -5.123 -0.474 1.00 . A A . 6 GLU OE1 1 1 16 10793 1 1 6 GLU OE2 O -6.008 -2.933 -0.338 1.00 . A A . 6 GLU OE2 1 1 16 10794 1 1 7 CYS C C 0.731 -5.651 -3.205 1.00 . A A . 7 CYS C 1 1 16 10795 1 1 7 CYS CA C 0.860 -4.167 -2.859 1.00 . A A . 7 CYS CA 1 1 16 10796 1 1 7 CYS CB C 2.114 -3.905 -2.011 1.00 . A A . 7 CYS CB 1 1 16 10797 1 1 7 CYS H H -0.191 -3.229 -1.279 1.00 . A A . 7 CYS H 1 1 16 10798 1 1 7 CYS HA H 0.921 -3.588 -3.771 1.00 . A A . 7 CYS HA 1 1 16 10799 1 1 7 CYS HB2 H 2.479 -2.912 -2.225 1.00 . A A . 7 CYS HB2 1 1 16 10800 1 1 7 CYS HB3 H 1.843 -3.960 -0.966 1.00 . A A . 7 CYS HB3 1 1 16 10801 1 1 7 CYS N N -0.315 -3.729 -2.118 1.00 . A A . 7 CYS N 1 1 16 10802 1 1 7 CYS O O 0.517 -6.483 -2.322 1.00 . A A . 7 CYS O 1 1 16 10803 1 1 7 CYS SG S 3.498 -5.064 -2.281 1.00 . A A . 7 CYS SG 1 1 16 10804 1 1 8 PRO C C 1.639 -8.331 -4.274 1.00 . A A . 8 PRO C 1 1 16 10805 1 1 8 PRO CA C 0.689 -7.374 -4.981 1.00 . A A . 8 PRO CA 1 1 16 10806 1 1 8 PRO CB C 1.029 -7.285 -6.478 1.00 . A A . 8 PRO CB 1 1 16 10807 1 1 8 PRO CD C 1.039 -5.055 -5.612 1.00 . A A . 8 PRO CD 1 1 16 10808 1 1 8 PRO CG C 1.631 -5.933 -6.675 1.00 . A A . 8 PRO CG 1 1 16 10809 1 1 8 PRO HA H -0.324 -7.730 -4.863 1.00 . A A . 8 PRO HA 1 1 16 10810 1 1 8 PRO HB2 H 1.728 -8.067 -6.735 1.00 . A A . 8 PRO HB2 1 1 16 10811 1 1 8 PRO HB3 H 0.126 -7.401 -7.059 1.00 . A A . 8 PRO HB3 1 1 16 10812 1 1 8 PRO HD2 H 1.733 -4.276 -5.333 1.00 . A A . 8 PRO HD2 1 1 16 10813 1 1 8 PRO HD3 H 0.103 -4.632 -5.946 1.00 . A A . 8 PRO HD3 1 1 16 10814 1 1 8 PRO HG2 H 2.703 -5.988 -6.560 1.00 . A A . 8 PRO HG2 1 1 16 10815 1 1 8 PRO HG3 H 1.377 -5.557 -7.655 1.00 . A A . 8 PRO HG3 1 1 16 10816 1 1 8 PRO N N 0.825 -5.992 -4.504 1.00 . A A . 8 PRO N 1 1 16 10817 1 1 8 PRO O O 1.262 -9.440 -3.901 1.00 . A A . 8 PRO O 1 1 16 10818 1 1 9 THR C C 3.863 -8.434 -1.905 1.00 . A A . 9 THR C 1 1 16 10819 1 1 9 THR CA C 3.871 -8.692 -3.411 1.00 . A A . 9 THR CA 1 1 16 10820 1 1 9 THR CB C 5.268 -8.398 -3.988 1.00 . A A . 9 THR CB 1 1 16 10821 1 1 9 THR CG2 C 5.539 -9.258 -5.213 1.00 . A A . 9 THR CG2 1 1 16 10822 1 1 9 THR H H 3.107 -6.992 -4.390 1.00 . A A . 9 THR H 1 1 16 10823 1 1 9 THR HA H 3.641 -9.732 -3.590 1.00 . A A . 9 THR HA 1 1 16 10824 1 1 9 THR HB H 6.008 -8.625 -3.234 1.00 . A A . 9 THR HB 1 1 16 10825 1 1 9 THR HG1 H 5.248 -6.470 -3.546 1.00 . A A . 9 THR HG1 1 1 16 10826 1 1 9 THR HG21 H 5.764 -10.267 -4.903 1.00 . A A . 9 THR HG21 1 1 16 10827 1 1 9 THR HG22 H 6.380 -8.853 -5.758 1.00 . A A . 9 THR HG22 1 1 16 10828 1 1 9 THR HG23 H 4.667 -9.263 -5.850 1.00 . A A . 9 THR HG23 1 1 16 10829 1 1 9 THR N N 2.868 -7.889 -4.082 1.00 . A A . 9 THR N 1 1 16 10830 1 1 9 THR O O 4.917 -8.337 -1.277 1.00 . A A . 9 THR O 1 1 16 10831 1 1 9 THR OG1 O 5.366 -7.008 -4.340 1.00 . A A . 9 THR OG1 1 1 16 10832 1 1 10 TRP C C 1.403 -8.852 0.702 1.00 . A A . 10 TRP C 1 1 16 10833 1 1 10 TRP CA C 2.550 -8.060 0.096 1.00 . A A . 10 TRP CA 1 1 16 10834 1 1 10 TRP CB C 2.315 -6.572 0.354 1.00 . A A . 10 TRP CB 1 1 16 10835 1 1 10 TRP CD1 C 1.655 -6.298 2.811 1.00 . A A . 10 TRP CD1 1 1 16 10836 1 1 10 TRP CD2 C 3.715 -5.576 2.317 1.00 . A A . 10 TRP CD2 1 1 16 10837 1 1 10 TRP CE2 C 3.492 -5.378 3.693 1.00 . A A . 10 TRP CE2 1 1 16 10838 1 1 10 TRP CE3 C 4.943 -5.193 1.768 1.00 . A A . 10 TRP CE3 1 1 16 10839 1 1 10 TRP CG C 2.537 -6.178 1.778 1.00 . A A . 10 TRP CG 1 1 16 10840 1 1 10 TRP CH2 C 5.644 -4.448 3.962 1.00 . A A . 10 TRP CH2 1 1 16 10841 1 1 10 TRP CZ2 C 4.456 -4.813 4.527 1.00 . A A . 10 TRP CZ2 1 1 16 10842 1 1 10 TRP CZ3 C 5.892 -4.631 2.597 1.00 . A A . 10 TRP CZ3 1 1 16 10843 1 1 10 TRP H H 1.859 -8.394 -1.875 1.00 . A A . 10 TRP H 1 1 16 10844 1 1 10 TRP HA H 3.473 -8.358 0.569 1.00 . A A . 10 TRP HA 1 1 16 10845 1 1 10 TRP HB2 H 2.990 -5.996 -0.261 1.00 . A A . 10 TRP HB2 1 1 16 10846 1 1 10 TRP HB3 H 1.296 -6.325 0.092 1.00 . A A . 10 TRP HB3 1 1 16 10847 1 1 10 TRP HD1 H 0.659 -6.712 2.715 1.00 . A A . 10 TRP HD1 1 1 16 10848 1 1 10 TRP HE1 H 1.796 -5.822 4.857 1.00 . A A . 10 TRP HE1 1 1 16 10849 1 1 10 TRP HE3 H 5.154 -5.323 0.714 1.00 . A A . 10 TRP HE3 1 1 16 10850 1 1 10 TRP HH2 H 6.417 -4.003 4.571 1.00 . A A . 10 TRP HH2 1 1 16 10851 1 1 10 TRP HZ2 H 4.288 -4.662 5.584 1.00 . A A . 10 TRP HZ2 1 1 16 10852 1 1 10 TRP HZ3 H 6.845 -4.325 2.191 1.00 . A A . 10 TRP HZ3 1 1 16 10853 1 1 10 TRP N N 2.672 -8.315 -1.328 1.00 . A A . 10 TRP N 1 1 16 10854 1 1 10 TRP NE1 N 2.225 -5.831 3.972 1.00 . A A . 10 TRP NE1 1 1 16 10855 1 1 10 TRP O O 0.236 -8.633 0.374 1.00 . A A . 10 TRP O 1 1 16 10856 1 1 11 ASP C C 1.289 -10.901 3.683 1.00 . A A . 11 ASP C 1 1 16 10857 1 1 11 ASP CA C 0.754 -10.551 2.305 1.00 . A A . 11 ASP CA 1 1 16 10858 1 1 11 ASP CB C 0.412 -11.816 1.514 1.00 . A A . 11 ASP CB 1 1 16 10859 1 1 11 ASP CG C -1.016 -12.262 1.761 1.00 . A A . 11 ASP CG 1 1 16 10860 1 1 11 ASP H H 2.689 -9.850 1.847 1.00 . A A . 11 ASP H 1 1 16 10861 1 1 11 ASP HA H -0.139 -9.952 2.421 1.00 . A A . 11 ASP HA 1 1 16 10862 1 1 11 ASP HB2 H 0.534 -11.620 0.459 1.00 . A A . 11 ASP HB2 1 1 16 10863 1 1 11 ASP HB3 H 1.078 -12.612 1.811 1.00 . A A . 11 ASP HB3 1 1 16 10864 1 1 11 ASP N N 1.744 -9.744 1.613 1.00 . A A . 11 ASP N 1 1 16 10865 1 1 11 ASP O O 1.412 -12.066 4.055 1.00 . A A . 11 ASP O 1 1 16 10866 1 1 11 ASP OD1 O -1.344 -12.641 2.900 1.00 . A A . 11 ASP OD1 1 1 16 10867 1 1 11 ASP OD2 O -1.834 -12.185 0.819 1.00 . A A . 11 ASP OD2 1 1 16 10868 1 1 12 SER C C 1.930 -8.776 6.592 1.00 . A A . 12 SER C 1 1 16 10869 1 1 12 SER CA C 2.196 -10.025 5.760 1.00 . A A . 12 SER CA 1 1 16 10870 1 1 12 SER CB C 3.703 -10.295 5.679 1.00 . A A . 12 SER CB 1 1 16 10871 1 1 12 SER H H 1.543 -8.963 4.063 1.00 . A A . 12 SER H 1 1 16 10872 1 1 12 SER HA H 1.709 -10.869 6.225 1.00 . A A . 12 SER HA 1 1 16 10873 1 1 12 SER HB2 H 4.192 -9.456 5.208 1.00 . A A . 12 SER HB2 1 1 16 10874 1 1 12 SER HB3 H 4.096 -10.428 6.676 1.00 . A A . 12 SER HB3 1 1 16 10875 1 1 12 SER HG H 3.136 -11.873 4.654 1.00 . A A . 12 SER HG 1 1 16 10876 1 1 12 SER N N 1.643 -9.865 4.427 1.00 . A A . 12 SER N 1 1 16 10877 1 1 12 SER O O 1.343 -7.805 6.101 1.00 . A A . 12 SER O 1 1 16 10878 1 1 12 SER OG O 3.973 -11.463 4.921 1.00 . A A . 12 SER OG 1 1 16 10879 1 1 13 VAL C C 3.169 -6.575 8.483 1.00 . A A . 13 VAL C 1 1 16 10880 1 1 13 VAL CA C 2.162 -7.689 8.753 1.00 . A A . 13 VAL CA 1 1 16 10881 1 1 13 VAL CB C 2.285 -8.148 10.225 1.00 . A A . 13 VAL CB 1 1 16 10882 1 1 13 VAL CG1 C 2.143 -6.973 11.183 1.00 . A A . 13 VAL CG1 1 1 16 10883 1 1 13 VAL CG2 C 1.251 -9.220 10.537 1.00 . A A . 13 VAL CG2 1 1 16 10884 1 1 13 VAL H H 2.814 -9.609 8.172 1.00 . A A . 13 VAL H 1 1 16 10885 1 1 13 VAL HA H 1.163 -7.305 8.600 1.00 . A A . 13 VAL HA 1 1 16 10886 1 1 13 VAL HB H 3.267 -8.577 10.364 1.00 . A A . 13 VAL HB 1 1 16 10887 1 1 13 VAL HG11 H 2.804 -6.176 10.875 1.00 . A A . 13 VAL HG11 1 1 16 10888 1 1 13 VAL HG12 H 2.403 -7.290 12.182 1.00 . A A . 13 VAL HG12 1 1 16 10889 1 1 13 VAL HG13 H 1.123 -6.620 11.171 1.00 . A A . 13 VAL HG13 1 1 16 10890 1 1 13 VAL HG21 H 0.971 -9.158 11.578 1.00 . A A . 13 VAL HG21 1 1 16 10891 1 1 13 VAL HG22 H 1.671 -10.194 10.334 1.00 . A A . 13 VAL HG22 1 1 16 10892 1 1 13 VAL HG23 H 0.378 -9.068 9.920 1.00 . A A . 13 VAL HG23 1 1 16 10893 1 1 13 VAL N N 2.358 -8.807 7.846 1.00 . A A . 13 VAL N 1 1 16 10894 1 1 13 VAL O O 4.379 -6.796 8.500 1.00 . A A . 13 VAL O 1 1 16 10895 1 1 14 CYS C C 4.154 -3.762 9.262 1.00 . A A . 14 CYS C 1 1 16 10896 1 1 14 CYS CA C 3.479 -4.214 7.972 1.00 . A A . 14 CYS CA 1 1 16 10897 1 1 14 CYS CB C 2.615 -3.082 7.407 1.00 . A A . 14 CYS CB 1 1 16 10898 1 1 14 CYS H H 1.679 -5.279 8.243 1.00 . A A . 14 CYS H 1 1 16 10899 1 1 14 CYS HA H 4.233 -4.488 7.250 1.00 . A A . 14 CYS HA 1 1 16 10900 1 1 14 CYS HB2 H 1.819 -3.511 6.818 1.00 . A A . 14 CYS HB2 1 1 16 10901 1 1 14 CYS HB3 H 2.185 -2.528 8.228 1.00 . A A . 14 CYS HB3 1 1 16 10902 1 1 14 CYS N N 2.651 -5.381 8.238 1.00 . A A . 14 CYS N 1 1 16 10903 1 1 14 CYS O O 3.485 -3.510 10.267 1.00 . A A . 14 CYS O 1 1 16 10904 1 1 14 CYS SG S 3.503 -1.897 6.344 1.00 . A A . 14 CYS SG 1 1 16 10905 1 1 15 ILE C C 6.628 -1.804 10.319 1.00 . A A . 15 ILE C 1 1 16 10906 1 1 15 ILE CA C 6.242 -3.279 10.406 1.00 . A A . 15 ILE CA 1 1 16 10907 1 1 15 ILE CB C 7.516 -4.144 10.558 1.00 . A A . 15 ILE CB 1 1 16 10908 1 1 15 ILE CD1 C 8.349 -6.557 10.561 1.00 . A A . 15 ILE CD1 1 1 16 10909 1 1 15 ILE CG1 C 7.151 -5.632 10.526 1.00 . A A . 15 ILE CG1 1 1 16 10910 1 1 15 ILE CG2 C 8.248 -3.806 11.852 1.00 . A A . 15 ILE CG2 1 1 16 10911 1 1 15 ILE H H 5.948 -3.913 8.411 1.00 . A A . 15 ILE H 1 1 16 10912 1 1 15 ILE HA H 5.623 -3.429 11.279 1.00 . A A . 15 ILE HA 1 1 16 10913 1 1 15 ILE HB H 8.175 -3.924 9.731 1.00 . A A . 15 ILE HB 1 1 16 10914 1 1 15 ILE HD11 H 8.011 -7.582 10.605 1.00 . A A . 15 ILE HD11 1 1 16 10915 1 1 15 ILE HD12 H 8.948 -6.338 11.433 1.00 . A A . 15 ILE HD12 1 1 16 10916 1 1 15 ILE HD13 H 8.943 -6.412 9.671 1.00 . A A . 15 ILE HD13 1 1 16 10917 1 1 15 ILE HG12 H 6.532 -5.861 11.380 1.00 . A A . 15 ILE HG12 1 1 16 10918 1 1 15 ILE HG13 H 6.597 -5.839 9.621 1.00 . A A . 15 ILE HG13 1 1 16 10919 1 1 15 ILE HG21 H 9.314 -3.877 11.692 1.00 . A A . 15 ILE HG21 1 1 16 10920 1 1 15 ILE HG22 H 7.953 -4.502 12.624 1.00 . A A . 15 ILE HG22 1 1 16 10921 1 1 15 ILE HG23 H 7.995 -2.801 12.157 1.00 . A A . 15 ILE HG23 1 1 16 10922 1 1 15 ILE N N 5.474 -3.681 9.235 1.00 . A A . 15 ILE N 1 1 16 10923 1 1 15 ILE O O 6.856 -1.144 11.332 1.00 . A A . 15 ILE O 1 1 16 10924 1 1 16 ASN C C 6.496 0.582 7.549 1.00 . A A . 16 ASN C 1 1 16 10925 1 1 16 ASN CA C 7.065 0.101 8.879 1.00 . A A . 16 ASN CA 1 1 16 10926 1 1 16 ASN CB C 8.595 0.249 8.907 1.00 . A A . 16 ASN CB 1 1 16 10927 1 1 16 ASN CG C 9.063 1.695 8.935 1.00 . A A . 16 ASN CG 1 1 16 10928 1 1 16 ASN H H 6.505 -1.860 8.327 1.00 . A A . 16 ASN H 1 1 16 10929 1 1 16 ASN HA H 6.636 0.688 9.677 1.00 . A A . 16 ASN HA 1 1 16 10930 1 1 16 ASN HB2 H 8.978 -0.246 9.786 1.00 . A A . 16 ASN HB2 1 1 16 10931 1 1 16 ASN HB3 H 9.008 -0.225 8.028 1.00 . A A . 16 ASN HB3 1 1 16 10932 1 1 16 ASN HD21 H 9.704 1.474 10.802 1.00 . A A . 16 ASN HD21 1 1 16 10933 1 1 16 ASN HD22 H 9.935 3.039 10.106 1.00 . A A . 16 ASN HD22 1 1 16 10934 1 1 16 ASN N N 6.700 -1.291 9.099 1.00 . A A . 16 ASN N 1 1 16 10935 1 1 16 ASN ND2 N 9.623 2.112 10.060 1.00 . A A . 16 ASN ND2 1 1 16 10936 1 1 16 ASN O O 6.266 -0.218 6.643 1.00 . A A . 16 ASN O 1 1 16 10937 1 1 16 ASN OD1 O 8.926 2.431 7.959 1.00 . A A . 16 ASN OD1 1 1 16 10938 1 1 17 LYS C C 6.672 2.347 5.051 1.00 . A A . 17 LYS C 1 1 16 10939 1 1 17 LYS CA C 5.712 2.486 6.239 1.00 . A A . 17 LYS CA 1 1 16 10940 1 1 17 LYS CB C 5.393 3.965 6.496 1.00 . A A . 17 LYS CB 1 1 16 10941 1 1 17 LYS CD C 4.548 6.164 5.610 1.00 . A A . 17 LYS CD 1 1 16 10942 1 1 17 LYS CE C 4.315 6.998 4.357 1.00 . A A . 17 LYS CE 1 1 16 10943 1 1 17 LYS CG C 4.876 4.716 5.276 1.00 . A A . 17 LYS CG 1 1 16 10944 1 1 17 LYS H H 6.463 2.460 8.213 1.00 . A A . 17 LYS H 1 1 16 10945 1 1 17 LYS HA H 4.795 1.969 6.002 1.00 . A A . 17 LYS HA 1 1 16 10946 1 1 17 LYS HB2 H 4.643 4.028 7.271 1.00 . A A . 17 LYS HB2 1 1 16 10947 1 1 17 LYS HB3 H 6.291 4.458 6.840 1.00 . A A . 17 LYS HB3 1 1 16 10948 1 1 17 LYS HD2 H 3.655 6.189 6.216 1.00 . A A . 17 LYS HD2 1 1 16 10949 1 1 17 LYS HD3 H 5.372 6.589 6.165 1.00 . A A . 17 LYS HD3 1 1 16 10950 1 1 17 LYS HE2 H 4.121 8.018 4.652 1.00 . A A . 17 LYS HE2 1 1 16 10951 1 1 17 LYS HE3 H 5.209 6.966 3.750 1.00 . A A . 17 LYS HE3 1 1 16 10952 1 1 17 LYS HG2 H 5.633 4.697 4.506 1.00 . A A . 17 LYS HG2 1 1 16 10953 1 1 17 LYS HG3 H 3.982 4.227 4.917 1.00 . A A . 17 LYS HG3 1 1 16 10954 1 1 17 LYS HZ1 H 2.281 6.932 3.883 1.00 . A A . 17 LYS HZ1 1 1 16 10955 1 1 17 LYS HZ2 H 3.088 5.471 3.615 1.00 . A A . 17 LYS HZ2 1 1 16 10956 1 1 17 LYS HZ3 H 3.298 6.766 2.542 1.00 . A A . 17 LYS HZ3 1 1 16 10957 1 1 17 LYS N N 6.262 1.883 7.447 1.00 . A A . 17 LYS N 1 1 16 10958 1 1 17 LYS NZ N 3.167 6.506 3.550 1.00 . A A . 17 LYS NZ 1 1 16 10959 1 1 17 LYS O O 6.228 2.191 3.914 1.00 . A A . 17 LYS O 1 1 16 10960 1 1 18 LYS C C 8.782 1.070 3.381 1.00 . A A . 18 LYS C 1 1 16 10961 1 1 18 LYS CA C 8.998 2.307 4.270 1.00 . A A . 18 LYS CA 1 1 16 10962 1 1 18 LYS CB C 10.409 2.305 4.876 1.00 . A A . 18 LYS CB 1 1 16 10963 1 1 18 LYS CD C 12.893 2.272 4.490 1.00 . A A . 18 LYS CD 1 1 16 10964 1 1 18 LYS CE C 14.002 2.247 3.451 1.00 . A A . 18 LYS CE 1 1 16 10965 1 1 18 LYS CG C 11.520 2.276 3.837 1.00 . A A . 18 LYS CG 1 1 16 10966 1 1 18 LYS H H 8.267 2.542 6.254 1.00 . A A . 18 LYS H 1 1 16 10967 1 1 18 LYS HA H 8.898 3.183 3.647 1.00 . A A . 18 LYS HA 1 1 16 10968 1 1 18 LYS HB2 H 10.531 3.194 5.477 1.00 . A A . 18 LYS HB2 1 1 16 10969 1 1 18 LYS HB3 H 10.514 1.436 5.508 1.00 . A A . 18 LYS HB3 1 1 16 10970 1 1 18 LYS HD2 H 12.997 3.163 5.092 1.00 . A A . 18 LYS HD2 1 1 16 10971 1 1 18 LYS HD3 H 12.979 1.398 5.118 1.00 . A A . 18 LYS HD3 1 1 16 10972 1 1 18 LYS HE2 H 13.893 1.358 2.848 1.00 . A A . 18 LYS HE2 1 1 16 10973 1 1 18 LYS HE3 H 13.910 3.121 2.823 1.00 . A A . 18 LYS HE3 1 1 16 10974 1 1 18 LYS HG2 H 11.416 1.385 3.238 1.00 . A A . 18 LYS HG2 1 1 16 10975 1 1 18 LYS HG3 H 11.433 3.149 3.207 1.00 . A A . 18 LYS HG3 1 1 16 10976 1 1 18 LYS HZ1 H 16.076 2.007 3.370 1.00 . A A . 18 LYS HZ1 1 1 16 10977 1 1 18 LYS HZ2 H 15.389 1.536 4.842 1.00 . A A . 18 LYS HZ2 1 1 16 10978 1 1 18 LYS HZ3 H 15.565 3.179 4.479 1.00 . A A . 18 LYS HZ3 1 1 16 10979 1 1 18 LYS N N 7.979 2.412 5.322 1.00 . A A . 18 LYS N 1 1 16 10980 1 1 18 LYS NZ N 15.352 2.242 4.080 1.00 . A A . 18 LYS NZ 1 1 16 10981 1 1 18 LYS O O 8.625 1.220 2.171 1.00 . A A . 18 LYS O 1 1 16 10982 1 1 19 PRO C C 7.359 -1.278 2.209 1.00 . A A . 19 PRO C 1 1 16 10983 1 1 19 PRO CA C 8.541 -1.399 3.170 1.00 . A A . 19 PRO CA 1 1 16 10984 1 1 19 PRO CB C 8.212 -2.418 4.262 1.00 . A A . 19 PRO CB 1 1 16 10985 1 1 19 PRO CD C 8.952 -0.468 5.385 1.00 . A A . 19 PRO CD 1 1 16 10986 1 1 19 PRO CG C 9.016 -1.969 5.422 1.00 . A A . 19 PRO CG 1 1 16 10987 1 1 19 PRO HA H 9.427 -1.704 2.633 1.00 . A A . 19 PRO HA 1 1 16 10988 1 1 19 PRO HB2 H 7.153 -2.382 4.478 1.00 . A A . 19 PRO HB2 1 1 16 10989 1 1 19 PRO HB3 H 8.482 -3.413 3.946 1.00 . A A . 19 PRO HB3 1 1 16 10990 1 1 19 PRO HD2 H 8.115 -0.112 5.968 1.00 . A A . 19 PRO HD2 1 1 16 10991 1 1 19 PRO HD3 H 9.875 -0.042 5.748 1.00 . A A . 19 PRO HD3 1 1 16 10992 1 1 19 PRO HG2 H 8.584 -2.344 6.339 1.00 . A A . 19 PRO HG2 1 1 16 10993 1 1 19 PRO HG3 H 10.037 -2.304 5.318 1.00 . A A . 19 PRO HG3 1 1 16 10994 1 1 19 PRO N N 8.761 -0.164 3.949 1.00 . A A . 19 PRO N 1 1 16 10995 1 1 19 PRO O O 7.445 -1.639 1.028 1.00 . A A . 19 PRO O 1 1 16 10996 1 1 20 CYS C C 5.268 0.433 0.833 1.00 . A A . 20 CYS C 1 1 16 10997 1 1 20 CYS CA C 5.046 -0.576 1.956 1.00 . A A . 20 CYS CA 1 1 16 10998 1 1 20 CYS CB C 3.914 -0.108 2.877 1.00 . A A . 20 CYS CB 1 1 16 10999 1 1 20 CYS H H 6.266 -0.488 3.675 1.00 . A A . 20 CYS H 1 1 16 11000 1 1 20 CYS HA H 4.783 -1.532 1.518 1.00 . A A . 20 CYS HA 1 1 16 11001 1 1 20 CYS HB2 H 3.767 -0.843 3.654 1.00 . A A . 20 CYS HB2 1 1 16 11002 1 1 20 CYS HB3 H 4.194 0.833 3.328 1.00 . A A . 20 CYS HB3 1 1 16 11003 1 1 20 CYS N N 6.259 -0.760 2.733 1.00 . A A . 20 CYS N 1 1 16 11004 1 1 20 CYS O O 4.999 0.142 -0.334 1.00 . A A . 20 CYS O 1 1 16 11005 1 1 20 CYS SG S 2.319 0.132 2.040 1.00 . A A . 20 CYS SG 1 1 16 11006 1 1 21 VAL C C 6.992 2.127 -0.879 1.00 . A A . 21 VAL C 1 1 16 11007 1 1 21 VAL CA C 6.062 2.653 0.206 1.00 . A A . 21 VAL CA 1 1 16 11008 1 1 21 VAL CB C 6.685 3.904 0.868 1.00 . A A . 21 VAL CB 1 1 16 11009 1 1 21 VAL CG1 C 7.094 4.934 -0.175 1.00 . A A . 21 VAL CG1 1 1 16 11010 1 1 21 VAL CG2 C 5.711 4.518 1.857 1.00 . A A . 21 VAL CG2 1 1 16 11011 1 1 21 VAL H H 5.998 1.772 2.133 1.00 . A A . 21 VAL H 1 1 16 11012 1 1 21 VAL HA H 5.123 2.939 -0.250 1.00 . A A . 21 VAL HA 1 1 16 11013 1 1 21 VAL HB H 7.569 3.600 1.408 1.00 . A A . 21 VAL HB 1 1 16 11014 1 1 21 VAL HG11 H 6.238 5.537 -0.440 1.00 . A A . 21 VAL HG11 1 1 16 11015 1 1 21 VAL HG12 H 7.465 4.429 -1.054 1.00 . A A . 21 VAL HG12 1 1 16 11016 1 1 21 VAL HG13 H 7.869 5.568 0.230 1.00 . A A . 21 VAL HG13 1 1 16 11017 1 1 21 VAL HG21 H 4.699 4.343 1.522 1.00 . A A . 21 VAL HG21 1 1 16 11018 1 1 21 VAL HG22 H 5.889 5.581 1.925 1.00 . A A . 21 VAL HG22 1 1 16 11019 1 1 21 VAL HG23 H 5.851 4.067 2.828 1.00 . A A . 21 VAL HG23 1 1 16 11020 1 1 21 VAL N N 5.785 1.608 1.186 1.00 . A A . 21 VAL N 1 1 16 11021 1 1 21 VAL O O 6.832 2.454 -2.054 1.00 . A A . 21 VAL O 1 1 16 11022 1 1 22 ALA C C 8.148 -0.122 -2.458 1.00 . A A . 22 ALA C 1 1 16 11023 1 1 22 ALA CA C 8.888 0.702 -1.412 1.00 . A A . 22 ALA CA 1 1 16 11024 1 1 22 ALA CB C 9.905 -0.156 -0.674 1.00 . A A . 22 ALA CB 1 1 16 11025 1 1 22 ALA H H 8.008 1.064 0.478 1.00 . A A . 22 ALA H 1 1 16 11026 1 1 22 ALA HA H 9.417 1.504 -1.907 1.00 . A A . 22 ALA HA 1 1 16 11027 1 1 22 ALA HB1 H 9.769 -0.040 0.391 1.00 . A A . 22 ALA HB1 1 1 16 11028 1 1 22 ALA HB2 H 10.903 0.155 -0.945 1.00 . A A . 22 ALA HB2 1 1 16 11029 1 1 22 ALA HB3 H 9.765 -1.192 -0.944 1.00 . A A . 22 ALA HB3 1 1 16 11030 1 1 22 ALA N N 7.946 1.295 -0.477 1.00 . A A . 22 ALA N 1 1 16 11031 1 1 22 ALA O O 8.398 0.019 -3.659 1.00 . A A . 22 ALA O 1 1 16 11032 1 1 23 CYS C C 5.583 -0.900 -3.821 1.00 . A A . 23 CYS C 1 1 16 11033 1 1 23 CYS CA C 6.442 -1.783 -2.932 1.00 . A A . 23 CYS CA 1 1 16 11034 1 1 23 CYS CB C 5.522 -2.765 -2.215 1.00 . A A . 23 CYS CB 1 1 16 11035 1 1 23 CYS H H 7.044 -1.026 -1.042 1.00 . A A . 23 CYS H 1 1 16 11036 1 1 23 CYS HA H 7.134 -2.336 -3.548 1.00 . A A . 23 CYS HA 1 1 16 11037 1 1 23 CYS HB2 H 6.061 -3.261 -1.424 1.00 . A A . 23 CYS HB2 1 1 16 11038 1 1 23 CYS HB3 H 4.688 -2.224 -1.793 1.00 . A A . 23 CYS HB3 1 1 16 11039 1 1 23 CYS N N 7.218 -0.965 -2.007 1.00 . A A . 23 CYS N 1 1 16 11040 1 1 23 CYS O O 5.563 -1.044 -5.046 1.00 . A A . 23 CYS O 1 1 16 11041 1 1 23 CYS SG S 4.848 -4.017 -3.363 1.00 . A A . 23 CYS SG 1 1 16 11042 1 1 24 CYS C C 4.758 1.697 -4.964 1.00 . A A . 24 CYS C 1 1 16 11043 1 1 24 CYS CA C 3.990 0.921 -3.896 1.00 . A A . 24 CYS CA 1 1 16 11044 1 1 24 CYS CB C 3.337 1.889 -2.910 1.00 . A A . 24 CYS CB 1 1 16 11045 1 1 24 CYS H H 4.924 0.061 -2.204 1.00 . A A . 24 CYS H 1 1 16 11046 1 1 24 CYS HA H 3.218 0.331 -4.373 1.00 . A A . 24 CYS HA 1 1 16 11047 1 1 24 CYS HB2 H 4.105 2.478 -2.434 1.00 . A A . 24 CYS HB2 1 1 16 11048 1 1 24 CYS HB3 H 2.670 2.545 -3.447 1.00 . A A . 24 CYS HB3 1 1 16 11049 1 1 24 CYS N N 4.868 0.009 -3.187 1.00 . A A . 24 CYS N 1 1 16 11050 1 1 24 CYS O O 4.289 1.848 -6.085 1.00 . A A . 24 CYS O 1 1 16 11051 1 1 24 CYS SG S 2.375 1.074 -1.596 1.00 . A A . 24 CYS SG 1 1 16 11052 1 1 25 LYS C C 7.204 2.096 -6.740 1.00 . A A . 25 LYS C 1 1 16 11053 1 1 25 LYS CA C 6.764 2.940 -5.549 1.00 . A A . 25 LYS CA 1 1 16 11054 1 1 25 LYS CB C 7.975 3.547 -4.836 1.00 . A A . 25 LYS CB 1 1 16 11055 1 1 25 LYS CD C 6.460 5.277 -3.811 1.00 . A A . 25 LYS CD 1 1 16 11056 1 1 25 LYS CE C 6.157 6.762 -3.699 1.00 . A A . 25 LYS CE 1 1 16 11057 1 1 25 LYS CG C 7.794 5.021 -4.496 1.00 . A A . 25 LYS CG 1 1 16 11058 1 1 25 LYS H H 6.274 2.024 -3.700 1.00 . A A . 25 LYS H 1 1 16 11059 1 1 25 LYS HA H 6.152 3.749 -5.922 1.00 . A A . 25 LYS HA 1 1 16 11060 1 1 25 LYS HB2 H 8.149 3.004 -3.918 1.00 . A A . 25 LYS HB2 1 1 16 11061 1 1 25 LYS HB3 H 8.842 3.449 -5.472 1.00 . A A . 25 LYS HB3 1 1 16 11062 1 1 25 LYS HD2 H 5.677 4.804 -4.384 1.00 . A A . 25 LYS HD2 1 1 16 11063 1 1 25 LYS HD3 H 6.489 4.849 -2.819 1.00 . A A . 25 LYS HD3 1 1 16 11064 1 1 25 LYS HE2 H 6.310 7.219 -4.664 1.00 . A A . 25 LYS HE2 1 1 16 11065 1 1 25 LYS HE3 H 5.124 6.882 -3.406 1.00 . A A . 25 LYS HE3 1 1 16 11066 1 1 25 LYS HG2 H 8.591 5.328 -3.835 1.00 . A A . 25 LYS HG2 1 1 16 11067 1 1 25 LYS HG3 H 7.838 5.598 -5.408 1.00 . A A . 25 LYS HG3 1 1 16 11068 1 1 25 LYS HZ1 H 7.460 6.742 -2.069 1.00 . A A . 25 LYS HZ1 1 1 16 11069 1 1 25 LYS HZ2 H 6.458 8.103 -2.131 1.00 . A A . 25 LYS HZ2 1 1 16 11070 1 1 25 LYS HZ3 H 7.775 7.975 -3.185 1.00 . A A . 25 LYS HZ3 1 1 16 11071 1 1 25 LYS N N 5.942 2.180 -4.614 1.00 . A A . 25 LYS N 1 1 16 11072 1 1 25 LYS NZ N 7.025 7.443 -2.701 1.00 . A A . 25 LYS NZ 1 1 16 11073 1 1 25 LYS O O 7.116 2.549 -7.881 1.00 . A A . 25 LYS O 1 1 16 11074 1 1 26 LYS C C 6.909 -0.431 -8.444 1.00 . A A . 26 LYS C 1 1 16 11075 1 1 26 LYS CA C 8.099 0.004 -7.584 1.00 . A A . 26 LYS CA 1 1 16 11076 1 1 26 LYS CB C 8.905 -1.208 -7.070 1.00 . A A . 26 LYS CB 1 1 16 11077 1 1 26 LYS CD C 7.222 -3.075 -6.743 1.00 . A A . 26 LYS CD 1 1 16 11078 1 1 26 LYS CE C 7.944 -4.035 -7.673 1.00 . A A . 26 LYS CE 1 1 16 11079 1 1 26 LYS CG C 8.184 -2.105 -6.070 1.00 . A A . 26 LYS CG 1 1 16 11080 1 1 26 LYS H H 7.710 0.548 -5.563 1.00 . A A . 26 LYS H 1 1 16 11081 1 1 26 LYS HA H 8.750 0.600 -8.209 1.00 . A A . 26 LYS HA 1 1 16 11082 1 1 26 LYS HB2 H 9.182 -1.816 -7.917 1.00 . A A . 26 LYS HB2 1 1 16 11083 1 1 26 LYS HB3 H 9.807 -0.842 -6.601 1.00 . A A . 26 LYS HB3 1 1 16 11084 1 1 26 LYS HD2 H 6.711 -3.646 -5.983 1.00 . A A . 26 LYS HD2 1 1 16 11085 1 1 26 LYS HD3 H 6.500 -2.509 -7.315 1.00 . A A . 26 LYS HD3 1 1 16 11086 1 1 26 LYS HE2 H 8.480 -3.462 -8.416 1.00 . A A . 26 LYS HE2 1 1 16 11087 1 1 26 LYS HE3 H 8.644 -4.619 -7.094 1.00 . A A . 26 LYS HE3 1 1 16 11088 1 1 26 LYS HG2 H 8.919 -2.674 -5.521 1.00 . A A . 26 LYS HG2 1 1 16 11089 1 1 26 LYS HG3 H 7.629 -1.482 -5.383 1.00 . A A . 26 LYS HG3 1 1 16 11090 1 1 26 LYS HZ1 H 6.491 -5.532 -7.659 1.00 . A A . 26 LYS HZ1 1 1 16 11091 1 1 26 LYS HZ2 H 7.512 -5.581 -9.007 1.00 . A A . 26 LYS HZ2 1 1 16 11092 1 1 26 LYS HZ3 H 6.302 -4.402 -8.906 1.00 . A A . 26 LYS HZ3 1 1 16 11093 1 1 26 LYS N N 7.665 0.872 -6.490 1.00 . A A . 26 LYS N 1 1 16 11094 1 1 26 LYS NZ N 6.996 -4.952 -8.359 1.00 . A A . 26 LYS NZ 1 1 16 11095 1 1 26 LYS O O 7.085 -0.910 -9.564 1.00 . A A . 26 LYS O 1 1 16 11096 1 1 27 ALA C C 3.803 0.618 -9.223 1.00 . A A . 27 ALA C 1 1 16 11097 1 1 27 ALA CA C 4.490 -0.625 -8.642 1.00 . A A . 27 ALA CA 1 1 16 11098 1 1 27 ALA CB C 3.543 -1.395 -7.734 1.00 . A A . 27 ALA CB 1 1 16 11099 1 1 27 ALA H H 5.620 0.124 -7.013 1.00 . A A . 27 ALA H 1 1 16 11100 1 1 27 ALA HA H 4.776 -1.276 -9.457 1.00 . A A . 27 ALA HA 1 1 16 11101 1 1 27 ALA HB1 H 3.646 -2.454 -7.920 1.00 . A A . 27 ALA HB1 1 1 16 11102 1 1 27 ALA HB2 H 2.526 -1.091 -7.934 1.00 . A A . 27 ALA HB2 1 1 16 11103 1 1 27 ALA HB3 H 3.784 -1.185 -6.702 1.00 . A A . 27 ALA HB3 1 1 16 11104 1 1 27 ALA N N 5.700 -0.261 -7.915 1.00 . A A . 27 ALA N 1 1 16 11105 1 1 27 ALA O O 2.672 0.548 -9.706 1.00 . A A . 27 ALA O 1 1 16 11106 1 1 28 LYS C C 2.814 3.561 -8.917 1.00 . A A . 28 LYS C 1 1 16 11107 1 1 28 LYS CA C 4.027 3.028 -9.702 1.00 . A A . 28 LYS CA 1 1 16 11108 1 1 28 LYS CB C 3.725 2.933 -11.210 1.00 . A A . 28 LYS CB 1 1 16 11109 1 1 28 LYS CD C 3.323 4.179 -13.371 1.00 . A A . 28 LYS CD 1 1 16 11110 1 1 28 LYS CE C 2.466 5.277 -13.989 1.00 . A A . 28 LYS CE 1 1 16 11111 1 1 28 LYS CG C 3.341 4.264 -11.852 1.00 . A A . 28 LYS CG 1 1 16 11112 1 1 28 LYS H H 5.414 1.714 -8.788 1.00 . A A . 28 LYS H 1 1 16 11113 1 1 28 LYS HA H 4.832 3.737 -9.570 1.00 . A A . 28 LYS HA 1 1 16 11114 1 1 28 LYS HB2 H 4.601 2.556 -11.716 1.00 . A A . 28 LYS HB2 1 1 16 11115 1 1 28 LYS HB3 H 2.911 2.240 -11.358 1.00 . A A . 28 LYS HB3 1 1 16 11116 1 1 28 LYS HD2 H 4.334 4.277 -13.738 1.00 . A A . 28 LYS HD2 1 1 16 11117 1 1 28 LYS HD3 H 2.925 3.217 -13.661 1.00 . A A . 28 LYS HD3 1 1 16 11118 1 1 28 LYS HE2 H 2.630 5.282 -15.056 1.00 . A A . 28 LYS HE2 1 1 16 11119 1 1 28 LYS HE3 H 1.427 5.056 -13.790 1.00 . A A . 28 LYS HE3 1 1 16 11120 1 1 28 LYS HG2 H 2.358 4.547 -11.508 1.00 . A A . 28 LYS HG2 1 1 16 11121 1 1 28 LYS HG3 H 4.057 5.015 -11.552 1.00 . A A . 28 LYS HG3 1 1 16 11122 1 1 28 LYS HZ1 H 3.243 6.551 -12.522 1.00 . A A . 28 LYS HZ1 1 1 16 11123 1 1 28 LYS HZ2 H 1.899 7.184 -13.336 1.00 . A A . 28 LYS HZ2 1 1 16 11124 1 1 28 LYS HZ3 H 3.411 7.139 -14.099 1.00 . A A . 28 LYS HZ3 1 1 16 11125 1 1 28 LYS N N 4.515 1.746 -9.180 1.00 . A A . 28 LYS N 1 1 16 11126 1 1 28 LYS NZ N 2.783 6.630 -13.450 1.00 . A A . 28 LYS NZ 1 1 16 11127 1 1 28 LYS O O 1.789 3.944 -9.489 1.00 . A A . 28 LYS O 1 1 16 11128 1 1 29 PHE C C 2.439 5.402 -6.033 1.00 . A A . 29 PHE C 1 1 16 11129 1 1 29 PHE CA C 1.909 4.159 -6.742 1.00 . A A . 29 PHE CA 1 1 16 11130 1 1 29 PHE CB C 1.403 3.133 -5.719 1.00 . A A . 29 PHE CB 1 1 16 11131 1 1 29 PHE CD1 C 1.112 0.992 -7.011 1.00 . A A . 29 PHE CD1 1 1 16 11132 1 1 29 PHE CD2 C -0.832 2.046 -6.126 1.00 . A A . 29 PHE CD2 1 1 16 11133 1 1 29 PHE CE1 C 0.327 -0.020 -7.532 1.00 . A A . 29 PHE CE1 1 1 16 11134 1 1 29 PHE CE2 C -1.621 1.035 -6.642 1.00 . A A . 29 PHE CE2 1 1 16 11135 1 1 29 PHE CG C 0.546 2.038 -6.305 1.00 . A A . 29 PHE CG 1 1 16 11136 1 1 29 PHE CZ C -1.040 0.002 -7.347 1.00 . A A . 29 PHE CZ 1 1 16 11137 1 1 29 PHE H H 3.802 3.333 -7.198 1.00 . A A . 29 PHE H 1 1 16 11138 1 1 29 PHE HA H 1.087 4.455 -7.379 1.00 . A A . 29 PHE HA 1 1 16 11139 1 1 29 PHE HB2 H 2.250 2.667 -5.240 1.00 . A A . 29 PHE HB2 1 1 16 11140 1 1 29 PHE HB3 H 0.815 3.647 -4.972 1.00 . A A . 29 PHE HB3 1 1 16 11141 1 1 29 PHE HD1 H 2.182 0.971 -7.158 1.00 . A A . 29 PHE HD1 1 1 16 11142 1 1 29 PHE HD2 H -1.292 2.856 -5.580 1.00 . A A . 29 PHE HD2 1 1 16 11143 1 1 29 PHE HE1 H 0.784 -0.828 -8.084 1.00 . A A . 29 PHE HE1 1 1 16 11144 1 1 29 PHE HE2 H -2.690 1.055 -6.495 1.00 . A A . 29 PHE HE2 1 1 16 11145 1 1 29 PHE HZ H -1.654 -0.789 -7.752 1.00 . A A . 29 PHE HZ 1 1 16 11146 1 1 29 PHE N N 2.956 3.624 -7.602 1.00 . A A . 29 PHE N 1 1 16 11147 1 1 29 PHE O O 3.627 5.483 -5.711 1.00 . A A . 29 PHE O 1 1 16 11148 1 1 30 SER C C 2.458 7.437 -3.764 1.00 . A A . 30 SER C 1 1 16 11149 1 1 30 SER CA C 1.919 7.631 -5.182 1.00 . A A . 30 SER CA 1 1 16 11150 1 1 30 SER CB C 0.697 8.549 -5.156 1.00 . A A . 30 SER CB 1 1 16 11151 1 1 30 SER H H 0.638 6.240 -6.117 1.00 . A A . 30 SER H 1 1 16 11152 1 1 30 SER HA H 2.685 8.095 -5.779 1.00 . A A . 30 SER HA 1 1 16 11153 1 1 30 SER HB2 H -0.017 8.177 -4.435 1.00 . A A . 30 SER HB2 1 1 16 11154 1 1 30 SER HB3 H 1.003 9.547 -4.881 1.00 . A A . 30 SER HB3 1 1 16 11155 1 1 30 SER HG H 0.551 9.214 -6.996 1.00 . A A . 30 SER HG 1 1 16 11156 1 1 30 SER N N 1.562 6.370 -5.820 1.00 . A A . 30 SER N 1 1 16 11157 1 1 30 SER O O 3.471 8.032 -3.395 1.00 . A A . 30 SER O 1 1 16 11158 1 1 30 SER OG O 0.077 8.595 -6.432 1.00 . A A . 30 SER OG 1 1 16 11159 1 1 31 ASP C C 1.476 5.146 -1.026 1.00 . A A . 31 ASP C 1 1 16 11160 1 1 31 ASP CA C 2.204 6.352 -1.599 1.00 . A A . 31 ASP CA 1 1 16 11161 1 1 31 ASP CB C 1.947 7.572 -0.708 1.00 . A A . 31 ASP CB 1 1 16 11162 1 1 31 ASP CG C 2.363 7.324 0.729 1.00 . A A . 31 ASP CG 1 1 16 11163 1 1 31 ASP H H 0.984 6.162 -3.327 1.00 . A A . 31 ASP H 1 1 16 11164 1 1 31 ASP HA H 3.263 6.144 -1.610 1.00 . A A . 31 ASP HA 1 1 16 11165 1 1 31 ASP HB2 H 2.509 8.413 -1.087 1.00 . A A . 31 ASP HB2 1 1 16 11166 1 1 31 ASP HB3 H 0.894 7.809 -0.725 1.00 . A A . 31 ASP HB3 1 1 16 11167 1 1 31 ASP N N 1.784 6.609 -2.977 1.00 . A A . 31 ASP N 1 1 16 11168 1 1 31 ASP O O 0.345 4.853 -1.414 1.00 . A A . 31 ASP O 1 1 16 11169 1 1 31 ASP OD1 O 3.556 7.027 0.966 1.00 . A A . 31 ASP OD1 1 1 16 11170 1 1 31 ASP OD2 O 1.501 7.396 1.627 1.00 . A A . 31 ASP OD2 1 1 16 11171 1 1 32 GLY C C 1.315 3.450 1.995 1.00 . A A . 32 GLY C 1 1 16 11172 1 1 32 GLY CA C 1.530 3.286 0.507 1.00 . A A . 32 GLY CA 1 1 16 11173 1 1 32 GLY H H 3.023 4.738 0.167 1.00 . A A . 32 GLY H 1 1 16 11174 1 1 32 GLY HA2 H 0.573 3.098 0.038 1.00 . A A . 32 GLY HA2 1 1 16 11175 1 1 32 GLY HA3 H 2.173 2.435 0.338 1.00 . A A . 32 GLY HA3 1 1 16 11176 1 1 32 GLY N N 2.127 4.451 -0.105 1.00 . A A . 32 GLY N 1 1 16 11177 1 1 32 GLY O O 2.091 4.122 2.680 1.00 . A A . 32 GLY O 1 1 16 11178 1 1 33 HIS C C -0.489 1.508 4.407 1.00 . A A . 33 HIS C 1 1 16 11179 1 1 33 HIS CA C -0.070 2.883 3.910 1.00 . A A . 33 HIS CA 1 1 16 11180 1 1 33 HIS CB C -1.181 3.911 4.178 1.00 . A A . 33 HIS CB 1 1 16 11181 1 1 33 HIS CD2 C -3.637 3.360 3.525 1.00 . A A . 33 HIS CD2 1 1 16 11182 1 1 33 HIS CE1 C -3.541 3.906 1.404 1.00 . A A . 33 HIS CE1 1 1 16 11183 1 1 33 HIS CG C -2.378 3.792 3.274 1.00 . A A . 33 HIS CG 1 1 16 11184 1 1 33 HIS H H -0.309 2.296 1.890 1.00 . A A . 33 HIS H 1 1 16 11185 1 1 33 HIS HA H 0.820 3.184 4.442 1.00 . A A . 33 HIS HA 1 1 16 11186 1 1 33 HIS HB2 H -1.526 3.794 5.194 1.00 . A A . 33 HIS HB2 1 1 16 11187 1 1 33 HIS HB3 H -0.771 4.902 4.059 1.00 . A A . 33 HIS HB3 1 1 16 11188 1 1 33 HIS HD1 H -1.578 4.474 1.443 1.00 . A A . 33 HIS HD1 1 1 16 11189 1 1 33 HIS HD2 H -4.017 3.007 4.472 1.00 . A A . 33 HIS HD2 1 1 16 11190 1 1 33 HIS HE1 H -3.811 4.063 0.371 1.00 . A A . 33 HIS HE1 1 1 16 11191 1 1 33 HIS N N 0.263 2.826 2.495 1.00 . A A . 33 HIS N 1 1 16 11192 1 1 33 HIS ND1 N -2.353 4.127 1.934 1.00 . A A . 33 HIS ND1 1 1 16 11193 1 1 33 HIS NE2 N -4.338 3.442 2.347 1.00 . A A . 33 HIS NE2 1 1 16 11194 1 1 33 HIS O O -1.335 0.849 3.804 1.00 . A A . 33 HIS O 1 1 16 11195 1 1 34 CYS C C -1.567 -0.252 6.697 1.00 . A A . 34 CYS C 1 1 16 11196 1 1 34 CYS CA C -0.167 -0.221 6.083 1.00 . A A . 34 CYS CA 1 1 16 11197 1 1 34 CYS CB C 0.874 -0.554 7.157 1.00 . A A . 34 CYS CB 1 1 16 11198 1 1 34 CYS H H 0.791 1.653 5.922 1.00 . A A . 34 CYS H 1 1 16 11199 1 1 34 CYS HA H -0.112 -0.960 5.298 1.00 . A A . 34 CYS HA 1 1 16 11200 1 1 34 CYS HB2 H 0.627 -0.020 8.062 1.00 . A A . 34 CYS HB2 1 1 16 11201 1 1 34 CYS HB3 H 0.847 -1.616 7.354 1.00 . A A . 34 CYS HB3 1 1 16 11202 1 1 34 CYS N N 0.120 1.081 5.498 1.00 . A A . 34 CYS N 1 1 16 11203 1 1 34 CYS O O -1.974 0.687 7.384 1.00 . A A . 34 CYS O 1 1 16 11204 1 1 34 CYS SG S 2.590 -0.115 6.707 1.00 . A A . 34 CYS SG 1 1 16 11205 1 1 35 SER C C -3.592 -1.705 8.491 1.00 . A A . 35 SER C 1 1 16 11206 1 1 35 SER CA C -3.641 -1.505 6.974 1.00 . A A . 35 SER CA 1 1 16 11207 1 1 35 SER CB C -4.325 -2.699 6.295 1.00 . A A . 35 SER CB 1 1 16 11208 1 1 35 SER H H -1.909 -2.044 5.885 1.00 . A A . 35 SER H 1 1 16 11209 1 1 35 SER HA H -4.200 -0.607 6.757 1.00 . A A . 35 SER HA 1 1 16 11210 1 1 35 SER HB2 H -4.274 -2.577 5.224 1.00 . A A . 35 SER HB2 1 1 16 11211 1 1 35 SER HB3 H -3.814 -3.608 6.576 1.00 . A A . 35 SER HB3 1 1 16 11212 1 1 35 SER HG H -6.247 -2.557 5.926 1.00 . A A . 35 SER HG 1 1 16 11213 1 1 35 SER N N -2.294 -1.335 6.445 1.00 . A A . 35 SER N 1 1 16 11214 1 1 35 SER O O -2.515 -1.803 9.079 1.00 . A A . 35 SER O 1 1 16 11215 1 1 35 SER OG O -5.689 -2.809 6.672 1.00 . A A . 35 SER OG 1 1 16 11216 1 1 36 LYS C C -4.876 -3.392 10.979 1.00 . A A . 36 LYS C 1 1 16 11217 1 1 36 LYS CA C -4.823 -1.920 10.566 1.00 . A A . 36 LYS CA 1 1 16 11218 1 1 36 LYS CB C -6.041 -1.193 11.126 1.00 . A A . 36 LYS CB 1 1 16 11219 1 1 36 LYS CD C -5.008 -0.345 13.254 1.00 . A A . 36 LYS CD 1 1 16 11220 1 1 36 LYS CE C -5.164 1.114 12.847 1.00 . A A . 36 LYS CE 1 1 16 11221 1 1 36 LYS CG C -6.095 -1.218 12.641 1.00 . A A . 36 LYS CG 1 1 16 11222 1 1 36 LYS H H -5.583 -1.661 8.606 1.00 . A A . 36 LYS H 1 1 16 11223 1 1 36 LYS HA H -3.934 -1.478 10.989 1.00 . A A . 36 LYS HA 1 1 16 11224 1 1 36 LYS HB2 H -6.014 -0.162 10.802 1.00 . A A . 36 LYS HB2 1 1 16 11225 1 1 36 LYS HB3 H -6.936 -1.661 10.745 1.00 . A A . 36 LYS HB3 1 1 16 11226 1 1 36 LYS HD2 H -5.068 -0.415 14.330 1.00 . A A . 36 LYS HD2 1 1 16 11227 1 1 36 LYS HD3 H -4.045 -0.701 12.921 1.00 . A A . 36 LYS HD3 1 1 16 11228 1 1 36 LYS HE2 H -5.170 1.174 11.769 1.00 . A A . 36 LYS HE2 1 1 16 11229 1 1 36 LYS HE3 H -6.103 1.483 13.232 1.00 . A A . 36 LYS HE3 1 1 16 11230 1 1 36 LYS HG2 H -7.060 -0.864 12.966 1.00 . A A . 36 LYS HG2 1 1 16 11231 1 1 36 LYS HG3 H -5.949 -2.239 12.969 1.00 . A A . 36 LYS HG3 1 1 16 11232 1 1 36 LYS HZ1 H -3.287 2.014 12.675 1.00 . A A . 36 LYS HZ1 1 1 16 11233 1 1 36 LYS HZ2 H -3.685 1.556 14.254 1.00 . A A . 36 LYS HZ2 1 1 16 11234 1 1 36 LYS HZ3 H -4.404 2.922 13.565 1.00 . A A . 36 LYS HZ3 1 1 16 11235 1 1 36 LYS N N -4.754 -1.752 9.123 1.00 . A A . 36 LYS N 1 1 16 11236 1 1 36 LYS NZ N -4.058 1.960 13.372 1.00 . A A . 36 LYS NZ 1 1 16 11237 1 1 36 LYS O O -4.254 -3.784 11.964 1.00 . A A . 36 LYS O 1 1 16 11238 1 1 37 ILE C C -4.520 -6.391 10.240 1.00 . A A . 37 ILE C 1 1 16 11239 1 1 37 ILE CA C -5.798 -5.608 10.562 1.00 . A A . 37 ILE CA 1 1 16 11240 1 1 37 ILE CB C -6.993 -6.218 9.797 1.00 . A A . 37 ILE CB 1 1 16 11241 1 1 37 ILE CD1 C -9.400 -5.761 9.093 1.00 . A A . 37 ILE CD1 1 1 16 11242 1 1 37 ILE CG1 C -8.232 -5.331 9.954 1.00 . A A . 37 ILE CG1 1 1 16 11243 1 1 37 ILE CG2 C -7.287 -7.629 10.297 1.00 . A A . 37 ILE CG2 1 1 16 11244 1 1 37 ILE H H -6.134 -3.812 9.489 1.00 . A A . 37 ILE H 1 1 16 11245 1 1 37 ILE HA H -5.998 -5.691 11.621 1.00 . A A . 37 ILE HA 1 1 16 11246 1 1 37 ILE HB H -6.731 -6.276 8.754 1.00 . A A . 37 ILE HB 1 1 16 11247 1 1 37 ILE HD11 H -9.436 -5.148 8.204 1.00 . A A . 37 ILE HD11 1 1 16 11248 1 1 37 ILE HD12 H -10.319 -5.645 9.648 1.00 . A A . 37 ILE HD12 1 1 16 11249 1 1 37 ILE HD13 H -9.278 -6.796 8.811 1.00 . A A . 37 ILE HD13 1 1 16 11250 1 1 37 ILE HG12 H -8.555 -5.355 10.984 1.00 . A A . 37 ILE HG12 1 1 16 11251 1 1 37 ILE HG13 H -7.976 -4.316 9.686 1.00 . A A . 37 ILE HG13 1 1 16 11252 1 1 37 ILE HG21 H -6.816 -8.348 9.643 1.00 . A A . 37 ILE HG21 1 1 16 11253 1 1 37 ILE HG22 H -8.354 -7.794 10.305 1.00 . A A . 37 ILE HG22 1 1 16 11254 1 1 37 ILE HG23 H -6.897 -7.745 11.298 1.00 . A A . 37 ILE HG23 1 1 16 11255 1 1 37 ILE N N -5.643 -4.189 10.247 1.00 . A A . 37 ILE N 1 1 16 11256 1 1 37 ILE O O -3.595 -6.441 11.047 1.00 . A A . 37 ILE O 1 1 16 11257 1 1 38 LEU C C -2.157 -6.836 8.268 1.00 . A A . 38 LEU C 1 1 16 11258 1 1 38 LEU CA C -3.310 -7.767 8.618 1.00 . A A . 38 LEU CA 1 1 16 11259 1 1 38 LEU CB C -3.668 -8.624 7.401 1.00 . A A . 38 LEU CB 1 1 16 11260 1 1 38 LEU CD1 C -2.350 -10.644 8.102 1.00 . A A . 38 LEU CD1 1 1 16 11261 1 1 38 LEU CD2 C -3.014 -10.358 5.710 1.00 . A A . 38 LEU CD2 1 1 16 11262 1 1 38 LEU CG C -2.602 -9.642 6.986 1.00 . A A . 38 LEU CG 1 1 16 11263 1 1 38 LEU H H -5.242 -6.914 8.451 1.00 . A A . 38 LEU H 1 1 16 11264 1 1 38 LEU HA H -3.011 -8.411 9.432 1.00 . A A . 38 LEU HA 1 1 16 11265 1 1 38 LEU HB2 H -4.581 -9.153 7.615 1.00 . A A . 38 LEU HB2 1 1 16 11266 1 1 38 LEU HB3 H -3.844 -7.964 6.565 1.00 . A A . 38 LEU HB3 1 1 16 11267 1 1 38 LEU HD11 H -3.246 -11.222 8.276 1.00 . A A . 38 LEU HD11 1 1 16 11268 1 1 38 LEU HD12 H -2.081 -10.117 9.006 1.00 . A A . 38 LEU HD12 1 1 16 11269 1 1 38 LEU HD13 H -1.545 -11.305 7.818 1.00 . A A . 38 LEU HD13 1 1 16 11270 1 1 38 LEU HD21 H -2.300 -10.142 4.929 1.00 . A A . 38 LEU HD21 1 1 16 11271 1 1 38 LEU HD22 H -3.993 -10.018 5.406 1.00 . A A . 38 LEU HD22 1 1 16 11272 1 1 38 LEU HD23 H -3.041 -11.423 5.888 1.00 . A A . 38 LEU HD23 1 1 16 11273 1 1 38 LEU HG H -1.676 -9.118 6.793 1.00 . A A . 38 LEU HG 1 1 16 11274 1 1 38 LEU N N -4.474 -6.992 9.051 1.00 . A A . 38 LEU N 1 1 16 11275 1 1 38 LEU O O -1.052 -7.272 7.958 1.00 . A A . 38 LEU O 1 1 16 11276 1 1 39 ARG C C -1.062 -4.575 6.551 1.00 . A A . 39 ARG C 1 1 16 11277 1 1 39 ARG CA C -1.489 -4.494 8.011 1.00 . A A . 39 ARG CA 1 1 16 11278 1 1 39 ARG CB C -0.247 -4.565 8.908 1.00 . A A . 39 ARG CB 1 1 16 11279 1 1 39 ARG CD C -1.185 -3.723 11.086 1.00 . A A . 39 ARG CD 1 1 16 11280 1 1 39 ARG CG C -0.518 -4.879 10.366 1.00 . A A . 39 ARG CG 1 1 16 11281 1 1 39 ARG CZ C -0.710 -4.293 13.450 1.00 . A A . 39 ARG CZ 1 1 16 11282 1 1 39 ARG H H -3.357 -5.287 8.573 1.00 . A A . 39 ARG H 1 1 16 11283 1 1 39 ARG HA H -1.981 -3.545 8.172 1.00 . A A . 39 ARG HA 1 1 16 11284 1 1 39 ARG HB2 H 0.414 -5.323 8.523 1.00 . A A . 39 ARG HB2 1 1 16 11285 1 1 39 ARG HB3 H 0.256 -3.610 8.864 1.00 . A A . 39 ARG HB3 1 1 16 11286 1 1 39 ARG HD2 H -0.496 -2.892 11.123 1.00 . A A . 39 ARG HD2 1 1 16 11287 1 1 39 ARG HD3 H -2.069 -3.434 10.536 1.00 . A A . 39 ARG HD3 1 1 16 11288 1 1 39 ARG HE H -2.537 -4.205 12.619 1.00 . A A . 39 ARG HE 1 1 16 11289 1 1 39 ARG HG2 H -1.160 -5.744 10.422 1.00 . A A . 39 ARG HG2 1 1 16 11290 1 1 39 ARG HG3 H 0.424 -5.098 10.848 1.00 . A A . 39 ARG HG3 1 1 16 11291 1 1 39 ARG HH11 H 0.938 -3.777 12.383 1.00 . A A . 39 ARG HH11 1 1 16 11292 1 1 39 ARG HH12 H 1.238 -4.249 14.021 1.00 . A A . 39 ARG HH12 1 1 16 11293 1 1 39 ARG HH21 H -2.142 -4.834 14.776 1.00 . A A . 39 ARG HH21 1 1 16 11294 1 1 39 ARG HH22 H -0.523 -4.853 15.388 1.00 . A A . 39 ARG HH22 1 1 16 11295 1 1 39 ARG N N -2.450 -5.543 8.319 1.00 . A A . 39 ARG N 1 1 16 11296 1 1 39 ARG NE N -1.571 -4.082 12.450 1.00 . A A . 39 ARG NE 1 1 16 11297 1 1 39 ARG NH1 N 0.594 -4.090 13.271 1.00 . A A . 39 ARG NH1 1 1 16 11298 1 1 39 ARG NH2 N -1.160 -4.691 14.634 1.00 . A A . 39 ARG NH2 1 1 16 11299 1 1 39 ARG O O 0.079 -4.265 6.214 1.00 . A A . 39 ARG O 1 1 16 11300 1 1 40 ARG C C -1.257 -3.716 3.727 1.00 . A A . 40 ARG C 1 1 16 11301 1 1 40 ARG CA C -1.697 -5.074 4.256 1.00 . A A . 40 ARG CA 1 1 16 11302 1 1 40 ARG CB C -2.913 -5.570 3.469 1.00 . A A . 40 ARG CB 1 1 16 11303 1 1 40 ARG CD C -4.288 -7.517 2.667 1.00 . A A . 40 ARG CD 1 1 16 11304 1 1 40 ARG CG C -3.132 -7.071 3.554 1.00 . A A . 40 ARG CG 1 1 16 11305 1 1 40 ARG CZ C -3.663 -9.846 2.086 1.00 . A A . 40 ARG CZ 1 1 16 11306 1 1 40 ARG H H -2.883 -5.209 6.007 1.00 . A A . 40 ARG H 1 1 16 11307 1 1 40 ARG HA H -0.885 -5.775 4.130 1.00 . A A . 40 ARG HA 1 1 16 11308 1 1 40 ARG HB2 H -3.797 -5.079 3.848 1.00 . A A . 40 ARG HB2 1 1 16 11309 1 1 40 ARG HB3 H -2.785 -5.306 2.429 1.00 . A A . 40 ARG HB3 1 1 16 11310 1 1 40 ARG HD2 H -5.194 -7.043 3.014 1.00 . A A . 40 ARG HD2 1 1 16 11311 1 1 40 ARG HD3 H -4.086 -7.207 1.652 1.00 . A A . 40 ARG HD3 1 1 16 11312 1 1 40 ARG HE H -5.227 -9.312 3.219 1.00 . A A . 40 ARG HE 1 1 16 11313 1 1 40 ARG HG2 H -2.231 -7.575 3.236 1.00 . A A . 40 ARG HG2 1 1 16 11314 1 1 40 ARG HG3 H -3.352 -7.335 4.579 1.00 . A A . 40 ARG HG3 1 1 16 11315 1 1 40 ARG HH11 H -2.528 -8.455 1.142 1.00 . A A . 40 ARG HH11 1 1 16 11316 1 1 40 ARG HH12 H -2.078 -10.106 0.845 1.00 . A A . 40 ARG HH12 1 1 16 11317 1 1 40 ARG HH21 H -4.602 -11.487 2.807 1.00 . A A . 40 ARG HH21 1 1 16 11318 1 1 40 ARG HH22 H -3.221 -11.807 1.795 1.00 . A A . 40 ARG HH22 1 1 16 11319 1 1 40 ARG N N -1.989 -4.980 5.682 1.00 . A A . 40 ARG N 1 1 16 11320 1 1 40 ARG NE N -4.473 -8.969 2.693 1.00 . A A . 40 ARG NE 1 1 16 11321 1 1 40 ARG NH1 N -2.678 -9.430 1.297 1.00 . A A . 40 ARG NH1 1 1 16 11322 1 1 40 ARG NH2 N -3.855 -11.147 2.242 1.00 . A A . 40 ARG NH2 1 1 16 11323 1 1 40 ARG O O -1.790 -2.685 4.130 1.00 . A A . 40 ARG O 1 1 16 11324 1 1 41 CYS C C -0.696 -1.906 1.253 1.00 . A A . 41 CYS C 1 1 16 11325 1 1 41 CYS CA C 0.256 -2.495 2.286 1.00 . A A . 41 CYS CA 1 1 16 11326 1 1 41 CYS CB C 1.612 -2.772 1.639 1.00 . A A . 41 CYS CB 1 1 16 11327 1 1 41 CYS H H 0.123 -4.576 2.587 1.00 . A A . 41 CYS H 1 1 16 11328 1 1 41 CYS HA H 0.388 -1.785 3.087 1.00 . A A . 41 CYS HA 1 1 16 11329 1 1 41 CYS HB2 H 2.326 -3.019 2.410 1.00 . A A . 41 CYS HB2 1 1 16 11330 1 1 41 CYS HB3 H 1.514 -3.611 0.965 1.00 . A A . 41 CYS HB3 1 1 16 11331 1 1 41 CYS N N -0.273 -3.723 2.854 1.00 . A A . 41 CYS N 1 1 16 11332 1 1 41 CYS O O -0.632 -2.259 0.082 1.00 . A A . 41 CYS O 1 1 16 11333 1 1 41 CYS SG S 2.285 -1.377 0.691 1.00 . A A . 41 CYS SG 1 1 16 11334 1 1 42 LEU C C -1.780 0.726 -0.022 1.00 . A A . 42 LEU C 1 1 16 11335 1 1 42 LEU CA C -2.497 -0.362 0.759 1.00 . A A . 42 LEU CA 1 1 16 11336 1 1 42 LEU CB C -3.691 0.249 1.506 1.00 . A A . 42 LEU CB 1 1 16 11337 1 1 42 LEU CD1 C -4.514 -1.668 2.907 1.00 . A A . 42 LEU CD1 1 1 16 11338 1 1 42 LEU CD2 C -6.107 0.098 2.147 1.00 . A A . 42 LEU CD2 1 1 16 11339 1 1 42 LEU CG C -4.860 -0.697 1.793 1.00 . A A . 42 LEU CG 1 1 16 11340 1 1 42 LEU H H -1.564 -0.734 2.625 1.00 . A A . 42 LEU H 1 1 16 11341 1 1 42 LEU HA H -2.850 -1.115 0.069 1.00 . A A . 42 LEU HA 1 1 16 11342 1 1 42 LEU HB2 H -3.331 0.631 2.450 1.00 . A A . 42 LEU HB2 1 1 16 11343 1 1 42 LEU HB3 H -4.064 1.082 0.925 1.00 . A A . 42 LEU HB3 1 1 16 11344 1 1 42 LEU HD11 H -3.788 -2.383 2.550 1.00 . A A . 42 LEU HD11 1 1 16 11345 1 1 42 LEU HD12 H -5.407 -2.188 3.222 1.00 . A A . 42 LEU HD12 1 1 16 11346 1 1 42 LEU HD13 H -4.101 -1.124 3.744 1.00 . A A . 42 LEU HD13 1 1 16 11347 1 1 42 LEU HD21 H -5.822 1.084 2.484 1.00 . A A . 42 LEU HD21 1 1 16 11348 1 1 42 LEU HD22 H -6.646 -0.409 2.934 1.00 . A A . 42 LEU HD22 1 1 16 11349 1 1 42 LEU HD23 H -6.739 0.184 1.276 1.00 . A A . 42 LEU HD23 1 1 16 11350 1 1 42 LEU HG H -5.073 -1.273 0.905 1.00 . A A . 42 LEU HG 1 1 16 11351 1 1 42 LEU N N -1.563 -0.997 1.679 1.00 . A A . 42 LEU N 1 1 16 11352 1 1 42 LEU O O -1.348 1.729 0.549 1.00 . A A . 42 LEU O 1 1 16 11353 1 1 43 CYS C C -1.978 2.422 -2.835 1.00 . A A . 43 CYS C 1 1 16 11354 1 1 43 CYS CA C -0.978 1.489 -2.165 1.00 . A A . 43 CYS CA 1 1 16 11355 1 1 43 CYS CB C -0.150 0.770 -3.231 1.00 . A A . 43 CYS CB 1 1 16 11356 1 1 43 CYS H H -2.011 -0.296 -1.719 1.00 . A A . 43 CYS H 1 1 16 11357 1 1 43 CYS HA H -0.315 2.074 -1.545 1.00 . A A . 43 CYS HA 1 1 16 11358 1 1 43 CYS HB2 H -0.798 0.129 -3.807 1.00 . A A . 43 CYS HB2 1 1 16 11359 1 1 43 CYS HB3 H 0.289 1.507 -3.887 1.00 . A A . 43 CYS HB3 1 1 16 11360 1 1 43 CYS N N -1.649 0.526 -1.317 1.00 . A A . 43 CYS N 1 1 16 11361 1 1 43 CYS O O -2.958 1.978 -3.431 1.00 . A A . 43 CYS O 1 1 16 11362 1 1 43 CYS SG S 1.202 -0.258 -2.576 1.00 . A A . 43 CYS SG 1 1 16 11363 1 1 44 THR C C -1.823 5.253 -4.595 1.00 . A A . 44 THR C 1 1 16 11364 1 1 44 THR CA C -2.545 4.721 -3.375 1.00 . A A . 44 THR CA 1 1 16 11365 1 1 44 THR CB C -2.822 5.894 -2.428 1.00 . A A . 44 THR CB 1 1 16 11366 1 1 44 THR CG2 C -4.310 6.167 -2.312 1.00 . A A . 44 THR CG2 1 1 16 11367 1 1 44 THR H H -0.893 3.997 -2.281 1.00 . A A . 44 THR H 1 1 16 11368 1 1 44 THR HA H -3.481 4.269 -3.670 1.00 . A A . 44 THR HA 1 1 16 11369 1 1 44 THR HB H -2.346 6.770 -2.841 1.00 . A A . 44 THR HB 1 1 16 11370 1 1 44 THR HG1 H -1.314 5.630 -1.176 1.00 . A A . 44 THR HG1 1 1 16 11371 1 1 44 THR HG21 H -4.565 7.034 -2.905 1.00 . A A . 44 THR HG21 1 1 16 11372 1 1 44 THR HG22 H -4.563 6.352 -1.278 1.00 . A A . 44 THR HG22 1 1 16 11373 1 1 44 THR HG23 H -4.862 5.311 -2.671 1.00 . A A . 44 THR HG23 1 1 16 11374 1 1 44 THR N N -1.707 3.710 -2.754 1.00 . A A . 44 THR N 1 1 16 11375 1 1 44 THR O O -0.596 5.320 -4.590 1.00 . A A . 44 THR O 1 1 16 11376 1 1 44 THR OG1 O -2.279 5.616 -1.127 1.00 . A A . 44 THR OG1 1 1 16 11377 1 1 45 LYS C C -2.815 6.974 -7.721 1.00 . A A . 45 LYS C 1 1 16 11378 1 1 45 LYS CA C -1.893 6.154 -6.825 1.00 . A A . 45 LYS CA 1 1 16 11379 1 1 45 LYS CB C -1.263 5.016 -7.646 1.00 . A A . 45 LYS CB 1 1 16 11380 1 1 45 LYS CD C -1.508 3.221 -9.383 1.00 . A A . 45 LYS CD 1 1 16 11381 1 1 45 LYS CE C -2.359 2.744 -10.547 1.00 . A A . 45 LYS CE 1 1 16 11382 1 1 45 LYS CG C -2.239 4.241 -8.523 1.00 . A A . 45 LYS CG 1 1 16 11383 1 1 45 LYS H H -3.526 5.573 -5.584 1.00 . A A . 45 LYS H 1 1 16 11384 1 1 45 LYS HA H -1.097 6.801 -6.489 1.00 . A A . 45 LYS HA 1 1 16 11385 1 1 45 LYS HB2 H -0.502 5.436 -8.287 1.00 . A A . 45 LYS HB2 1 1 16 11386 1 1 45 LYS HB3 H -0.797 4.319 -6.965 1.00 . A A . 45 LYS HB3 1 1 16 11387 1 1 45 LYS HD2 H -0.609 3.675 -9.772 1.00 . A A . 45 LYS HD2 1 1 16 11388 1 1 45 LYS HD3 H -1.245 2.372 -8.768 1.00 . A A . 45 LYS HD3 1 1 16 11389 1 1 45 LYS HE2 H -1.886 1.882 -10.993 1.00 . A A . 45 LYS HE2 1 1 16 11390 1 1 45 LYS HE3 H -3.334 2.466 -10.173 1.00 . A A . 45 LYS HE3 1 1 16 11391 1 1 45 LYS HG2 H -2.947 3.725 -7.891 1.00 . A A . 45 LYS HG2 1 1 16 11392 1 1 45 LYS HG3 H -2.762 4.934 -9.166 1.00 . A A . 45 LYS HG3 1 1 16 11393 1 1 45 LYS HZ1 H -1.592 4.166 -11.872 1.00 . A A . 45 LYS HZ1 1 1 16 11394 1 1 45 LYS HZ2 H -3.094 4.590 -11.216 1.00 . A A . 45 LYS HZ2 1 1 16 11395 1 1 45 LYS HZ3 H -2.999 3.407 -12.423 1.00 . A A . 45 LYS HZ3 1 1 16 11396 1 1 45 LYS N N -2.549 5.634 -5.631 1.00 . A A . 45 LYS N 1 1 16 11397 1 1 45 LYS NZ N -2.522 3.798 -11.587 1.00 . A A . 45 LYS NZ 1 1 16 11398 1 1 45 LYS O O -3.930 7.345 -7.348 1.00 . A A . 45 LYS O 1 1 16 11399 1 1 46 GLU C C -4.007 7.227 -10.697 1.00 . A A . 46 GLU C 1 1 16 11400 1 1 46 GLU CA C -2.935 8.020 -9.948 1.00 . A A . 46 GLU CA 1 1 16 11401 1 1 46 GLU CB C -1.849 8.444 -10.941 1.00 . A A . 46 GLU CB 1 1 16 11402 1 1 46 GLU CD C 0.132 7.615 -12.322 1.00 . A A . 46 GLU CD 1 1 16 11403 1 1 46 GLU CG C -1.046 7.250 -11.447 1.00 . A A . 46 GLU CG 1 1 16 11404 1 1 46 GLU H H -1.392 6.900 -9.089 1.00 . A A . 46 GLU H 1 1 16 11405 1 1 46 GLU HA H -3.373 8.898 -9.504 1.00 . A A . 46 GLU HA 1 1 16 11406 1 1 46 GLU HB2 H -2.313 8.933 -11.786 1.00 . A A . 46 GLU HB2 1 1 16 11407 1 1 46 GLU HB3 H -1.173 9.131 -10.456 1.00 . A A . 46 GLU HB3 1 1 16 11408 1 1 46 GLU HG2 H -0.674 6.703 -10.594 1.00 . A A . 46 GLU HG2 1 1 16 11409 1 1 46 GLU HG3 H -1.708 6.610 -12.014 1.00 . A A . 46 GLU HG3 1 1 16 11410 1 1 46 GLU N N -2.288 7.240 -8.907 1.00 . A A . 46 GLU N 1 1 16 11411 1 1 46 GLU O O -3.806 6.058 -11.051 1.00 . A A . 46 GLU O 1 1 16 11412 1 1 46 GLU OE1 O 1.082 8.246 -11.825 1.00 . A A . 46 GLU OE1 1 1 16 11413 1 1 46 GLU OE2 O 0.137 7.220 -13.503 1.00 . A A . 46 GLU OE2 1 1 16 11414 1 1 47 CYS C C -7.351 8.367 -11.769 1.00 . A A . 47 CYS C 1 1 16 11415 1 1 47 CYS CA C -6.237 7.334 -11.713 1.00 . A A . 47 CYS CA 1 1 16 11416 1 1 47 CYS CB C -6.749 6.019 -11.126 1.00 . A A . 47 CYS CB 1 1 16 11417 1 1 47 CYS H H -5.182 8.830 -10.673 1.00 . A A . 47 CYS H 1 1 16 11418 1 1 47 CYS HA H -5.888 7.153 -12.718 1.00 . A A . 47 CYS HA 1 1 16 11419 1 1 47 CYS HB2 H -7.421 5.560 -11.835 1.00 . A A . 47 CYS HB2 1 1 16 11420 1 1 47 CYS HB3 H -5.908 5.360 -10.964 1.00 . A A . 47 CYS HB3 1 1 16 11421 1 1 47 CYS N N -5.118 7.895 -10.963 1.00 . A A . 47 CYS N 1 1 16 11422 1 1 47 CYS O O -7.083 9.520 -11.369 1.00 . A A . 47 CYS O 1 1 16 11423 1 1 47 CYS OXT O -8.476 8.027 -12.179 1.00 . A A . 47 CYS OXT 1 1 16 11424 1 1 47 CYS SG S -7.643 6.164 -9.552 1.00 . A A . 47 CYS SG 1 1 17 11425 1 1 1 ALA C C -9.250 11.232 -5.740 1.00 . A A . 1 ALA C 1 1 17 11426 1 1 1 ALA CA C -10.068 12.140 -6.654 1.00 . A A . 1 ALA CA 1 1 17 11427 1 1 1 ALA CB C -9.152 12.983 -7.531 1.00 . A A . 1 ALA CB 1 1 17 11428 1 1 1 ALA H1 H -10.672 12.980 -4.853 1.00 . A A . 1 ALA H1 1 1 17 11429 1 1 1 ALA H2 H -11.937 12.694 -5.941 1.00 . A A . 1 ALA H2 1 1 17 11430 1 1 1 ALA H3 H -10.884 13.992 -6.192 1.00 . A A . 1 ALA H3 1 1 17 11431 1 1 1 ALA HA H -10.686 11.529 -7.297 1.00 . A A . 1 ALA HA 1 1 17 11432 1 1 1 ALA HB1 H -8.921 12.441 -8.436 1.00 . A A . 1 ALA HB1 1 1 17 11433 1 1 1 ALA HB2 H -8.239 13.198 -6.997 1.00 . A A . 1 ALA HB2 1 1 17 11434 1 1 1 ALA HB3 H -9.648 13.909 -7.784 1.00 . A A . 1 ALA HB3 1 1 17 11435 1 1 1 ALA N N -10.953 13.013 -5.854 1.00 . A A . 1 ALA N 1 1 17 11436 1 1 1 ALA O O -8.056 11.032 -5.948 1.00 . A A . 1 ALA O 1 1 17 11437 1 1 2 THR C C -9.598 8.358 -4.145 1.00 . A A . 2 THR C 1 1 17 11438 1 1 2 THR CA C -9.247 9.793 -3.788 1.00 . A A . 2 THR CA 1 1 17 11439 1 1 2 THR CB C -9.689 10.097 -2.345 1.00 . A A . 2 THR CB 1 1 17 11440 1 1 2 THR CG2 C -8.758 9.437 -1.338 1.00 . A A . 2 THR CG2 1 1 17 11441 1 1 2 THR H H -10.856 10.868 -4.609 1.00 . A A . 2 THR H 1 1 17 11442 1 1 2 THR HA H -8.179 9.935 -3.869 1.00 . A A . 2 THR HA 1 1 17 11443 1 1 2 THR HB H -10.688 9.711 -2.200 1.00 . A A . 2 THR HB 1 1 17 11444 1 1 2 THR HG1 H -9.224 11.721 -1.322 1.00 . A A . 2 THR HG1 1 1 17 11445 1 1 2 THR HG21 H -8.301 10.195 -0.719 1.00 . A A . 2 THR HG21 1 1 17 11446 1 1 2 THR HG22 H -7.990 8.889 -1.863 1.00 . A A . 2 THR HG22 1 1 17 11447 1 1 2 THR HG23 H -9.323 8.757 -0.717 1.00 . A A . 2 THR HG23 1 1 17 11448 1 1 2 THR N N -9.905 10.684 -4.725 1.00 . A A . 2 THR N 1 1 17 11449 1 1 2 THR O O -10.758 7.959 -4.052 1.00 . A A . 2 THR O 1 1 17 11450 1 1 2 THR OG1 O -9.697 11.518 -2.134 1.00 . A A . 2 THR OG1 1 1 17 11451 1 1 3 CYS C C -8.109 5.213 -4.202 1.00 . A A . 3 CYS C 1 1 17 11452 1 1 3 CYS CA C -8.867 6.241 -5.034 1.00 . A A . 3 CYS CA 1 1 17 11453 1 1 3 CYS CB C -8.513 6.140 -6.512 1.00 . A A . 3 CYS CB 1 1 17 11454 1 1 3 CYS H H -7.714 7.984 -4.709 1.00 . A A . 3 CYS H 1 1 17 11455 1 1 3 CYS HA H -9.924 6.055 -4.924 1.00 . A A . 3 CYS HA 1 1 17 11456 1 1 3 CYS HB2 H -7.461 6.357 -6.651 1.00 . A A . 3 CYS HB2 1 1 17 11457 1 1 3 CYS HB3 H -8.727 5.146 -6.872 1.00 . A A . 3 CYS HB3 1 1 17 11458 1 1 3 CYS N N -8.617 7.604 -4.606 1.00 . A A . 3 CYS N 1 1 17 11459 1 1 3 CYS O O -6.926 5.376 -3.914 1.00 . A A . 3 CYS O 1 1 17 11460 1 1 3 CYS SG S -9.452 7.325 -7.516 1.00 . A A . 3 CYS SG 1 1 17 11461 1 1 4 LYS C C -8.420 1.754 -3.765 1.00 . A A . 4 LYS C 1 1 17 11462 1 1 4 LYS CA C -8.257 3.071 -3.024 1.00 . A A . 4 LYS CA 1 1 17 11463 1 1 4 LYS CB C -8.971 3.002 -1.659 1.00 . A A . 4 LYS CB 1 1 17 11464 1 1 4 LYS CD C -8.509 0.589 -0.953 1.00 . A A . 4 LYS CD 1 1 17 11465 1 1 4 LYS CE C -9.975 0.179 -0.998 1.00 . A A . 4 LYS CE 1 1 17 11466 1 1 4 LYS CG C -8.326 2.071 -0.625 1.00 . A A . 4 LYS CG 1 1 17 11467 1 1 4 LYS H H -9.759 4.095 -4.096 1.00 . A A . 4 LYS H 1 1 17 11468 1 1 4 LYS HA H -7.202 3.260 -2.870 1.00 . A A . 4 LYS HA 1 1 17 11469 1 1 4 LYS HB2 H -8.999 3.995 -1.237 1.00 . A A . 4 LYS HB2 1 1 17 11470 1 1 4 LYS HB3 H -9.986 2.668 -1.822 1.00 . A A . 4 LYS HB3 1 1 17 11471 1 1 4 LYS HD2 H -8.064 0.389 -1.916 1.00 . A A . 4 LYS HD2 1 1 17 11472 1 1 4 LYS HD3 H -8.005 0.002 -0.198 1.00 . A A . 4 LYS HD3 1 1 17 11473 1 1 4 LYS HE2 H -10.397 0.285 -0.010 1.00 . A A . 4 LYS HE2 1 1 17 11474 1 1 4 LYS HE3 H -10.497 0.832 -1.683 1.00 . A A . 4 LYS HE3 1 1 17 11475 1 1 4 LYS HG2 H -7.269 2.285 -0.581 1.00 . A A . 4 LYS HG2 1 1 17 11476 1 1 4 LYS HG3 H -8.769 2.271 0.341 1.00 . A A . 4 LYS HG3 1 1 17 11477 1 1 4 LYS HZ1 H -9.598 -1.883 -0.832 1.00 . A A . 4 LYS HZ1 1 1 17 11478 1 1 4 LYS HZ2 H -9.804 -1.346 -2.424 1.00 . A A . 4 LYS HZ2 1 1 17 11479 1 1 4 LYS HZ3 H -11.146 -1.505 -1.411 1.00 . A A . 4 LYS HZ3 1 1 17 11480 1 1 4 LYS N N -8.819 4.153 -3.824 1.00 . A A . 4 LYS N 1 1 17 11481 1 1 4 LYS NZ N -10.146 -1.232 -1.448 1.00 . A A . 4 LYS NZ 1 1 17 11482 1 1 4 LYS O O -9.510 1.425 -4.234 1.00 . A A . 4 LYS O 1 1 17 11483 1 1 5 ALA C C -6.163 -1.103 -3.984 1.00 . A A . 5 ALA C 1 1 17 11484 1 1 5 ALA CA C -7.343 -0.297 -4.485 1.00 . A A . 5 ALA CA 1 1 17 11485 1 1 5 ALA CB C -7.280 -0.143 -5.999 1.00 . A A . 5 ALA CB 1 1 17 11486 1 1 5 ALA H H -6.508 1.318 -3.415 1.00 . A A . 5 ALA H 1 1 17 11487 1 1 5 ALA HA H -8.260 -0.808 -4.227 1.00 . A A . 5 ALA HA 1 1 17 11488 1 1 5 ALA HB1 H -7.465 0.887 -6.264 1.00 . A A . 5 ALA HB1 1 1 17 11489 1 1 5 ALA HB2 H -8.029 -0.772 -6.457 1.00 . A A . 5 ALA HB2 1 1 17 11490 1 1 5 ALA HB3 H -6.301 -0.435 -6.350 1.00 . A A . 5 ALA HB3 1 1 17 11491 1 1 5 ALA N N -7.342 0.999 -3.835 1.00 . A A . 5 ALA N 1 1 17 11492 1 1 5 ALA O O -5.032 -0.622 -4.001 1.00 . A A . 5 ALA O 1 1 17 11493 1 1 6 GLU C C -4.415 -3.503 -4.133 1.00 . A A . 6 GLU C 1 1 17 11494 1 1 6 GLU CA C -5.376 -3.168 -3.010 1.00 . A A . 6 GLU CA 1 1 17 11495 1 1 6 GLU CB C -5.939 -4.459 -2.394 1.00 . A A . 6 GLU CB 1 1 17 11496 1 1 6 GLU CD C -8.129 -3.553 -1.378 1.00 . A A . 6 GLU CD 1 1 17 11497 1 1 6 GLU CG C -6.793 -4.253 -1.141 1.00 . A A . 6 GLU CG 1 1 17 11498 1 1 6 GLU H H -7.353 -2.643 -3.517 1.00 . A A . 6 GLU H 1 1 17 11499 1 1 6 GLU HA H -4.842 -2.617 -2.249 1.00 . A A . 6 GLU HA 1 1 17 11500 1 1 6 GLU HB2 H -6.530 -4.970 -3.130 1.00 . A A . 6 GLU HB2 1 1 17 11501 1 1 6 GLU HB3 H -5.107 -5.094 -2.125 1.00 . A A . 6 GLU HB3 1 1 17 11502 1 1 6 GLU HG2 H -6.996 -5.220 -0.707 1.00 . A A . 6 GLU HG2 1 1 17 11503 1 1 6 GLU HG3 H -6.221 -3.666 -0.436 1.00 . A A . 6 GLU HG3 1 1 17 11504 1 1 6 GLU N N -6.424 -2.313 -3.521 1.00 . A A . 6 GLU N 1 1 17 11505 1 1 6 GLU O O -4.837 -3.787 -5.255 1.00 . A A . 6 GLU O 1 1 17 11506 1 1 6 GLU OE1 O -8.533 -3.365 -2.544 1.00 . A A . 6 GLU OE1 1 1 17 11507 1 1 6 GLU OE2 O -8.786 -3.179 -0.383 1.00 . A A . 6 GLU OE2 1 1 17 11508 1 1 7 CYS C C -2.337 -5.087 -5.458 1.00 . A A . 7 CYS C 1 1 17 11509 1 1 7 CYS CA C -2.099 -3.720 -4.821 1.00 . A A . 7 CYS CA 1 1 17 11510 1 1 7 CYS CB C -0.705 -3.672 -4.189 1.00 . A A . 7 CYS CB 1 1 17 11511 1 1 7 CYS H H -2.877 -3.185 -2.914 1.00 . A A . 7 CYS H 1 1 17 11512 1 1 7 CYS HA H -2.163 -2.960 -5.588 1.00 . A A . 7 CYS HA 1 1 17 11513 1 1 7 CYS HB2 H -0.611 -2.766 -3.608 1.00 . A A . 7 CYS HB2 1 1 17 11514 1 1 7 CYS HB3 H -0.582 -4.526 -3.539 1.00 . A A . 7 CYS HB3 1 1 17 11515 1 1 7 CYS N N -3.132 -3.441 -3.829 1.00 . A A . 7 CYS N 1 1 17 11516 1 1 7 CYS O O -2.451 -6.094 -4.756 1.00 . A A . 7 CYS O 1 1 17 11517 1 1 7 CYS SG S 0.657 -3.697 -5.405 1.00 . A A . 7 CYS SG 1 1 17 11518 1 1 8 PRO C C -1.652 -7.447 -7.228 1.00 . A A . 8 PRO C 1 1 17 11519 1 1 8 PRO CA C -2.688 -6.376 -7.540 1.00 . A A . 8 PRO CA 1 1 17 11520 1 1 8 PRO CB C -2.590 -5.948 -9.007 1.00 . A A . 8 PRO CB 1 1 17 11521 1 1 8 PRO CD C -2.347 -3.967 -7.696 1.00 . A A . 8 PRO CD 1 1 17 11522 1 1 8 PRO CG C -2.884 -4.489 -8.999 1.00 . A A . 8 PRO CG 1 1 17 11523 1 1 8 PRO HA H -3.676 -6.764 -7.340 1.00 . A A . 8 PRO HA 1 1 17 11524 1 1 8 PRO HB2 H -1.595 -6.149 -9.377 1.00 . A A . 8 PRO HB2 1 1 17 11525 1 1 8 PRO HB3 H -3.314 -6.493 -9.593 1.00 . A A . 8 PRO HB3 1 1 17 11526 1 1 8 PRO HD2 H -1.321 -3.649 -7.811 1.00 . A A . 8 PRO HD2 1 1 17 11527 1 1 8 PRO HD3 H -2.957 -3.153 -7.334 1.00 . A A . 8 PRO HD3 1 1 17 11528 1 1 8 PRO HG2 H -2.387 -4.009 -9.829 1.00 . A A . 8 PRO HG2 1 1 17 11529 1 1 8 PRO HG3 H -3.951 -4.329 -9.055 1.00 . A A . 8 PRO HG3 1 1 17 11530 1 1 8 PRO N N -2.439 -5.133 -6.800 1.00 . A A . 8 PRO N 1 1 17 11531 1 1 8 PRO O O -1.984 -8.616 -7.044 1.00 . A A . 8 PRO O 1 1 17 11532 1 1 9 THR C C 0.880 -8.068 -5.336 1.00 . A A . 9 THR C 1 1 17 11533 1 1 9 THR CA C 0.690 -7.944 -6.844 1.00 . A A . 9 THR CA 1 1 17 11534 1 1 9 THR CB C 2.001 -7.476 -7.503 1.00 . A A . 9 THR CB 1 1 17 11535 1 1 9 THR CG2 C 2.071 -7.935 -8.951 1.00 . A A . 9 THR CG2 1 1 17 11536 1 1 9 THR H H -0.200 -6.087 -7.290 1.00 . A A . 9 THR H 1 1 17 11537 1 1 9 THR HA H 0.435 -8.914 -7.245 1.00 . A A . 9 THR HA 1 1 17 11538 1 1 9 THR HB H 2.831 -7.908 -6.963 1.00 . A A . 9 THR HB 1 1 17 11539 1 1 9 THR HG1 H 2.052 -5.760 -6.513 1.00 . A A . 9 THR HG1 1 1 17 11540 1 1 9 THR HG21 H 1.793 -7.119 -9.602 1.00 . A A . 9 THR HG21 1 1 17 11541 1 1 9 THR HG22 H 1.392 -8.762 -9.100 1.00 . A A . 9 THR HG22 1 1 17 11542 1 1 9 THR HG23 H 3.078 -8.252 -9.180 1.00 . A A . 9 THR HG23 1 1 17 11543 1 1 9 THR N N -0.398 -7.034 -7.152 1.00 . A A . 9 THR N 1 1 17 11544 1 1 9 THR O O 1.985 -7.889 -4.823 1.00 . A A . 9 THR O 1 1 17 11545 1 1 9 THR OG1 O 2.098 -6.041 -7.443 1.00 . A A . 9 THR OG1 1 1 17 11546 1 1 10 TRP C C -1.155 -9.549 -2.712 1.00 . A A . 10 TRP C 1 1 17 11547 1 1 10 TRP CA C -0.158 -8.499 -3.188 1.00 . A A . 10 TRP CA 1 1 17 11548 1 1 10 TRP CB C -0.473 -7.161 -2.515 1.00 . A A . 10 TRP CB 1 1 17 11549 1 1 10 TRP CD1 C -1.258 -7.553 -0.109 1.00 . A A . 10 TRP CD1 1 1 17 11550 1 1 10 TRP CD2 C 0.862 -6.855 -0.288 1.00 . A A . 10 TRP CD2 1 1 17 11551 1 1 10 TRP CE2 C 0.569 -7.046 1.075 1.00 . A A . 10 TRP CE2 1 1 17 11552 1 1 10 TRP CE3 C 2.136 -6.411 -0.648 1.00 . A A . 10 TRP CE3 1 1 17 11553 1 1 10 TRP CG C -0.312 -7.200 -1.028 1.00 . A A . 10 TRP CG 1 1 17 11554 1 1 10 TRP CH2 C 2.744 -6.369 1.694 1.00 . A A . 10 TRP CH2 1 1 17 11555 1 1 10 TRP CZ2 C 1.508 -6.806 2.078 1.00 . A A . 10 TRP CZ2 1 1 17 11556 1 1 10 TRP CZ3 C 3.062 -6.170 0.346 1.00 . A A . 10 TRP CZ3 1 1 17 11557 1 1 10 TRP H H -1.060 -8.489 -5.098 1.00 . A A . 10 TRP H 1 1 17 11558 1 1 10 TRP HA H 0.838 -8.808 -2.912 1.00 . A A . 10 TRP HA 1 1 17 11559 1 1 10 TRP HB2 H 0.192 -6.404 -2.903 1.00 . A A . 10 TRP HB2 1 1 17 11560 1 1 10 TRP HB3 H -1.494 -6.885 -2.735 1.00 . A A . 10 TRP HB3 1 1 17 11561 1 1 10 TRP HD1 H -2.267 -7.858 -0.361 1.00 . A A . 10 TRP HD1 1 1 17 11562 1 1 10 TRP HE1 H -1.206 -7.700 1.993 1.00 . A A . 10 TRP HE1 1 1 17 11563 1 1 10 TRP HE3 H 2.399 -6.251 -1.683 1.00 . A A . 10 TRP HE3 1 1 17 11564 1 1 10 TRP HH2 H 3.501 -6.166 2.438 1.00 . A A . 10 TRP HH2 1 1 17 11565 1 1 10 TRP HZ2 H 1.283 -6.954 3.128 1.00 . A A . 10 TRP HZ2 1 1 17 11566 1 1 10 TRP HZ3 H 4.048 -5.817 0.086 1.00 . A A . 10 TRP HZ3 1 1 17 11567 1 1 10 TRP N N -0.204 -8.363 -4.632 1.00 . A A . 10 TRP N 1 1 17 11568 1 1 10 TRP NE1 N -0.731 -7.478 1.159 1.00 . A A . 10 TRP NE1 1 1 17 11569 1 1 10 TRP O O -2.348 -9.478 -3.017 1.00 . A A . 10 TRP O 1 1 17 11570 1 1 11 ASP C C -0.924 -12.072 -0.091 1.00 . A A . 11 ASP C 1 1 17 11571 1 1 11 ASP CA C -1.489 -11.579 -1.416 1.00 . A A . 11 ASP CA 1 1 17 11572 1 1 11 ASP CB C -1.572 -12.741 -2.413 1.00 . A A . 11 ASP CB 1 1 17 11573 1 1 11 ASP CG C -0.209 -13.165 -2.934 1.00 . A A . 11 ASP CG 1 1 17 11574 1 1 11 ASP H H 0.300 -10.508 -1.748 1.00 . A A . 11 ASP H 1 1 17 11575 1 1 11 ASP HA H -2.479 -11.182 -1.251 1.00 . A A . 11 ASP HA 1 1 17 11576 1 1 11 ASP HB2 H -2.030 -13.590 -1.928 1.00 . A A . 11 ASP HB2 1 1 17 11577 1 1 11 ASP HB3 H -2.181 -12.442 -3.254 1.00 . A A . 11 ASP HB3 1 1 17 11578 1 1 11 ASP N N -0.659 -10.510 -1.953 1.00 . A A . 11 ASP N 1 1 17 11579 1 1 11 ASP O O -1.246 -13.166 0.369 1.00 . A A . 11 ASP O 1 1 17 11580 1 1 11 ASP OD1 O 0.675 -13.488 -2.112 1.00 . A A . 11 ASP OD1 1 1 17 11581 1 1 11 ASP OD2 O -0.022 -13.165 -4.167 1.00 . A A . 11 ASP OD2 1 1 17 11582 1 1 12 SER C C 0.044 -10.687 2.911 1.00 . A A . 12 SER C 1 1 17 11583 1 1 12 SER CA C 0.526 -11.610 1.790 1.00 . A A . 12 SER CA 1 1 17 11584 1 1 12 SER CB C 2.053 -11.557 1.662 1.00 . A A . 12 SER CB 1 1 17 11585 1 1 12 SER H H 0.129 -10.390 0.116 1.00 . A A . 12 SER H 1 1 17 11586 1 1 12 SER HA H 0.230 -12.622 2.024 1.00 . A A . 12 SER HA 1 1 17 11587 1 1 12 SER HB2 H 2.350 -12.028 0.737 1.00 . A A . 12 SER HB2 1 1 17 11588 1 1 12 SER HB3 H 2.375 -10.526 1.660 1.00 . A A . 12 SER HB3 1 1 17 11589 1 1 12 SER HG H 2.969 -13.103 2.444 1.00 . A A . 12 SER HG 1 1 17 11590 1 1 12 SER N N -0.083 -11.251 0.523 1.00 . A A . 12 SER N 1 1 17 11591 1 1 12 SER O O -0.855 -9.864 2.714 1.00 . A A . 12 SER O 1 1 17 11592 1 1 12 SER OG O 2.689 -12.231 2.738 1.00 . A A . 12 SER OG 1 1 17 11593 1 1 13 VAL C C 1.149 -8.772 5.328 1.00 . A A . 13 VAL C 1 1 17 11594 1 1 13 VAL CA C 0.294 -10.034 5.243 1.00 . A A . 13 VAL CA 1 1 17 11595 1 1 13 VAL CB C 0.459 -10.851 6.545 1.00 . A A . 13 VAL CB 1 1 17 11596 1 1 13 VAL CG1 C 0.138 -10.006 7.769 1.00 . A A . 13 VAL CG1 1 1 17 11597 1 1 13 VAL CG2 C -0.417 -12.095 6.509 1.00 . A A . 13 VAL CG2 1 1 17 11598 1 1 13 VAL H H 1.358 -11.508 4.166 1.00 . A A . 13 VAL H 1 1 17 11599 1 1 13 VAL HA H -0.744 -9.750 5.150 1.00 . A A . 13 VAL HA 1 1 17 11600 1 1 13 VAL HB H 1.489 -11.167 6.617 1.00 . A A . 13 VAL HB 1 1 17 11601 1 1 13 VAL HG11 H 0.333 -8.967 7.551 1.00 . A A . 13 VAL HG11 1 1 17 11602 1 1 13 VAL HG12 H 0.755 -10.323 8.597 1.00 . A A . 13 VAL HG12 1 1 17 11603 1 1 13 VAL HG13 H -0.903 -10.130 8.029 1.00 . A A . 13 VAL HG13 1 1 17 11604 1 1 13 VAL HG21 H -0.715 -12.296 5.491 1.00 . A A . 13 VAL HG21 1 1 17 11605 1 1 13 VAL HG22 H -1.295 -11.935 7.117 1.00 . A A . 13 VAL HG22 1 1 17 11606 1 1 13 VAL HG23 H 0.139 -12.937 6.895 1.00 . A A . 13 VAL HG23 1 1 17 11607 1 1 13 VAL N N 0.647 -10.834 4.082 1.00 . A A . 13 VAL N 1 1 17 11608 1 1 13 VAL O O 2.374 -8.842 5.418 1.00 . A A . 13 VAL O 1 1 17 11609 1 1 14 CYS C C 1.549 -6.075 6.866 1.00 . A A . 14 CYS C 1 1 17 11610 1 1 14 CYS CA C 1.191 -6.348 5.410 1.00 . A A . 14 CYS CA 1 1 17 11611 1 1 14 CYS CB C 0.306 -5.225 4.861 1.00 . A A . 14 CYS CB 1 1 17 11612 1 1 14 CYS H H -0.483 -7.628 5.249 1.00 . A A . 14 CYS H 1 1 17 11613 1 1 14 CYS HA H 2.096 -6.411 4.825 1.00 . A A . 14 CYS HA 1 1 17 11614 1 1 14 CYS HB2 H -0.097 -5.532 3.908 1.00 . A A . 14 CYS HB2 1 1 17 11615 1 1 14 CYS HB3 H -0.511 -5.058 5.549 1.00 . A A . 14 CYS HB3 1 1 17 11616 1 1 14 CYS N N 0.495 -7.621 5.314 1.00 . A A . 14 CYS N 1 1 17 11617 1 1 14 CYS O O 0.668 -5.988 7.723 1.00 . A A . 14 CYS O 1 1 17 11618 1 1 14 CYS SG S 1.150 -3.631 4.608 1.00 . A A . 14 CYS SG 1 1 17 11619 1 1 15 ILE C C 3.602 -4.235 8.713 1.00 . A A . 15 ILE C 1 1 17 11620 1 1 15 ILE CA C 3.289 -5.713 8.509 1.00 . A A . 15 ILE CA 1 1 17 11621 1 1 15 ILE CB C 4.541 -6.555 8.845 1.00 . A A . 15 ILE CB 1 1 17 11622 1 1 15 ILE CD1 C 5.458 -8.937 8.822 1.00 . A A . 15 ILE CD1 1 1 17 11623 1 1 15 ILE CG1 C 4.254 -8.043 8.614 1.00 . A A . 15 ILE CG1 1 1 17 11624 1 1 15 ILE CG2 C 4.979 -6.312 10.285 1.00 . A A . 15 ILE CG2 1 1 17 11625 1 1 15 ILE H H 3.494 -6.054 6.431 1.00 . A A . 15 ILE H 1 1 17 11626 1 1 15 ILE HA H 2.495 -5.999 9.184 1.00 . A A . 15 ILE HA 1 1 17 11627 1 1 15 ILE HB H 5.343 -6.244 8.193 1.00 . A A . 15 ILE HB 1 1 17 11628 1 1 15 ILE HD11 H 5.382 -9.424 9.784 1.00 . A A . 15 ILE HD11 1 1 17 11629 1 1 15 ILE HD12 H 6.358 -8.342 8.789 1.00 . A A . 15 ILE HD12 1 1 17 11630 1 1 15 ILE HD13 H 5.491 -9.684 8.043 1.00 . A A . 15 ILE HD13 1 1 17 11631 1 1 15 ILE HG12 H 3.482 -8.364 9.297 1.00 . A A . 15 ILE HG12 1 1 17 11632 1 1 15 ILE HG13 H 3.909 -8.181 7.599 1.00 . A A . 15 ILE HG13 1 1 17 11633 1 1 15 ILE HG21 H 4.226 -5.731 10.797 1.00 . A A . 15 ILE HG21 1 1 17 11634 1 1 15 ILE HG22 H 5.915 -5.774 10.290 1.00 . A A . 15 ILE HG22 1 1 17 11635 1 1 15 ILE HG23 H 5.105 -7.260 10.787 1.00 . A A . 15 ILE HG23 1 1 17 11636 1 1 15 ILE N N 2.835 -5.959 7.149 1.00 . A A . 15 ILE N 1 1 17 11637 1 1 15 ILE O O 3.152 -3.620 9.679 1.00 . A A . 15 ILE O 1 1 17 11638 1 1 16 ASN C C 4.362 -1.566 6.557 1.00 . A A . 16 ASN C 1 1 17 11639 1 1 16 ASN CA C 4.750 -2.272 7.854 1.00 . A A . 16 ASN CA 1 1 17 11640 1 1 16 ASN CB C 6.260 -2.156 8.122 1.00 . A A . 16 ASN CB 1 1 17 11641 1 1 16 ASN CG C 6.756 -0.720 8.177 1.00 . A A . 16 ASN CG 1 1 17 11642 1 1 16 ASN H H 4.683 -4.218 7.043 1.00 . A A . 16 ASN H 1 1 17 11643 1 1 16 ASN HA H 4.210 -1.818 8.672 1.00 . A A . 16 ASN HA 1 1 17 11644 1 1 16 ASN HB2 H 6.486 -2.626 9.066 1.00 . A A . 16 ASN HB2 1 1 17 11645 1 1 16 ASN HB3 H 6.795 -2.670 7.336 1.00 . A A . 16 ASN HB3 1 1 17 11646 1 1 16 ASN HD21 H 8.376 -1.206 7.138 1.00 . A A . 16 ASN HD21 1 1 17 11647 1 1 16 ASN HD22 H 8.258 0.450 7.617 1.00 . A A . 16 ASN HD22 1 1 17 11648 1 1 16 ASN N N 4.368 -3.675 7.791 1.00 . A A . 16 ASN N 1 1 17 11649 1 1 16 ASN ND2 N 7.910 -0.466 7.578 1.00 . A A . 16 ASN ND2 1 1 17 11650 1 1 16 ASN O O 4.058 -2.219 5.560 1.00 . A A . 16 ASN O 1 1 17 11651 1 1 16 ASN OD1 O 6.116 0.151 8.762 1.00 . A A . 16 ASN OD1 1 1 17 11652 1 1 17 LYS C C 4.926 0.289 4.228 1.00 . A A . 17 LYS C 1 1 17 11653 1 1 17 LYS CA C 4.001 0.559 5.414 1.00 . A A . 17 LYS CA 1 1 17 11654 1 1 17 LYS CB C 4.038 2.055 5.754 1.00 . A A . 17 LYS CB 1 1 17 11655 1 1 17 LYS CD C 1.596 2.624 6.119 1.00 . A A . 17 LYS CD 1 1 17 11656 1 1 17 LYS CE C 1.379 3.995 5.477 1.00 . A A . 17 LYS CE 1 1 17 11657 1 1 17 LYS CG C 2.978 2.494 6.754 1.00 . A A . 17 LYS CG 1 1 17 11658 1 1 17 LYS H H 4.605 0.219 7.417 1.00 . A A . 17 LYS H 1 1 17 11659 1 1 17 LYS HA H 2.993 0.293 5.133 1.00 . A A . 17 LYS HA 1 1 17 11660 1 1 17 LYS HB2 H 5.008 2.292 6.166 1.00 . A A . 17 LYS HB2 1 1 17 11661 1 1 17 LYS HB3 H 3.898 2.620 4.844 1.00 . A A . 17 LYS HB3 1 1 17 11662 1 1 17 LYS HD2 H 1.490 1.865 5.358 1.00 . A A . 17 LYS HD2 1 1 17 11663 1 1 17 LYS HD3 H 0.847 2.474 6.883 1.00 . A A . 17 LYS HD3 1 1 17 11664 1 1 17 LYS HE2 H 0.318 4.160 5.368 1.00 . A A . 17 LYS HE2 1 1 17 11665 1 1 17 LYS HE3 H 1.791 4.749 6.131 1.00 . A A . 17 LYS HE3 1 1 17 11666 1 1 17 LYS HG2 H 2.926 1.763 7.547 1.00 . A A . 17 LYS HG2 1 1 17 11667 1 1 17 LYS HG3 H 3.264 3.450 7.166 1.00 . A A . 17 LYS HG3 1 1 17 11668 1 1 17 LYS HZ1 H 1.467 4.770 3.531 1.00 . A A . 17 LYS HZ1 1 1 17 11669 1 1 17 LYS HZ2 H 2.052 3.187 3.670 1.00 . A A . 17 LYS HZ2 1 1 17 11670 1 1 17 LYS HZ3 H 2.986 4.484 4.227 1.00 . A A . 17 LYS HZ3 1 1 17 11671 1 1 17 LYS N N 4.361 -0.239 6.581 1.00 . A A . 17 LYS N 1 1 17 11672 1 1 17 LYS NZ N 2.021 4.115 4.139 1.00 . A A . 17 LYS NZ 1 1 17 11673 1 1 17 LYS O O 4.476 0.306 3.092 1.00 . A A . 17 LYS O 1 1 17 11674 1 1 18 LYS C C 6.748 -1.196 2.392 1.00 . A A . 18 LYS C 1 1 17 11675 1 1 18 LYS CA C 7.206 -0.157 3.431 1.00 . A A . 18 LYS CA 1 1 17 11676 1 1 18 LYS CB C 8.574 -0.539 4.018 1.00 . A A . 18 LYS CB 1 1 17 11677 1 1 18 LYS CD C 9.893 0.503 2.139 1.00 . A A . 18 LYS CD 1 1 17 11678 1 1 18 LYS CE C 10.859 0.248 0.991 1.00 . A A . 18 LYS CE 1 1 17 11679 1 1 18 LYS CG C 9.653 -0.756 2.963 1.00 . A A . 18 LYS CG 1 1 17 11680 1 1 18 LYS H H 6.517 0.095 5.429 1.00 . A A . 18 LYS H 1 1 17 11681 1 1 18 LYS HA H 7.318 0.782 2.914 1.00 . A A . 18 LYS HA 1 1 17 11682 1 1 18 LYS HB2 H 8.901 0.249 4.680 1.00 . A A . 18 LYS HB2 1 1 17 11683 1 1 18 LYS HB3 H 8.467 -1.452 4.585 1.00 . A A . 18 LYS HB3 1 1 17 11684 1 1 18 LYS HD2 H 8.951 0.841 1.734 1.00 . A A . 18 LYS HD2 1 1 17 11685 1 1 18 LYS HD3 H 10.305 1.267 2.782 1.00 . A A . 18 LYS HD3 1 1 17 11686 1 1 18 LYS HE2 H 10.456 -0.534 0.365 1.00 . A A . 18 LYS HE2 1 1 17 11687 1 1 18 LYS HE3 H 10.956 1.156 0.412 1.00 . A A . 18 LYS HE3 1 1 17 11688 1 1 18 LYS HG2 H 10.573 -1.032 3.454 1.00 . A A . 18 LYS HG2 1 1 17 11689 1 1 18 LYS HG3 H 9.342 -1.553 2.303 1.00 . A A . 18 LYS HG3 1 1 17 11690 1 1 18 LYS HZ1 H 12.483 0.405 2.296 1.00 . A A . 18 LYS HZ1 1 1 17 11691 1 1 18 LYS HZ2 H 12.912 -0.030 0.719 1.00 . A A . 18 LYS HZ2 1 1 17 11692 1 1 18 LYS HZ3 H 12.197 -1.169 1.744 1.00 . A A . 18 LYS HZ3 1 1 17 11693 1 1 18 LYS N N 6.218 0.073 4.497 1.00 . A A . 18 LYS N 1 1 17 11694 1 1 18 LYS NZ N 12.207 -0.166 1.471 1.00 . A A . 18 LYS NZ 1 1 17 11695 1 1 18 LYS O O 6.658 -0.857 1.213 1.00 . A A . 18 LYS O 1 1 17 11696 1 1 19 PRO C C 4.857 -3.016 0.955 1.00 . A A . 19 PRO C 1 1 17 11697 1 1 19 PRO CA C 6.009 -3.495 1.835 1.00 . A A . 19 PRO CA 1 1 17 11698 1 1 19 PRO CB C 5.512 -4.610 2.761 1.00 . A A . 19 PRO CB 1 1 17 11699 1 1 19 PRO CD C 6.547 -2.996 4.160 1.00 . A A . 19 PRO CD 1 1 17 11700 1 1 19 PRO CG C 6.357 -4.475 3.973 1.00 . A A . 19 PRO CG 1 1 17 11701 1 1 19 PRO HA H 6.817 -3.859 1.219 1.00 . A A . 19 PRO HA 1 1 17 11702 1 1 19 PRO HB2 H 4.468 -4.449 2.988 1.00 . A A . 19 PRO HB2 1 1 17 11703 1 1 19 PRO HB3 H 5.636 -5.574 2.290 1.00 . A A . 19 PRO HB3 1 1 17 11704 1 1 19 PRO HD2 H 5.763 -2.590 4.783 1.00 . A A . 19 PRO HD2 1 1 17 11705 1 1 19 PRO HD3 H 7.516 -2.791 4.590 1.00 . A A . 19 PRO HD3 1 1 17 11706 1 1 19 PRO HG2 H 5.850 -4.902 4.826 1.00 . A A . 19 PRO HG2 1 1 17 11707 1 1 19 PRO HG3 H 7.309 -4.959 3.816 1.00 . A A . 19 PRO HG3 1 1 17 11708 1 1 19 PRO N N 6.458 -2.460 2.784 1.00 . A A . 19 PRO N 1 1 17 11709 1 1 19 PRO O O 4.860 -3.193 -0.270 1.00 . A A . 19 PRO O 1 1 17 11710 1 1 20 CYS C C 3.065 -0.735 -0.001 1.00 . A A . 20 CYS C 1 1 17 11711 1 1 20 CYS CA C 2.705 -1.902 0.915 1.00 . A A . 20 CYS CA 1 1 17 11712 1 1 20 CYS CB C 1.651 -1.475 1.938 1.00 . A A . 20 CYS CB 1 1 17 11713 1 1 20 CYS H H 3.947 -2.295 2.573 1.00 . A A . 20 CYS H 1 1 17 11714 1 1 20 CYS HA H 2.307 -2.708 0.314 1.00 . A A . 20 CYS HA 1 1 17 11715 1 1 20 CYS HB2 H 1.550 -2.250 2.683 1.00 . A A . 20 CYS HB2 1 1 17 11716 1 1 20 CYS HB3 H 1.975 -0.563 2.417 1.00 . A A . 20 CYS HB3 1 1 17 11717 1 1 20 CYS N N 3.878 -2.406 1.601 1.00 . A A . 20 CYS N 1 1 17 11718 1 1 20 CYS O O 2.731 -0.742 -1.185 1.00 . A A . 20 CYS O 1 1 17 11719 1 1 20 CYS SG S 0.004 -1.175 1.230 1.00 . A A . 20 CYS SG 1 1 17 11720 1 1 21 VAL C C 4.969 1.002 -1.455 1.00 . A A . 21 VAL C 1 1 17 11721 1 1 21 VAL CA C 4.177 1.422 -0.226 1.00 . A A . 21 VAL CA 1 1 17 11722 1 1 21 VAL CB C 5.014 2.409 0.623 1.00 . A A . 21 VAL CB 1 1 17 11723 1 1 21 VAL CG1 C 5.596 3.522 -0.238 1.00 . A A . 21 VAL CG1 1 1 17 11724 1 1 21 VAL CG2 C 4.167 3.002 1.737 1.00 . A A . 21 VAL CG2 1 1 17 11725 1 1 21 VAL H H 4.015 0.197 1.495 1.00 . A A . 21 VAL H 1 1 17 11726 1 1 21 VAL HA H 3.281 1.934 -0.553 1.00 . A A . 21 VAL HA 1 1 17 11727 1 1 21 VAL HB H 5.832 1.865 1.073 1.00 . A A . 21 VAL HB 1 1 17 11728 1 1 21 VAL HG11 H 4.814 3.951 -0.847 1.00 . A A . 21 VAL HG11 1 1 17 11729 1 1 21 VAL HG12 H 6.368 3.117 -0.876 1.00 . A A . 21 VAL HG12 1 1 17 11730 1 1 21 VAL HG13 H 6.018 4.286 0.397 1.00 . A A . 21 VAL HG13 1 1 17 11731 1 1 21 VAL HG21 H 4.811 3.366 2.524 1.00 . A A . 21 VAL HG21 1 1 17 11732 1 1 21 VAL HG22 H 3.509 2.243 2.132 1.00 . A A . 21 VAL HG22 1 1 17 11733 1 1 21 VAL HG23 H 3.580 3.820 1.346 1.00 . A A . 21 VAL HG23 1 1 17 11734 1 1 21 VAL N N 3.764 0.256 0.545 1.00 . A A . 21 VAL N 1 1 17 11735 1 1 21 VAL O O 4.772 1.556 -2.531 1.00 . A A . 21 VAL O 1 1 17 11736 1 1 22 ALA C C 5.744 -1.033 -3.509 1.00 . A A . 22 ALA C 1 1 17 11737 1 1 22 ALA CA C 6.645 -0.486 -2.406 1.00 . A A . 22 ALA CA 1 1 17 11738 1 1 22 ALA CB C 7.612 -1.557 -1.926 1.00 . A A . 22 ALA CB 1 1 17 11739 1 1 22 ALA H H 5.941 -0.401 -0.407 1.00 . A A . 22 ALA H 1 1 17 11740 1 1 22 ALA HA H 7.220 0.339 -2.801 1.00 . A A . 22 ALA HA 1 1 17 11741 1 1 22 ALA HB1 H 7.154 -2.529 -2.029 1.00 . A A . 22 ALA HB1 1 1 17 11742 1 1 22 ALA HB2 H 7.856 -1.383 -0.888 1.00 . A A . 22 ALA HB2 1 1 17 11743 1 1 22 ALA HB3 H 8.514 -1.520 -2.519 1.00 . A A . 22 ALA HB3 1 1 17 11744 1 1 22 ALA N N 5.843 0.013 -1.295 1.00 . A A . 22 ALA N 1 1 17 11745 1 1 22 ALA O O 5.894 -0.676 -4.685 1.00 . A A . 22 ALA O 1 1 17 11746 1 1 23 CYS C C 3.048 -1.340 -4.736 1.00 . A A . 23 CYS C 1 1 17 11747 1 1 23 CYS CA C 3.851 -2.456 -4.073 1.00 . A A . 23 CYS CA 1 1 17 11748 1 1 23 CYS CB C 2.910 -3.434 -3.363 1.00 . A A . 23 CYS CB 1 1 17 11749 1 1 23 CYS H H 4.712 -2.108 -2.168 1.00 . A A . 23 CYS H 1 1 17 11750 1 1 23 CYS HA H 4.416 -2.984 -4.828 1.00 . A A . 23 CYS HA 1 1 17 11751 1 1 23 CYS HB2 H 3.460 -3.957 -2.597 1.00 . A A . 23 CYS HB2 1 1 17 11752 1 1 23 CYS HB3 H 2.108 -2.876 -2.902 1.00 . A A . 23 CYS HB3 1 1 17 11753 1 1 23 CYS N N 4.793 -1.879 -3.120 1.00 . A A . 23 CYS N 1 1 17 11754 1 1 23 CYS O O 2.895 -1.293 -5.958 1.00 . A A . 23 CYS O 1 1 17 11755 1 1 23 CYS SG S 2.155 -4.686 -4.458 1.00 . A A . 23 CYS SG 1 1 17 11756 1 1 24 CYS C C 2.620 1.577 -5.338 1.00 . A A . 24 CYS C 1 1 17 11757 1 1 24 CYS CA C 1.781 0.699 -4.410 1.00 . A A . 24 CYS CA 1 1 17 11758 1 1 24 CYS CB C 1.249 1.522 -3.240 1.00 . A A . 24 CYS CB 1 1 17 11759 1 1 24 CYS H H 2.719 -0.513 -2.950 1.00 . A A . 24 CYS H 1 1 17 11760 1 1 24 CYS HA H 0.943 0.303 -4.968 1.00 . A A . 24 CYS HA 1 1 17 11761 1 1 24 CYS HB2 H 2.082 1.901 -2.668 1.00 . A A . 24 CYS HB2 1 1 17 11762 1 1 24 CYS HB3 H 0.675 2.351 -3.621 1.00 . A A . 24 CYS HB3 1 1 17 11763 1 1 24 CYS N N 2.554 -0.427 -3.919 1.00 . A A . 24 CYS N 1 1 17 11764 1 1 24 CYS O O 2.111 2.107 -6.318 1.00 . A A . 24 CYS O 1 1 17 11765 1 1 24 CYS SG S 0.184 0.583 -2.103 1.00 . A A . 24 CYS SG 1 1 17 11766 1 1 25 LYS C C 4.876 1.982 -7.271 1.00 . A A . 25 LYS C 1 1 17 11767 1 1 25 LYS CA C 4.801 2.533 -5.856 1.00 . A A . 25 LYS CA 1 1 17 11768 1 1 25 LYS CB C 6.215 2.592 -5.262 1.00 . A A . 25 LYS CB 1 1 17 11769 1 1 25 LYS CD C 6.290 5.003 -4.488 1.00 . A A . 25 LYS CD 1 1 17 11770 1 1 25 LYS CE C 4.861 5.520 -4.438 1.00 . A A . 25 LYS CE 1 1 17 11771 1 1 25 LYS CG C 6.382 3.538 -4.077 1.00 . A A . 25 LYS CG 1 1 17 11772 1 1 25 LYS H H 4.268 1.268 -4.237 1.00 . A A . 25 LYS H 1 1 17 11773 1 1 25 LYS HA H 4.391 3.532 -5.894 1.00 . A A . 25 LYS HA 1 1 17 11774 1 1 25 LYS HB2 H 6.490 1.601 -4.935 1.00 . A A . 25 LYS HB2 1 1 17 11775 1 1 25 LYS HB3 H 6.900 2.903 -6.038 1.00 . A A . 25 LYS HB3 1 1 17 11776 1 1 25 LYS HD2 H 6.896 5.592 -3.816 1.00 . A A . 25 LYS HD2 1 1 17 11777 1 1 25 LYS HD3 H 6.665 5.106 -5.496 1.00 . A A . 25 LYS HD3 1 1 17 11778 1 1 25 LYS HE2 H 4.848 6.541 -4.788 1.00 . A A . 25 LYS HE2 1 1 17 11779 1 1 25 LYS HE3 H 4.248 4.910 -5.085 1.00 . A A . 25 LYS HE3 1 1 17 11780 1 1 25 LYS HG2 H 5.606 3.332 -3.355 1.00 . A A . 25 LYS HG2 1 1 17 11781 1 1 25 LYS HG3 H 7.347 3.362 -3.625 1.00 . A A . 25 LYS HG3 1 1 17 11782 1 1 25 LYS HZ1 H 3.932 4.527 -2.854 1.00 . A A . 25 LYS HZ1 1 1 17 11783 1 1 25 LYS HZ2 H 3.528 6.168 -2.961 1.00 . A A . 25 LYS HZ2 1 1 17 11784 1 1 25 LYS HZ3 H 5.043 5.705 -2.365 1.00 . A A . 25 LYS HZ3 1 1 17 11785 1 1 25 LYS N N 3.908 1.723 -5.032 1.00 . A A . 25 LYS N 1 1 17 11786 1 1 25 LYS NZ N 4.304 5.475 -3.059 1.00 . A A . 25 LYS NZ 1 1 17 11787 1 1 25 LYS O O 4.671 2.715 -8.238 1.00 . A A . 25 LYS O 1 1 17 11788 1 1 26 LYS C C 3.886 -0.009 -9.384 1.00 . A A . 26 LYS C 1 1 17 11789 1 1 26 LYS CA C 5.254 0.056 -8.704 1.00 . A A . 26 LYS CA 1 1 17 11790 1 1 26 LYS CB C 5.918 -1.333 -8.620 1.00 . A A . 26 LYS CB 1 1 17 11791 1 1 26 LYS CD C 4.104 -3.011 -8.066 1.00 . A A . 26 LYS CD 1 1 17 11792 1 1 26 LYS CE C 4.435 -3.968 -9.197 1.00 . A A . 26 LYS CE 1 1 17 11793 1 1 26 LYS CG C 5.337 -2.270 -7.568 1.00 . A A . 26 LYS CG 1 1 17 11794 1 1 26 LYS H H 5.308 0.146 -6.582 1.00 . A A . 26 LYS H 1 1 17 11795 1 1 26 LYS HA H 5.887 0.693 -9.307 1.00 . A A . 26 LYS HA 1 1 17 11796 1 1 26 LYS HB2 H 5.823 -1.816 -9.581 1.00 . A A . 26 LYS HB2 1 1 17 11797 1 1 26 LYS HB3 H 6.968 -1.198 -8.405 1.00 . A A . 26 LYS HB3 1 1 17 11798 1 1 26 LYS HD2 H 3.680 -3.573 -7.248 1.00 . A A . 26 LYS HD2 1 1 17 11799 1 1 26 LYS HD3 H 3.382 -2.288 -8.419 1.00 . A A . 26 LYS HD3 1 1 17 11800 1 1 26 LYS HE2 H 4.808 -3.400 -10.037 1.00 . A A . 26 LYS HE2 1 1 17 11801 1 1 26 LYS HE3 H 5.197 -4.655 -8.860 1.00 . A A . 26 LYS HE3 1 1 17 11802 1 1 26 LYS HG2 H 6.089 -2.995 -7.296 1.00 . A A . 26 LYS HG2 1 1 17 11803 1 1 26 LYS HG3 H 5.067 -1.689 -6.698 1.00 . A A . 26 LYS HG3 1 1 17 11804 1 1 26 LYS HZ1 H 2.804 -5.214 -8.801 1.00 . A A . 26 LYS HZ1 1 1 17 11805 1 1 26 LYS HZ2 H 3.512 -5.464 -10.321 1.00 . A A . 26 LYS HZ2 1 1 17 11806 1 1 26 LYS HZ3 H 2.540 -4.106 -10.057 1.00 . A A . 26 LYS HZ3 1 1 17 11807 1 1 26 LYS N N 5.161 0.686 -7.390 1.00 . A A . 26 LYS N 1 1 17 11808 1 1 26 LYS NZ N 3.240 -4.741 -9.627 1.00 . A A . 26 LYS NZ 1 1 17 11809 1 1 26 LYS O O 3.796 -0.190 -10.597 1.00 . A A . 26 LYS O 1 1 17 11810 1 1 27 ALA C C 0.962 1.538 -9.436 1.00 . A A . 27 ALA C 1 1 17 11811 1 1 27 ALA CA C 1.467 0.119 -9.136 1.00 . A A . 27 ALA CA 1 1 17 11812 1 1 27 ALA CB C 0.534 -0.594 -8.170 1.00 . A A . 27 ALA CB 1 1 17 11813 1 1 27 ALA H H 2.955 0.285 -7.634 1.00 . A A . 27 ALA H 1 1 17 11814 1 1 27 ALA HA H 1.488 -0.444 -10.058 1.00 . A A . 27 ALA HA 1 1 17 11815 1 1 27 ALA HB1 H 1.062 -0.811 -7.253 1.00 . A A . 27 ALA HB1 1 1 17 11816 1 1 27 ALA HB2 H 0.192 -1.517 -8.614 1.00 . A A . 27 ALA HB2 1 1 17 11817 1 1 27 ALA HB3 H -0.314 0.039 -7.955 1.00 . A A . 27 ALA HB3 1 1 17 11818 1 1 27 ALA N N 2.823 0.144 -8.599 1.00 . A A . 27 ALA N 1 1 17 11819 1 1 27 ALA O O -0.206 1.730 -9.777 1.00 . A A . 27 ALA O 1 1 17 11820 1 1 28 LYS C C 0.552 4.513 -8.552 1.00 . A A . 28 LYS C 1 1 17 11821 1 1 28 LYS CA C 1.550 3.932 -9.580 1.00 . A A . 28 LYS CA 1 1 17 11822 1 1 28 LYS CB C 1.058 4.112 -11.037 1.00 . A A . 28 LYS CB 1 1 17 11823 1 1 28 LYS CD C 1.720 6.560 -11.012 1.00 . A A . 28 LYS CD 1 1 17 11824 1 1 28 LYS CE C 1.103 7.938 -10.799 1.00 . A A . 28 LYS CE 1 1 17 11825 1 1 28 LYS CG C 0.666 5.540 -11.422 1.00 . A A . 28 LYS CG 1 1 17 11826 1 1 28 LYS H H 2.776 2.284 -9.050 1.00 . A A . 28 LYS H 1 1 17 11827 1 1 28 LYS HA H 2.478 4.476 -9.472 1.00 . A A . 28 LYS HA 1 1 17 11828 1 1 28 LYS HB2 H 1.844 3.794 -11.705 1.00 . A A . 28 LYS HB2 1 1 17 11829 1 1 28 LYS HB3 H 0.198 3.476 -11.189 1.00 . A A . 28 LYS HB3 1 1 17 11830 1 1 28 LYS HD2 H 2.182 6.237 -10.091 1.00 . A A . 28 LYS HD2 1 1 17 11831 1 1 28 LYS HD3 H 2.467 6.625 -11.789 1.00 . A A . 28 LYS HD3 1 1 17 11832 1 1 28 LYS HE2 H 1.892 8.642 -10.579 1.00 . A A . 28 LYS HE2 1 1 17 11833 1 1 28 LYS HE3 H 0.599 8.237 -11.707 1.00 . A A . 28 LYS HE3 1 1 17 11834 1 1 28 LYS HG2 H 0.535 5.588 -12.492 1.00 . A A . 28 LYS HG2 1 1 17 11835 1 1 28 LYS HG3 H -0.267 5.786 -10.934 1.00 . A A . 28 LYS HG3 1 1 17 11836 1 1 28 LYS HZ1 H 0.002 6.980 -9.294 1.00 . A A . 28 LYS HZ1 1 1 17 11837 1 1 28 LYS HZ2 H -0.812 8.287 -10.004 1.00 . A A . 28 LYS HZ2 1 1 17 11838 1 1 28 LYS HZ3 H 0.447 8.567 -8.910 1.00 . A A . 28 LYS HZ3 1 1 17 11839 1 1 28 LYS N N 1.861 2.520 -9.317 1.00 . A A . 28 LYS N 1 1 17 11840 1 1 28 LYS NZ N 0.121 7.943 -9.675 1.00 . A A . 28 LYS NZ 1 1 17 11841 1 1 28 LYS O O -0.292 5.354 -8.867 1.00 . A A . 28 LYS O 1 1 17 11842 1 1 29 PHE C C 0.628 5.571 -5.356 1.00 . A A . 29 PHE C 1 1 17 11843 1 1 29 PHE CA C -0.175 4.637 -6.251 1.00 . A A . 29 PHE CA 1 1 17 11844 1 1 29 PHE CB C -0.818 3.529 -5.419 1.00 . A A . 29 PHE CB 1 1 17 11845 1 1 29 PHE CD1 C -1.632 1.793 -7.044 1.00 . A A . 29 PHE CD1 1 1 17 11846 1 1 29 PHE CD2 C -3.256 3.091 -5.882 1.00 . A A . 29 PHE CD2 1 1 17 11847 1 1 29 PHE CE1 C -2.642 1.107 -7.692 1.00 . A A . 29 PHE CE1 1 1 17 11848 1 1 29 PHE CE2 C -4.270 2.406 -6.525 1.00 . A A . 29 PHE CE2 1 1 17 11849 1 1 29 PHE CG C -1.923 2.793 -6.135 1.00 . A A . 29 PHE CG 1 1 17 11850 1 1 29 PHE CZ C -3.962 1.414 -7.432 1.00 . A A . 29 PHE CZ 1 1 17 11851 1 1 29 PHE H H 1.390 3.463 -7.074 1.00 . A A . 29 PHE H 1 1 17 11852 1 1 29 PHE HA H -0.955 5.212 -6.728 1.00 . A A . 29 PHE HA 1 1 17 11853 1 1 29 PHE HB2 H -0.057 2.810 -5.150 1.00 . A A . 29 PHE HB2 1 1 17 11854 1 1 29 PHE HB3 H -1.232 3.963 -4.518 1.00 . A A . 29 PHE HB3 1 1 17 11855 1 1 29 PHE HD1 H -0.600 1.550 -7.251 1.00 . A A . 29 PHE HD1 1 1 17 11856 1 1 29 PHE HD2 H -3.504 3.871 -5.176 1.00 . A A . 29 PHE HD2 1 1 17 11857 1 1 29 PHE HE1 H -2.399 0.330 -8.402 1.00 . A A . 29 PHE HE1 1 1 17 11858 1 1 29 PHE HE2 H -5.302 2.648 -6.318 1.00 . A A . 29 PHE HE2 1 1 17 11859 1 1 29 PHE HZ H -4.752 0.877 -7.936 1.00 . A A . 29 PHE HZ 1 1 17 11860 1 1 29 PHE N N 0.681 4.108 -7.304 1.00 . A A . 29 PHE N 1 1 17 11861 1 1 29 PHE O O 1.824 5.362 -5.139 1.00 . A A . 29 PHE O 1 1 17 11862 1 1 30 SER C C 1.196 6.975 -2.748 1.00 . A A . 30 SER C 1 1 17 11863 1 1 30 SER CA C 0.604 7.602 -4.009 1.00 . A A . 30 SER CA 1 1 17 11864 1 1 30 SER CB C -0.422 8.672 -3.641 1.00 . A A . 30 SER CB 1 1 17 11865 1 1 30 SER H H -0.979 6.719 -5.085 1.00 . A A . 30 SER H 1 1 17 11866 1 1 30 SER HA H 1.399 8.060 -4.572 1.00 . A A . 30 SER HA 1 1 17 11867 1 1 30 SER HB2 H -1.078 8.293 -2.871 1.00 . A A . 30 SER HB2 1 1 17 11868 1 1 30 SER HB3 H 0.089 9.553 -3.282 1.00 . A A . 30 SER HB3 1 1 17 11869 1 1 30 SER HG H -1.212 9.977 -4.877 1.00 . A A . 30 SER HG 1 1 17 11870 1 1 30 SER N N -0.030 6.607 -4.861 1.00 . A A . 30 SER N 1 1 17 11871 1 1 30 SER O O 2.361 7.207 -2.420 1.00 . A A . 30 SER O 1 1 17 11872 1 1 30 SER OG O -1.198 9.021 -4.777 1.00 . A A . 30 SER OG 1 1 17 11873 1 1 31 ASP C C -0.008 4.299 -0.530 1.00 . A A . 31 ASP C 1 1 17 11874 1 1 31 ASP CA C 0.856 5.513 -0.833 1.00 . A A . 31 ASP CA 1 1 17 11875 1 1 31 ASP CB C 0.846 6.491 0.355 1.00 . A A . 31 ASP CB 1 1 17 11876 1 1 31 ASP CG C 1.271 5.839 1.663 1.00 . A A . 31 ASP CG 1 1 17 11877 1 1 31 ASP H H -0.516 6.015 -2.375 1.00 . A A . 31 ASP H 1 1 17 11878 1 1 31 ASP HA H 1.869 5.179 -1.000 1.00 . A A . 31 ASP HA 1 1 17 11879 1 1 31 ASP HB2 H 1.524 7.305 0.146 1.00 . A A . 31 ASP HB2 1 1 17 11880 1 1 31 ASP HB3 H -0.153 6.885 0.478 1.00 . A A . 31 ASP HB3 1 1 17 11881 1 1 31 ASP N N 0.402 6.173 -2.056 1.00 . A A . 31 ASP N 1 1 17 11882 1 1 31 ASP O O -1.168 4.233 -0.945 1.00 . A A . 31 ASP O 1 1 17 11883 1 1 31 ASP OD1 O 0.410 5.265 2.364 1.00 . A A . 31 ASP OD1 1 1 17 11884 1 1 31 ASP OD2 O 2.477 5.858 1.981 1.00 . A A . 31 ASP OD2 1 1 17 11885 1 1 32 GLY C C -0.208 1.923 2.023 1.00 . A A . 32 GLY C 1 1 17 11886 1 1 32 GLY CA C -0.148 2.139 0.531 1.00 . A A . 32 GLY CA 1 1 17 11887 1 1 32 GLY H H 1.492 3.456 0.479 1.00 . A A . 32 GLY H 1 1 17 11888 1 1 32 GLY HA2 H -1.156 2.207 0.146 1.00 . A A . 32 GLY HA2 1 1 17 11889 1 1 32 GLY HA3 H 0.344 1.293 0.075 1.00 . A A . 32 GLY HA3 1 1 17 11890 1 1 32 GLY N N 0.568 3.341 0.182 1.00 . A A . 32 GLY N 1 1 17 11891 1 1 32 GLY O O 0.767 2.170 2.739 1.00 . A A . 32 GLY O 1 1 17 11892 1 1 33 HIS C C -2.151 -0.175 4.136 1.00 . A A . 33 HIS C 1 1 17 11893 1 1 33 HIS CA C -1.539 1.200 3.910 1.00 . A A . 33 HIS CA 1 1 17 11894 1 1 33 HIS CB C -2.413 2.295 4.533 1.00 . A A . 33 HIS CB 1 1 17 11895 1 1 33 HIS CD2 C -4.219 3.158 2.869 1.00 . A A . 33 HIS CD2 1 1 17 11896 1 1 33 HIS CE1 C -5.927 2.026 3.638 1.00 . A A . 33 HIS CE1 1 1 17 11897 1 1 33 HIS CG C -3.780 2.422 3.920 1.00 . A A . 33 HIS CG 1 1 17 11898 1 1 33 HIS H H -2.083 1.265 1.866 1.00 . A A . 33 HIS H 1 1 17 11899 1 1 33 HIS HA H -0.566 1.223 4.379 1.00 . A A . 33 HIS HA 1 1 17 11900 1 1 33 HIS HB2 H -2.544 2.082 5.583 1.00 . A A . 33 HIS HB2 1 1 17 11901 1 1 33 HIS HB3 H -1.910 3.242 4.428 1.00 . A A . 33 HIS HB3 1 1 17 11902 1 1 33 HIS HD1 H -4.883 1.092 5.127 1.00 . A A . 33 HIS HD1 1 1 17 11903 1 1 33 HIS HD2 H -3.624 3.807 2.248 1.00 . A A . 33 HIS HD2 1 1 17 11904 1 1 33 HIS HE1 H -6.919 1.618 3.753 1.00 . A A . 33 HIS HE1 1 1 17 11905 1 1 33 HIS N N -1.348 1.454 2.495 1.00 . A A . 33 HIS N 1 1 17 11906 1 1 33 HIS ND1 N -4.877 1.724 4.378 1.00 . A A . 33 HIS ND1 1 1 17 11907 1 1 33 HIS NE2 N -5.556 2.894 2.719 1.00 . A A . 33 HIS NE2 1 1 17 11908 1 1 33 HIS O O -3.091 -0.573 3.449 1.00 . A A . 33 HIS O 1 1 17 11909 1 1 34 CYS C C -3.496 -2.165 5.996 1.00 . A A . 34 CYS C 1 1 17 11910 1 1 34 CYS CA C -2.077 -2.227 5.435 1.00 . A A . 34 CYS CA 1 1 17 11911 1 1 34 CYS CB C -1.152 -2.872 6.469 1.00 . A A . 34 CYS CB 1 1 17 11912 1 1 34 CYS H H -0.855 -0.513 5.606 1.00 . A A . 34 CYS H 1 1 17 11913 1 1 34 CYS HA H -2.077 -2.822 4.534 1.00 . A A . 34 CYS HA 1 1 17 11914 1 1 34 CYS HB2 H -1.422 -2.514 7.451 1.00 . A A . 34 CYS HB2 1 1 17 11915 1 1 34 CYS HB3 H -1.284 -3.944 6.437 1.00 . A A . 34 CYS HB3 1 1 17 11916 1 1 34 CYS N N -1.603 -0.892 5.101 1.00 . A A . 34 CYS N 1 1 17 11917 1 1 34 CYS O O -3.814 -1.280 6.792 1.00 . A A . 34 CYS O 1 1 17 11918 1 1 34 CYS SG S 0.625 -2.526 6.229 1.00 . A A . 34 CYS SG 1 1 17 11919 1 1 35 SER C C -5.819 -3.929 7.368 1.00 . A A . 35 SER C 1 1 17 11920 1 1 35 SER CA C -5.719 -3.129 6.070 1.00 . A A . 35 SER CA 1 1 17 11921 1 1 35 SER CB C -6.646 -3.720 5.008 1.00 . A A . 35 SER CB 1 1 17 11922 1 1 35 SER H H -4.047 -3.778 4.948 1.00 . A A . 35 SER H 1 1 17 11923 1 1 35 SER HA H -6.021 -2.113 6.266 1.00 . A A . 35 SER HA 1 1 17 11924 1 1 35 SER HB2 H -7.611 -3.922 5.448 1.00 . A A . 35 SER HB2 1 1 17 11925 1 1 35 SER HB3 H -6.760 -3.013 4.199 1.00 . A A . 35 SER HB3 1 1 17 11926 1 1 35 SER HG H -5.569 -4.725 3.718 1.00 . A A . 35 SER HG 1 1 17 11927 1 1 35 SER N N -4.347 -3.097 5.585 1.00 . A A . 35 SER N 1 1 17 11928 1 1 35 SER O O -4.837 -4.088 8.094 1.00 . A A . 35 SER O 1 1 17 11929 1 1 35 SER OG O -6.121 -4.927 4.489 1.00 . A A . 35 SER OG 1 1 17 11930 1 1 36 LYS C C -7.829 -6.583 8.547 1.00 . A A . 36 LYS C 1 1 17 11931 1 1 36 LYS CA C -7.231 -5.215 8.863 1.00 . A A . 36 LYS CA 1 1 17 11932 1 1 36 LYS CB C -8.151 -4.454 9.823 1.00 . A A . 36 LYS CB 1 1 17 11933 1 1 36 LYS CD C -9.445 -4.468 11.983 1.00 . A A . 36 LYS CD 1 1 17 11934 1 1 36 LYS CE C -9.982 -5.336 13.112 1.00 . A A . 36 LYS CE 1 1 17 11935 1 1 36 LYS CG C -8.566 -5.270 11.037 1.00 . A A . 36 LYS CG 1 1 17 11936 1 1 36 LYS H H -7.750 -4.276 7.040 1.00 . A A . 36 LYS H 1 1 17 11937 1 1 36 LYS HA H -6.274 -5.359 9.342 1.00 . A A . 36 LYS HA 1 1 17 11938 1 1 36 LYS HB2 H -7.639 -3.568 10.168 1.00 . A A . 36 LYS HB2 1 1 17 11939 1 1 36 LYS HB3 H -9.044 -4.160 9.291 1.00 . A A . 36 LYS HB3 1 1 17 11940 1 1 36 LYS HD2 H -8.862 -3.664 12.407 1.00 . A A . 36 LYS HD2 1 1 17 11941 1 1 36 LYS HD3 H -10.276 -4.060 11.428 1.00 . A A . 36 LYS HD3 1 1 17 11942 1 1 36 LYS HE2 H -10.568 -4.718 13.776 1.00 . A A . 36 LYS HE2 1 1 17 11943 1 1 36 LYS HE3 H -10.611 -6.105 12.688 1.00 . A A . 36 LYS HE3 1 1 17 11944 1 1 36 LYS HG2 H -9.114 -6.138 10.701 1.00 . A A . 36 LYS HG2 1 1 17 11945 1 1 36 LYS HG3 H -7.677 -5.586 11.564 1.00 . A A . 36 LYS HG3 1 1 17 11946 1 1 36 LYS HZ1 H -8.226 -5.260 14.242 1.00 . A A . 36 LYS HZ1 1 1 17 11947 1 1 36 LYS HZ2 H -8.368 -6.652 13.291 1.00 . A A . 36 LYS HZ2 1 1 17 11948 1 1 36 LYS HZ3 H -9.285 -6.496 14.703 1.00 . A A . 36 LYS HZ3 1 1 17 11949 1 1 36 LYS N N -7.007 -4.435 7.654 1.00 . A A . 36 LYS N 1 1 17 11950 1 1 36 LYS NZ N -8.889 -5.980 13.892 1.00 . A A . 36 LYS NZ 1 1 17 11951 1 1 36 LYS O O -7.527 -7.561 9.225 1.00 . A A . 36 LYS O 1 1 17 11952 1 1 37 ILE C C -8.372 -9.001 6.864 1.00 . A A . 37 ILE C 1 1 17 11953 1 1 37 ILE CA C -9.364 -7.874 7.147 1.00 . A A . 37 ILE CA 1 1 17 11954 1 1 37 ILE CB C -10.241 -7.660 5.896 1.00 . A A . 37 ILE CB 1 1 17 11955 1 1 37 ILE CD1 C -12.027 -6.147 4.889 1.00 . A A . 37 ILE CD1 1 1 17 11956 1 1 37 ILE CG1 C -11.224 -6.508 6.122 1.00 . A A . 37 ILE CG1 1 1 17 11957 1 1 37 ILE CG2 C -10.991 -8.940 5.545 1.00 . A A . 37 ILE CG2 1 1 17 11958 1 1 37 ILE H H -8.904 -5.812 7.054 1.00 . A A . 37 ILE H 1 1 17 11959 1 1 37 ILE HA H -10.003 -8.172 7.962 1.00 . A A . 37 ILE HA 1 1 17 11960 1 1 37 ILE HB H -9.593 -7.414 5.070 1.00 . A A . 37 ILE HB 1 1 17 11961 1 1 37 ILE HD11 H -11.602 -6.640 4.026 1.00 . A A . 37 ILE HD11 1 1 17 11962 1 1 37 ILE HD12 H -11.999 -5.078 4.742 1.00 . A A . 37 ILE HD12 1 1 17 11963 1 1 37 ILE HD13 H -13.050 -6.467 5.019 1.00 . A A . 37 ILE HD13 1 1 17 11964 1 1 37 ILE HG12 H -11.919 -6.783 6.900 1.00 . A A . 37 ILE HG12 1 1 17 11965 1 1 37 ILE HG13 H -10.674 -5.630 6.429 1.00 . A A . 37 ILE HG13 1 1 17 11966 1 1 37 ILE HG21 H -10.815 -9.187 4.508 1.00 . A A . 37 ILE HG21 1 1 17 11967 1 1 37 ILE HG22 H -12.049 -8.793 5.706 1.00 . A A . 37 ILE HG22 1 1 17 11968 1 1 37 ILE HG23 H -10.640 -9.746 6.172 1.00 . A A . 37 ILE HG23 1 1 17 11969 1 1 37 ILE N N -8.693 -6.633 7.537 1.00 . A A . 37 ILE N 1 1 17 11970 1 1 37 ILE O O -8.462 -10.077 7.446 1.00 . A A . 37 ILE O 1 1 17 11971 1 1 38 LEU C C -5.085 -9.086 5.429 1.00 . A A . 38 LEU C 1 1 17 11972 1 1 38 LEU CA C -6.435 -9.751 5.613 1.00 . A A . 38 LEU CA 1 1 17 11973 1 1 38 LEU CB C -6.840 -10.458 4.320 1.00 . A A . 38 LEU CB 1 1 17 11974 1 1 38 LEU CD1 C -6.314 -12.814 4.991 1.00 . A A . 38 LEU CD1 1 1 17 11975 1 1 38 LEU CD2 C -6.298 -12.169 2.570 1.00 . A A . 38 LEU CD2 1 1 17 11976 1 1 38 LEU CG C -6.024 -11.704 3.992 1.00 . A A . 38 LEU CG 1 1 17 11977 1 1 38 LEU H H -7.410 -7.875 5.530 1.00 . A A . 38 LEU H 1 1 17 11978 1 1 38 LEU HA H -6.375 -10.472 6.414 1.00 . A A . 38 LEU HA 1 1 17 11979 1 1 38 LEU HB2 H -7.878 -10.733 4.396 1.00 . A A . 38 LEU HB2 1 1 17 11980 1 1 38 LEU HB3 H -6.730 -9.759 3.505 1.00 . A A . 38 LEU HB3 1 1 17 11981 1 1 38 LEU HD11 H -7.298 -13.218 4.804 1.00 . A A . 38 LEU HD11 1 1 17 11982 1 1 38 LEU HD12 H -6.272 -12.416 5.994 1.00 . A A . 38 LEU HD12 1 1 17 11983 1 1 38 LEU HD13 H -5.578 -13.597 4.883 1.00 . A A . 38 LEU HD13 1 1 17 11984 1 1 38 LEU HD21 H -5.372 -12.475 2.107 1.00 . A A . 38 LEU HD21 1 1 17 11985 1 1 38 LEU HD22 H -6.733 -11.359 2.004 1.00 . A A . 38 LEU HD22 1 1 17 11986 1 1 38 LEU HD23 H -6.983 -13.003 2.590 1.00 . A A . 38 LEU HD23 1 1 17 11987 1 1 38 LEU HG H -4.976 -11.453 4.071 1.00 . A A . 38 LEU HG 1 1 17 11988 1 1 38 LEU N N -7.432 -8.749 5.967 1.00 . A A . 38 LEU N 1 1 17 11989 1 1 38 LEU O O -4.204 -9.591 4.736 1.00 . A A . 38 LEU O 1 1 17 11990 1 1 39 ARG C C -3.330 -6.868 4.539 1.00 . A A . 39 ARG C 1 1 17 11991 1 1 39 ARG CA C -3.733 -7.128 5.985 1.00 . A A . 39 ARG CA 1 1 17 11992 1 1 39 ARG CB C -2.582 -7.804 6.730 1.00 . A A . 39 ARG CB 1 1 17 11993 1 1 39 ARG CD C -3.009 -6.623 8.912 1.00 . A A . 39 ARG CD 1 1 17 11994 1 1 39 ARG CG C -2.821 -7.965 8.218 1.00 . A A . 39 ARG CG 1 1 17 11995 1 1 39 ARG CZ C -1.630 -4.666 9.559 1.00 . A A . 39 ARG CZ 1 1 17 11996 1 1 39 ARG H H -5.704 -7.600 6.576 1.00 . A A . 39 ARG H 1 1 17 11997 1 1 39 ARG HA H -3.942 -6.180 6.457 1.00 . A A . 39 ARG HA 1 1 17 11998 1 1 39 ARG HB2 H -2.423 -8.785 6.307 1.00 . A A . 39 ARG HB2 1 1 17 11999 1 1 39 ARG HB3 H -1.687 -7.215 6.593 1.00 . A A . 39 ARG HB3 1 1 17 12000 1 1 39 ARG HD2 H -3.727 -6.041 8.352 1.00 . A A . 39 ARG HD2 1 1 17 12001 1 1 39 ARG HD3 H -3.389 -6.798 9.908 1.00 . A A . 39 ARG HD3 1 1 17 12002 1 1 39 ARG HE H -0.941 -6.312 8.650 1.00 . A A . 39 ARG HE 1 1 17 12003 1 1 39 ARG HG2 H -3.705 -8.565 8.367 1.00 . A A . 39 ARG HG2 1 1 17 12004 1 1 39 ARG HG3 H -1.965 -8.465 8.647 1.00 . A A . 39 ARG HG3 1 1 17 12005 1 1 39 ARG HH11 H -3.617 -4.407 9.863 1.00 . A A . 39 ARG HH11 1 1 17 12006 1 1 39 ARG HH12 H -2.612 -3.100 10.392 1.00 . A A . 39 ARG HH12 1 1 17 12007 1 1 39 ARG HH21 H 0.383 -4.592 9.320 1.00 . A A . 39 ARG HH21 1 1 17 12008 1 1 39 ARG HH22 H -0.323 -3.204 10.082 1.00 . A A . 39 ARG HH22 1 1 17 12009 1 1 39 ARG N N -4.950 -7.929 6.055 1.00 . A A . 39 ARG N 1 1 17 12010 1 1 39 ARG NE N -1.753 -5.874 9.004 1.00 . A A . 39 ARG NE 1 1 17 12011 1 1 39 ARG NH1 N -2.705 -4.004 9.972 1.00 . A A . 39 ARG NH1 1 1 17 12012 1 1 39 ARG NH2 N -0.429 -4.107 9.662 1.00 . A A . 39 ARG NH2 1 1 17 12013 1 1 39 ARG O O -2.153 -6.692 4.238 1.00 . A A . 39 ARG O 1 1 17 12014 1 1 40 ARG C C -3.555 -5.145 2.074 1.00 . A A . 40 ARG C 1 1 17 12015 1 1 40 ARG CA C -4.040 -6.573 2.247 1.00 . A A . 40 ARG CA 1 1 17 12016 1 1 40 ARG CB C -5.270 -6.843 1.382 1.00 . A A . 40 ARG CB 1 1 17 12017 1 1 40 ARG CD C -6.602 -8.562 0.106 1.00 . A A . 40 ARG CD 1 1 17 12018 1 1 40 ARG CG C -5.485 -8.321 1.109 1.00 . A A . 40 ARG CG 1 1 17 12019 1 1 40 ARG CZ C -5.679 -10.469 -1.177 1.00 . A A . 40 ARG CZ 1 1 17 12020 1 1 40 ARG H H -5.237 -6.976 3.944 1.00 . A A . 40 ARG H 1 1 17 12021 1 1 40 ARG HA H -3.246 -7.241 1.942 1.00 . A A . 40 ARG HA 1 1 17 12022 1 1 40 ARG HB2 H -6.145 -6.458 1.885 1.00 . A A . 40 ARG HB2 1 1 17 12023 1 1 40 ARG HB3 H -5.153 -6.335 0.436 1.00 . A A . 40 ARG HB3 1 1 17 12024 1 1 40 ARG HD2 H -7.549 -8.345 0.579 1.00 . A A . 40 ARG HD2 1 1 17 12025 1 1 40 ARG HD3 H -6.461 -7.905 -0.739 1.00 . A A . 40 ARG HD3 1 1 17 12026 1 1 40 ARG HE H -7.327 -10.532 -0.029 1.00 . A A . 40 ARG HE 1 1 17 12027 1 1 40 ARG HG2 H -4.570 -8.739 0.716 1.00 . A A . 40 ARG HG2 1 1 17 12028 1 1 40 ARG HG3 H -5.735 -8.813 2.037 1.00 . A A . 40 ARG HG3 1 1 17 12029 1 1 40 ARG HH11 H -4.748 -8.703 -1.520 1.00 . A A . 40 ARG HH11 1 1 17 12030 1 1 40 ARG HH12 H -4.043 -10.069 -2.324 1.00 . A A . 40 ARG HH12 1 1 17 12031 1 1 40 ARG HH21 H -6.407 -12.361 -1.094 1.00 . A A . 40 ARG HH21 1 1 17 12032 1 1 40 ARG HH22 H -4.996 -12.154 -2.079 1.00 . A A . 40 ARG HH22 1 1 17 12033 1 1 40 ARG N N -4.311 -6.833 3.647 1.00 . A A . 40 ARG N 1 1 17 12034 1 1 40 ARG NE N -6.611 -9.950 -0.366 1.00 . A A . 40 ARG NE 1 1 17 12035 1 1 40 ARG NH1 N -4.751 -9.684 -1.715 1.00 . A A . 40 ARG NH1 1 1 17 12036 1 1 40 ARG NH2 N -5.698 -11.765 -1.474 1.00 . A A . 40 ARG NH2 1 1 17 12037 1 1 40 ARG O O -3.995 -4.240 2.787 1.00 . A A . 40 ARG O 1 1 17 12038 1 1 41 CYS C C -3.012 -2.749 0.164 1.00 . A A . 41 CYS C 1 1 17 12039 1 1 41 CYS CA C -2.039 -3.665 0.895 1.00 . A A . 41 CYS CA 1 1 17 12040 1 1 41 CYS CB C -0.771 -3.843 0.062 1.00 . A A . 41 CYS CB 1 1 17 12041 1 1 41 CYS H H -2.304 -5.737 0.651 1.00 . A A . 41 CYS H 1 1 17 12042 1 1 41 CYS HA H -1.778 -3.218 1.841 1.00 . A A . 41 CYS HA 1 1 17 12043 1 1 41 CYS HB2 H -0.043 -4.391 0.641 1.00 . A A . 41 CYS HB2 1 1 17 12044 1 1 41 CYS HB3 H -1.011 -4.407 -0.828 1.00 . A A . 41 CYS HB3 1 1 17 12045 1 1 41 CYS N N -2.626 -4.965 1.159 1.00 . A A . 41 CYS N 1 1 17 12046 1 1 41 CYS O O -3.156 -2.835 -1.054 1.00 . A A . 41 CYS O 1 1 17 12047 1 1 41 CYS SG S 0.003 -2.288 -0.461 1.00 . A A . 41 CYS SG 1 1 17 12048 1 1 42 LEU C C -3.805 0.259 -0.259 1.00 . A A . 42 LEU C 1 1 17 12049 1 1 42 LEU CA C -4.584 -0.913 0.302 1.00 . A A . 42 LEU CA 1 1 17 12050 1 1 42 LEU CB C -5.613 -0.412 1.322 1.00 . A A . 42 LEU CB 1 1 17 12051 1 1 42 LEU CD1 C -6.567 -2.665 1.876 1.00 . A A . 42 LEU CD1 1 1 17 12052 1 1 42 LEU CD2 C -7.861 -0.606 2.420 1.00 . A A . 42 LEU CD2 1 1 17 12053 1 1 42 LEU CG C -6.889 -1.249 1.443 1.00 . A A . 42 LEU CG 1 1 17 12054 1 1 42 LEU H H -3.493 -1.819 1.874 1.00 . A A . 42 LEU H 1 1 17 12055 1 1 42 LEU HA H -5.092 -1.418 -0.509 1.00 . A A . 42 LEU HA 1 1 17 12056 1 1 42 LEU HB2 H -5.136 -0.387 2.292 1.00 . A A . 42 LEU HB2 1 1 17 12057 1 1 42 LEU HB3 H -5.892 0.601 1.055 1.00 . A A . 42 LEU HB3 1 1 17 12058 1 1 42 LEU HD11 H -7.311 -3.341 1.481 1.00 . A A . 42 LEU HD11 1 1 17 12059 1 1 42 LEU HD12 H -6.567 -2.720 2.955 1.00 . A A . 42 LEU HD12 1 1 17 12060 1 1 42 LEU HD13 H -5.593 -2.943 1.502 1.00 . A A . 42 LEU HD13 1 1 17 12061 1 1 42 LEU HD21 H -7.372 0.214 2.926 1.00 . A A . 42 LEU HD21 1 1 17 12062 1 1 42 LEU HD22 H -8.180 -1.339 3.146 1.00 . A A . 42 LEU HD22 1 1 17 12063 1 1 42 LEU HD23 H -8.720 -0.235 1.882 1.00 . A A . 42 LEU HD23 1 1 17 12064 1 1 42 LEU HG H -7.371 -1.298 0.477 1.00 . A A . 42 LEU HG 1 1 17 12065 1 1 42 LEU N N -3.659 -1.858 0.905 1.00 . A A . 42 LEU N 1 1 17 12066 1 1 42 LEU O O -3.212 1.036 0.492 1.00 . A A . 42 LEU O 1 1 17 12067 1 1 43 CYS C C -4.019 2.609 -2.527 1.00 . A A . 43 CYS C 1 1 17 12068 1 1 43 CYS CA C -3.088 1.447 -2.229 1.00 . A A . 43 CYS CA 1 1 17 12069 1 1 43 CYS CB C -2.461 0.938 -3.525 1.00 . A A . 43 CYS CB 1 1 17 12070 1 1 43 CYS H H -4.296 -0.270 -2.116 1.00 . A A . 43 CYS H 1 1 17 12071 1 1 43 CYS HA H -2.304 1.785 -1.567 1.00 . A A . 43 CYS HA 1 1 17 12072 1 1 43 CYS HB2 H -3.234 0.508 -4.143 1.00 . A A . 43 CYS HB2 1 1 17 12073 1 1 43 CYS HB3 H -2.015 1.771 -4.048 1.00 . A A . 43 CYS HB3 1 1 17 12074 1 1 43 CYS N N -3.803 0.379 -1.569 1.00 . A A . 43 CYS N 1 1 17 12075 1 1 43 CYS O O -5.138 2.414 -3.004 1.00 . A A . 43 CYS O 1 1 17 12076 1 1 43 CYS SG S -1.173 -0.328 -3.302 1.00 . A A . 43 CYS SG 1 1 17 12077 1 1 44 THR C C -3.626 5.863 -3.563 1.00 . A A . 44 THR C 1 1 17 12078 1 1 44 THR CA C -4.333 5.003 -2.525 1.00 . A A . 44 THR CA 1 1 17 12079 1 1 44 THR CB C -4.592 5.821 -1.244 1.00 . A A . 44 THR CB 1 1 17 12080 1 1 44 THR CG2 C -5.716 5.205 -0.424 1.00 . A A . 44 THR CG2 1 1 17 12081 1 1 44 THR H H -2.645 3.905 -1.892 1.00 . A A . 44 THR H 1 1 17 12082 1 1 44 THR HA H -5.287 4.690 -2.927 1.00 . A A . 44 THR HA 1 1 17 12083 1 1 44 THR HB H -4.887 6.820 -1.533 1.00 . A A . 44 THR HB 1 1 17 12084 1 1 44 THR HG1 H -2.727 5.317 -0.811 1.00 . A A . 44 THR HG1 1 1 17 12085 1 1 44 THR HG21 H -6.376 5.985 -0.074 1.00 . A A . 44 THR HG21 1 1 17 12086 1 1 44 THR HG22 H -5.297 4.681 0.423 1.00 . A A . 44 THR HG22 1 1 17 12087 1 1 44 THR HG23 H -6.271 4.511 -1.037 1.00 . A A . 44 THR HG23 1 1 17 12088 1 1 44 THR N N -3.552 3.812 -2.262 1.00 . A A . 44 THR N 1 1 17 12089 1 1 44 THR O O -2.403 6.006 -3.522 1.00 . A A . 44 THR O 1 1 17 12090 1 1 44 THR OG1 O -3.402 5.900 -0.447 1.00 . A A . 44 THR OG1 1 1 17 12091 1 1 45 LYS C C -4.894 8.125 -6.170 1.00 . A A . 45 LYS C 1 1 17 12092 1 1 45 LYS CA C -3.827 7.246 -5.551 1.00 . A A . 45 LYS CA 1 1 17 12093 1 1 45 LYS CB C -3.165 6.389 -6.640 1.00 . A A . 45 LYS CB 1 1 17 12094 1 1 45 LYS CD C -3.362 5.145 -8.812 1.00 . A A . 45 LYS CD 1 1 17 12095 1 1 45 LYS CE C -4.082 5.196 -10.148 1.00 . A A . 45 LYS CE 1 1 17 12096 1 1 45 LYS CG C -4.109 5.920 -7.740 1.00 . A A . 45 LYS CG 1 1 17 12097 1 1 45 LYS H H -5.360 6.252 -4.479 1.00 . A A . 45 LYS H 1 1 17 12098 1 1 45 LYS HA H -3.077 7.888 -5.115 1.00 . A A . 45 LYS HA 1 1 17 12099 1 1 45 LYS HB2 H -2.376 6.965 -7.100 1.00 . A A . 45 LYS HB2 1 1 17 12100 1 1 45 LYS HB3 H -2.731 5.516 -6.174 1.00 . A A . 45 LYS HB3 1 1 17 12101 1 1 45 LYS HD2 H -2.378 5.573 -8.931 1.00 . A A . 45 LYS HD2 1 1 17 12102 1 1 45 LYS HD3 H -3.273 4.114 -8.501 1.00 . A A . 45 LYS HD3 1 1 17 12103 1 1 45 LYS HE2 H -3.596 4.516 -10.832 1.00 . A A . 45 LYS HE2 1 1 17 12104 1 1 45 LYS HE3 H -5.107 4.887 -10.003 1.00 . A A . 45 LYS HE3 1 1 17 12105 1 1 45 LYS HG2 H -4.863 5.280 -7.306 1.00 . A A . 45 LYS HG2 1 1 17 12106 1 1 45 LYS HG3 H -4.579 6.782 -8.191 1.00 . A A . 45 LYS HG3 1 1 17 12107 1 1 45 LYS HZ1 H -4.922 7.090 -10.446 1.00 . A A . 45 LYS HZ1 1 1 17 12108 1 1 45 LYS HZ2 H -4.037 6.516 -11.768 1.00 . A A . 45 LYS HZ2 1 1 17 12109 1 1 45 LYS HZ3 H -3.229 7.097 -10.397 1.00 . A A . 45 LYS HZ3 1 1 17 12110 1 1 45 LYS N N -4.389 6.414 -4.496 1.00 . A A . 45 LYS N 1 1 17 12111 1 1 45 LYS NZ N -4.067 6.565 -10.733 1.00 . A A . 45 LYS NZ 1 1 17 12112 1 1 45 LYS O O -6.067 8.066 -5.800 1.00 . A A . 45 LYS O 1 1 17 12113 1 1 46 GLU C C -6.048 9.228 -8.970 1.00 . A A . 46 GLU C 1 1 17 12114 1 1 46 GLU CA C -5.299 9.879 -7.799 1.00 . A A . 46 GLU CA 1 1 17 12115 1 1 46 GLU CB C -4.426 11.039 -8.307 1.00 . A A . 46 GLU CB 1 1 17 12116 1 1 46 GLU CD C -2.540 9.490 -9.156 1.00 . A A . 46 GLU CD 1 1 17 12117 1 1 46 GLU CG C -3.449 10.681 -9.439 1.00 . A A . 46 GLU CG 1 1 17 12118 1 1 46 GLU H H -3.492 8.931 -7.311 1.00 . A A . 46 GLU H 1 1 17 12119 1 1 46 GLU HA H -6.019 10.269 -7.098 1.00 . A A . 46 GLU HA 1 1 17 12120 1 1 46 GLU HB2 H -5.074 11.824 -8.666 1.00 . A A . 46 GLU HB2 1 1 17 12121 1 1 46 GLU HB3 H -3.849 11.421 -7.476 1.00 . A A . 46 GLU HB3 1 1 17 12122 1 1 46 GLU HG2 H -4.022 10.456 -10.320 1.00 . A A . 46 GLU HG2 1 1 17 12123 1 1 46 GLU HG3 H -2.828 11.542 -9.631 1.00 . A A . 46 GLU HG3 1 1 17 12124 1 1 46 GLU N N -4.452 8.943 -7.096 1.00 . A A . 46 GLU N 1 1 17 12125 1 1 46 GLU O O -5.450 8.539 -9.799 1.00 . A A . 46 GLU O 1 1 17 12126 1 1 46 GLU OE1 O -1.875 9.472 -8.105 1.00 . A A . 46 GLU OE1 1 1 17 12127 1 1 46 GLU OE2 O -2.470 8.563 -10.002 1.00 . A A . 46 GLU OE2 1 1 17 12128 1 1 47 CYS C C -9.586 9.504 -9.991 1.00 . A A . 47 CYS C 1 1 17 12129 1 1 47 CYS CA C -8.167 8.975 -10.150 1.00 . A A . 47 CYS CA 1 1 17 12130 1 1 47 CYS CB C -8.142 7.434 -10.264 1.00 . A A . 47 CYS CB 1 1 17 12131 1 1 47 CYS H H -7.766 10.057 -8.383 1.00 . A A . 47 CYS H 1 1 17 12132 1 1 47 CYS HA H -7.759 9.388 -11.055 1.00 . A A . 47 CYS HA 1 1 17 12133 1 1 47 CYS HB2 H -8.233 7.167 -11.305 1.00 . A A . 47 CYS HB2 1 1 17 12134 1 1 47 CYS HB3 H -7.186 7.081 -9.901 1.00 . A A . 47 CYS HB3 1 1 17 12135 1 1 47 CYS N N -7.345 9.482 -9.055 1.00 . A A . 47 CYS N 1 1 17 12136 1 1 47 CYS O O -9.837 10.201 -8.976 1.00 . A A . 47 CYS O 1 1 17 12137 1 1 47 CYS OXT O -10.419 9.261 -10.884 1.00 . A A . 47 CYS OXT 1 1 17 12138 1 1 47 CYS SG S -9.440 6.518 -9.366 1.00 . A A . 47 CYS SG 1 1 18 12139 1 1 1 ALA C C -7.497 12.091 -6.642 1.00 . A A . 1 ALA C 1 1 18 12140 1 1 1 ALA CA C -8.465 12.884 -7.505 1.00 . A A . 1 ALA CA 1 1 18 12141 1 1 1 ALA CB C -9.384 11.955 -8.286 1.00 . A A . 1 ALA CB 1 1 18 12142 1 1 1 ALA H1 H -8.288 14.603 -8.664 1.00 . A A . 1 ALA H1 1 1 18 12143 1 1 1 ALA H2 H -7.493 13.252 -9.311 1.00 . A A . 1 ALA H2 1 1 18 12144 1 1 1 ALA H3 H -6.833 14.071 -7.985 1.00 . A A . 1 ALA H3 1 1 18 12145 1 1 1 ALA HA H -9.072 13.497 -6.864 1.00 . A A . 1 ALA HA 1 1 18 12146 1 1 1 ALA HB1 H -8.790 11.238 -8.833 1.00 . A A . 1 ALA HB1 1 1 18 12147 1 1 1 ALA HB2 H -9.978 12.533 -8.977 1.00 . A A . 1 ALA HB2 1 1 18 12148 1 1 1 ALA HB3 H -10.036 11.433 -7.600 1.00 . A A . 1 ALA HB3 1 1 18 12149 1 1 1 ALA N N -7.722 13.768 -8.427 1.00 . A A . 1 ALA N 1 1 18 12150 1 1 1 ALA O O -6.334 12.472 -6.503 1.00 . A A . 1 ALA O 1 1 18 12151 1 1 2 THR C C -7.608 8.698 -5.330 1.00 . A A . 2 THR C 1 1 18 12152 1 1 2 THR CA C -7.149 10.148 -5.225 1.00 . A A . 2 THR CA 1 1 18 12153 1 1 2 THR CB C -7.202 10.605 -3.752 1.00 . A A . 2 THR CB 1 1 18 12154 1 1 2 THR CG2 C -6.199 9.832 -2.906 1.00 . A A . 2 THR CG2 1 1 18 12155 1 1 2 THR H H -8.908 10.744 -6.224 1.00 . A A . 2 THR H 1 1 18 12156 1 1 2 THR HA H -6.128 10.221 -5.571 1.00 . A A . 2 THR HA 1 1 18 12157 1 1 2 THR HB H -8.195 10.421 -3.367 1.00 . A A . 2 THR HB 1 1 18 12158 1 1 2 THR HG1 H -6.233 12.231 -4.309 1.00 . A A . 2 THR HG1 1 1 18 12159 1 1 2 THR HG21 H -5.450 10.511 -2.526 1.00 . A A . 2 THR HG21 1 1 18 12160 1 1 2 THR HG22 H -5.724 9.075 -3.512 1.00 . A A . 2 THR HG22 1 1 18 12161 1 1 2 THR HG23 H -6.712 9.363 -2.079 1.00 . A A . 2 THR HG23 1 1 18 12162 1 1 2 THR N N -7.974 10.995 -6.071 1.00 . A A . 2 THR N 1 1 18 12163 1 1 2 THR O O -8.634 8.307 -4.768 1.00 . A A . 2 THR O 1 1 18 12164 1 1 2 THR OG1 O -6.917 12.007 -3.669 1.00 . A A . 2 THR OG1 1 1 18 12165 1 1 3 CYS C C -6.335 5.652 -5.323 1.00 . A A . 3 CYS C 1 1 18 12166 1 1 3 CYS CA C -7.140 6.515 -6.278 1.00 . A A . 3 CYS CA 1 1 18 12167 1 1 3 CYS CB C -6.834 6.140 -7.730 1.00 . A A . 3 CYS CB 1 1 18 12168 1 1 3 CYS H H -6.044 8.297 -6.487 1.00 . A A . 3 CYS H 1 1 18 12169 1 1 3 CYS HA H -8.192 6.362 -6.088 1.00 . A A . 3 CYS HA 1 1 18 12170 1 1 3 CYS HB2 H -5.833 6.468 -7.973 1.00 . A A . 3 CYS HB2 1 1 18 12171 1 1 3 CYS HB3 H -6.893 5.068 -7.841 1.00 . A A . 3 CYS HB3 1 1 18 12172 1 1 3 CYS N N -6.844 7.916 -6.065 1.00 . A A . 3 CYS N 1 1 18 12173 1 1 3 CYS O O -5.200 5.987 -4.985 1.00 . A A . 3 CYS O 1 1 18 12174 1 1 3 CYS SG S -7.968 6.898 -8.940 1.00 . A A . 3 CYS SG 1 1 18 12175 1 1 4 LYS C C -6.680 2.207 -4.178 1.00 . A A . 4 LYS C 1 1 18 12176 1 1 4 LYS CA C -6.230 3.645 -3.981 1.00 . A A . 4 LYS CA 1 1 18 12177 1 1 4 LYS CB C -6.416 4.067 -2.519 1.00 . A A . 4 LYS CB 1 1 18 12178 1 1 4 LYS CD C -7.930 4.444 -0.565 1.00 . A A . 4 LYS CD 1 1 18 12179 1 1 4 LYS CE C -9.368 4.462 -0.068 1.00 . A A . 4 LYS CE 1 1 18 12180 1 1 4 LYS CG C -7.853 4.063 -2.034 1.00 . A A . 4 LYS CG 1 1 18 12181 1 1 4 LYS H H -7.820 4.322 -5.196 1.00 . A A . 4 LYS H 1 1 18 12182 1 1 4 LYS HA H -5.176 3.698 -4.217 1.00 . A A . 4 LYS HA 1 1 18 12183 1 1 4 LYS HB2 H -5.852 3.394 -1.892 1.00 . A A . 4 LYS HB2 1 1 18 12184 1 1 4 LYS HB3 H -6.023 5.066 -2.397 1.00 . A A . 4 LYS HB3 1 1 18 12185 1 1 4 LYS HD2 H -7.365 3.724 0.013 1.00 . A A . 4 LYS HD2 1 1 18 12186 1 1 4 LYS HD3 H -7.499 5.426 -0.436 1.00 . A A . 4 LYS HD3 1 1 18 12187 1 1 4 LYS HE2 H -9.783 3.471 -0.172 1.00 . A A . 4 LYS HE2 1 1 18 12188 1 1 4 LYS HE3 H -9.371 4.745 0.975 1.00 . A A . 4 LYS HE3 1 1 18 12189 1 1 4 LYS HG2 H -8.424 4.774 -2.612 1.00 . A A . 4 LYS HG2 1 1 18 12190 1 1 4 LYS HG3 H -8.266 3.073 -2.163 1.00 . A A . 4 LYS HG3 1 1 18 12191 1 1 4 LYS HZ1 H -9.619 5.989 -1.474 1.00 . A A . 4 LYS HZ1 1 1 18 12192 1 1 4 LYS HZ2 H -10.707 6.064 -0.181 1.00 . A A . 4 LYS HZ2 1 1 18 12193 1 1 4 LYS HZ3 H -10.918 4.907 -1.397 1.00 . A A . 4 LYS HZ3 1 1 18 12194 1 1 4 LYS N N -6.916 4.544 -4.891 1.00 . A A . 4 LYS N 1 1 18 12195 1 1 4 LYS NZ N -10.212 5.423 -0.833 1.00 . A A . 4 LYS NZ 1 1 18 12196 1 1 4 LYS O O -7.864 1.928 -4.366 1.00 . A A . 4 LYS O 1 1 18 12197 1 1 5 ALA C C -4.720 -0.848 -3.739 1.00 . A A . 5 ALA C 1 1 18 12198 1 1 5 ALA CA C -5.924 -0.111 -4.297 1.00 . A A . 5 ALA CA 1 1 18 12199 1 1 5 ALA CB C -6.136 -0.461 -5.764 1.00 . A A . 5 ALA CB 1 1 18 12200 1 1 5 ALA H H -4.788 1.634 -3.977 1.00 . A A . 5 ALA H 1 1 18 12201 1 1 5 ALA HA H -6.806 -0.392 -3.739 1.00 . A A . 5 ALA HA 1 1 18 12202 1 1 5 ALA HB1 H -5.292 -1.032 -6.124 1.00 . A A . 5 ALA HB1 1 1 18 12203 1 1 5 ALA HB2 H -6.228 0.448 -6.340 1.00 . A A . 5 ALA HB2 1 1 18 12204 1 1 5 ALA HB3 H -7.037 -1.046 -5.868 1.00 . A A . 5 ALA HB3 1 1 18 12205 1 1 5 ALA N N -5.708 1.315 -4.131 1.00 . A A . 5 ALA N 1 1 18 12206 1 1 5 ALA O O -3.615 -0.308 -3.744 1.00 . A A . 5 ALA O 1 1 18 12207 1 1 6 GLU C C -2.789 -3.138 -3.715 1.00 . A A . 6 GLU C 1 1 18 12208 1 1 6 GLU CA C -3.843 -2.828 -2.661 1.00 . A A . 6 GLU CA 1 1 18 12209 1 1 6 GLU CB C -4.367 -4.122 -2.037 1.00 . A A . 6 GLU CB 1 1 18 12210 1 1 6 GLU CD C -6.127 -5.167 -0.572 1.00 . A A . 6 GLU CD 1 1 18 12211 1 1 6 GLU CG C -5.755 -3.985 -1.434 1.00 . A A . 6 GLU CG 1 1 18 12212 1 1 6 GLU H H -5.829 -2.428 -3.241 1.00 . A A . 6 GLU H 1 1 18 12213 1 1 6 GLU HA H -3.387 -2.228 -1.887 1.00 . A A . 6 GLU HA 1 1 18 12214 1 1 6 GLU HB2 H -4.395 -4.893 -2.791 1.00 . A A . 6 GLU HB2 1 1 18 12215 1 1 6 GLU HB3 H -3.690 -4.427 -1.253 1.00 . A A . 6 GLU HB3 1 1 18 12216 1 1 6 GLU HG2 H -5.784 -3.093 -0.825 1.00 . A A . 6 GLU HG2 1 1 18 12217 1 1 6 GLU HG3 H -6.476 -3.898 -2.234 1.00 . A A . 6 GLU HG3 1 1 18 12218 1 1 6 GLU N N -4.929 -2.053 -3.237 1.00 . A A . 6 GLU N 1 1 18 12219 1 1 6 GLU O O -3.114 -3.365 -4.883 1.00 . A A . 6 GLU O 1 1 18 12220 1 1 6 GLU OE1 O -5.927 -6.315 -1.021 1.00 . A A . 6 GLU OE1 1 1 18 12221 1 1 6 GLU OE2 O -6.614 -4.952 0.558 1.00 . A A . 6 GLU OE2 1 1 18 12222 1 1 7 CYS C C -0.592 -4.748 -4.863 1.00 . A A . 7 CYS C 1 1 18 12223 1 1 7 CYS CA C -0.412 -3.391 -4.189 1.00 . A A . 7 CYS CA 1 1 18 12224 1 1 7 CYS CB C 0.915 -3.355 -3.417 1.00 . A A . 7 CYS CB 1 1 18 12225 1 1 7 CYS H H -1.357 -2.920 -2.351 1.00 . A A . 7 CYS H 1 1 18 12226 1 1 7 CYS HA H -0.403 -2.622 -4.947 1.00 . A A . 7 CYS HA 1 1 18 12227 1 1 7 CYS HB2 H 0.963 -2.442 -2.842 1.00 . A A . 7 CYS HB2 1 1 18 12228 1 1 7 CYS HB3 H 0.954 -4.199 -2.744 1.00 . A A . 7 CYS HB3 1 1 18 12229 1 1 7 CYS N N -1.533 -3.124 -3.293 1.00 . A A . 7 CYS N 1 1 18 12230 1 1 7 CYS O O -0.857 -5.747 -4.195 1.00 . A A . 7 CYS O 1 1 18 12231 1 1 7 CYS SG S 2.403 -3.419 -4.477 1.00 . A A . 7 CYS SG 1 1 18 12232 1 1 8 PRO C C 0.233 -7.164 -6.468 1.00 . A A . 8 PRO C 1 1 18 12233 1 1 8 PRO CA C -0.638 -6.024 -6.983 1.00 . A A . 8 PRO CA 1 1 18 12234 1 1 8 PRO CB C -0.213 -5.624 -8.406 1.00 . A A . 8 PRO CB 1 1 18 12235 1 1 8 PRO CD C -0.182 -3.642 -7.066 1.00 . A A . 8 PRO CD 1 1 18 12236 1 1 8 PRO CG C 0.433 -4.283 -8.275 1.00 . A A . 8 PRO CG 1 1 18 12237 1 1 8 PRO HA H -1.670 -6.343 -6.992 1.00 . A A . 8 PRO HA 1 1 18 12238 1 1 8 PRO HB2 H 0.480 -6.357 -8.792 1.00 . A A . 8 PRO HB2 1 1 18 12239 1 1 8 PRO HB3 H -1.084 -5.579 -9.042 1.00 . A A . 8 PRO HB3 1 1 18 12240 1 1 8 PRO HD2 H 0.521 -2.969 -6.595 1.00 . A A . 8 PRO HD2 1 1 18 12241 1 1 8 PRO HD3 H -1.089 -3.121 -7.333 1.00 . A A . 8 PRO HD3 1 1 18 12242 1 1 8 PRO HG2 H 1.498 -4.399 -8.136 1.00 . A A . 8 PRO HG2 1 1 18 12243 1 1 8 PRO HG3 H 0.231 -3.691 -9.156 1.00 . A A . 8 PRO HG3 1 1 18 12244 1 1 8 PRO N N -0.470 -4.793 -6.203 1.00 . A A . 8 PRO N 1 1 18 12245 1 1 8 PRO O O -0.208 -8.308 -6.381 1.00 . A A . 8 PRO O 1 1 18 12246 1 1 9 THR C C 2.344 -7.868 -4.072 1.00 . A A . 9 THR C 1 1 18 12247 1 1 9 THR CA C 2.389 -7.839 -5.596 1.00 . A A . 9 THR CA 1 1 18 12248 1 1 9 THR CB C 3.832 -7.566 -6.067 1.00 . A A . 9 THR CB 1 1 18 12249 1 1 9 THR CG2 C 3.967 -7.801 -7.564 1.00 . A A . 9 THR CG2 1 1 18 12250 1 1 9 THR H H 1.761 -5.915 -6.194 1.00 . A A . 9 THR H 1 1 18 12251 1 1 9 THR HA H 2.085 -8.804 -5.975 1.00 . A A . 9 THR HA 1 1 18 12252 1 1 9 THR HB H 4.496 -8.244 -5.551 1.00 . A A . 9 THR HB 1 1 18 12253 1 1 9 THR HG1 H 3.731 -5.927 -4.962 1.00 . A A . 9 THR HG1 1 1 18 12254 1 1 9 THR HG21 H 4.114 -8.854 -7.753 1.00 . A A . 9 THR HG21 1 1 18 12255 1 1 9 THR HG22 H 4.814 -7.247 -7.940 1.00 . A A . 9 THR HG22 1 1 18 12256 1 1 9 THR HG23 H 3.069 -7.467 -8.063 1.00 . A A . 9 THR HG23 1 1 18 12257 1 1 9 THR N N 1.468 -6.844 -6.115 1.00 . A A . 9 THR N 1 1 18 12258 1 1 9 THR O O 3.381 -7.790 -3.411 1.00 . A A . 9 THR O 1 1 18 12259 1 1 9 THR OG1 O 4.208 -6.216 -5.756 1.00 . A A . 9 THR OG1 1 1 18 12260 1 1 10 TRP C C -0.344 -8.675 -1.709 1.00 . A A . 10 TRP C 1 1 18 12261 1 1 10 TRP CA C 0.967 -7.989 -2.078 1.00 . A A . 10 TRP CA 1 1 18 12262 1 1 10 TRP CB C 0.982 -6.568 -1.510 1.00 . A A . 10 TRP CB 1 1 18 12263 1 1 10 TRP CD1 C 0.433 -6.890 0.972 1.00 . A A . 10 TRP CD1 1 1 18 12264 1 1 10 TRP CD2 C 2.472 -6.055 0.578 1.00 . A A . 10 TRP CD2 1 1 18 12265 1 1 10 TRP CE2 C 2.305 -6.185 1.970 1.00 . A A . 10 TRP CE2 1 1 18 12266 1 1 10 TRP CE3 C 3.679 -5.548 0.088 1.00 . A A . 10 TRP CE3 1 1 18 12267 1 1 10 TRP CG C 1.268 -6.518 -0.041 1.00 . A A . 10 TRP CG 1 1 18 12268 1 1 10 TRP CH2 C 4.471 -5.330 2.364 1.00 . A A . 10 TRP CH2 1 1 18 12269 1 1 10 TRP CZ2 C 3.304 -5.824 2.874 1.00 . A A . 10 TRP CZ2 1 1 18 12270 1 1 10 TRP CZ3 C 4.664 -5.190 0.986 1.00 . A A . 10 TRP CZ3 1 1 18 12271 1 1 10 TRP H H 0.347 -8.011 -4.098 1.00 . A A . 10 TRP H 1 1 18 12272 1 1 10 TRP HA H 1.788 -8.548 -1.653 1.00 . A A . 10 TRP HA 1 1 18 12273 1 1 10 TRP HB2 H 1.743 -5.992 -2.017 1.00 . A A . 10 TRP HB2 1 1 18 12274 1 1 10 TRP HB3 H 0.019 -6.110 -1.680 1.00 . A A . 10 TRP HB3 1 1 18 12275 1 1 10 TRP HD1 H -0.564 -7.285 0.823 1.00 . A A . 10 TRP HD1 1 1 18 12276 1 1 10 TRP HE1 H 0.656 -6.906 3.063 1.00 . A A . 10 TRP HE1 1 1 18 12277 1 1 10 TRP HE3 H 3.846 -5.433 -0.973 1.00 . A A . 10 TRP HE3 1 1 18 12278 1 1 10 TRP HH2 H 5.270 -5.036 3.029 1.00 . A A . 10 TRP HH2 1 1 18 12279 1 1 10 TRP HZ2 H 3.177 -5.924 3.941 1.00 . A A . 10 TRP HZ2 1 1 18 12280 1 1 10 TRP HZ3 H 5.602 -4.794 0.625 1.00 . A A . 10 TRP HZ3 1 1 18 12281 1 1 10 TRP N N 1.141 -7.963 -3.520 1.00 . A A . 10 TRP N 1 1 18 12282 1 1 10 TRP NE1 N 1.050 -6.701 2.185 1.00 . A A . 10 TRP NE1 1 1 18 12283 1 1 10 TRP O O -1.387 -8.416 -2.310 1.00 . A A . 10 TRP O 1 1 18 12284 1 1 11 ASP C C -1.303 -10.629 1.226 1.00 . A A . 11 ASP C 1 1 18 12285 1 1 11 ASP CA C -1.442 -10.286 -0.251 1.00 . A A . 11 ASP CA 1 1 18 12286 1 1 11 ASP CB C -1.629 -11.574 -1.069 1.00 . A A . 11 ASP CB 1 1 18 12287 1 1 11 ASP CG C -0.399 -12.473 -1.062 1.00 . A A . 11 ASP CG 1 1 18 12288 1 1 11 ASP H H 0.589 -9.706 -0.290 1.00 . A A . 11 ASP H 1 1 18 12289 1 1 11 ASP HA H -2.309 -9.656 -0.383 1.00 . A A . 11 ASP HA 1 1 18 12290 1 1 11 ASP HB2 H -2.458 -12.132 -0.661 1.00 . A A . 11 ASP HB2 1 1 18 12291 1 1 11 ASP HB3 H -1.851 -11.309 -2.093 1.00 . A A . 11 ASP HB3 1 1 18 12292 1 1 11 ASP N N -0.275 -9.548 -0.719 1.00 . A A . 11 ASP N 1 1 18 12293 1 1 11 ASP O O -2.296 -10.799 1.936 1.00 . A A . 11 ASP O 1 1 18 12294 1 1 11 ASP OD1 O 0.004 -12.936 0.028 1.00 . A A . 11 ASP OD1 1 1 18 12295 1 1 11 ASP OD2 O 0.164 -12.708 -2.148 1.00 . A A . 11 ASP OD2 1 1 18 12296 1 1 12 SER C C -0.009 -9.988 4.018 1.00 . A A . 12 SER C 1 1 18 12297 1 1 12 SER CA C 0.255 -11.126 3.031 1.00 . A A . 12 SER CA 1 1 18 12298 1 1 12 SER CB C 1.714 -11.567 3.107 1.00 . A A . 12 SER CB 1 1 18 12299 1 1 12 SER H H 0.673 -10.639 1.031 1.00 . A A . 12 SER H 1 1 18 12300 1 1 12 SER HA H -0.371 -11.964 3.298 1.00 . A A . 12 SER HA 1 1 18 12301 1 1 12 SER HB2 H 2.355 -10.715 2.938 1.00 . A A . 12 SER HB2 1 1 18 12302 1 1 12 SER HB3 H 1.913 -11.979 4.086 1.00 . A A . 12 SER HB3 1 1 18 12303 1 1 12 SER HG H 1.228 -12.666 1.539 1.00 . A A . 12 SER HG 1 1 18 12304 1 1 12 SER N N -0.060 -10.762 1.662 1.00 . A A . 12 SER N 1 1 18 12305 1 1 12 SER O O -0.363 -8.869 3.634 1.00 . A A . 12 SER O 1 1 18 12306 1 1 12 SER OG O 1.996 -12.555 2.128 1.00 . A A . 12 SER OG 1 1 18 12307 1 1 13 VAL C C 1.134 -8.373 6.484 1.00 . A A . 13 VAL C 1 1 18 12308 1 1 13 VAL CA C -0.045 -9.336 6.366 1.00 . A A . 13 VAL CA 1 1 18 12309 1 1 13 VAL CB C -0.255 -10.063 7.715 1.00 . A A . 13 VAL CB 1 1 18 12310 1 1 13 VAL CG1 C -0.416 -9.073 8.858 1.00 . A A . 13 VAL CG1 1 1 18 12311 1 1 13 VAL CG2 C -1.460 -10.989 7.636 1.00 . A A . 13 VAL CG2 1 1 18 12312 1 1 13 VAL H H 0.451 -11.204 5.528 1.00 . A A . 13 VAL H 1 1 18 12313 1 1 13 VAL HA H -0.940 -8.774 6.139 1.00 . A A . 13 VAL HA 1 1 18 12314 1 1 13 VAL HB H 0.619 -10.666 7.914 1.00 . A A . 13 VAL HB 1 1 18 12315 1 1 13 VAL HG11 H 0.490 -9.052 9.446 1.00 . A A . 13 VAL HG11 1 1 18 12316 1 1 13 VAL HG12 H -1.243 -9.375 9.482 1.00 . A A . 13 VAL HG12 1 1 18 12317 1 1 13 VAL HG13 H -0.607 -8.088 8.457 1.00 . A A . 13 VAL HG13 1 1 18 12318 1 1 13 VAL HG21 H -1.135 -11.978 7.348 1.00 . A A . 13 VAL HG21 1 1 18 12319 1 1 13 VAL HG22 H -2.156 -10.612 6.901 1.00 . A A . 13 VAL HG22 1 1 18 12320 1 1 13 VAL HG23 H -1.943 -11.035 8.600 1.00 . A A . 13 VAL HG23 1 1 18 12321 1 1 13 VAL N N 0.169 -10.296 5.296 1.00 . A A . 13 VAL N 1 1 18 12322 1 1 13 VAL O O 2.285 -8.790 6.603 1.00 . A A . 13 VAL O 1 1 18 12323 1 1 14 CYS C C 2.332 -5.887 7.990 1.00 . A A . 14 CYS C 1 1 18 12324 1 1 14 CYS CA C 1.839 -6.042 6.554 1.00 . A A . 14 CYS CA 1 1 18 12325 1 1 14 CYS CB C 1.269 -4.713 6.055 1.00 . A A . 14 CYS CB 1 1 18 12326 1 1 14 CYS H H -0.113 -6.824 6.350 1.00 . A A . 14 CYS H 1 1 18 12327 1 1 14 CYS HA H 2.672 -6.322 5.928 1.00 . A A . 14 CYS HA 1 1 18 12328 1 1 14 CYS HB2 H 1.454 -4.626 4.994 1.00 . A A . 14 CYS HB2 1 1 18 12329 1 1 14 CYS HB3 H 0.203 -4.700 6.231 1.00 . A A . 14 CYS HB3 1 1 18 12330 1 1 14 CYS N N 0.828 -7.084 6.448 1.00 . A A . 14 CYS N 1 1 18 12331 1 1 14 CYS O O 1.543 -5.902 8.936 1.00 . A A . 14 CYS O 1 1 18 12332 1 1 14 CYS SG S 1.982 -3.244 6.863 1.00 . A A . 14 CYS SG 1 1 18 12333 1 1 15 ILE C C 4.496 -4.076 9.741 1.00 . A A . 15 ILE C 1 1 18 12334 1 1 15 ILE CA C 4.239 -5.556 9.458 1.00 . A A . 15 ILE CA 1 1 18 12335 1 1 15 ILE CB C 5.564 -6.342 9.575 1.00 . A A . 15 ILE CB 1 1 18 12336 1 1 15 ILE CD1 C 6.601 -8.646 9.218 1.00 . A A . 15 ILE CD1 1 1 18 12337 1 1 15 ILE CG1 C 5.335 -7.818 9.233 1.00 . A A . 15 ILE CG1 1 1 18 12338 1 1 15 ILE CG2 C 6.147 -6.203 10.977 1.00 . A A . 15 ILE CG2 1 1 18 12339 1 1 15 ILE H H 4.213 -5.718 7.352 1.00 . A A . 15 ILE H 1 1 18 12340 1 1 15 ILE HA H 3.547 -5.940 10.194 1.00 . A A . 15 ILE HA 1 1 18 12341 1 1 15 ILE HB H 6.271 -5.923 8.874 1.00 . A A . 15 ILE HB 1 1 18 12342 1 1 15 ILE HD11 H 6.435 -9.568 9.755 1.00 . A A . 15 ILE HD11 1 1 18 12343 1 1 15 ILE HD12 H 7.399 -8.093 9.690 1.00 . A A . 15 ILE HD12 1 1 18 12344 1 1 15 ILE HD13 H 6.873 -8.869 8.196 1.00 . A A . 15 ILE HD13 1 1 18 12345 1 1 15 ILE HG12 H 4.668 -8.248 9.965 1.00 . A A . 15 ILE HG12 1 1 18 12346 1 1 15 ILE HG13 H 4.880 -7.886 8.255 1.00 . A A . 15 ILE HG13 1 1 18 12347 1 1 15 ILE HG21 H 7.188 -6.493 10.966 1.00 . A A . 15 ILE HG21 1 1 18 12348 1 1 15 ILE HG22 H 5.604 -6.842 11.658 1.00 . A A . 15 ILE HG22 1 1 18 12349 1 1 15 ILE HG23 H 6.063 -5.177 11.302 1.00 . A A . 15 ILE HG23 1 1 18 12350 1 1 15 ILE N N 3.639 -5.727 8.143 1.00 . A A . 15 ILE N 1 1 18 12351 1 1 15 ILE O O 4.303 -3.602 10.860 1.00 . A A . 15 ILE O 1 1 18 12352 1 1 16 ASN C C 4.821 -1.180 7.576 1.00 . A A . 16 ASN C 1 1 18 12353 1 1 16 ASN CA C 5.201 -1.923 8.855 1.00 . A A . 16 ASN CA 1 1 18 12354 1 1 16 ASN CB C 6.681 -1.704 9.199 1.00 . A A . 16 ASN CB 1 1 18 12355 1 1 16 ASN CG C 7.028 -0.240 9.399 1.00 . A A . 16 ASN CG 1 1 18 12356 1 1 16 ASN H H 5.046 -3.774 7.846 1.00 . A A . 16 ASN H 1 1 18 12357 1 1 16 ASN HA H 4.594 -1.548 9.666 1.00 . A A . 16 ASN HA 1 1 18 12358 1 1 16 ASN HB2 H 6.914 -2.236 10.109 1.00 . A A . 16 ASN HB2 1 1 18 12359 1 1 16 ASN HB3 H 7.291 -2.093 8.396 1.00 . A A . 16 ASN HB3 1 1 18 12360 1 1 16 ASN HD21 H 8.719 -0.471 8.390 1.00 . A A . 16 ASN HD21 1 1 18 12361 1 1 16 ASN HD22 H 8.417 1.116 9.002 1.00 . A A . 16 ASN HD22 1 1 18 12362 1 1 16 ASN N N 4.922 -3.348 8.717 1.00 . A A . 16 ASN N 1 1 18 12363 1 1 16 ASN ND2 N 8.168 0.177 8.873 1.00 . A A . 16 ASN ND2 1 1 18 12364 1 1 16 ASN O O 4.728 -1.784 6.507 1.00 . A A . 16 ASN O 1 1 18 12365 1 1 16 ASN OD1 O 6.285 0.506 10.031 1.00 . A A . 16 ASN OD1 1 1 18 12366 1 1 17 LYS C C 5.261 1.037 5.490 1.00 . A A . 17 LYS C 1 1 18 12367 1 1 17 LYS CA C 4.172 0.951 6.565 1.00 . A A . 17 LYS CA 1 1 18 12368 1 1 17 LYS CB C 3.804 2.361 7.047 1.00 . A A . 17 LYS CB 1 1 18 12369 1 1 17 LYS CD C 2.796 4.611 6.526 1.00 . A A . 17 LYS CD 1 1 18 12370 1 1 17 LYS CE C 1.881 5.393 5.587 1.00 . A A . 17 LYS CE 1 1 18 12371 1 1 17 LYS CG C 3.108 3.217 5.994 1.00 . A A . 17 LYS CG 1 1 18 12372 1 1 17 LYS H H 4.650 0.533 8.587 1.00 . A A . 17 LYS H 1 1 18 12373 1 1 17 LYS HA H 3.296 0.499 6.126 1.00 . A A . 17 LYS HA 1 1 18 12374 1 1 17 LYS HB2 H 3.145 2.275 7.899 1.00 . A A . 17 LYS HB2 1 1 18 12375 1 1 17 LYS HB3 H 4.706 2.869 7.352 1.00 . A A . 17 LYS HB3 1 1 18 12376 1 1 17 LYS HD2 H 2.310 4.517 7.486 1.00 . A A . 17 LYS HD2 1 1 18 12377 1 1 17 LYS HD3 H 3.723 5.153 6.643 1.00 . A A . 17 LYS HD3 1 1 18 12378 1 1 17 LYS HE2 H 0.952 4.854 5.483 1.00 . A A . 17 LYS HE2 1 1 18 12379 1 1 17 LYS HE3 H 1.686 6.362 6.023 1.00 . A A . 17 LYS HE3 1 1 18 12380 1 1 17 LYS HG2 H 3.755 3.307 5.133 1.00 . A A . 17 LYS HG2 1 1 18 12381 1 1 17 LYS HG3 H 2.186 2.738 5.704 1.00 . A A . 17 LYS HG3 1 1 18 12382 1 1 17 LYS HZ1 H 2.463 4.680 3.712 1.00 . A A . 17 LYS HZ1 1 1 18 12383 1 1 17 LYS HZ2 H 3.459 5.906 4.318 1.00 . A A . 17 LYS HZ2 1 1 18 12384 1 1 17 LYS HZ3 H 1.932 6.291 3.690 1.00 . A A . 17 LYS HZ3 1 1 18 12385 1 1 17 LYS N N 4.575 0.120 7.698 1.00 . A A . 17 LYS N 1 1 18 12386 1 1 17 LYS NZ N 2.479 5.581 4.238 1.00 . A A . 17 LYS NZ 1 1 18 12387 1 1 17 LYS O O 4.948 1.141 4.307 1.00 . A A . 17 LYS O 1 1 18 12388 1 1 18 LYS C C 7.537 0.099 3.805 1.00 . A A . 18 LYS C 1 1 18 12389 1 1 18 LYS CA C 7.655 1.114 4.958 1.00 . A A . 18 LYS CA 1 1 18 12390 1 1 18 LYS CB C 9.002 0.963 5.679 1.00 . A A . 18 LYS CB 1 1 18 12391 1 1 18 LYS CD C 11.516 1.024 5.518 1.00 . A A . 18 LYS CD 1 1 18 12392 1 1 18 LYS CE C 12.707 1.236 4.595 1.00 . A A . 18 LYS CE 1 1 18 12393 1 1 18 LYS CG C 10.202 1.161 4.764 1.00 . A A . 18 LYS CG 1 1 18 12394 1 1 18 LYS H H 6.718 0.944 6.862 1.00 . A A . 18 LYS H 1 1 18 12395 1 1 18 LYS HA H 7.613 2.105 4.529 1.00 . A A . 18 LYS HA 1 1 18 12396 1 1 18 LYS HB2 H 9.057 1.692 6.473 1.00 . A A . 18 LYS HB2 1 1 18 12397 1 1 18 LYS HB3 H 9.061 -0.028 6.106 1.00 . A A . 18 LYS HB3 1 1 18 12398 1 1 18 LYS HD2 H 11.547 1.763 6.305 1.00 . A A . 18 LYS HD2 1 1 18 12399 1 1 18 LYS HD3 H 11.574 0.034 5.946 1.00 . A A . 18 LYS HD3 1 1 18 12400 1 1 18 LYS HE2 H 12.671 0.498 3.808 1.00 . A A . 18 LYS HE2 1 1 18 12401 1 1 18 LYS HE3 H 12.641 2.224 4.165 1.00 . A A . 18 LYS HE3 1 1 18 12402 1 1 18 LYS HG2 H 10.171 0.417 3.982 1.00 . A A . 18 LYS HG2 1 1 18 12403 1 1 18 LYS HG3 H 10.149 2.147 4.327 1.00 . A A . 18 LYS HG3 1 1 18 12404 1 1 18 LYS HZ1 H 14.130 0.132 5.654 1.00 . A A . 18 LYS HZ1 1 1 18 12405 1 1 18 LYS HZ2 H 14.022 1.750 6.136 1.00 . A A . 18 LYS HZ2 1 1 18 12406 1 1 18 LYS HZ3 H 14.791 1.350 4.683 1.00 . A A . 18 LYS HZ3 1 1 18 12407 1 1 18 LYS N N 6.532 1.014 5.904 1.00 . A A . 18 LYS N 1 1 18 12408 1 1 18 LYS NZ N 14.003 1.108 5.318 1.00 . A A . 18 LYS NZ 1 1 18 12409 1 1 18 LYS O O 7.514 0.504 2.643 1.00 . A A . 18 LYS O 1 1 18 12410 1 1 19 PRO C C 6.172 -1.951 2.085 1.00 . A A . 19 PRO C 1 1 18 12411 1 1 19 PRO CA C 7.325 -2.253 3.039 1.00 . A A . 19 PRO CA 1 1 18 12412 1 1 19 PRO CB C 7.024 -3.528 3.829 1.00 . A A . 19 PRO CB 1 1 18 12413 1 1 19 PRO CD C 7.483 -1.837 5.435 1.00 . A A . 19 PRO CD 1 1 18 12414 1 1 19 PRO CG C 7.660 -3.301 5.151 1.00 . A A . 19 PRO CG 1 1 18 12415 1 1 19 PRO HA H 8.241 -2.373 2.479 1.00 . A A . 19 PRO HA 1 1 18 12416 1 1 19 PRO HB2 H 5.954 -3.650 3.921 1.00 . A A . 19 PRO HB2 1 1 18 12417 1 1 19 PRO HB3 H 7.446 -4.384 3.326 1.00 . A A . 19 PRO HB3 1 1 18 12418 1 1 19 PRO HD2 H 6.553 -1.664 5.956 1.00 . A A . 19 PRO HD2 1 1 18 12419 1 1 19 PRO HD3 H 8.315 -1.461 6.010 1.00 . A A . 19 PRO HD3 1 1 18 12420 1 1 19 PRO HG2 H 7.164 -3.894 5.906 1.00 . A A . 19 PRO HG2 1 1 18 12421 1 1 19 PRO HG3 H 8.710 -3.550 5.104 1.00 . A A . 19 PRO HG3 1 1 18 12422 1 1 19 PRO N N 7.455 -1.227 4.090 1.00 . A A . 19 PRO N 1 1 18 12423 1 1 19 PRO O O 6.285 -2.125 0.867 1.00 . A A . 19 PRO O 1 1 18 12424 1 1 20 CYS C C 4.191 0.004 0.927 1.00 . A A . 20 CYS C 1 1 18 12425 1 1 20 CYS CA C 3.885 -1.143 1.888 1.00 . A A . 20 CYS CA 1 1 18 12426 1 1 20 CYS CB C 2.746 -0.760 2.837 1.00 . A A . 20 CYS CB 1 1 18 12427 1 1 20 CYS H H 5.055 -1.365 3.629 1.00 . A A . 20 CYS H 1 1 18 12428 1 1 20 CYS HA H 3.593 -2.011 1.317 1.00 . A A . 20 CYS HA 1 1 18 12429 1 1 20 CYS HB2 H 2.568 -1.577 3.518 1.00 . A A . 20 CYS HB2 1 1 18 12430 1 1 20 CYS HB3 H 3.038 0.114 3.401 1.00 . A A . 20 CYS HB3 1 1 18 12431 1 1 20 CYS N N 5.069 -1.488 2.657 1.00 . A A . 20 CYS N 1 1 18 12432 1 1 20 CYS O O 3.902 -0.080 -0.267 1.00 . A A . 20 CYS O 1 1 18 12433 1 1 20 CYS SG S 1.169 -0.382 2.011 1.00 . A A . 20 CYS SG 1 1 18 12434 1 1 21 VAL C C 6.082 1.814 -0.506 1.00 . A A . 21 VAL C 1 1 18 12435 1 1 21 VAL CA C 5.165 2.223 0.642 1.00 . A A . 21 VAL CA 1 1 18 12436 1 1 21 VAL CB C 5.857 3.317 1.487 1.00 . A A . 21 VAL CB 1 1 18 12437 1 1 21 VAL CG1 C 6.255 4.505 0.622 1.00 . A A . 21 VAL CG1 1 1 18 12438 1 1 21 VAL CG2 C 4.953 3.769 2.622 1.00 . A A . 21 VAL CG2 1 1 18 12439 1 1 21 VAL H H 5.024 1.061 2.409 1.00 . A A . 21 VAL H 1 1 18 12440 1 1 21 VAL HA H 4.254 2.638 0.228 1.00 . A A . 21 VAL HA 1 1 18 12441 1 1 21 VAL HB H 6.755 2.897 1.917 1.00 . A A . 21 VAL HB 1 1 18 12442 1 1 21 VAL HG11 H 5.386 4.875 0.099 1.00 . A A . 21 VAL HG11 1 1 18 12443 1 1 21 VAL HG12 H 7.001 4.195 -0.094 1.00 . A A . 21 VAL HG12 1 1 18 12444 1 1 21 VAL HG13 H 6.659 5.287 1.248 1.00 . A A . 21 VAL HG13 1 1 18 12445 1 1 21 VAL HG21 H 4.297 2.959 2.904 1.00 . A A . 21 VAL HG21 1 1 18 12446 1 1 21 VAL HG22 H 4.363 4.614 2.298 1.00 . A A . 21 VAL HG22 1 1 18 12447 1 1 21 VAL HG23 H 5.556 4.056 3.471 1.00 . A A . 21 VAL HG23 1 1 18 12448 1 1 21 VAL N N 4.801 1.064 1.452 1.00 . A A . 21 VAL N 1 1 18 12449 1 1 21 VAL O O 5.955 2.322 -1.619 1.00 . A A . 21 VAL O 1 1 18 12450 1 1 22 ALA C C 7.151 -0.282 -2.383 1.00 . A A . 22 ALA C 1 1 18 12451 1 1 22 ALA CA C 7.915 0.401 -1.251 1.00 . A A . 22 ALA CA 1 1 18 12452 1 1 22 ALA CB C 8.929 -0.553 -0.637 1.00 . A A . 22 ALA CB 1 1 18 12453 1 1 22 ALA H H 7.036 0.512 0.675 1.00 . A A . 22 ALA H 1 1 18 12454 1 1 22 ALA HA H 8.448 1.252 -1.651 1.00 . A A . 22 ALA HA 1 1 18 12455 1 1 22 ALA HB1 H 9.429 -1.100 -1.422 1.00 . A A . 22 ALA HB1 1 1 18 12456 1 1 22 ALA HB2 H 8.420 -1.246 0.017 1.00 . A A . 22 ALA HB2 1 1 18 12457 1 1 22 ALA HB3 H 9.656 0.010 -0.070 1.00 . A A . 22 ALA HB3 1 1 18 12458 1 1 22 ALA N N 6.991 0.887 -0.234 1.00 . A A . 22 ALA N 1 1 18 12459 1 1 22 ALA O O 7.401 -0.020 -3.564 1.00 . A A . 22 ALA O 1 1 18 12460 1 1 23 CYS C C 4.572 -0.859 -3.803 1.00 . A A . 23 CYS C 1 1 18 12461 1 1 23 CYS CA C 5.384 -1.856 -2.985 1.00 . A A . 23 CYS CA 1 1 18 12462 1 1 23 CYS CB C 4.439 -2.828 -2.266 1.00 . A A . 23 CYS CB 1 1 18 12463 1 1 23 CYS H H 6.047 -1.293 -1.053 1.00 . A A . 23 CYS H 1 1 18 12464 1 1 23 CYS HA H 6.037 -2.409 -3.643 1.00 . A A . 23 CYS HA 1 1 18 12465 1 1 23 CYS HB2 H 4.950 -3.245 -1.413 1.00 . A A . 23 CYS HB2 1 1 18 12466 1 1 23 CYS HB3 H 3.572 -2.282 -1.924 1.00 . A A . 23 CYS HB3 1 1 18 12467 1 1 23 CYS N N 6.206 -1.143 -2.012 1.00 . A A . 23 CYS N 1 1 18 12468 1 1 23 CYS O O 4.469 -0.959 -5.025 1.00 . A A . 23 CYS O 1 1 18 12469 1 1 23 CYS SG S 3.846 -4.222 -3.291 1.00 . A A . 23 CYS SG 1 1 18 12470 1 1 24 CYS C C 4.005 2.032 -4.641 1.00 . A A . 24 CYS C 1 1 18 12471 1 1 24 CYS CA C 3.185 1.128 -3.730 1.00 . A A . 24 CYS CA 1 1 18 12472 1 1 24 CYS CB C 2.496 1.943 -2.645 1.00 . A A . 24 CYS CB 1 1 18 12473 1 1 24 CYS H H 4.119 0.118 -2.130 1.00 . A A . 24 CYS H 1 1 18 12474 1 1 24 CYS HA H 2.431 0.634 -4.323 1.00 . A A . 24 CYS HA 1 1 18 12475 1 1 24 CYS HB2 H 3.241 2.365 -1.988 1.00 . A A . 24 CYS HB2 1 1 18 12476 1 1 24 CYS HB3 H 1.927 2.738 -3.098 1.00 . A A . 24 CYS HB3 1 1 18 12477 1 1 24 CYS N N 3.999 0.102 -3.107 1.00 . A A . 24 CYS N 1 1 18 12478 1 1 24 CYS O O 3.565 2.381 -5.732 1.00 . A A . 24 CYS O 1 1 18 12479 1 1 24 CYS SG S 1.361 0.944 -1.639 1.00 . A A . 24 CYS SG 1 1 18 12480 1 1 25 LYS C C 6.444 2.630 -6.293 1.00 . A A . 25 LYS C 1 1 18 12481 1 1 25 LYS CA C 6.048 3.290 -4.976 1.00 . A A . 25 LYS CA 1 1 18 12482 1 1 25 LYS CB C 7.286 3.693 -4.169 1.00 . A A . 25 LYS CB 1 1 18 12483 1 1 25 LYS CD C 7.102 6.056 -5.053 1.00 . A A . 25 LYS CD 1 1 18 12484 1 1 25 LYS CE C 6.295 6.489 -3.833 1.00 . A A . 25 LYS CE 1 1 18 12485 1 1 25 LYS CG C 8.036 4.887 -4.747 1.00 . A A . 25 LYS CG 1 1 18 12486 1 1 25 LYS H H 5.492 2.111 -3.307 1.00 . A A . 25 LYS H 1 1 18 12487 1 1 25 LYS HA H 5.480 4.181 -5.202 1.00 . A A . 25 LYS HA 1 1 18 12488 1 1 25 LYS HB2 H 6.980 3.941 -3.164 1.00 . A A . 25 LYS HB2 1 1 18 12489 1 1 25 LYS HB3 H 7.964 2.853 -4.132 1.00 . A A . 25 LYS HB3 1 1 18 12490 1 1 25 LYS HD2 H 7.692 6.893 -5.392 1.00 . A A . 25 LYS HD2 1 1 18 12491 1 1 25 LYS HD3 H 6.419 5.758 -5.836 1.00 . A A . 25 LYS HD3 1 1 18 12492 1 1 25 LYS HE2 H 5.588 7.246 -4.138 1.00 . A A . 25 LYS HE2 1 1 18 12493 1 1 25 LYS HE3 H 5.758 5.632 -3.452 1.00 . A A . 25 LYS HE3 1 1 18 12494 1 1 25 LYS HG2 H 8.777 5.212 -4.033 1.00 . A A . 25 LYS HG2 1 1 18 12495 1 1 25 LYS HG3 H 8.525 4.582 -5.661 1.00 . A A . 25 LYS HG3 1 1 18 12496 1 1 25 LYS HZ1 H 6.583 7.627 -2.109 1.00 . A A . 25 LYS HZ1 1 1 18 12497 1 1 25 LYS HZ2 H 7.910 7.627 -3.160 1.00 . A A . 25 LYS HZ2 1 1 18 12498 1 1 25 LYS HZ3 H 7.586 6.267 -2.209 1.00 . A A . 25 LYS HZ3 1 1 18 12499 1 1 25 LYS N N 5.191 2.416 -4.192 1.00 . A A . 25 LYS N 1 1 18 12500 1 1 25 LYS NZ N 7.155 7.041 -2.752 1.00 . A A . 25 LYS NZ 1 1 18 12501 1 1 25 LYS O O 6.364 3.257 -7.349 1.00 . A A . 25 LYS O 1 1 18 12502 1 1 26 LYS C C 6.001 0.444 -8.351 1.00 . A A . 26 LYS C 1 1 18 12503 1 1 26 LYS CA C 7.223 0.642 -7.453 1.00 . A A . 26 LYS CA 1 1 18 12504 1 1 26 LYS CB C 7.868 -0.713 -7.130 1.00 . A A . 26 LYS CB 1 1 18 12505 1 1 26 LYS CD C 7.480 -3.086 -6.373 1.00 . A A . 26 LYS CD 1 1 18 12506 1 1 26 LYS CE C 6.511 -4.008 -5.655 1.00 . A A . 26 LYS CE 1 1 18 12507 1 1 26 LYS CG C 6.945 -1.666 -6.399 1.00 . A A . 26 LYS CG 1 1 18 12508 1 1 26 LYS H H 6.875 0.900 -5.372 1.00 . A A . 26 LYS H 1 1 18 12509 1 1 26 LYS HA H 7.941 1.253 -7.983 1.00 . A A . 26 LYS HA 1 1 18 12510 1 1 26 LYS HB2 H 8.175 -1.181 -8.054 1.00 . A A . 26 LYS HB2 1 1 18 12511 1 1 26 LYS HB3 H 8.740 -0.546 -6.515 1.00 . A A . 26 LYS HB3 1 1 18 12512 1 1 26 LYS HD2 H 7.613 -3.432 -7.388 1.00 . A A . 26 LYS HD2 1 1 18 12513 1 1 26 LYS HD3 H 8.428 -3.097 -5.856 1.00 . A A . 26 LYS HD3 1 1 18 12514 1 1 26 LYS HE2 H 6.505 -3.754 -4.606 1.00 . A A . 26 LYS HE2 1 1 18 12515 1 1 26 LYS HE3 H 5.522 -3.856 -6.064 1.00 . A A . 26 LYS HE3 1 1 18 12516 1 1 26 LYS HG2 H 6.826 -1.324 -5.382 1.00 . A A . 26 LYS HG2 1 1 18 12517 1 1 26 LYS HG3 H 5.984 -1.664 -6.892 1.00 . A A . 26 LYS HG3 1 1 18 12518 1 1 26 LYS HZ1 H 7.460 -5.745 -4.994 1.00 . A A . 26 LYS HZ1 1 1 18 12519 1 1 26 LYS HZ2 H 7.410 -5.588 -6.678 1.00 . A A . 26 LYS HZ2 1 1 18 12520 1 1 26 LYS HZ3 H 6.011 -6.025 -5.827 1.00 . A A . 26 LYS HZ3 1 1 18 12521 1 1 26 LYS N N 6.846 1.362 -6.238 1.00 . A A . 26 LYS N 1 1 18 12522 1 1 26 LYS NZ N 6.877 -5.441 -5.799 1.00 . A A . 26 LYS NZ 1 1 18 12523 1 1 26 LYS O O 6.121 0.370 -9.572 1.00 . A A . 26 LYS O 1 1 18 12524 1 1 27 ALA C C 3.064 1.499 -9.051 1.00 . A A . 27 ALA C 1 1 18 12525 1 1 27 ALA CA C 3.574 0.177 -8.470 1.00 . A A . 27 ALA CA 1 1 18 12526 1 1 27 ALA CB C 2.519 -0.455 -7.574 1.00 . A A . 27 ALA CB 1 1 18 12527 1 1 27 ALA H H 4.789 0.430 -6.754 1.00 . A A . 27 ALA H 1 1 18 12528 1 1 27 ALA HA H 3.772 -0.505 -9.284 1.00 . A A . 27 ALA HA 1 1 18 12529 1 1 27 ALA HB1 H 1.633 0.163 -7.571 1.00 . A A . 27 ALA HB1 1 1 18 12530 1 1 27 ALA HB2 H 2.903 -0.537 -6.568 1.00 . A A . 27 ALA HB2 1 1 18 12531 1 1 27 ALA HB3 H 2.271 -1.438 -7.946 1.00 . A A . 27 ALA HB3 1 1 18 12532 1 1 27 ALA N N 4.821 0.362 -7.732 1.00 . A A . 27 ALA N 1 1 18 12533 1 1 27 ALA O O 1.963 1.556 -9.604 1.00 . A A . 27 ALA O 1 1 18 12534 1 1 28 LYS C C 2.479 4.578 -8.612 1.00 . A A . 28 LYS C 1 1 18 12535 1 1 28 LYS CA C 3.561 3.878 -9.456 1.00 . A A . 28 LYS CA 1 1 18 12536 1 1 28 LYS CB C 3.148 3.777 -10.935 1.00 . A A . 28 LYS CB 1 1 18 12537 1 1 28 LYS CD C 2.839 4.887 -13.164 1.00 . A A . 28 LYS CD 1 1 18 12538 1 1 28 LYS CE C 1.578 4.072 -13.412 1.00 . A A . 28 LYS CE 1 1 18 12539 1 1 28 LYS CG C 3.083 5.103 -11.677 1.00 . A A . 28 LYS CG 1 1 18 12540 1 1 28 LYS H H 4.751 2.415 -8.493 1.00 . A A . 28 LYS H 1 1 18 12541 1 1 28 LYS HA H 4.464 4.469 -9.396 1.00 . A A . 28 LYS HA 1 1 18 12542 1 1 28 LYS HB2 H 3.857 3.144 -11.447 1.00 . A A . 28 LYS HB2 1 1 18 12543 1 1 28 LYS HB3 H 2.172 3.315 -10.988 1.00 . A A . 28 LYS HB3 1 1 18 12544 1 1 28 LYS HD2 H 2.735 5.849 -13.645 1.00 . A A . 28 LYS HD2 1 1 18 12545 1 1 28 LYS HD3 H 3.685 4.363 -13.584 1.00 . A A . 28 LYS HD3 1 1 18 12546 1 1 28 LYS HE2 H 1.633 3.162 -12.834 1.00 . A A . 28 LYS HE2 1 1 18 12547 1 1 28 LYS HE3 H 0.723 4.650 -13.091 1.00 . A A . 28 LYS HE3 1 1 18 12548 1 1 28 LYS HG2 H 2.277 5.695 -11.270 1.00 . A A . 28 LYS HG2 1 1 18 12549 1 1 28 LYS HG3 H 4.020 5.626 -11.545 1.00 . A A . 28 LYS HG3 1 1 18 12550 1 1 28 LYS HZ1 H 0.458 3.350 -15.022 1.00 . A A . 28 LYS HZ1 1 1 18 12551 1 1 28 LYS HZ2 H 2.109 2.997 -15.122 1.00 . A A . 28 LYS HZ2 1 1 18 12552 1 1 28 LYS HZ3 H 1.560 4.565 -15.443 1.00 . A A . 28 LYS HZ3 1 1 18 12553 1 1 28 LYS N N 3.884 2.547 -8.935 1.00 . A A . 28 LYS N 1 1 18 12554 1 1 28 LYS NZ N 1.414 3.722 -14.850 1.00 . A A . 28 LYS NZ 1 1 18 12555 1 1 28 LYS O O 1.646 5.333 -9.130 1.00 . A A . 28 LYS O 1 1 18 12556 1 1 29 PHE C C 2.355 5.959 -5.482 1.00 . A A . 29 PHE C 1 1 18 12557 1 1 29 PHE CA C 1.590 4.994 -6.381 1.00 . A A . 29 PHE CA 1 1 18 12558 1 1 29 PHE CB C 0.822 3.972 -5.535 1.00 . A A . 29 PHE CB 1 1 18 12559 1 1 29 PHE CD1 C 0.140 2.201 -7.184 1.00 . A A . 29 PHE CD1 1 1 18 12560 1 1 29 PHE CD2 C -1.575 3.461 -6.114 1.00 . A A . 29 PHE CD2 1 1 18 12561 1 1 29 PHE CE1 C -0.817 1.482 -7.876 1.00 . A A . 29 PHE CE1 1 1 18 12562 1 1 29 PHE CE2 C -2.536 2.743 -6.801 1.00 . A A . 29 PHE CE2 1 1 18 12563 1 1 29 PHE CG C -0.224 3.200 -6.298 1.00 . A A . 29 PHE CG 1 1 18 12564 1 1 29 PHE CZ C -2.156 1.753 -7.684 1.00 . A A . 29 PHE CZ 1 1 18 12565 1 1 29 PHE H H 3.226 3.770 -6.940 1.00 . A A . 29 PHE H 1 1 18 12566 1 1 29 PHE HA H 0.885 5.562 -6.972 1.00 . A A . 29 PHE HA 1 1 18 12567 1 1 29 PHE HB2 H 1.524 3.260 -5.127 1.00 . A A . 29 PHE HB2 1 1 18 12568 1 1 29 PHE HB3 H 0.330 4.488 -4.721 1.00 . A A . 29 PHE HB3 1 1 18 12569 1 1 29 PHE HD1 H 1.187 1.986 -7.337 1.00 . A A . 29 PHE HD1 1 1 18 12570 1 1 29 PHE HD2 H -1.878 4.240 -5.428 1.00 . A A . 29 PHE HD2 1 1 18 12571 1 1 29 PHE HE1 H -0.516 0.707 -8.566 1.00 . A A . 29 PHE HE1 1 1 18 12572 1 1 29 PHE HE2 H -3.583 2.957 -6.648 1.00 . A A . 29 PHE HE2 1 1 18 12573 1 1 29 PHE HZ H -2.905 1.190 -8.221 1.00 . A A . 29 PHE HZ 1 1 18 12574 1 1 29 PHE N N 2.524 4.357 -7.304 1.00 . A A . 29 PHE N 1 1 18 12575 1 1 29 PHE O O 3.525 5.732 -5.168 1.00 . A A . 29 PHE O 1 1 18 12576 1 1 30 SER C C 2.534 7.623 -2.832 1.00 . A A . 30 SER C 1 1 18 12577 1 1 30 SER CA C 2.331 8.074 -4.282 1.00 . A A . 30 SER CA 1 1 18 12578 1 1 30 SER CB C 1.458 9.326 -4.313 1.00 . A A . 30 SER CB 1 1 18 12579 1 1 30 SER H H 0.787 7.185 -5.413 1.00 . A A . 30 SER H 1 1 18 12580 1 1 30 SER HA H 3.289 8.308 -4.711 1.00 . A A . 30 SER HA 1 1 18 12581 1 1 30 SER HB2 H 0.693 9.250 -3.555 1.00 . A A . 30 SER HB2 1 1 18 12582 1 1 30 SER HB3 H 2.070 10.196 -4.124 1.00 . A A . 30 SER HB3 1 1 18 12583 1 1 30 SER HG H 1.443 9.890 -6.196 1.00 . A A . 30 SER HG 1 1 18 12584 1 1 30 SER N N 1.709 7.048 -5.107 1.00 . A A . 30 SER N 1 1 18 12585 1 1 30 SER O O 3.586 7.876 -2.236 1.00 . A A . 30 SER O 1 1 18 12586 1 1 30 SER OG O 0.835 9.470 -5.580 1.00 . A A . 30 SER OG 1 1 18 12587 1 1 31 ASP C C 1.107 5.088 -0.744 1.00 . A A . 31 ASP C 1 1 18 12588 1 1 31 ASP CA C 1.571 6.531 -0.880 1.00 . A A . 31 ASP CA 1 1 18 12589 1 1 31 ASP CB C 0.692 7.447 -0.004 1.00 . A A . 31 ASP CB 1 1 18 12590 1 1 31 ASP CG C 0.481 6.912 1.407 1.00 . A A . 31 ASP CG 1 1 18 12591 1 1 31 ASP H H 0.704 6.821 -2.796 1.00 . A A . 31 ASP H 1 1 18 12592 1 1 31 ASP HA H 2.592 6.600 -0.541 1.00 . A A . 31 ASP HA 1 1 18 12593 1 1 31 ASP HB2 H 1.161 8.417 0.070 1.00 . A A . 31 ASP HB2 1 1 18 12594 1 1 31 ASP HB3 H -0.274 7.558 -0.474 1.00 . A A . 31 ASP HB3 1 1 18 12595 1 1 31 ASP N N 1.522 6.983 -2.269 1.00 . A A . 31 ASP N 1 1 18 12596 1 1 31 ASP O O 0.456 4.542 -1.630 1.00 . A A . 31 ASP O 1 1 18 12597 1 1 31 ASP OD1 O 1.476 6.786 2.161 1.00 . A A . 31 ASP OD1 1 1 18 12598 1 1 31 ASP OD2 O -0.675 6.575 1.750 1.00 . A A . 31 ASP OD2 1 1 18 12599 1 1 32 GLY C C 0.738 3.009 2.163 1.00 . A A . 32 GLY C 1 1 18 12600 1 1 32 GLY CA C 1.029 3.147 0.689 1.00 . A A . 32 GLY CA 1 1 18 12601 1 1 32 GLY H H 1.928 5.012 1.061 1.00 . A A . 32 GLY H 1 1 18 12602 1 1 32 GLY HA2 H 0.134 2.909 0.125 1.00 . A A . 32 GLY HA2 1 1 18 12603 1 1 32 GLY HA3 H 1.820 2.466 0.417 1.00 . A A . 32 GLY HA3 1 1 18 12604 1 1 32 GLY N N 1.429 4.498 0.391 1.00 . A A . 32 GLY N 1 1 18 12605 1 1 32 GLY O O 1.556 3.389 3.004 1.00 . A A . 32 GLY O 1 1 18 12606 1 1 33 HIS C C -1.473 0.974 4.097 1.00 . A A . 33 HIS C 1 1 18 12607 1 1 33 HIS CA C -0.844 2.337 3.869 1.00 . A A . 33 HIS CA 1 1 18 12608 1 1 33 HIS CB C -1.834 3.442 4.265 1.00 . A A . 33 HIS CB 1 1 18 12609 1 1 33 HIS CD2 C -4.296 3.164 3.480 1.00 . A A . 33 HIS CD2 1 1 18 12610 1 1 33 HIS CE1 C -4.102 4.048 1.486 1.00 . A A . 33 HIS CE1 1 1 18 12611 1 1 33 HIS CG C -3.011 3.570 3.339 1.00 . A A . 33 HIS CG 1 1 18 12612 1 1 33 HIS H H -1.050 2.221 1.763 1.00 . A A . 33 HIS H 1 1 18 12613 1 1 33 HIS HA H 0.037 2.421 4.486 1.00 . A A . 33 HIS HA 1 1 18 12614 1 1 33 HIS HB2 H -2.215 3.234 5.254 1.00 . A A . 33 HIS HB2 1 1 18 12615 1 1 33 HIS HB3 H -1.315 4.388 4.279 1.00 . A A . 33 HIS HB3 1 1 18 12616 1 1 33 HIS HD1 H -2.122 4.533 1.678 1.00 . A A . 33 HIS HD1 1 1 18 12617 1 1 33 HIS HD2 H -4.722 2.676 4.344 1.00 . A A . 33 HIS HD2 1 1 18 12618 1 1 33 HIS HE1 H -4.328 4.375 0.483 1.00 . A A . 33 HIS HE1 1 1 18 12619 1 1 33 HIS N N -0.433 2.495 2.484 1.00 . A A . 33 HIS N 1 1 18 12620 1 1 33 HIS ND1 N -2.926 4.124 2.077 1.00 . A A . 33 HIS ND1 1 1 18 12621 1 1 33 HIS NE2 N -4.951 3.474 2.316 1.00 . A A . 33 HIS NE2 1 1 18 12622 1 1 33 HIS O O -2.335 0.537 3.339 1.00 . A A . 33 HIS O 1 1 18 12623 1 1 34 CYS C C -2.952 -0.905 6.072 1.00 . A A . 34 CYS C 1 1 18 12624 1 1 34 CYS CA C -1.548 -1.004 5.484 1.00 . A A . 34 CYS CA 1 1 18 12625 1 1 34 CYS CB C -0.596 -1.687 6.459 1.00 . A A . 34 CYS CB 1 1 18 12626 1 1 34 CYS H H -0.349 0.715 5.712 1.00 . A A . 34 CYS H 1 1 18 12627 1 1 34 CYS HA H -1.594 -1.585 4.574 1.00 . A A . 34 CYS HA 1 1 18 12628 1 1 34 CYS HB2 H -0.630 -1.173 7.408 1.00 . A A . 34 CYS HB2 1 1 18 12629 1 1 34 CYS HB3 H -0.900 -2.714 6.596 1.00 . A A . 34 CYS HB3 1 1 18 12630 1 1 34 CYS N N -1.036 0.311 5.146 1.00 . A A . 34 CYS N 1 1 18 12631 1 1 34 CYS O O -3.200 -0.115 6.985 1.00 . A A . 34 CYS O 1 1 18 12632 1 1 34 CYS SG S 1.133 -1.688 5.883 1.00 . A A . 34 CYS SG 1 1 18 12633 1 1 35 SER C C -5.377 -2.248 7.388 1.00 . A A . 35 SER C 1 1 18 12634 1 1 35 SER CA C -5.248 -1.720 5.962 1.00 . A A . 35 SER CA 1 1 18 12635 1 1 35 SER CB C -6.079 -2.584 5.004 1.00 . A A . 35 SER CB 1 1 18 12636 1 1 35 SER H H -3.589 -2.295 4.792 1.00 . A A . 35 SER H 1 1 18 12637 1 1 35 SER HA H -5.620 -0.708 5.930 1.00 . A A . 35 SER HA 1 1 18 12638 1 1 35 SER HB2 H -5.943 -2.227 3.994 1.00 . A A . 35 SER HB2 1 1 18 12639 1 1 35 SER HB3 H -5.744 -3.609 5.069 1.00 . A A . 35 SER HB3 1 1 18 12640 1 1 35 SER HG H -7.971 -2.478 4.500 1.00 . A A . 35 SER HG 1 1 18 12641 1 1 35 SER N N -3.861 -1.700 5.528 1.00 . A A . 35 SER N 1 1 18 12642 1 1 35 SER O O -4.442 -2.831 7.944 1.00 . A A . 35 SER O 1 1 18 12643 1 1 35 SER OG O -7.462 -2.536 5.319 1.00 . A A . 35 SER OG 1 1 18 12644 1 1 36 LYS C C -7.393 -3.908 9.306 1.00 . A A . 36 LYS C 1 1 18 12645 1 1 36 LYS CA C -6.838 -2.485 9.317 1.00 . A A . 36 LYS CA 1 1 18 12646 1 1 36 LYS CB C -7.843 -1.530 9.973 1.00 . A A . 36 LYS CB 1 1 18 12647 1 1 36 LYS CD C -9.370 -1.052 11.924 1.00 . A A . 36 LYS CD 1 1 18 12648 1 1 36 LYS CE C -10.612 -0.832 11.074 1.00 . A A . 36 LYS CE 1 1 18 12649 1 1 36 LYS CG C -8.415 -2.049 11.283 1.00 . A A . 36 LYS CG 1 1 18 12650 1 1 36 LYS H H -7.244 -1.574 7.458 1.00 . A A . 36 LYS H 1 1 18 12651 1 1 36 LYS HA H -5.917 -2.471 9.880 1.00 . A A . 36 LYS HA 1 1 18 12652 1 1 36 LYS HB2 H -7.352 -0.589 10.170 1.00 . A A . 36 LYS HB2 1 1 18 12653 1 1 36 LYS HB3 H -8.662 -1.362 9.290 1.00 . A A . 36 LYS HB3 1 1 18 12654 1 1 36 LYS HD2 H -9.671 -1.428 12.890 1.00 . A A . 36 LYS HD2 1 1 18 12655 1 1 36 LYS HD3 H -8.858 -0.109 12.047 1.00 . A A . 36 LYS HD3 1 1 18 12656 1 1 36 LYS HE2 H -10.310 -0.438 10.114 1.00 . A A . 36 LYS HE2 1 1 18 12657 1 1 36 LYS HE3 H -11.109 -1.780 10.933 1.00 . A A . 36 LYS HE3 1 1 18 12658 1 1 36 LYS HG2 H -8.950 -2.968 11.083 1.00 . A A . 36 LYS HG2 1 1 18 12659 1 1 36 LYS HG3 H -7.601 -2.247 11.964 1.00 . A A . 36 LYS HG3 1 1 18 12660 1 1 36 LYS HZ1 H -11.082 1.030 11.898 1.00 . A A . 36 LYS HZ1 1 1 18 12661 1 1 36 LYS HZ2 H -11.905 -0.263 12.613 1.00 . A A . 36 LYS HZ2 1 1 18 12662 1 1 36 LYS HZ3 H -12.372 0.294 11.086 1.00 . A A . 36 LYS HZ3 1 1 18 12663 1 1 36 LYS N N -6.547 -2.040 7.965 1.00 . A A . 36 LYS N 1 1 18 12664 1 1 36 LYS NZ N -11.559 0.124 11.712 1.00 . A A . 36 LYS NZ 1 1 18 12665 1 1 36 LYS O O -7.300 -4.625 10.297 1.00 . A A . 36 LYS O 1 1 18 12666 1 1 37 ILE C C -7.510 -6.715 7.991 1.00 . A A . 37 ILE C 1 1 18 12667 1 1 37 ILE CA C -8.581 -5.621 8.041 1.00 . A A . 37 ILE CA 1 1 18 12668 1 1 37 ILE CB C -9.452 -5.710 6.771 1.00 . A A . 37 ILE CB 1 1 18 12669 1 1 37 ILE CD1 C -10.955 -4.360 5.229 1.00 . A A . 37 ILE CD1 1 1 18 12670 1 1 37 ILE CG1 C -10.280 -4.438 6.582 1.00 . A A . 37 ILE CG1 1 1 18 12671 1 1 37 ILE CG2 C -10.370 -6.927 6.840 1.00 . A A . 37 ILE CG2 1 1 18 12672 1 1 37 ILE H H -8.037 -3.668 7.431 1.00 . A A . 37 ILE H 1 1 18 12673 1 1 37 ILE HA H -9.209 -5.791 8.899 1.00 . A A . 37 ILE HA 1 1 18 12674 1 1 37 ILE HB H -8.795 -5.830 5.927 1.00 . A A . 37 ILE HB 1 1 18 12675 1 1 37 ILE HD11 H -11.998 -4.618 5.331 1.00 . A A . 37 ILE HD11 1 1 18 12676 1 1 37 ILE HD12 H -10.477 -5.053 4.549 1.00 . A A . 37 ILE HD12 1 1 18 12677 1 1 37 ILE HD13 H -10.868 -3.356 4.840 1.00 . A A . 37 ILE HD13 1 1 18 12678 1 1 37 ILE HG12 H -11.049 -4.400 7.340 1.00 . A A . 37 ILE HG12 1 1 18 12679 1 1 37 ILE HG13 H -9.636 -3.577 6.685 1.00 . A A . 37 ILE HG13 1 1 18 12680 1 1 37 ILE HG21 H -9.933 -7.740 6.280 1.00 . A A . 37 ILE HG21 1 1 18 12681 1 1 37 ILE HG22 H -11.332 -6.675 6.418 1.00 . A A . 37 ILE HG22 1 1 18 12682 1 1 37 ILE HG23 H -10.495 -7.225 7.870 1.00 . A A . 37 ILE HG23 1 1 18 12683 1 1 37 ILE N N -7.986 -4.294 8.182 1.00 . A A . 37 ILE N 1 1 18 12684 1 1 37 ILE O O -6.927 -7.075 9.008 1.00 . A A . 37 ILE O 1 1 18 12685 1 1 38 LEU C C -4.851 -7.722 6.606 1.00 . A A . 38 LEU C 1 1 18 12686 1 1 38 LEU CA C -6.261 -8.305 6.626 1.00 . A A . 38 LEU CA 1 1 18 12687 1 1 38 LEU CB C -6.520 -9.070 5.333 1.00 . A A . 38 LEU CB 1 1 18 12688 1 1 38 LEU CD1 C -6.169 -11.358 6.292 1.00 . A A . 38 LEU CD1 1 1 18 12689 1 1 38 LEU CD2 C -5.926 -10.986 3.830 1.00 . A A . 38 LEU CD2 1 1 18 12690 1 1 38 LEU CG C -5.744 -10.377 5.209 1.00 . A A . 38 LEU CG 1 1 18 12691 1 1 38 LEU H H -7.752 -6.930 6.017 1.00 . A A . 38 LEU H 1 1 18 12692 1 1 38 LEU HA H -6.348 -8.983 7.462 1.00 . A A . 38 LEU HA 1 1 18 12693 1 1 38 LEU HB2 H -7.574 -9.283 5.268 1.00 . A A . 38 LEU HB2 1 1 18 12694 1 1 38 LEU HB3 H -6.247 -8.436 4.502 1.00 . A A . 38 LEU HB3 1 1 18 12695 1 1 38 LEU HD11 H -5.529 -12.227 6.261 1.00 . A A . 38 LEU HD11 1 1 18 12696 1 1 38 LEU HD12 H -7.193 -11.658 6.123 1.00 . A A . 38 LEU HD12 1 1 18 12697 1 1 38 LEU HD13 H -6.088 -10.885 7.259 1.00 . A A . 38 LEU HD13 1 1 18 12698 1 1 38 LEU HD21 H -6.980 -11.120 3.633 1.00 . A A . 38 LEU HD21 1 1 18 12699 1 1 38 LEU HD22 H -5.428 -11.943 3.790 1.00 . A A . 38 LEU HD22 1 1 18 12700 1 1 38 LEU HD23 H -5.502 -10.327 3.087 1.00 . A A . 38 LEU HD23 1 1 18 12701 1 1 38 LEU HG H -4.694 -10.161 5.349 1.00 . A A . 38 LEU HG 1 1 18 12702 1 1 38 LEU N N -7.256 -7.249 6.797 1.00 . A A . 38 LEU N 1 1 18 12703 1 1 38 LEU O O -3.885 -8.390 6.239 1.00 . A A . 38 LEU O 1 1 18 12704 1 1 39 ARG C C -2.852 -5.673 5.686 1.00 . A A . 39 ARG C 1 1 18 12705 1 1 39 ARG CA C -3.500 -5.743 7.071 1.00 . A A . 39 ARG CA 1 1 18 12706 1 1 39 ARG CB C -2.568 -6.405 8.090 1.00 . A A . 39 ARG CB 1 1 18 12707 1 1 39 ARG CD C -2.010 -4.228 9.199 1.00 . A A . 39 ARG CD 1 1 18 12708 1 1 39 ARG CG C -1.458 -5.502 8.589 1.00 . A A . 39 ARG CG 1 1 18 12709 1 1 39 ARG CZ C -1.136 -2.143 10.187 1.00 . A A . 39 ARG CZ 1 1 18 12710 1 1 39 ARG H H -5.574 -6.018 7.294 1.00 . A A . 39 ARG H 1 1 18 12711 1 1 39 ARG HA H -3.717 -4.737 7.399 1.00 . A A . 39 ARG HA 1 1 18 12712 1 1 39 ARG HB2 H -3.153 -6.721 8.940 1.00 . A A . 39 ARG HB2 1 1 18 12713 1 1 39 ARG HB3 H -2.117 -7.274 7.634 1.00 . A A . 39 ARG HB3 1 1 18 12714 1 1 39 ARG HD2 H -2.531 -3.672 8.432 1.00 . A A . 39 ARG HD2 1 1 18 12715 1 1 39 ARG HD3 H -2.705 -4.490 9.985 1.00 . A A . 39 ARG HD3 1 1 18 12716 1 1 39 ARG HE H -0.054 -3.794 9.837 1.00 . A A . 39 ARG HE 1 1 18 12717 1 1 39 ARG HG2 H -0.888 -6.030 9.339 1.00 . A A . 39 ARG HG2 1 1 18 12718 1 1 39 ARG HG3 H -0.816 -5.245 7.759 1.00 . A A . 39 ARG HG3 1 1 18 12719 1 1 39 ARG HH11 H -3.081 -2.064 9.613 1.00 . A A . 39 ARG HH11 1 1 18 12720 1 1 39 ARG HH12 H -2.474 -0.627 10.366 1.00 . A A . 39 ARG HH12 1 1 18 12721 1 1 39 ARG HH21 H 0.775 -1.899 10.828 1.00 . A A . 39 ARG HH21 1 1 18 12722 1 1 39 ARG HH22 H -0.264 -0.533 11.064 1.00 . A A . 39 ARG HH22 1 1 18 12723 1 1 39 ARG N N -4.759 -6.468 7.013 1.00 . A A . 39 ARG N 1 1 18 12724 1 1 39 ARG NE N -0.949 -3.390 9.759 1.00 . A A . 39 ARG NE 1 1 18 12725 1 1 39 ARG NH1 N -2.325 -1.563 10.045 1.00 . A A . 39 ARG NH1 1 1 18 12726 1 1 39 ARG NH2 N -0.128 -1.469 10.736 1.00 . A A . 39 ARG NH2 1 1 18 12727 1 1 39 ARG O O -1.629 -5.600 5.554 1.00 . A A . 39 ARG O 1 1 18 12728 1 1 40 ARG C C -2.711 -4.222 2.949 1.00 . A A . 40 ARG C 1 1 18 12729 1 1 40 ARG CA C -3.230 -5.618 3.278 1.00 . A A . 40 ARG CA 1 1 18 12730 1 1 40 ARG CB C -4.354 -6.014 2.328 1.00 . A A . 40 ARG CB 1 1 18 12731 1 1 40 ARG CD C -5.849 -7.873 1.521 1.00 . A A . 40 ARG CD 1 1 18 12732 1 1 40 ARG CG C -4.569 -7.513 2.256 1.00 . A A . 40 ARG CG 1 1 18 12733 1 1 40 ARG CZ C -5.130 -9.605 -0.075 1.00 . A A . 40 ARG CZ 1 1 18 12734 1 1 40 ARG H H -4.655 -5.748 4.833 1.00 . A A . 40 ARG H 1 1 18 12735 1 1 40 ARG HA H -2.417 -6.321 3.169 1.00 . A A . 40 ARG HA 1 1 18 12736 1 1 40 ARG HB2 H -5.273 -5.553 2.661 1.00 . A A . 40 ARG HB2 1 1 18 12737 1 1 40 ARG HB3 H -4.118 -5.656 1.337 1.00 . A A . 40 ARG HB3 1 1 18 12738 1 1 40 ARG HD2 H -6.682 -7.773 2.201 1.00 . A A . 40 ARG HD2 1 1 18 12739 1 1 40 ARG HD3 H -5.977 -7.198 0.689 1.00 . A A . 40 ARG HD3 1 1 18 12740 1 1 40 ARG HE H -6.221 -9.934 1.576 1.00 . A A . 40 ARG HE 1 1 18 12741 1 1 40 ARG HG2 H -3.734 -7.960 1.737 1.00 . A A . 40 ARG HG2 1 1 18 12742 1 1 40 ARG HG3 H -4.620 -7.906 3.261 1.00 . A A . 40 ARG HG3 1 1 18 12743 1 1 40 ARG HH11 H -4.965 -7.702 -0.787 1.00 . A A . 40 ARG HH11 1 1 18 12744 1 1 40 ARG HH12 H -4.215 -8.937 -1.760 1.00 . A A . 40 ARG HH12 1 1 18 12745 1 1 40 ARG HH21 H -5.273 -11.596 0.278 1.00 . A A . 40 ARG HH21 1 1 18 12746 1 1 40 ARG HH22 H -4.409 -11.161 -1.158 1.00 . A A . 40 ARG HH22 1 1 18 12747 1 1 40 ARG N N -3.692 -5.688 4.658 1.00 . A A . 40 ARG N 1 1 18 12748 1 1 40 ARG NE N -5.803 -9.245 1.021 1.00 . A A . 40 ARG NE 1 1 18 12749 1 1 40 ARG NH1 N -4.739 -8.681 -0.947 1.00 . A A . 40 ARG NH1 1 1 18 12750 1 1 40 ARG NH2 N -4.925 -10.892 -0.341 1.00 . A A . 40 ARG NH2 1 1 18 12751 1 1 40 ARG O O -3.196 -3.229 3.486 1.00 . A A . 40 ARG O 1 1 18 12752 1 1 41 CYS C C -1.943 -2.135 0.674 1.00 . A A . 41 CYS C 1 1 18 12753 1 1 41 CYS CA C -1.101 -2.888 1.704 1.00 . A A . 41 CYS CA 1 1 18 12754 1 1 41 CYS CB C 0.297 -3.149 1.141 1.00 . A A . 41 CYS CB 1 1 18 12755 1 1 41 CYS H H -1.355 -4.986 1.709 1.00 . A A . 41 CYS H 1 1 18 12756 1 1 41 CYS HA H -1.011 -2.281 2.592 1.00 . A A . 41 CYS HA 1 1 18 12757 1 1 41 CYS HB2 H 0.926 -3.538 1.928 1.00 . A A . 41 CYS HB2 1 1 18 12758 1 1 41 CYS HB3 H 0.226 -3.883 0.352 1.00 . A A . 41 CYS HB3 1 1 18 12759 1 1 41 CYS N N -1.709 -4.157 2.090 1.00 . A A . 41 CYS N 1 1 18 12760 1 1 41 CYS O O -1.987 -2.515 -0.492 1.00 . A A . 41 CYS O 1 1 18 12761 1 1 41 CYS SG S 1.121 -1.680 0.456 1.00 . A A . 41 CYS SG 1 1 18 12762 1 1 42 LEU C C -2.540 0.921 -0.333 1.00 . A A . 42 LEU C 1 1 18 12763 1 1 42 LEU CA C -3.385 -0.217 0.217 1.00 . A A . 42 LEU CA 1 1 18 12764 1 1 42 LEU CB C -4.605 0.356 0.948 1.00 . A A . 42 LEU CB 1 1 18 12765 1 1 42 LEU CD1 C -5.664 -1.838 1.574 1.00 . A A . 42 LEU CD1 1 1 18 12766 1 1 42 LEU CD2 C -7.042 0.246 1.517 1.00 . A A . 42 LEU CD2 1 1 18 12767 1 1 42 LEU CG C -5.874 -0.498 0.888 1.00 . A A . 42 LEU CG 1 1 18 12768 1 1 42 LEU H H -2.478 -0.777 2.046 1.00 . A A . 42 LEU H 1 1 18 12769 1 1 42 LEU HA H -3.719 -0.834 -0.603 1.00 . A A . 42 LEU HA 1 1 18 12770 1 1 42 LEU HB2 H -4.339 0.491 1.986 1.00 . A A . 42 LEU HB2 1 1 18 12771 1 1 42 LEU HB3 H -4.829 1.330 0.526 1.00 . A A . 42 LEU HB3 1 1 18 12772 1 1 42 LEU HD11 H -4.714 -2.253 1.271 1.00 . A A . 42 LEU HD11 1 1 18 12773 1 1 42 LEU HD12 H -6.458 -2.515 1.293 1.00 . A A . 42 LEU HD12 1 1 18 12774 1 1 42 LEU HD13 H -5.672 -1.701 2.645 1.00 . A A . 42 LEU HD13 1 1 18 12775 1 1 42 LEU HD21 H -7.879 0.245 0.834 1.00 . A A . 42 LEU HD21 1 1 18 12776 1 1 42 LEU HD22 H -6.749 1.264 1.726 1.00 . A A . 42 LEU HD22 1 1 18 12777 1 1 42 LEU HD23 H -7.327 -0.242 2.437 1.00 . A A . 42 LEU HD23 1 1 18 12778 1 1 42 LEU HG H -6.121 -0.690 -0.146 1.00 . A A . 42 LEU HG 1 1 18 12779 1 1 42 LEU N N -2.578 -1.047 1.107 1.00 . A A . 42 LEU N 1 1 18 12780 1 1 42 LEU O O -1.980 1.711 0.426 1.00 . A A . 42 LEU O 1 1 18 12781 1 1 43 CYS C C -2.516 3.198 -2.735 1.00 . A A . 43 CYS C 1 1 18 12782 1 1 43 CYS CA C -1.655 2.026 -2.293 1.00 . A A . 43 CYS CA 1 1 18 12783 1 1 43 CYS CB C -0.935 1.420 -3.489 1.00 . A A . 43 CYS CB 1 1 18 12784 1 1 43 CYS H H -2.908 0.333 -2.201 1.00 . A A . 43 CYS H 1 1 18 12785 1 1 43 CYS HA H -0.920 2.379 -1.585 1.00 . A A . 43 CYS HA 1 1 18 12786 1 1 43 CYS HB2 H -1.664 1.030 -4.183 1.00 . A A . 43 CYS HB2 1 1 18 12787 1 1 43 CYS HB3 H -0.350 2.186 -3.977 1.00 . A A . 43 CYS HB3 1 1 18 12788 1 1 43 CYS N N -2.444 0.997 -1.644 1.00 . A A . 43 CYS N 1 1 18 12789 1 1 43 CYS O O -3.526 3.012 -3.405 1.00 . A A . 43 CYS O 1 1 18 12790 1 1 43 CYS SG S 0.186 0.068 -3.035 1.00 . A A . 43 CYS SG 1 1 18 12791 1 1 44 THR C C -2.001 6.424 -3.737 1.00 . A A . 44 THR C 1 1 18 12792 1 1 44 THR CA C -2.809 5.614 -2.731 1.00 . A A . 44 THR CA 1 1 18 12793 1 1 44 THR CB C -3.074 6.494 -1.501 1.00 . A A . 44 THR CB 1 1 18 12794 1 1 44 THR CG2 C -4.564 6.697 -1.285 1.00 . A A . 44 THR CG2 1 1 18 12795 1 1 44 THR H H -1.271 4.476 -1.843 1.00 . A A . 44 THR H 1 1 18 12796 1 1 44 THR HA H -3.757 5.337 -3.170 1.00 . A A . 44 THR HA 1 1 18 12797 1 1 44 THR HB H -2.618 7.458 -1.676 1.00 . A A . 44 THR HB 1 1 18 12798 1 1 44 THR HG1 H -1.898 6.525 0.102 1.00 . A A . 44 THR HG1 1 1 18 12799 1 1 44 THR HG21 H -5.015 7.053 -2.200 1.00 . A A . 44 THR HG21 1 1 18 12800 1 1 44 THR HG22 H -4.719 7.424 -0.501 1.00 . A A . 44 THR HG22 1 1 18 12801 1 1 44 THR HG23 H -5.018 5.759 -1.001 1.00 . A A . 44 THR HG23 1 1 18 12802 1 1 44 THR N N -2.100 4.399 -2.369 1.00 . A A . 44 THR N 1 1 18 12803 1 1 44 THR O O -0.772 6.437 -3.691 1.00 . A A . 44 THR O 1 1 18 12804 1 1 44 THR OG1 O -2.492 5.893 -0.331 1.00 . A A . 44 THR OG1 1 1 18 12805 1 1 45 LYS C C -3.005 8.920 -6.244 1.00 . A A . 45 LYS C 1 1 18 12806 1 1 45 LYS CA C -2.033 7.918 -5.645 1.00 . A A . 45 LYS CA 1 1 18 12807 1 1 45 LYS CB C -1.447 7.054 -6.770 1.00 . A A . 45 LYS CB 1 1 18 12808 1 1 45 LYS CD C -1.887 5.748 -8.896 1.00 . A A . 45 LYS CD 1 1 18 12809 1 1 45 LYS CE C -1.482 6.763 -9.962 1.00 . A A . 45 LYS CE 1 1 18 12810 1 1 45 LYS CG C -2.499 6.409 -7.663 1.00 . A A . 45 LYS CG 1 1 18 12811 1 1 45 LYS H H -3.671 7.057 -4.617 1.00 . A A . 45 LYS H 1 1 18 12812 1 1 45 LYS HA H -1.230 8.457 -5.163 1.00 . A A . 45 LYS HA 1 1 18 12813 1 1 45 LYS HB2 H -0.812 7.671 -7.388 1.00 . A A . 45 LYS HB2 1 1 18 12814 1 1 45 LYS HB3 H -0.850 6.269 -6.329 1.00 . A A . 45 LYS HB3 1 1 18 12815 1 1 45 LYS HD2 H -1.010 5.196 -8.594 1.00 . A A . 45 LYS HD2 1 1 18 12816 1 1 45 LYS HD3 H -2.612 5.067 -9.319 1.00 . A A . 45 LYS HD3 1 1 18 12817 1 1 45 LYS HE2 H -1.373 6.248 -10.905 1.00 . A A . 45 LYS HE2 1 1 18 12818 1 1 45 LYS HE3 H -2.266 7.502 -10.049 1.00 . A A . 45 LYS HE3 1 1 18 12819 1 1 45 LYS HG2 H -3.026 5.658 -7.094 1.00 . A A . 45 LYS HG2 1 1 18 12820 1 1 45 LYS HG3 H -3.196 7.170 -7.984 1.00 . A A . 45 LYS HG3 1 1 18 12821 1 1 45 LYS HZ1 H 0.196 7.881 -10.504 1.00 . A A . 45 LYS HZ1 1 1 18 12822 1 1 45 LYS HZ2 H 0.486 6.781 -9.251 1.00 . A A . 45 LYS HZ2 1 1 18 12823 1 1 45 LYS HZ3 H -0.369 8.217 -8.945 1.00 . A A . 45 LYS HZ3 1 1 18 12824 1 1 45 LYS N N -2.690 7.100 -4.636 1.00 . A A . 45 LYS N 1 1 18 12825 1 1 45 LYS NZ N -0.203 7.453 -9.645 1.00 . A A . 45 LYS NZ 1 1 18 12826 1 1 45 LYS O O -4.218 8.823 -6.051 1.00 . A A . 45 LYS O 1 1 18 12827 1 1 46 GLU C C -3.860 10.273 -8.965 1.00 . A A . 46 GLU C 1 1 18 12828 1 1 46 GLU CA C -3.245 10.850 -7.693 1.00 . A A . 46 GLU CA 1 1 18 12829 1 1 46 GLU CB C -2.414 12.108 -8.018 1.00 . A A . 46 GLU CB 1 1 18 12830 1 1 46 GLU CD C -0.491 10.661 -8.976 1.00 . A A . 46 GLU CD 1 1 18 12831 1 1 46 GLU CG C -0.900 11.913 -8.212 1.00 . A A . 46 GLU CG 1 1 18 12832 1 1 46 GLU H H -1.482 9.835 -7.143 1.00 . A A . 46 GLU H 1 1 18 12833 1 1 46 GLU HA H -4.050 11.134 -7.031 1.00 . A A . 46 GLU HA 1 1 18 12834 1 1 46 GLU HB2 H -2.802 12.542 -8.927 1.00 . A A . 46 GLU HB2 1 1 18 12835 1 1 46 GLU HB3 H -2.555 12.819 -7.216 1.00 . A A . 46 GLU HB3 1 1 18 12836 1 1 46 GLU HG2 H -0.518 12.767 -8.749 1.00 . A A . 46 GLU HG2 1 1 18 12837 1 1 46 GLU HG3 H -0.438 11.882 -7.236 1.00 . A A . 46 GLU HG3 1 1 18 12838 1 1 46 GLU N N -2.460 9.847 -7.004 1.00 . A A . 46 GLU N 1 1 18 12839 1 1 46 GLU O O -3.323 9.336 -9.560 1.00 . A A . 46 GLU O 1 1 18 12840 1 1 46 GLU OE1 O -0.390 10.708 -10.214 1.00 . A A . 46 GLU OE1 1 1 18 12841 1 1 46 GLU OE2 O -0.262 9.619 -8.321 1.00 . A A . 46 GLU OE2 1 1 18 12842 1 1 47 CYS C C -6.771 11.406 -10.905 1.00 . A A . 47 CYS C 1 1 18 12843 1 1 47 CYS CA C -5.691 10.394 -10.563 1.00 . A A . 47 CYS CA 1 1 18 12844 1 1 47 CYS CB C -6.301 9.000 -10.368 1.00 . A A . 47 CYS CB 1 1 18 12845 1 1 47 CYS H H -5.369 11.574 -8.846 1.00 . A A . 47 CYS H 1 1 18 12846 1 1 47 CYS HA H -4.976 10.358 -11.372 1.00 . A A . 47 CYS HA 1 1 18 12847 1 1 47 CYS HB2 H -6.851 8.731 -11.257 1.00 . A A . 47 CYS HB2 1 1 18 12848 1 1 47 CYS HB3 H -5.503 8.288 -10.218 1.00 . A A . 47 CYS HB3 1 1 18 12849 1 1 47 CYS N N -4.990 10.834 -9.367 1.00 . A A . 47 CYS N 1 1 18 12850 1 1 47 CYS O O -6.704 12.529 -10.355 1.00 . A A . 47 CYS O 1 1 18 12851 1 1 47 CYS OXT O -7.676 11.087 -11.692 1.00 . A A . 47 CYS OXT 1 1 18 12852 1 1 47 CYS SG S -7.442 8.862 -8.952 1.00 . A A . 47 CYS SG 1 1 19 12853 1 1 1 ALA C C -10.225 9.882 -8.785 1.00 . A A . 1 ALA C 1 1 19 12854 1 1 1 ALA CA C -11.379 10.482 -9.575 1.00 . A A . 1 ALA CA 1 1 19 12855 1 1 1 ALA CB C -12.636 9.637 -9.417 1.00 . A A . 1 ALA CB 1 1 19 12856 1 1 1 ALA H1 H -11.778 11.059 -11.539 1.00 . A A . 1 ALA H1 1 1 19 12857 1 1 1 ALA H2 H -10.856 9.650 -11.414 1.00 . A A . 1 ALA H2 1 1 19 12858 1 1 1 ALA H3 H -10.139 11.152 -11.119 1.00 . A A . 1 ALA H3 1 1 19 12859 1 1 1 ALA HA H -11.586 11.465 -9.189 1.00 . A A . 1 ALA HA 1 1 19 12860 1 1 1 ALA HB1 H -12.957 9.284 -10.386 1.00 . A A . 1 ALA HB1 1 1 19 12861 1 1 1 ALA HB2 H -13.419 10.235 -8.974 1.00 . A A . 1 ALA HB2 1 1 19 12862 1 1 1 ALA HB3 H -12.424 8.792 -8.779 1.00 . A A . 1 ALA HB3 1 1 19 12863 1 1 1 ALA N N -11.021 10.593 -11.008 1.00 . A A . 1 ALA N 1 1 19 12864 1 1 1 ALA O O -9.065 10.052 -9.146 1.00 . A A . 1 ALA O 1 1 19 12865 1 1 2 THR C C -9.429 7.068 -7.250 1.00 . A A . 2 THR C 1 1 19 12866 1 1 2 THR CA C -9.537 8.546 -6.890 1.00 . A A . 2 THR CA 1 1 19 12867 1 1 2 THR CB C -9.875 8.693 -5.395 1.00 . A A . 2 THR CB 1 1 19 12868 1 1 2 THR CG2 C -8.679 8.325 -4.528 1.00 . A A . 2 THR CG2 1 1 19 12869 1 1 2 THR H H -11.490 9.079 -7.479 1.00 . A A . 2 THR H 1 1 19 12870 1 1 2 THR HA H -8.589 9.030 -7.081 1.00 . A A . 2 THR HA 1 1 19 12871 1 1 2 THR HB H -10.694 8.030 -5.158 1.00 . A A . 2 THR HB 1 1 19 12872 1 1 2 THR HG1 H -9.955 10.298 -4.249 1.00 . A A . 2 THR HG1 1 1 19 12873 1 1 2 THR HG21 H -8.144 9.222 -4.253 1.00 . A A . 2 THR HG21 1 1 19 12874 1 1 2 THR HG22 H -8.023 7.668 -5.079 1.00 . A A . 2 THR HG22 1 1 19 12875 1 1 2 THR HG23 H -9.023 7.824 -3.635 1.00 . A A . 2 THR HG23 1 1 19 12876 1 1 2 THR N N -10.548 9.179 -7.716 1.00 . A A . 2 THR N 1 1 19 12877 1 1 2 THR O O -10.355 6.293 -7.009 1.00 . A A . 2 THR O 1 1 19 12878 1 1 2 THR OG1 O -10.268 10.045 -5.122 1.00 . A A . 2 THR OG1 1 1 19 12879 1 1 3 CYS C C -7.442 4.503 -7.126 1.00 . A A . 3 CYS C 1 1 19 12880 1 1 3 CYS CA C -8.095 5.308 -8.242 1.00 . A A . 3 CYS CA 1 1 19 12881 1 1 3 CYS CB C -7.260 5.253 -9.523 1.00 . A A . 3 CYS CB 1 1 19 12882 1 1 3 CYS H H -7.609 7.354 -8.017 1.00 . A A . 3 CYS H 1 1 19 12883 1 1 3 CYS HA H -9.065 4.878 -8.446 1.00 . A A . 3 CYS HA 1 1 19 12884 1 1 3 CYS HB2 H -6.471 5.991 -9.466 1.00 . A A . 3 CYS HB2 1 1 19 12885 1 1 3 CYS HB3 H -6.825 4.269 -9.624 1.00 . A A . 3 CYS HB3 1 1 19 12886 1 1 3 CYS N N -8.310 6.687 -7.839 1.00 . A A . 3 CYS N 1 1 19 12887 1 1 3 CYS O O -6.469 4.944 -6.510 1.00 . A A . 3 CYS O 1 1 19 12888 1 1 3 CYS SG S -8.220 5.597 -11.032 1.00 . A A . 3 CYS SG 1 1 19 12889 1 1 4 LYS C C -7.119 1.091 -6.437 1.00 . A A . 4 LYS C 1 1 19 12890 1 1 4 LYS CA C -7.495 2.436 -5.829 1.00 . A A . 4 LYS CA 1 1 19 12891 1 1 4 LYS CB C -8.574 2.249 -4.743 1.00 . A A . 4 LYS CB 1 1 19 12892 1 1 4 LYS CD C -7.826 0.069 -3.649 1.00 . A A . 4 LYS CD 1 1 19 12893 1 1 4 LYS CE C -9.052 -0.689 -4.141 1.00 . A A . 4 LYS CE 1 1 19 12894 1 1 4 LYS CG C -8.104 1.558 -3.458 1.00 . A A . 4 LYS CG 1 1 19 12895 1 1 4 LYS H H -8.771 3.041 -7.397 1.00 . A A . 4 LYS H 1 1 19 12896 1 1 4 LYS HA H -6.615 2.884 -5.388 1.00 . A A . 4 LYS HA 1 1 19 12897 1 1 4 LYS HB2 H -8.959 3.220 -4.474 1.00 . A A . 4 LYS HB2 1 1 19 12898 1 1 4 LYS HB3 H -9.381 1.663 -5.161 1.00 . A A . 4 LYS HB3 1 1 19 12899 1 1 4 LYS HD2 H -7.034 -0.048 -4.373 1.00 . A A . 4 LYS HD2 1 1 19 12900 1 1 4 LYS HD3 H -7.512 -0.350 -2.703 1.00 . A A . 4 LYS HD3 1 1 19 12901 1 1 4 LYS HE2 H -9.784 -0.720 -3.347 1.00 . A A . 4 LYS HE2 1 1 19 12902 1 1 4 LYS HE3 H -9.466 -0.167 -4.991 1.00 . A A . 4 LYS HE3 1 1 19 12903 1 1 4 LYS HG2 H -7.196 2.036 -3.123 1.00 . A A . 4 LYS HG2 1 1 19 12904 1 1 4 LYS HG3 H -8.868 1.676 -2.704 1.00 . A A . 4 LYS HG3 1 1 19 12905 1 1 4 LYS HZ1 H -9.552 -2.694 -4.464 1.00 . A A . 4 LYS HZ1 1 1 19 12906 1 1 4 LYS HZ2 H -7.963 -2.469 -3.924 1.00 . A A . 4 LYS HZ2 1 1 19 12907 1 1 4 LYS HZ3 H -8.377 -2.104 -5.525 1.00 . A A . 4 LYS HZ3 1 1 19 12908 1 1 4 LYS N N -7.995 3.323 -6.869 1.00 . A A . 4 LYS N 1 1 19 12909 1 1 4 LYS NZ N -8.717 -2.084 -4.544 1.00 . A A . 4 LYS NZ 1 1 19 12910 1 1 4 LYS O O -7.906 0.489 -7.168 1.00 . A A . 4 LYS O 1 1 19 12911 1 1 5 ALA C C -4.309 -1.130 -5.690 1.00 . A A . 5 ALA C 1 1 19 12912 1 1 5 ALA CA C -5.439 -0.661 -6.586 1.00 . A A . 5 ALA CA 1 1 19 12913 1 1 5 ALA CB C -4.964 -0.550 -8.029 1.00 . A A . 5 ALA CB 1 1 19 12914 1 1 5 ALA H H -5.361 1.148 -5.498 1.00 . A A . 5 ALA H 1 1 19 12915 1 1 5 ALA HA H -6.249 -1.375 -6.543 1.00 . A A . 5 ALA HA 1 1 19 12916 1 1 5 ALA HB1 H -5.552 0.195 -8.545 1.00 . A A . 5 ALA HB1 1 1 19 12917 1 1 5 ALA HB2 H -5.081 -1.505 -8.521 1.00 . A A . 5 ALA HB2 1 1 19 12918 1 1 5 ALA HB3 H -3.923 -0.262 -8.045 1.00 . A A . 5 ALA HB3 1 1 19 12919 1 1 5 ALA N N -5.931 0.619 -6.106 1.00 . A A . 5 ALA N 1 1 19 12920 1 1 5 ALA O O -3.434 -0.342 -5.339 1.00 . A A . 5 ALA O 1 1 19 12921 1 1 6 GLU C C -1.979 -2.935 -5.177 1.00 . A A . 6 GLU C 1 1 19 12922 1 1 6 GLU CA C -3.305 -2.942 -4.439 1.00 . A A . 6 GLU CA 1 1 19 12923 1 1 6 GLU CB C -3.642 -4.371 -3.977 1.00 . A A . 6 GLU CB 1 1 19 12924 1 1 6 GLU CD C -6.152 -3.920 -3.772 1.00 . A A . 6 GLU CD 1 1 19 12925 1 1 6 GLU CG C -4.905 -4.497 -3.123 1.00 . A A . 6 GLU CG 1 1 19 12926 1 1 6 GLU H H -5.065 -2.979 -5.602 1.00 . A A . 6 GLU H 1 1 19 12927 1 1 6 GLU HA H -3.225 -2.300 -3.573 1.00 . A A . 6 GLU HA 1 1 19 12928 1 1 6 GLU HB2 H -3.752 -5.003 -4.841 1.00 . A A . 6 GLU HB2 1 1 19 12929 1 1 6 GLU HB3 H -2.811 -4.739 -3.392 1.00 . A A . 6 GLU HB3 1 1 19 12930 1 1 6 GLU HG2 H -5.082 -5.543 -2.924 1.00 . A A . 6 GLU HG2 1 1 19 12931 1 1 6 GLU HG3 H -4.737 -3.983 -2.187 1.00 . A A . 6 GLU HG3 1 1 19 12932 1 1 6 GLU N N -4.335 -2.395 -5.304 1.00 . A A . 6 GLU N 1 1 19 12933 1 1 6 GLU O O -1.935 -3.214 -6.377 1.00 . A A . 6 GLU O 1 1 19 12934 1 1 6 GLU OE1 O -6.446 -4.258 -4.934 1.00 . A A . 6 GLU OE1 1 1 19 12935 1 1 6 GLU OE2 O -6.845 -3.116 -3.120 1.00 . A A . 6 GLU OE2 1 1 19 12936 1 1 7 CYS C C 0.733 -3.850 -5.774 1.00 . A A . 7 CYS C 1 1 19 12937 1 1 7 CYS CA C 0.414 -2.534 -5.067 1.00 . A A . 7 CYS CA 1 1 19 12938 1 1 7 CYS CB C 1.484 -2.232 -4.010 1.00 . A A . 7 CYS CB 1 1 19 12939 1 1 7 CYS H H -1.036 -2.362 -3.519 1.00 . A A . 7 CYS H 1 1 19 12940 1 1 7 CYS HA H 0.410 -1.740 -5.800 1.00 . A A . 7 CYS HA 1 1 19 12941 1 1 7 CYS HB2 H 1.187 -1.359 -3.446 1.00 . A A . 7 CYS HB2 1 1 19 12942 1 1 7 CYS HB3 H 1.567 -3.076 -3.340 1.00 . A A . 7 CYS HB3 1 1 19 12943 1 1 7 CYS N N -0.916 -2.593 -4.467 1.00 . A A . 7 CYS N 1 1 19 12944 1 1 7 CYS O O 0.649 -4.921 -5.171 1.00 . A A . 7 CYS O 1 1 19 12945 1 1 7 CYS SG S 3.142 -1.906 -4.705 1.00 . A A . 7 CYS SG 1 1 19 12946 1 1 8 PRO C C 2.479 -5.825 -7.256 1.00 . A A . 8 PRO C 1 1 19 12947 1 1 8 PRO CA C 1.388 -4.967 -7.881 1.00 . A A . 8 PRO CA 1 1 19 12948 1 1 8 PRO CB C 1.865 -4.379 -9.212 1.00 . A A . 8 PRO CB 1 1 19 12949 1 1 8 PRO CD C 1.168 -2.539 -7.860 1.00 . A A . 8 PRO CD 1 1 19 12950 1 1 8 PRO CG C 1.237 -3.031 -9.278 1.00 . A A . 8 PRO CG 1 1 19 12951 1 1 8 PRO HA H 0.508 -5.572 -8.046 1.00 . A A . 8 PRO HA 1 1 19 12952 1 1 8 PRO HB2 H 2.944 -4.314 -9.213 1.00 . A A . 8 PRO HB2 1 1 19 12953 1 1 8 PRO HB3 H 1.536 -5.008 -10.025 1.00 . A A . 8 PRO HB3 1 1 19 12954 1 1 8 PRO HD2 H 2.062 -1.987 -7.609 1.00 . A A . 8 PRO HD2 1 1 19 12955 1 1 8 PRO HD3 H 0.291 -1.927 -7.715 1.00 . A A . 8 PRO HD3 1 1 19 12956 1 1 8 PRO HG2 H 1.848 -2.370 -9.876 1.00 . A A . 8 PRO HG2 1 1 19 12957 1 1 8 PRO HG3 H 0.245 -3.108 -9.697 1.00 . A A . 8 PRO HG3 1 1 19 12958 1 1 8 PRO N N 1.079 -3.781 -7.073 1.00 . A A . 8 PRO N 1 1 19 12959 1 1 8 PRO O O 2.380 -7.050 -7.218 1.00 . A A . 8 PRO O 1 1 19 12960 1 1 9 THR C C 4.367 -6.020 -4.621 1.00 . A A . 9 THR C 1 1 19 12961 1 1 9 THR CA C 4.613 -5.875 -6.118 1.00 . A A . 9 THR CA 1 1 19 12962 1 1 9 THR CB C 5.952 -5.150 -6.360 1.00 . A A . 9 THR CB 1 1 19 12963 1 1 9 THR CG2 C 6.400 -5.312 -7.805 1.00 . A A . 9 THR CG2 1 1 19 12964 1 1 9 THR H H 3.532 -4.197 -6.800 1.00 . A A . 9 THR H 1 1 19 12965 1 1 9 THR HA H 4.676 -6.859 -6.558 1.00 . A A . 9 THR HA 1 1 19 12966 1 1 9 THR HB H 6.701 -5.587 -5.716 1.00 . A A . 9 THR HB 1 1 19 12967 1 1 9 THR HG1 H 5.278 -3.649 -5.254 1.00 . A A . 9 THR HG1 1 1 19 12968 1 1 9 THR HG21 H 6.094 -6.282 -8.170 1.00 . A A . 9 THR HG21 1 1 19 12969 1 1 9 THR HG22 H 7.476 -5.230 -7.860 1.00 . A A . 9 THR HG22 1 1 19 12970 1 1 9 THR HG23 H 5.949 -4.541 -8.411 1.00 . A A . 9 THR HG23 1 1 19 12971 1 1 9 THR N N 3.514 -5.174 -6.753 1.00 . A A . 9 THR N 1 1 19 12972 1 1 9 THR O O 5.254 -5.755 -3.810 1.00 . A A . 9 THR O 1 1 19 12973 1 1 9 THR OG1 O 5.827 -3.751 -6.049 1.00 . A A . 9 THR OG1 1 1 19 12974 1 1 10 TRP C C 1.912 -7.806 -2.657 1.00 . A A . 10 TRP C 1 1 19 12975 1 1 10 TRP CA C 2.811 -6.595 -2.859 1.00 . A A . 10 TRP CA 1 1 19 12976 1 1 10 TRP CB C 2.098 -5.346 -2.334 1.00 . A A . 10 TRP CB 1 1 19 12977 1 1 10 TRP CD1 C 0.857 -5.981 -0.185 1.00 . A A . 10 TRP CD1 1 1 19 12978 1 1 10 TRP CD2 C 2.699 -4.748 0.139 1.00 . A A . 10 TRP CD2 1 1 19 12979 1 1 10 TRP CE2 C 2.132 -5.038 1.393 1.00 . A A . 10 TRP CE2 1 1 19 12980 1 1 10 TRP CE3 C 3.862 -3.976 0.086 1.00 . A A . 10 TRP CE3 1 1 19 12981 1 1 10 TRP CG C 1.882 -5.375 -0.854 1.00 . A A . 10 TRP CG 1 1 19 12982 1 1 10 TRP CH2 C 3.829 -3.823 2.500 1.00 . A A . 10 TRP CH2 1 1 19 12983 1 1 10 TRP CZ2 C 2.694 -4.579 2.585 1.00 . A A . 10 TRP CZ2 1 1 19 12984 1 1 10 TRP CZ3 C 4.412 -3.520 1.266 1.00 . A A . 10 TRP CZ3 1 1 19 12985 1 1 10 TRP H H 2.485 -6.622 -4.947 1.00 . A A . 10 TRP H 1 1 19 12986 1 1 10 TRP HA H 3.724 -6.738 -2.302 1.00 . A A . 10 TRP HA 1 1 19 12987 1 1 10 TRP HB2 H 2.690 -4.475 -2.569 1.00 . A A . 10 TRP HB2 1 1 19 12988 1 1 10 TRP HB3 H 1.133 -5.261 -2.812 1.00 . A A . 10 TRP HB3 1 1 19 12989 1 1 10 TRP HD1 H 0.058 -6.534 -0.668 1.00 . A A . 10 TRP HD1 1 1 19 12990 1 1 10 TRP HE1 H 0.413 -6.157 1.868 1.00 . A A . 10 TRP HE1 1 1 19 12991 1 1 10 TRP HE3 H 4.328 -3.732 -0.857 1.00 . A A . 10 TRP HE3 1 1 19 12992 1 1 10 TRP HH2 H 4.294 -3.444 3.398 1.00 . A A . 10 TRP HH2 1 1 19 12993 1 1 10 TRP HZ2 H 2.261 -4.801 3.548 1.00 . A A . 10 TRP HZ2 1 1 19 12994 1 1 10 TRP HZ3 H 5.305 -2.914 1.244 1.00 . A A . 10 TRP HZ3 1 1 19 12995 1 1 10 TRP N N 3.160 -6.430 -4.257 1.00 . A A . 10 TRP N 1 1 19 12996 1 1 10 TRP NE1 N 1.010 -5.800 1.171 1.00 . A A . 10 TRP NE1 1 1 19 12997 1 1 10 TRP O O 0.815 -7.884 -3.211 1.00 . A A . 10 TRP O 1 1 19 12998 1 1 11 ASP C C 1.988 -10.389 -0.115 1.00 . A A . 11 ASP C 1 1 19 12999 1 1 11 ASP CA C 1.619 -9.931 -1.518 1.00 . A A . 11 ASP CA 1 1 19 13000 1 1 11 ASP CB C 1.890 -11.040 -2.539 1.00 . A A . 11 ASP CB 1 1 19 13001 1 1 11 ASP CG C 0.782 -12.075 -2.563 1.00 . A A . 11 ASP CG 1 1 19 13002 1 1 11 ASP H H 3.247 -8.595 -1.409 1.00 . A A . 11 ASP H 1 1 19 13003 1 1 11 ASP HA H 0.569 -9.677 -1.538 1.00 . A A . 11 ASP HA 1 1 19 13004 1 1 11 ASP HB2 H 1.973 -10.603 -3.524 1.00 . A A . 11 ASP HB2 1 1 19 13005 1 1 11 ASP HB3 H 2.817 -11.535 -2.288 1.00 . A A . 11 ASP HB3 1 1 19 13006 1 1 11 ASP N N 2.375 -8.730 -1.833 1.00 . A A . 11 ASP N 1 1 19 13007 1 1 11 ASP O O 2.466 -11.500 0.097 1.00 . A A . 11 ASP O 1 1 19 13008 1 1 11 ASP OD1 O -0.381 -11.690 -2.825 1.00 . A A . 11 ASP OD1 1 1 19 13009 1 1 11 ASP OD2 O 1.063 -13.263 -2.326 1.00 . A A . 11 ASP OD2 1 1 19 13010 1 1 12 SER C C 1.220 -8.983 3.169 1.00 . A A . 12 SER C 1 1 19 13011 1 1 12 SER CA C 2.125 -9.777 2.231 1.00 . A A . 12 SER CA 1 1 19 13012 1 1 12 SER CB C 3.594 -9.438 2.497 1.00 . A A . 12 SER CB 1 1 19 13013 1 1 12 SER H H 1.435 -8.617 0.611 1.00 . A A . 12 SER H 1 1 19 13014 1 1 12 SER HA H 1.969 -10.831 2.403 1.00 . A A . 12 SER HA 1 1 19 13015 1 1 12 SER HB2 H 3.753 -8.382 2.335 1.00 . A A . 12 SER HB2 1 1 19 13016 1 1 12 SER HB3 H 3.839 -9.686 3.520 1.00 . A A . 12 SER HB3 1 1 19 13017 1 1 12 SER HG H 3.924 -10.796 1.117 1.00 . A A . 12 SER HG 1 1 19 13018 1 1 12 SER N N 1.794 -9.496 0.844 1.00 . A A . 12 SER N 1 1 19 13019 1 1 12 SER O O 0.387 -8.189 2.721 1.00 . A A . 12 SER O 1 1 19 13020 1 1 12 SER OG O 4.449 -10.166 1.632 1.00 . A A . 12 SER OG 1 1 19 13021 1 1 13 VAL C C 1.082 -7.113 5.724 1.00 . A A . 13 VAL C 1 1 19 13022 1 1 13 VAL CA C 0.584 -8.535 5.477 1.00 . A A . 13 VAL CA 1 1 19 13023 1 1 13 VAL CB C 0.607 -9.323 6.807 1.00 . A A . 13 VAL CB 1 1 19 13024 1 1 13 VAL CG1 C -0.211 -8.618 7.879 1.00 . A A . 13 VAL CG1 1 1 19 13025 1 1 13 VAL CG2 C 0.100 -10.741 6.593 1.00 . A A . 13 VAL CG2 1 1 19 13026 1 1 13 VAL H H 2.060 -9.857 4.752 1.00 . A A . 13 VAL H 1 1 19 13027 1 1 13 VAL HA H -0.436 -8.494 5.124 1.00 . A A . 13 VAL HA 1 1 19 13028 1 1 13 VAL HB H 1.630 -9.379 7.148 1.00 . A A . 13 VAL HB 1 1 19 13029 1 1 13 VAL HG11 H -0.896 -7.926 7.413 1.00 . A A . 13 VAL HG11 1 1 19 13030 1 1 13 VAL HG12 H 0.451 -8.079 8.540 1.00 . A A . 13 VAL HG12 1 1 19 13031 1 1 13 VAL HG13 H -0.768 -9.350 8.446 1.00 . A A . 13 VAL HG13 1 1 19 13032 1 1 13 VAL HG21 H 0.926 -11.382 6.322 1.00 . A A . 13 VAL HG21 1 1 19 13033 1 1 13 VAL HG22 H -0.634 -10.746 5.801 1.00 . A A . 13 VAL HG22 1 1 19 13034 1 1 13 VAL HG23 H -0.352 -11.103 7.505 1.00 . A A . 13 VAL HG23 1 1 19 13035 1 1 13 VAL N N 1.384 -9.210 4.465 1.00 . A A . 13 VAL N 1 1 19 13036 1 1 13 VAL O O 2.208 -6.903 6.175 1.00 . A A . 13 VAL O 1 1 19 13037 1 1 14 CYS C C 0.160 -4.320 7.037 1.00 . A A . 14 CYS C 1 1 19 13038 1 1 14 CYS CA C 0.558 -4.742 5.629 1.00 . A A . 14 CYS CA 1 1 19 13039 1 1 14 CYS CB C -0.179 -3.884 4.595 1.00 . A A . 14 CYS CB 1 1 19 13040 1 1 14 CYS H H -0.657 -6.378 5.078 1.00 . A A . 14 CYS H 1 1 19 13041 1 1 14 CYS HA H 1.623 -4.621 5.506 1.00 . A A . 14 CYS HA 1 1 19 13042 1 1 14 CYS HB2 H -0.103 -4.360 3.629 1.00 . A A . 14 CYS HB2 1 1 19 13043 1 1 14 CYS HB3 H -1.221 -3.821 4.874 1.00 . A A . 14 CYS HB3 1 1 19 13044 1 1 14 CYS N N 0.228 -6.144 5.432 1.00 . A A . 14 CYS N 1 1 19 13045 1 1 14 CYS O O -1.022 -4.344 7.389 1.00 . A A . 14 CYS O 1 1 19 13046 1 1 14 CYS SG S 0.448 -2.182 4.412 1.00 . A A . 14 CYS SG 1 1 19 13047 1 1 15 ILE C C 1.211 -2.044 9.375 1.00 . A A . 15 ILE C 1 1 19 13048 1 1 15 ILE CA C 0.882 -3.521 9.206 1.00 . A A . 15 ILE CA 1 1 19 13049 1 1 15 ILE CB C 1.702 -4.350 10.220 1.00 . A A . 15 ILE CB 1 1 19 13050 1 1 15 ILE CD1 C 2.255 -6.739 10.928 1.00 . A A . 15 ILE CD1 1 1 19 13051 1 1 15 ILE CG1 C 1.420 -5.845 10.036 1.00 . A A . 15 ILE CG1 1 1 19 13052 1 1 15 ILE CG2 C 1.380 -3.918 11.646 1.00 . A A . 15 ILE CG2 1 1 19 13053 1 1 15 ILE H H 2.060 -3.951 7.505 1.00 . A A . 15 ILE H 1 1 19 13054 1 1 15 ILE HA H -0.169 -3.673 9.410 1.00 . A A . 15 ILE HA 1 1 19 13055 1 1 15 ILE HB H 2.749 -4.163 10.041 1.00 . A A . 15 ILE HB 1 1 19 13056 1 1 15 ILE HD11 H 3.152 -7.034 10.404 1.00 . A A . 15 ILE HD11 1 1 19 13057 1 1 15 ILE HD12 H 1.686 -7.619 11.190 1.00 . A A . 15 ILE HD12 1 1 19 13058 1 1 15 ILE HD13 H 2.523 -6.203 11.827 1.00 . A A . 15 ILE HD13 1 1 19 13059 1 1 15 ILE HG12 H 0.381 -6.038 10.256 1.00 . A A . 15 ILE HG12 1 1 19 13060 1 1 15 ILE HG13 H 1.621 -6.118 9.010 1.00 . A A . 15 ILE HG13 1 1 19 13061 1 1 15 ILE HG21 H 0.472 -4.405 11.973 1.00 . A A . 15 ILE HG21 1 1 19 13062 1 1 15 ILE HG22 H 1.245 -2.847 11.677 1.00 . A A . 15 ILE HG22 1 1 19 13063 1 1 15 ILE HG23 H 2.193 -4.198 12.299 1.00 . A A . 15 ILE HG23 1 1 19 13064 1 1 15 ILE N N 1.142 -3.943 7.839 1.00 . A A . 15 ILE N 1 1 19 13065 1 1 15 ILE O O 0.387 -1.260 9.843 1.00 . A A . 15 ILE O 1 1 19 13066 1 1 16 ASN C C 2.542 0.465 7.792 1.00 . A A . 16 ASN C 1 1 19 13067 1 1 16 ASN CA C 2.860 -0.289 9.080 1.00 . A A . 16 ASN CA 1 1 19 13068 1 1 16 ASN CB C 4.356 -0.221 9.408 1.00 . A A . 16 ASN CB 1 1 19 13069 1 1 16 ASN CG C 4.856 1.202 9.592 1.00 . A A . 16 ASN CG 1 1 19 13070 1 1 16 ASN H H 3.027 -2.339 8.609 1.00 . A A . 16 ASN H 1 1 19 13071 1 1 16 ASN HA H 2.306 0.169 9.888 1.00 . A A . 16 ASN HA 1 1 19 13072 1 1 16 ASN HB2 H 4.542 -0.766 10.321 1.00 . A A . 16 ASN HB2 1 1 19 13073 1 1 16 ASN HB3 H 4.914 -0.678 8.603 1.00 . A A . 16 ASN HB3 1 1 19 13074 1 1 16 ASN HD21 H 6.605 0.726 8.782 1.00 . A A . 16 ASN HD21 1 1 19 13075 1 1 16 ASN HD22 H 6.436 2.365 9.302 1.00 . A A . 16 ASN HD22 1 1 19 13076 1 1 16 ASN N N 2.420 -1.671 8.981 1.00 . A A . 16 ASN N 1 1 19 13077 1 1 16 ASN ND2 N 6.088 1.457 9.179 1.00 . A A . 16 ASN ND2 1 1 19 13078 1 1 16 ASN O O 2.607 -0.096 6.698 1.00 . A A . 16 ASN O 1 1 19 13079 1 1 16 ASN OD1 O 4.154 2.058 10.122 1.00 . A A . 16 ASN OD1 1 1 19 13080 1 1 17 LYS C C 2.969 2.783 5.829 1.00 . A A . 17 LYS C 1 1 19 13081 1 1 17 LYS CA C 1.813 2.592 6.821 1.00 . A A . 17 LYS CA 1 1 19 13082 1 1 17 LYS CB C 1.367 3.953 7.371 1.00 . A A . 17 LYS CB 1 1 19 13083 1 1 17 LYS CD C -0.628 4.549 5.952 1.00 . A A . 17 LYS CD 1 1 19 13084 1 1 17 LYS CE C -1.343 5.717 5.282 1.00 . A A . 17 LYS CE 1 1 19 13085 1 1 17 LYS CG C 0.797 4.914 6.337 1.00 . A A . 17 LYS CG 1 1 19 13086 1 1 17 LYS H H 2.134 2.097 8.852 1.00 . A A . 17 LYS H 1 1 19 13087 1 1 17 LYS HA H 0.982 2.135 6.306 1.00 . A A . 17 LYS HA 1 1 19 13088 1 1 17 LYS HB2 H 0.606 3.785 8.118 1.00 . A A . 17 LYS HB2 1 1 19 13089 1 1 17 LYS HB3 H 2.215 4.428 7.841 1.00 . A A . 17 LYS HB3 1 1 19 13090 1 1 17 LYS HD2 H -0.603 3.715 5.266 1.00 . A A . 17 LYS HD2 1 1 19 13091 1 1 17 LYS HD3 H -1.171 4.270 6.843 1.00 . A A . 17 LYS HD3 1 1 19 13092 1 1 17 LYS HE2 H -2.355 5.419 5.054 1.00 . A A . 17 LYS HE2 1 1 19 13093 1 1 17 LYS HE3 H -1.361 6.551 5.968 1.00 . A A . 17 LYS HE3 1 1 19 13094 1 1 17 LYS HG2 H 0.803 5.913 6.747 1.00 . A A . 17 LYS HG2 1 1 19 13095 1 1 17 LYS HG3 H 1.418 4.884 5.453 1.00 . A A . 17 LYS HG3 1 1 19 13096 1 1 17 LYS HZ1 H -0.379 5.302 3.477 1.00 . A A . 17 LYS HZ1 1 1 19 13097 1 1 17 LYS HZ2 H 0.166 6.712 4.233 1.00 . A A . 17 LYS HZ2 1 1 19 13098 1 1 17 LYS HZ3 H -1.326 6.706 3.434 1.00 . A A . 17 LYS HZ3 1 1 19 13099 1 1 17 LYS N N 2.177 1.730 7.942 1.00 . A A . 17 LYS N 1 1 19 13100 1 1 17 LYS NZ N -0.672 6.137 4.027 1.00 . A A . 17 LYS NZ 1 1 19 13101 1 1 17 LYS O O 2.754 2.774 4.617 1.00 . A A . 17 LYS O 1 1 19 13102 1 1 18 LYS C C 5.560 2.173 4.402 1.00 . A A . 18 LYS C 1 1 19 13103 1 1 18 LYS CA C 5.367 3.224 5.514 1.00 . A A . 18 LYS CA 1 1 19 13104 1 1 18 LYS CB C 6.632 3.327 6.376 1.00 . A A . 18 LYS CB 1 1 19 13105 1 1 18 LYS CD C 9.104 3.808 6.477 1.00 . A A . 18 LYS CD 1 1 19 13106 1 1 18 LYS CE C 10.342 4.180 5.675 1.00 . A A . 18 LYS CE 1 1 19 13107 1 1 18 LYS CG C 7.881 3.684 5.582 1.00 . A A . 18 LYS CG 1 1 19 13108 1 1 18 LYS H H 4.276 3.002 7.326 1.00 . A A . 18 LYS H 1 1 19 13109 1 1 18 LYS HA H 5.216 4.178 5.033 1.00 . A A . 18 LYS HA 1 1 19 13110 1 1 18 LYS HB2 H 6.480 4.087 7.129 1.00 . A A . 18 LYS HB2 1 1 19 13111 1 1 18 LYS HB3 H 6.800 2.379 6.864 1.00 . A A . 18 LYS HB3 1 1 19 13112 1 1 18 LYS HD2 H 8.922 4.573 7.216 1.00 . A A . 18 LYS HD2 1 1 19 13113 1 1 18 LYS HD3 H 9.275 2.862 6.970 1.00 . A A . 18 LYS HD3 1 1 19 13114 1 1 18 LYS HE2 H 10.523 3.410 4.939 1.00 . A A . 18 LYS HE2 1 1 19 13115 1 1 18 LYS HE3 H 10.161 5.119 5.174 1.00 . A A . 18 LYS HE3 1 1 19 13116 1 1 18 LYS HG2 H 8.062 2.911 4.850 1.00 . A A . 18 LYS HG2 1 1 19 13117 1 1 18 LYS HG3 H 7.718 4.626 5.080 1.00 . A A . 18 LYS HG3 1 1 19 13118 1 1 18 LYS HZ1 H 11.462 5.157 7.144 1.00 . A A . 18 LYS HZ1 1 1 19 13119 1 1 18 LYS HZ2 H 12.400 4.414 5.949 1.00 . A A . 18 LYS HZ2 1 1 19 13120 1 1 18 LYS HZ3 H 11.654 3.475 7.142 1.00 . A A . 18 LYS HZ3 1 1 19 13121 1 1 18 LYS N N 4.181 2.985 6.352 1.00 . A A . 18 LYS N 1 1 19 13122 1 1 18 LYS NZ N 11.549 4.316 6.538 1.00 . A A . 18 LYS NZ 1 1 19 13123 1 1 18 LYS O O 5.661 2.548 3.236 1.00 . A A . 18 LYS O 1 1 19 13124 1 1 19 PRO C C 4.860 -0.064 2.533 1.00 . A A . 19 PRO C 1 1 19 13125 1 1 19 PRO CA C 5.819 -0.198 3.712 1.00 . A A . 19 PRO CA 1 1 19 13126 1 1 19 PRO CB C 5.508 -1.478 4.488 1.00 . A A . 19 PRO CB 1 1 19 13127 1 1 19 PRO CD C 5.550 0.285 6.083 1.00 . A A . 19 PRO CD 1 1 19 13128 1 1 19 PRO CG C 5.907 -1.162 5.882 1.00 . A A . 19 PRO CG 1 1 19 13129 1 1 19 PRO HA H 6.836 -0.228 3.351 1.00 . A A . 19 PRO HA 1 1 19 13130 1 1 19 PRO HB2 H 4.451 -1.695 4.418 1.00 . A A . 19 PRO HB2 1 1 19 13131 1 1 19 PRO HB3 H 6.076 -2.303 4.087 1.00 . A A . 19 PRO HB3 1 1 19 13132 1 1 19 PRO HD2 H 4.550 0.374 6.481 1.00 . A A . 19 PRO HD2 1 1 19 13133 1 1 19 PRO HD3 H 6.262 0.760 6.742 1.00 . A A . 19 PRO HD3 1 1 19 13134 1 1 19 PRO HG2 H 5.360 -1.786 6.573 1.00 . A A . 19 PRO HG2 1 1 19 13135 1 1 19 PRO HG3 H 6.971 -1.306 6.003 1.00 . A A . 19 PRO HG3 1 1 19 13136 1 1 19 PRO N N 5.629 0.857 4.725 1.00 . A A . 19 PRO N 1 1 19 13137 1 1 19 PRO O O 5.261 -0.173 1.369 1.00 . A A . 19 PRO O 1 1 19 13138 1 1 20 CYS C C 2.833 1.569 0.980 1.00 . A A . 20 CYS C 1 1 19 13139 1 1 20 CYS CA C 2.575 0.323 1.824 1.00 . A A . 20 CYS CA 1 1 19 13140 1 1 20 CYS CB C 1.191 0.395 2.471 1.00 . A A . 20 CYS CB 1 1 19 13141 1 1 20 CYS H H 3.344 0.256 3.789 1.00 . A A . 20 CYS H 1 1 19 13142 1 1 20 CYS HA H 2.623 -0.549 1.185 1.00 . A A . 20 CYS HA 1 1 19 13143 1 1 20 CYS HB2 H 1.096 -0.408 3.187 1.00 . A A . 20 CYS HB2 1 1 19 13144 1 1 20 CYS HB3 H 1.093 1.340 2.985 1.00 . A A . 20 CYS HB3 1 1 19 13145 1 1 20 CYS N N 3.596 0.176 2.845 1.00 . A A . 20 CYS N 1 1 19 13146 1 1 20 CYS O O 2.841 1.505 -0.249 1.00 . A A . 20 CYS O 1 1 19 13147 1 1 20 CYS SG S -0.194 0.254 1.299 1.00 . A A . 20 CYS SG 1 1 19 13148 1 1 21 VAL C C 4.543 3.809 0.027 1.00 . A A . 21 VAL C 1 1 19 13149 1 1 21 VAL CA C 3.342 3.955 0.955 1.00 . A A . 21 VAL CA 1 1 19 13150 1 1 21 VAL CB C 3.601 5.112 1.947 1.00 . A A . 21 VAL CB 1 1 19 13151 1 1 21 VAL CG1 C 3.890 6.412 1.209 1.00 . A A . 21 VAL CG1 1 1 19 13152 1 1 21 VAL CG2 C 2.418 5.289 2.883 1.00 . A A . 21 VAL CG2 1 1 19 13153 1 1 21 VAL H H 3.066 2.683 2.629 1.00 . A A . 21 VAL H 1 1 19 13154 1 1 21 VAL HA H 2.472 4.204 0.359 1.00 . A A . 21 VAL HA 1 1 19 13155 1 1 21 VAL HB H 4.468 4.862 2.542 1.00 . A A . 21 VAL HB 1 1 19 13156 1 1 21 VAL HG11 H 3.560 6.325 0.184 1.00 . A A . 21 VAL HG11 1 1 19 13157 1 1 21 VAL HG12 H 4.952 6.609 1.229 1.00 . A A . 21 VAL HG12 1 1 19 13158 1 1 21 VAL HG13 H 3.365 7.224 1.689 1.00 . A A . 21 VAL HG13 1 1 19 13159 1 1 21 VAL HG21 H 1.767 6.059 2.498 1.00 . A A . 21 VAL HG21 1 1 19 13160 1 1 21 VAL HG22 H 2.774 5.574 3.862 1.00 . A A . 21 VAL HG22 1 1 19 13161 1 1 21 VAL HG23 H 1.874 4.359 2.954 1.00 . A A . 21 VAL HG23 1 1 19 13162 1 1 21 VAL N N 3.068 2.698 1.646 1.00 . A A . 21 VAL N 1 1 19 13163 1 1 21 VAL O O 4.545 4.341 -1.080 1.00 . A A . 21 VAL O 1 1 19 13164 1 1 22 ALA C C 6.410 2.083 -1.590 1.00 . A A . 22 ALA C 1 1 19 13165 1 1 22 ALA CA C 6.751 2.850 -0.315 1.00 . A A . 22 ALA CA 1 1 19 13166 1 1 22 ALA CB C 7.795 2.098 0.498 1.00 . A A . 22 ALA CB 1 1 19 13167 1 1 22 ALA H H 5.486 2.669 1.375 1.00 . A A . 22 ALA H 1 1 19 13168 1 1 22 ALA HA H 7.160 3.813 -0.584 1.00 . A A . 22 ALA HA 1 1 19 13169 1 1 22 ALA HB1 H 7.823 1.066 0.181 1.00 . A A . 22 ALA HB1 1 1 19 13170 1 1 22 ALA HB2 H 7.538 2.146 1.545 1.00 . A A . 22 ALA HB2 1 1 19 13171 1 1 22 ALA HB3 H 8.764 2.549 0.343 1.00 . A A . 22 ALA HB3 1 1 19 13172 1 1 22 ALA N N 5.553 3.076 0.481 1.00 . A A . 22 ALA N 1 1 19 13173 1 1 22 ALA O O 6.790 2.492 -2.692 1.00 . A A . 22 ALA O 1 1 19 13174 1 1 23 CYS C C 4.408 0.985 -3.524 1.00 . A A . 23 CYS C 1 1 19 13175 1 1 23 CYS CA C 5.260 0.160 -2.567 1.00 . A A . 23 CYS CA 1 1 19 13176 1 1 23 CYS CB C 4.461 -1.053 -2.078 1.00 . A A . 23 CYS CB 1 1 19 13177 1 1 23 CYS H H 5.392 0.724 -0.526 1.00 . A A . 23 CYS H 1 1 19 13178 1 1 23 CYS HA H 6.147 -0.178 -3.081 1.00 . A A . 23 CYS HA 1 1 19 13179 1 1 23 CYS HB2 H 4.885 -1.399 -1.150 1.00 . A A . 23 CYS HB2 1 1 19 13180 1 1 23 CYS HB3 H 3.438 -0.751 -1.906 1.00 . A A . 23 CYS HB3 1 1 19 13181 1 1 23 CYS N N 5.673 0.984 -1.432 1.00 . A A . 23 CYS N 1 1 19 13182 1 1 23 CYS O O 4.580 0.938 -4.742 1.00 . A A . 23 CYS O 1 1 19 13183 1 1 23 CYS SG S 4.433 -2.465 -3.239 1.00 . A A . 23 CYS SG 1 1 19 13184 1 1 24 CYS C C 3.344 3.711 -4.430 1.00 . A A . 24 CYS C 1 1 19 13185 1 1 24 CYS CA C 2.596 2.581 -3.732 1.00 . A A . 24 CYS CA 1 1 19 13186 1 1 24 CYS CB C 1.508 3.144 -2.826 1.00 . A A . 24 CYS CB 1 1 19 13187 1 1 24 CYS H H 3.401 1.727 -1.975 1.00 . A A . 24 CYS H 1 1 19 13188 1 1 24 CYS HA H 2.132 1.960 -4.484 1.00 . A A . 24 CYS HA 1 1 19 13189 1 1 24 CYS HB2 H 1.968 3.667 -2.002 1.00 . A A . 24 CYS HB2 1 1 19 13190 1 1 24 CYS HB3 H 0.896 3.833 -3.384 1.00 . A A . 24 CYS HB3 1 1 19 13191 1 1 24 CYS N N 3.489 1.740 -2.956 1.00 . A A . 24 CYS N 1 1 19 13192 1 1 24 CYS O O 3.018 4.072 -5.557 1.00 . A A . 24 CYS O 1 1 19 13193 1 1 24 CYS SG S 0.421 1.862 -2.134 1.00 . A A . 24 CYS SG 1 1 19 13194 1 1 25 LYS C C 5.871 4.916 -5.566 1.00 . A A . 25 LYS C 1 1 19 13195 1 1 25 LYS CA C 5.103 5.375 -4.331 1.00 . A A . 25 LYS CA 1 1 19 13196 1 1 25 LYS CB C 6.040 5.980 -3.282 1.00 . A A . 25 LYS CB 1 1 19 13197 1 1 25 LYS CD C 5.266 8.277 -4.014 1.00 . A A . 25 LYS CD 1 1 19 13198 1 1 25 LYS CE C 4.119 8.247 -3.007 1.00 . A A . 25 LYS CE 1 1 19 13199 1 1 25 LYS CG C 6.453 7.417 -3.581 1.00 . A A . 25 LYS CG 1 1 19 13200 1 1 25 LYS H H 4.554 3.957 -2.855 1.00 . A A . 25 LYS H 1 1 19 13201 1 1 25 LYS HA H 4.396 6.132 -4.637 1.00 . A A . 25 LYS HA 1 1 19 13202 1 1 25 LYS HB2 H 5.545 5.964 -2.322 1.00 . A A . 25 LYS HB2 1 1 19 13203 1 1 25 LYS HB3 H 6.934 5.376 -3.225 1.00 . A A . 25 LYS HB3 1 1 19 13204 1 1 25 LYS HD2 H 5.599 9.298 -4.126 1.00 . A A . 25 LYS HD2 1 1 19 13205 1 1 25 LYS HD3 H 4.904 7.914 -4.965 1.00 . A A . 25 LYS HD3 1 1 19 13206 1 1 25 LYS HE2 H 3.253 8.707 -3.456 1.00 . A A . 25 LYS HE2 1 1 19 13207 1 1 25 LYS HE3 H 3.894 7.216 -2.774 1.00 . A A . 25 LYS HE3 1 1 19 13208 1 1 25 LYS HG2 H 6.887 7.847 -2.692 1.00 . A A . 25 LYS HG2 1 1 19 13209 1 1 25 LYS HG3 H 7.188 7.410 -4.374 1.00 . A A . 25 LYS HG3 1 1 19 13210 1 1 25 LYS HZ1 H 4.861 8.310 -1.057 1.00 . A A . 25 LYS HZ1 1 1 19 13211 1 1 25 LYS HZ2 H 3.575 9.372 -1.338 1.00 . A A . 25 LYS HZ2 1 1 19 13212 1 1 25 LYS HZ3 H 5.116 9.735 -1.934 1.00 . A A . 25 LYS HZ3 1 1 19 13213 1 1 25 LYS N N 4.337 4.277 -3.760 1.00 . A A . 25 LYS N 1 1 19 13214 1 1 25 LYS NZ N 4.443 8.966 -1.746 1.00 . A A . 25 LYS NZ 1 1 19 13215 1 1 25 LYS O O 5.840 5.584 -6.598 1.00 . A A . 25 LYS O 1 1 19 13216 1 1 26 LYS C C 6.269 2.832 -7.728 1.00 . A A . 26 LYS C 1 1 19 13217 1 1 26 LYS CA C 7.255 3.224 -6.627 1.00 . A A . 26 LYS CA 1 1 19 13218 1 1 26 LYS CB C 8.129 2.022 -6.237 1.00 . A A . 26 LYS CB 1 1 19 13219 1 1 26 LYS CD C 8.093 -0.344 -5.362 1.00 . A A . 26 LYS CD 1 1 19 13220 1 1 26 LYS CE C 7.872 -1.045 -6.692 1.00 . A A . 26 LYS CE 1 1 19 13221 1 1 26 LYS CG C 7.427 1.021 -5.340 1.00 . A A . 26 LYS CG 1 1 19 13222 1 1 26 LYS H H 6.496 3.248 -4.639 1.00 . A A . 26 LYS H 1 1 19 13223 1 1 26 LYS HA H 7.892 4.012 -7.003 1.00 . A A . 26 LYS HA 1 1 19 13224 1 1 26 LYS HB2 H 8.438 1.511 -7.136 1.00 . A A . 26 LYS HB2 1 1 19 13225 1 1 26 LYS HB3 H 9.006 2.383 -5.720 1.00 . A A . 26 LYS HB3 1 1 19 13226 1 1 26 LYS HD2 H 9.154 -0.219 -5.203 1.00 . A A . 26 LYS HD2 1 1 19 13227 1 1 26 LYS HD3 H 7.676 -0.950 -4.571 1.00 . A A . 26 LYS HD3 1 1 19 13228 1 1 26 LYS HE2 H 6.832 -0.946 -6.968 1.00 . A A . 26 LYS HE2 1 1 19 13229 1 1 26 LYS HE3 H 8.490 -0.572 -7.441 1.00 . A A . 26 LYS HE3 1 1 19 13230 1 1 26 LYS HG2 H 7.438 1.394 -4.327 1.00 . A A . 26 LYS HG2 1 1 19 13231 1 1 26 LYS HG3 H 6.404 0.916 -5.672 1.00 . A A . 26 LYS HG3 1 1 19 13232 1 1 26 LYS HZ1 H 7.355 -3.052 -6.436 1.00 . A A . 26 LYS HZ1 1 1 19 13233 1 1 26 LYS HZ2 H 8.895 -2.656 -5.849 1.00 . A A . 26 LYS HZ2 1 1 19 13234 1 1 26 LYS HZ3 H 8.639 -2.802 -7.514 1.00 . A A . 26 LYS HZ3 1 1 19 13235 1 1 26 LYS N N 6.526 3.759 -5.478 1.00 . A A . 26 LYS N 1 1 19 13236 1 1 26 LYS NZ N 8.217 -2.488 -6.618 1.00 . A A . 26 LYS NZ 1 1 19 13237 1 1 26 LYS O O 6.582 2.906 -8.918 1.00 . A A . 26 LYS O 1 1 19 13238 1 1 27 ALA C C 3.410 3.275 -8.929 1.00 . A A . 27 ALA C 1 1 19 13239 1 1 27 ALA CA C 4.012 2.045 -8.247 1.00 . A A . 27 ALA CA 1 1 19 13240 1 1 27 ALA CB C 2.932 1.251 -7.527 1.00 . A A . 27 ALA CB 1 1 19 13241 1 1 27 ALA H H 4.879 2.409 -6.352 1.00 . A A . 27 ALA H 1 1 19 13242 1 1 27 ALA HA H 4.452 1.408 -9.001 1.00 . A A . 27 ALA HA 1 1 19 13243 1 1 27 ALA HB1 H 2.635 0.411 -8.138 1.00 . A A . 27 ALA HB1 1 1 19 13244 1 1 27 ALA HB2 H 2.077 1.886 -7.348 1.00 . A A . 27 ALA HB2 1 1 19 13245 1 1 27 ALA HB3 H 3.317 0.892 -6.584 1.00 . A A . 27 ALA HB3 1 1 19 13246 1 1 27 ALA N N 5.067 2.432 -7.315 1.00 . A A . 27 ALA N 1 1 19 13247 1 1 27 ALA O O 2.595 3.147 -9.844 1.00 . A A . 27 ALA O 1 1 19 13248 1 1 28 LYS C C 2.024 6.145 -8.463 1.00 . A A . 28 LYS C 1 1 19 13249 1 1 28 LYS CA C 3.400 5.750 -9.005 1.00 . A A . 28 LYS CA 1 1 19 13250 1 1 28 LYS CB C 3.400 5.730 -10.537 1.00 . A A . 28 LYS CB 1 1 19 13251 1 1 28 LYS CD C 3.924 6.942 -12.682 1.00 . A A . 28 LYS CD 1 1 19 13252 1 1 28 LYS CE C 5.269 6.279 -12.983 1.00 . A A . 28 LYS CE 1 1 19 13253 1 1 28 LYS CG C 3.668 7.078 -11.184 1.00 . A A . 28 LYS CG 1 1 19 13254 1 1 28 LYS H H 4.501 4.458 -7.744 1.00 . A A . 28 LYS H 1 1 19 13255 1 1 28 LYS HA H 4.114 6.491 -8.674 1.00 . A A . 28 LYS HA 1 1 19 13256 1 1 28 LYS HB2 H 4.159 5.041 -10.874 1.00 . A A . 28 LYS HB2 1 1 19 13257 1 1 28 LYS HB3 H 2.436 5.379 -10.878 1.00 . A A . 28 LYS HB3 1 1 19 13258 1 1 28 LYS HD2 H 3.139 6.342 -13.115 1.00 . A A . 28 LYS HD2 1 1 19 13259 1 1 28 LYS HD3 H 3.912 7.926 -13.127 1.00 . A A . 28 LYS HD3 1 1 19 13260 1 1 28 LYS HE2 H 5.472 6.377 -14.038 1.00 . A A . 28 LYS HE2 1 1 19 13261 1 1 28 LYS HE3 H 6.038 6.793 -12.424 1.00 . A A . 28 LYS HE3 1 1 19 13262 1 1 28 LYS HG2 H 2.810 7.716 -11.033 1.00 . A A . 28 LYS HG2 1 1 19 13263 1 1 28 LYS HG3 H 4.535 7.523 -10.718 1.00 . A A . 28 LYS HG3 1 1 19 13264 1 1 28 LYS HZ1 H 5.805 4.289 -13.349 1.00 . A A . 28 LYS HZ1 1 1 19 13265 1 1 28 LYS HZ2 H 4.327 4.461 -12.546 1.00 . A A . 28 LYS HZ2 1 1 19 13266 1 1 28 LYS HZ3 H 5.776 4.698 -11.707 1.00 . A A . 28 LYS HZ3 1 1 19 13267 1 1 28 LYS N N 3.842 4.457 -8.473 1.00 . A A . 28 LYS N 1 1 19 13268 1 1 28 LYS NZ N 5.296 4.831 -12.622 1.00 . A A . 28 LYS NZ 1 1 19 13269 1 1 28 LYS O O 1.218 6.770 -9.157 1.00 . A A . 28 LYS O 1 1 19 13270 1 1 29 PHE C C 0.792 7.217 -5.491 1.00 . A A . 29 PHE C 1 1 19 13271 1 1 29 PHE CA C 0.529 6.145 -6.540 1.00 . A A . 29 PHE CA 1 1 19 13272 1 1 29 PHE CB C -0.119 4.911 -5.903 1.00 . A A . 29 PHE CB 1 1 19 13273 1 1 29 PHE CD1 C -0.041 3.266 -7.805 1.00 . A A . 29 PHE CD1 1 1 19 13274 1 1 29 PHE CD2 C -2.167 3.872 -6.918 1.00 . A A . 29 PHE CD2 1 1 19 13275 1 1 29 PHE CE1 C -0.656 2.425 -8.712 1.00 . A A . 29 PHE CE1 1 1 19 13276 1 1 29 PHE CE2 C -2.788 3.032 -7.822 1.00 . A A . 29 PHE CE2 1 1 19 13277 1 1 29 PHE CG C -0.788 4.000 -6.898 1.00 . A A . 29 PHE CG 1 1 19 13278 1 1 29 PHE CZ C -2.032 2.307 -8.720 1.00 . A A . 29 PHE CZ 1 1 19 13279 1 1 29 PHE H H 2.473 5.328 -6.697 1.00 . A A . 29 PHE H 1 1 19 13280 1 1 29 PHE HA H -0.141 6.550 -7.286 1.00 . A A . 29 PHE HA 1 1 19 13281 1 1 29 PHE HB2 H 0.643 4.341 -5.393 1.00 . A A . 29 PHE HB2 1 1 19 13282 1 1 29 PHE HB3 H -0.863 5.228 -5.185 1.00 . A A . 29 PHE HB3 1 1 19 13283 1 1 29 PHE HD1 H 1.036 3.356 -7.800 1.00 . A A . 29 PHE HD1 1 1 19 13284 1 1 29 PHE HD2 H -2.761 4.440 -6.216 1.00 . A A . 29 PHE HD2 1 1 19 13285 1 1 29 PHE HE1 H -0.061 1.859 -9.414 1.00 . A A . 29 PHE HE1 1 1 19 13286 1 1 29 PHE HE2 H -3.865 2.942 -7.825 1.00 . A A . 29 PHE HE2 1 1 19 13287 1 1 29 PHE HZ H -2.514 1.650 -9.428 1.00 . A A . 29 PHE HZ 1 1 19 13288 1 1 29 PHE N N 1.778 5.805 -7.207 1.00 . A A . 29 PHE N 1 1 19 13289 1 1 29 PHE O O 1.886 7.284 -4.931 1.00 . A A . 29 PHE O 1 1 19 13290 1 1 30 SER C C 0.210 8.655 -2.880 1.00 . A A . 30 SER C 1 1 19 13291 1 1 30 SER CA C -0.064 9.160 -4.297 1.00 . A A . 30 SER CA 1 1 19 13292 1 1 30 SER CB C -1.329 10.025 -4.314 1.00 . A A . 30 SER CB 1 1 19 13293 1 1 30 SER H H -1.035 7.970 -5.747 1.00 . A A . 30 SER H 1 1 19 13294 1 1 30 SER HA H 0.770 9.764 -4.609 1.00 . A A . 30 SER HA 1 1 19 13295 1 1 30 SER HB2 H -1.533 10.339 -5.327 1.00 . A A . 30 SER HB2 1 1 19 13296 1 1 30 SER HB3 H -2.163 9.445 -3.944 1.00 . A A . 30 SER HB3 1 1 19 13297 1 1 30 SER HG H -1.384 10.956 -2.590 1.00 . A A . 30 SER HG 1 1 19 13298 1 1 30 SER N N -0.196 8.066 -5.253 1.00 . A A . 30 SER N 1 1 19 13299 1 1 30 SER O O 1.121 9.145 -2.204 1.00 . A A . 30 SER O 1 1 19 13300 1 1 30 SER OG O -1.180 11.177 -3.503 1.00 . A A . 30 SER OG 1 1 19 13301 1 1 31 ASP C C -0.961 5.731 -0.973 1.00 . A A . 31 ASP C 1 1 19 13302 1 1 31 ASP CA C -0.408 7.146 -1.080 1.00 . A A . 31 ASP CA 1 1 19 13303 1 1 31 ASP CB C -1.102 8.048 -0.053 1.00 . A A . 31 ASP CB 1 1 19 13304 1 1 31 ASP CG C -0.939 7.533 1.363 1.00 . A A . 31 ASP CG 1 1 19 13305 1 1 31 ASP H H -1.284 7.331 -3.008 1.00 . A A . 31 ASP H 1 1 19 13306 1 1 31 ASP HA H 0.649 7.122 -0.864 1.00 . A A . 31 ASP HA 1 1 19 13307 1 1 31 ASP HB2 H -0.678 9.039 -0.108 1.00 . A A . 31 ASP HB2 1 1 19 13308 1 1 31 ASP HB3 H -2.157 8.098 -0.281 1.00 . A A . 31 ASP HB3 1 1 19 13309 1 1 31 ASP N N -0.574 7.686 -2.428 1.00 . A A . 31 ASP N 1 1 19 13310 1 1 31 ASP O O -1.866 5.349 -1.718 1.00 . A A . 31 ASP O 1 1 19 13311 1 1 31 ASP OD1 O 0.216 7.386 1.815 1.00 . A A . 31 ASP OD1 1 1 19 13312 1 1 31 ASP OD2 O -1.960 7.247 2.026 1.00 . A A . 31 ASP OD2 1 1 19 13313 1 1 32 GLY C C -1.340 3.373 1.587 1.00 . A A . 32 GLY C 1 1 19 13314 1 1 32 GLY CA C -0.847 3.603 0.174 1.00 . A A . 32 GLY CA 1 1 19 13315 1 1 32 GLY H H 0.300 5.340 0.525 1.00 . A A . 32 GLY H 1 1 19 13316 1 1 32 GLY HA2 H -1.647 3.380 -0.517 1.00 . A A . 32 GLY HA2 1 1 19 13317 1 1 32 GLY HA3 H -0.020 2.937 -0.020 1.00 . A A . 32 GLY HA3 1 1 19 13318 1 1 32 GLY N N -0.411 4.966 -0.038 1.00 . A A . 32 GLY N 1 1 19 13319 1 1 32 GLY O O -0.806 3.941 2.539 1.00 . A A . 32 GLY O 1 1 19 13320 1 1 33 HIS C C -3.173 0.726 3.168 1.00 . A A . 33 HIS C 1 1 19 13321 1 1 33 HIS CA C -2.926 2.225 3.031 1.00 . A A . 33 HIS CA 1 1 19 13322 1 1 33 HIS CB C -4.235 3.000 3.254 1.00 . A A . 33 HIS CB 1 1 19 13323 1 1 33 HIS CD2 C -6.385 2.215 2.018 1.00 . A A . 33 HIS CD2 1 1 19 13324 1 1 33 HIS CE1 C -6.062 3.252 0.115 1.00 . A A . 33 HIS CE1 1 1 19 13325 1 1 33 HIS CG C -5.220 2.899 2.121 1.00 . A A . 33 HIS CG 1 1 19 13326 1 1 33 HIS H H -2.732 2.105 0.921 1.00 . A A . 33 HIS H 1 1 19 13327 1 1 33 HIS HA H -2.210 2.526 3.783 1.00 . A A . 33 HIS HA 1 1 19 13328 1 1 33 HIS HB2 H -4.718 2.621 4.142 1.00 . A A . 33 HIS HB2 1 1 19 13329 1 1 33 HIS HB3 H -4.001 4.044 3.399 1.00 . A A . 33 HIS HB3 1 1 19 13330 1 1 33 HIS HD1 H -4.295 4.119 0.665 1.00 . A A . 33 HIS HD1 1 1 19 13331 1 1 33 HIS HD2 H -6.832 1.592 2.779 1.00 . A A . 33 HIS HD2 1 1 19 13332 1 1 33 HIS HE1 H -6.189 3.601 -0.899 1.00 . A A . 33 HIS HE1 1 1 19 13333 1 1 33 HIS N N -2.356 2.537 1.726 1.00 . A A . 33 HIS N 1 1 19 13334 1 1 33 HIS ND1 N -5.048 3.538 0.908 1.00 . A A . 33 HIS ND1 1 1 19 13335 1 1 33 HIS NE2 N -6.887 2.453 0.763 1.00 . A A . 33 HIS NE2 1 1 19 13336 1 1 33 HIS O O -3.712 0.091 2.261 1.00 . A A . 33 HIS O 1 1 19 13337 1 1 34 CYS C C -4.406 -1.627 4.701 1.00 . A A . 34 CYS C 1 1 19 13338 1 1 34 CYS CA C -2.931 -1.252 4.568 1.00 . A A . 34 CYS CA 1 1 19 13339 1 1 34 CYS CB C -2.194 -1.638 5.853 1.00 . A A . 34 CYS CB 1 1 19 13340 1 1 34 CYS H H -2.341 0.734 4.979 1.00 . A A . 34 CYS H 1 1 19 13341 1 1 34 CYS HA H -2.503 -1.798 3.741 1.00 . A A . 34 CYS HA 1 1 19 13342 1 1 34 CYS HB2 H -2.691 -1.177 6.693 1.00 . A A . 34 CYS HB2 1 1 19 13343 1 1 34 CYS HB3 H -2.231 -2.712 5.969 1.00 . A A . 34 CYS HB3 1 1 19 13344 1 1 34 CYS N N -2.768 0.172 4.301 1.00 . A A . 34 CYS N 1 1 19 13345 1 1 34 CYS O O -5.166 -0.959 5.402 1.00 . A A . 34 CYS O 1 1 19 13346 1 1 34 CYS SG S -0.441 -1.135 5.910 1.00 . A A . 34 CYS SG 1 1 19 13347 1 1 35 SER C C -6.444 -3.912 5.374 1.00 . A A . 35 SER C 1 1 19 13348 1 1 35 SER CA C -6.173 -3.175 4.069 1.00 . A A . 35 SER CA 1 1 19 13349 1 1 35 SER CB C -6.451 -4.107 2.886 1.00 . A A . 35 SER CB 1 1 19 13350 1 1 35 SER H H -4.143 -3.188 3.483 1.00 . A A . 35 SER H 1 1 19 13351 1 1 35 SER HA H -6.827 -2.319 4.006 1.00 . A A . 35 SER HA 1 1 19 13352 1 1 35 SER HB2 H -6.253 -3.581 1.965 1.00 . A A . 35 SER HB2 1 1 19 13353 1 1 35 SER HB3 H -5.803 -4.969 2.952 1.00 . A A . 35 SER HB3 1 1 19 13354 1 1 35 SER HG H -8.233 -4.222 2.079 1.00 . A A . 35 SER HG 1 1 19 13355 1 1 35 SER N N -4.799 -2.698 4.027 1.00 . A A . 35 SER N 1 1 19 13356 1 1 35 SER O O -5.525 -4.436 6.009 1.00 . A A . 35 SER O 1 1 19 13357 1 1 35 SER OG O -7.799 -4.549 2.874 1.00 . A A . 35 SER OG 1 1 19 13358 1 1 36 LYS C C -8.403 -6.116 6.681 1.00 . A A . 36 LYS C 1 1 19 13359 1 1 36 LYS CA C -8.121 -4.644 6.971 1.00 . A A . 36 LYS CA 1 1 19 13360 1 1 36 LYS CB C -9.373 -3.984 7.556 1.00 . A A . 36 LYS CB 1 1 19 13361 1 1 36 LYS CD C -11.309 -4.173 9.159 1.00 . A A . 36 LYS CD 1 1 19 13362 1 1 36 LYS CE C -11.931 -4.998 10.274 1.00 . A A . 36 LYS CE 1 1 19 13363 1 1 36 LYS CG C -10.012 -4.795 8.670 1.00 . A A . 36 LYS CG 1 1 19 13364 1 1 36 LYS H H -8.390 -3.532 5.198 1.00 . A A . 36 LYS H 1 1 19 13365 1 1 36 LYS HA H -7.315 -4.573 7.686 1.00 . A A . 36 LYS HA 1 1 19 13366 1 1 36 LYS HB2 H -9.106 -3.015 7.950 1.00 . A A . 36 LYS HB2 1 1 19 13367 1 1 36 LYS HB3 H -10.102 -3.856 6.769 1.00 . A A . 36 LYS HB3 1 1 19 13368 1 1 36 LYS HD2 H -11.103 -3.180 9.530 1.00 . A A . 36 LYS HD2 1 1 19 13369 1 1 36 LYS HD3 H -12.003 -4.115 8.333 1.00 . A A . 36 LYS HD3 1 1 19 13370 1 1 36 LYS HE2 H -11.261 -5.000 11.121 1.00 . A A . 36 LYS HE2 1 1 19 13371 1 1 36 LYS HE3 H -12.869 -4.545 10.560 1.00 . A A . 36 LYS HE3 1 1 19 13372 1 1 36 LYS HG2 H -10.221 -5.788 8.294 1.00 . A A . 36 LYS HG2 1 1 19 13373 1 1 36 LYS HG3 H -9.318 -4.861 9.495 1.00 . A A . 36 LYS HG3 1 1 19 13374 1 1 36 LYS HZ1 H -12.276 -7.018 10.690 1.00 . A A . 36 LYS HZ1 1 1 19 13375 1 1 36 LYS HZ2 H -11.390 -6.754 9.275 1.00 . A A . 36 LYS HZ2 1 1 19 13376 1 1 36 LYS HZ3 H -13.057 -6.463 9.295 1.00 . A A . 36 LYS HZ3 1 1 19 13377 1 1 36 LYS N N -7.709 -3.961 5.757 1.00 . A A . 36 LYS N 1 1 19 13378 1 1 36 LYS NZ N -12.181 -6.406 9.854 1.00 . A A . 36 LYS NZ 1 1 19 13379 1 1 36 LYS O O -8.318 -6.960 7.571 1.00 . A A . 36 LYS O 1 1 19 13380 1 1 37 ILE C C -7.820 -8.646 5.011 1.00 . A A . 37 ILE C 1 1 19 13381 1 1 37 ILE CA C -9.072 -7.764 5.009 1.00 . A A . 37 ILE CA 1 1 19 13382 1 1 37 ILE CB C -9.690 -7.779 3.596 1.00 . A A . 37 ILE CB 1 1 19 13383 1 1 37 ILE CD1 C -11.156 -6.452 1.998 1.00 . A A . 37 ILE CD1 1 1 19 13384 1 1 37 ILE CG1 C -10.706 -6.647 3.431 1.00 . A A . 37 ILE CG1 1 1 19 13385 1 1 37 ILE CG2 C -10.353 -9.124 3.319 1.00 . A A . 37 ILE CG2 1 1 19 13386 1 1 37 ILE H H -8.813 -5.677 4.778 1.00 . A A . 37 ILE H 1 1 19 13387 1 1 37 ILE HA H -9.793 -8.174 5.702 1.00 . A A . 37 ILE HA 1 1 19 13388 1 1 37 ILE HB H -8.894 -7.642 2.886 1.00 . A A . 37 ILE HB 1 1 19 13389 1 1 37 ILE HD11 H -11.207 -5.397 1.776 1.00 . A A . 37 ILE HD11 1 1 19 13390 1 1 37 ILE HD12 H -12.132 -6.896 1.863 1.00 . A A . 37 ILE HD12 1 1 19 13391 1 1 37 ILE HD13 H -10.449 -6.927 1.332 1.00 . A A . 37 ILE HD13 1 1 19 13392 1 1 37 ILE HG12 H -11.580 -6.864 4.027 1.00 . A A . 37 ILE HG12 1 1 19 13393 1 1 37 ILE HG13 H -10.264 -5.721 3.770 1.00 . A A . 37 ILE HG13 1 1 19 13394 1 1 37 ILE HG21 H -11.242 -8.972 2.725 1.00 . A A . 37 ILE HG21 1 1 19 13395 1 1 37 ILE HG22 H -10.622 -9.592 4.255 1.00 . A A . 37 ILE HG22 1 1 19 13396 1 1 37 ILE HG23 H -9.665 -9.761 2.783 1.00 . A A . 37 ILE HG23 1 1 19 13397 1 1 37 ILE N N -8.756 -6.404 5.433 1.00 . A A . 37 ILE N 1 1 19 13398 1 1 37 ILE O O -7.367 -9.099 6.057 1.00 . A A . 37 ILE O 1 1 19 13399 1 1 38 LEU C C -4.813 -8.897 3.957 1.00 . A A . 38 LEU C 1 1 19 13400 1 1 38 LEU CA C -6.072 -9.713 3.685 1.00 . A A . 38 LEU CA 1 1 19 13401 1 1 38 LEU CB C -6.006 -10.300 2.279 1.00 . A A . 38 LEU CB 1 1 19 13402 1 1 38 LEU CD1 C -5.381 -12.629 2.962 1.00 . A A . 38 LEU CD1 1 1 19 13403 1 1 38 LEU CD2 C -4.863 -11.825 0.651 1.00 . A A . 38 LEU CD2 1 1 19 13404 1 1 38 LEU CG C -4.993 -11.428 2.112 1.00 . A A . 38 LEU CG 1 1 19 13405 1 1 38 LEU H H -7.672 -8.498 3.025 1.00 . A A . 38 LEU H 1 1 19 13406 1 1 38 LEU HA H -6.133 -10.516 4.403 1.00 . A A . 38 LEU HA 1 1 19 13407 1 1 38 LEU HB2 H -6.983 -10.668 2.018 1.00 . A A . 38 LEU HB2 1 1 19 13408 1 1 38 LEU HB3 H -5.744 -9.509 1.593 1.00 . A A . 38 LEU HB3 1 1 19 13409 1 1 38 LEU HD11 H -5.779 -12.287 3.907 1.00 . A A . 38 LEU HD11 1 1 19 13410 1 1 38 LEU HD12 H -4.510 -13.241 3.139 1.00 . A A . 38 LEU HD12 1 1 19 13411 1 1 38 LEU HD13 H -6.130 -13.209 2.445 1.00 . A A . 38 LEU HD13 1 1 19 13412 1 1 38 LEU HD21 H -4.228 -11.115 0.141 1.00 . A A . 38 LEU HD21 1 1 19 13413 1 1 38 LEU HD22 H -5.840 -11.830 0.191 1.00 . A A . 38 LEU HD22 1 1 19 13414 1 1 38 LEU HD23 H -4.427 -12.810 0.584 1.00 . A A . 38 LEU HD23 1 1 19 13415 1 1 38 LEU HG H -4.032 -11.073 2.455 1.00 . A A . 38 LEU HG 1 1 19 13416 1 1 38 LEU N N -7.265 -8.884 3.825 1.00 . A A . 38 LEU N 1 1 19 13417 1 1 38 LEU O O -3.698 -9.316 3.651 1.00 . A A . 38 LEU O 1 1 19 13418 1 1 39 ARG C C -3.120 -6.418 3.639 1.00 . A A . 39 ARG C 1 1 19 13419 1 1 39 ARG CA C -3.939 -6.808 4.867 1.00 . A A . 39 ARG CA 1 1 19 13420 1 1 39 ARG CB C -3.031 -7.417 5.938 1.00 . A A . 39 ARG CB 1 1 19 13421 1 1 39 ARG CD C -4.655 -7.004 7.828 1.00 . A A . 39 ARG CD 1 1 19 13422 1 1 39 ARG CG C -3.230 -6.825 7.324 1.00 . A A . 39 ARG CG 1 1 19 13423 1 1 39 ARG CZ C -4.728 -5.200 9.528 1.00 . A A . 39 ARG CZ 1 1 19 13424 1 1 39 ARG H H -5.935 -7.473 4.740 1.00 . A A . 39 ARG H 1 1 19 13425 1 1 39 ARG HA H -4.391 -5.914 5.270 1.00 . A A . 39 ARG HA 1 1 19 13426 1 1 39 ARG HB2 H -3.224 -8.478 5.994 1.00 . A A . 39 ARG HB2 1 1 19 13427 1 1 39 ARG HB3 H -2.002 -7.263 5.649 1.00 . A A . 39 ARG HB3 1 1 19 13428 1 1 39 ARG HD2 H -5.327 -6.473 7.169 1.00 . A A . 39 ARG HD2 1 1 19 13429 1 1 39 ARG HD3 H -4.899 -8.056 7.817 1.00 . A A . 39 ARG HD3 1 1 19 13430 1 1 39 ARG HE H -4.977 -7.155 9.898 1.00 . A A . 39 ARG HE 1 1 19 13431 1 1 39 ARG HG2 H -2.556 -7.313 8.010 1.00 . A A . 39 ARG HG2 1 1 19 13432 1 1 39 ARG HG3 H -3.002 -5.769 7.286 1.00 . A A . 39 ARG HG3 1 1 19 13433 1 1 39 ARG HH11 H -4.577 -4.522 7.620 1.00 . A A . 39 ARG HH11 1 1 19 13434 1 1 39 ARG HH12 H -4.522 -3.300 8.848 1.00 . A A . 39 ARG HH12 1 1 19 13435 1 1 39 ARG HH21 H -4.922 -5.537 11.517 1.00 . A A . 39 ARG HH21 1 1 19 13436 1 1 39 ARG HH22 H -4.724 -3.877 11.065 1.00 . A A . 39 ARG HH22 1 1 19 13437 1 1 39 ARG N N -5.019 -7.726 4.531 1.00 . A A . 39 ARG N 1 1 19 13438 1 1 39 ARG NE N -4.820 -6.491 9.191 1.00 . A A . 39 ARG NE 1 1 19 13439 1 1 39 ARG NH1 N -4.600 -4.264 8.593 1.00 . A A . 39 ARG NH1 1 1 19 13440 1 1 39 ARG NH2 N -4.799 -4.843 10.806 1.00 . A A . 39 ARG NH2 1 1 19 13441 1 1 39 ARG O O -1.939 -6.108 3.748 1.00 . A A . 39 ARG O 1 1 19 13442 1 1 40 ARG C C -2.819 -4.530 1.217 1.00 . A A . 40 ARG C 1 1 19 13443 1 1 40 ARG CA C -3.062 -6.034 1.246 1.00 . A A . 40 ARG CA 1 1 19 13444 1 1 40 ARG CB C -3.855 -6.460 0.010 1.00 . A A . 40 ARG CB 1 1 19 13445 1 1 40 ARG CD C -4.433 -8.304 -1.599 1.00 . A A . 40 ARG CD 1 1 19 13446 1 1 40 ARG CG C -3.783 -7.949 -0.269 1.00 . A A . 40 ARG CG 1 1 19 13447 1 1 40 ARG CZ C -3.079 -10.266 -2.273 1.00 . A A . 40 ARG CZ 1 1 19 13448 1 1 40 ARG H H -4.701 -6.665 2.438 1.00 . A A . 40 ARG H 1 1 19 13449 1 1 40 ARG HA H -2.106 -6.537 1.238 1.00 . A A . 40 ARG HA 1 1 19 13450 1 1 40 ARG HB2 H -4.892 -6.191 0.151 1.00 . A A . 40 ARG HB2 1 1 19 13451 1 1 40 ARG HB3 H -3.469 -5.935 -0.851 1.00 . A A . 40 ARG HB3 1 1 19 13452 1 1 40 ARG HD2 H -5.489 -8.088 -1.539 1.00 . A A . 40 ARG HD2 1 1 19 13453 1 1 40 ARG HD3 H -3.985 -7.703 -2.376 1.00 . A A . 40 ARG HD3 1 1 19 13454 1 1 40 ARG HE H -5.041 -10.298 -1.841 1.00 . A A . 40 ARG HE 1 1 19 13455 1 1 40 ARG HG2 H -2.747 -8.251 -0.295 1.00 . A A . 40 ARG HG2 1 1 19 13456 1 1 40 ARG HG3 H -4.294 -8.478 0.523 1.00 . A A . 40 ARG HG3 1 1 19 13457 1 1 40 ARG HH11 H -2.070 -8.512 -2.413 1.00 . A A . 40 ARG HH11 1 1 19 13458 1 1 40 ARG HH12 H -1.135 -9.939 -2.753 1.00 . A A . 40 ARG HH12 1 1 19 13459 1 1 40 ARG HH21 H -3.759 -12.173 -2.306 1.00 . A A . 40 ARG HH21 1 1 19 13460 1 1 40 ARG HH22 H -2.068 -11.977 -2.684 1.00 . A A . 40 ARG HH22 1 1 19 13461 1 1 40 ARG N N -3.752 -6.415 2.473 1.00 . A A . 40 ARG N 1 1 19 13462 1 1 40 ARG NE N -4.253 -9.718 -1.926 1.00 . A A . 40 ARG NE 1 1 19 13463 1 1 40 ARG NH1 N -2.014 -9.505 -2.495 1.00 . A A . 40 ARG NH1 1 1 19 13464 1 1 40 ARG NH2 N -2.972 -11.576 -2.435 1.00 . A A . 40 ARG NH2 1 1 19 13465 1 1 40 ARG O O -3.583 -3.762 1.796 1.00 . A A . 40 ARG O 1 1 19 13466 1 1 41 CYS C C -2.258 -2.041 -0.636 1.00 . A A . 41 CYS C 1 1 19 13467 1 1 41 CYS CA C -1.422 -2.703 0.450 1.00 . A A . 41 CYS CA 1 1 19 13468 1 1 41 CYS CB C 0.066 -2.536 0.144 1.00 . A A . 41 CYS CB 1 1 19 13469 1 1 41 CYS H H -1.178 -4.773 0.112 1.00 . A A . 41 CYS H 1 1 19 13470 1 1 41 CYS HA H -1.644 -2.237 1.399 1.00 . A A . 41 CYS HA 1 1 19 13471 1 1 41 CYS HB2 H 0.639 -2.866 0.997 1.00 . A A . 41 CYS HB2 1 1 19 13472 1 1 41 CYS HB3 H 0.319 -3.149 -0.709 1.00 . A A . 41 CYS HB3 1 1 19 13473 1 1 41 CYS N N -1.754 -4.116 0.552 1.00 . A A . 41 CYS N 1 1 19 13474 1 1 41 CYS O O -2.017 -2.245 -1.825 1.00 . A A . 41 CYS O 1 1 19 13475 1 1 41 CYS SG S 0.575 -0.831 -0.230 1.00 . A A . 41 CYS SG 1 1 19 13476 1 1 42 LEU C C -3.484 0.774 -1.557 1.00 . A A . 42 LEU C 1 1 19 13477 1 1 42 LEU CA C -4.102 -0.553 -1.164 1.00 . A A . 42 LEU CA 1 1 19 13478 1 1 42 LEU CB C -5.488 -0.305 -0.554 1.00 . A A . 42 LEU CB 1 1 19 13479 1 1 42 LEU CD1 C -5.974 -2.728 -0.089 1.00 . A A . 42 LEU CD1 1 1 19 13480 1 1 42 LEU CD2 C -7.823 -1.056 -0.047 1.00 . A A . 42 LEU CD2 1 1 19 13481 1 1 42 LEU CG C -6.503 -1.443 -0.696 1.00 . A A . 42 LEU CG 1 1 19 13482 1 1 42 LEU H H -3.378 -1.121 0.739 1.00 . A A . 42 LEU H 1 1 19 13483 1 1 42 LEU HA H -4.202 -1.170 -2.046 1.00 . A A . 42 LEU HA 1 1 19 13484 1 1 42 LEU HB2 H -5.358 -0.105 0.500 1.00 . A A . 42 LEU HB2 1 1 19 13485 1 1 42 LEU HB3 H -5.906 0.579 -1.018 1.00 . A A . 42 LEU HB3 1 1 19 13486 1 1 42 LEU HD11 H -6.576 -3.560 -0.424 1.00 . A A . 42 LEU HD11 1 1 19 13487 1 1 42 LEU HD12 H -6.018 -2.662 0.988 1.00 . A A . 42 LEU HD12 1 1 19 13488 1 1 42 LEU HD13 H -4.950 -2.877 -0.399 1.00 . A A . 42 LEU HD13 1 1 19 13489 1 1 42 LEU HD21 H -7.719 -0.095 0.435 1.00 . A A . 42 LEU HD21 1 1 19 13490 1 1 42 LEU HD22 H -8.094 -1.799 0.688 1.00 . A A . 42 LEU HD22 1 1 19 13491 1 1 42 LEU HD23 H -8.593 -0.998 -0.802 1.00 . A A . 42 LEU HD23 1 1 19 13492 1 1 42 LEU HG H -6.688 -1.621 -1.745 1.00 . A A . 42 LEU HG 1 1 19 13493 1 1 42 LEU N N -3.237 -1.249 -0.224 1.00 . A A . 42 LEU N 1 1 19 13494 1 1 42 LEU O O -3.261 1.639 -0.708 1.00 . A A . 42 LEU O 1 1 19 13495 1 1 43 CYS C C -3.708 3.067 -3.907 1.00 . A A . 43 CYS C 1 1 19 13496 1 1 43 CYS CA C -2.635 2.165 -3.329 1.00 . A A . 43 CYS CA 1 1 19 13497 1 1 43 CYS CB C -1.572 1.859 -4.382 1.00 . A A . 43 CYS CB 1 1 19 13498 1 1 43 CYS H H -3.427 0.219 -3.471 1.00 . A A . 43 CYS H 1 1 19 13499 1 1 43 CYS HA H -2.168 2.669 -2.495 1.00 . A A . 43 CYS HA 1 1 19 13500 1 1 43 CYS HB2 H -2.030 1.338 -5.207 1.00 . A A . 43 CYS HB2 1 1 19 13501 1 1 43 CYS HB3 H -1.154 2.789 -4.739 1.00 . A A . 43 CYS HB3 1 1 19 13502 1 1 43 CYS N N -3.219 0.939 -2.835 1.00 . A A . 43 CYS N 1 1 19 13503 1 1 43 CYS O O -4.586 2.615 -4.643 1.00 . A A . 43 CYS O 1 1 19 13504 1 1 43 CYS SG S -0.202 0.838 -3.767 1.00 . A A . 43 CYS SG 1 1 19 13505 1 1 44 THR C C -3.866 6.433 -4.790 1.00 . A A . 44 THR C 1 1 19 13506 1 1 44 THR CA C -4.586 5.312 -4.061 1.00 . A A . 44 THR CA 1 1 19 13507 1 1 44 THR CB C -5.435 5.893 -2.917 1.00 . A A . 44 THR CB 1 1 19 13508 1 1 44 THR CG2 C -6.768 5.170 -2.812 1.00 . A A . 44 THR CG2 1 1 19 13509 1 1 44 THR H H -2.906 4.638 -2.981 1.00 . A A . 44 THR H 1 1 19 13510 1 1 44 THR HA H -5.247 4.813 -4.755 1.00 . A A . 44 THR HA 1 1 19 13511 1 1 44 THR HB H -5.624 6.936 -3.131 1.00 . A A . 44 THR HB 1 1 19 13512 1 1 44 THR HG1 H -3.804 6.047 -1.803 1.00 . A A . 44 THR HG1 1 1 19 13513 1 1 44 THR HG21 H -7.228 5.118 -3.788 1.00 . A A . 44 THR HG21 1 1 19 13514 1 1 44 THR HG22 H -7.417 5.708 -2.137 1.00 . A A . 44 THR HG22 1 1 19 13515 1 1 44 THR HG23 H -6.607 4.171 -2.436 1.00 . A A . 44 THR HG23 1 1 19 13516 1 1 44 THR N N -3.633 4.339 -3.574 1.00 . A A . 44 THR N 1 1 19 13517 1 1 44 THR O O -2.782 6.857 -4.380 1.00 . A A . 44 THR O 1 1 19 13518 1 1 44 THR OG1 O -4.724 5.787 -1.672 1.00 . A A . 44 THR OG1 1 1 19 13519 1 1 45 LYS C C -4.909 8.705 -7.460 1.00 . A A . 45 LYS C 1 1 19 13520 1 1 45 LYS CA C -3.858 7.958 -6.668 1.00 . A A . 45 LYS CA 1 1 19 13521 1 1 45 LYS CB C -2.790 7.406 -7.619 1.00 . A A . 45 LYS CB 1 1 19 13522 1 1 45 LYS CD C -2.266 6.281 -9.820 1.00 . A A . 45 LYS CD 1 1 19 13523 1 1 45 LYS CE C -1.788 7.507 -10.597 1.00 . A A . 45 LYS CE 1 1 19 13524 1 1 45 LYS CG C -3.348 6.624 -8.800 1.00 . A A . 45 LYS CG 1 1 19 13525 1 1 45 LYS H H -5.316 6.509 -6.158 1.00 . A A . 45 LYS H 1 1 19 13526 1 1 45 LYS HA H -3.389 8.658 -5.994 1.00 . A A . 45 LYS HA 1 1 19 13527 1 1 45 LYS HB2 H -2.211 8.231 -8.007 1.00 . A A . 45 LYS HB2 1 1 19 13528 1 1 45 LYS HB3 H -2.134 6.752 -7.062 1.00 . A A . 45 LYS HB3 1 1 19 13529 1 1 45 LYS HD2 H -1.423 5.850 -9.301 1.00 . A A . 45 LYS HD2 1 1 19 13530 1 1 45 LYS HD3 H -2.665 5.559 -10.518 1.00 . A A . 45 LYS HD3 1 1 19 13531 1 1 45 LYS HE2 H -1.239 7.173 -11.464 1.00 . A A . 45 LYS HE2 1 1 19 13532 1 1 45 LYS HE3 H -2.653 8.070 -10.917 1.00 . A A . 45 LYS HE3 1 1 19 13533 1 1 45 LYS HG2 H -3.786 5.707 -8.435 1.00 . A A . 45 LYS HG2 1 1 19 13534 1 1 45 LYS HG3 H -4.109 7.220 -9.283 1.00 . A A . 45 LYS HG3 1 1 19 13535 1 1 45 LYS HZ1 H 0.034 7.967 -9.673 1.00 . A A . 45 LYS HZ1 1 1 19 13536 1 1 45 LYS HZ2 H -1.321 8.553 -8.848 1.00 . A A . 45 LYS HZ2 1 1 19 13537 1 1 45 LYS HZ3 H -0.801 9.327 -10.257 1.00 . A A . 45 LYS HZ3 1 1 19 13538 1 1 45 LYS N N -4.455 6.896 -5.876 1.00 . A A . 45 LYS N 1 1 19 13539 1 1 45 LYS NZ N -0.907 8.395 -9.786 1.00 . A A . 45 LYS NZ 1 1 19 13540 1 1 45 LYS O O -6.084 8.336 -7.483 1.00 . A A . 45 LYS O 1 1 19 13541 1 1 46 GLU C C -5.538 10.001 -10.266 1.00 . A A . 46 GLU C 1 1 19 13542 1 1 46 GLU CA C -5.266 10.625 -8.897 1.00 . A A . 46 GLU CA 1 1 19 13543 1 1 46 GLU CB C -4.546 11.973 -9.053 1.00 . A A . 46 GLU CB 1 1 19 13544 1 1 46 GLU CD C -2.138 11.134 -9.479 1.00 . A A . 46 GLU CD 1 1 19 13545 1 1 46 GLU CG C -3.330 11.943 -9.984 1.00 . A A . 46 GLU CG 1 1 19 13546 1 1 46 GLU H H -3.491 9.977 -8.005 1.00 . A A . 46 GLU H 1 1 19 13547 1 1 46 GLU HA H -6.203 10.780 -8.386 1.00 . A A . 46 GLU HA 1 1 19 13548 1 1 46 GLU HB2 H -5.248 12.696 -9.442 1.00 . A A . 46 GLU HB2 1 1 19 13549 1 1 46 GLU HB3 H -4.215 12.300 -8.078 1.00 . A A . 46 GLU HB3 1 1 19 13550 1 1 46 GLU HG2 H -3.640 11.517 -10.922 1.00 . A A . 46 GLU HG2 1 1 19 13551 1 1 46 GLU HG3 H -3.006 12.958 -10.148 1.00 . A A . 46 GLU HG3 1 1 19 13552 1 1 46 GLU N N -4.450 9.757 -8.091 1.00 . A A . 46 GLU N 1 1 19 13553 1 1 46 GLU O O -4.699 9.277 -10.812 1.00 . A A . 46 GLU O 1 1 19 13554 1 1 46 GLU OE1 O -2.130 10.696 -8.307 1.00 . A A . 46 GLU OE1 1 1 19 13555 1 1 46 GLU OE2 O -1.198 10.914 -10.271 1.00 . A A . 46 GLU OE2 1 1 19 13556 1 1 47 CYS C C -8.463 10.440 -12.455 1.00 . A A . 47 CYS C 1 1 19 13557 1 1 47 CYS CA C -7.133 9.792 -12.099 1.00 . A A . 47 CYS CA 1 1 19 13558 1 1 47 CYS CB C -7.262 8.263 -12.100 1.00 . A A . 47 CYS CB 1 1 19 13559 1 1 47 CYS H H -7.327 10.872 -10.308 1.00 . A A . 47 CYS H 1 1 19 13560 1 1 47 CYS HA H -6.391 10.085 -12.823 1.00 . A A . 47 CYS HA 1 1 19 13561 1 1 47 CYS HB2 H -7.517 7.935 -13.096 1.00 . A A . 47 CYS HB2 1 1 19 13562 1 1 47 CYS HB3 H -6.312 7.833 -11.819 1.00 . A A . 47 CYS HB3 1 1 19 13563 1 1 47 CYS N N -6.712 10.291 -10.801 1.00 . A A . 47 CYS N 1 1 19 13564 1 1 47 CYS O O -8.762 11.513 -11.879 1.00 . A A . 47 CYS O 1 1 19 13565 1 1 47 CYS OXT O -9.225 9.870 -13.257 1.00 . A A . 47 CYS OXT 1 1 19 13566 1 1 47 CYS SG S -8.527 7.602 -10.965 1.00 . A A . 47 CYS SG 1 1 20 13567 1 1 1 ALA C C -7.672 10.123 -7.143 1.00 . A A . 1 ALA C 1 1 20 13568 1 1 1 ALA CA C -8.335 10.870 -8.297 1.00 . A A . 1 ALA CA 1 1 20 13569 1 1 1 ALA CB C -7.391 11.920 -8.866 1.00 . A A . 1 ALA CB 1 1 20 13570 1 1 1 ALA H1 H -9.611 11.540 -6.801 1.00 . A A . 1 ALA H1 1 1 20 13571 1 1 1 ALA H2 H -10.407 10.980 -8.187 1.00 . A A . 1 ALA H2 1 1 20 13572 1 1 1 ALA H3 H -9.637 12.484 -8.204 1.00 . A A . 1 ALA H3 1 1 20 13573 1 1 1 ALA HA H -8.578 10.168 -9.081 1.00 . A A . 1 ALA HA 1 1 20 13574 1 1 1 ALA HB1 H -7.455 12.821 -8.272 1.00 . A A . 1 ALA HB1 1 1 20 13575 1 1 1 ALA HB2 H -7.670 12.141 -9.885 1.00 . A A . 1 ALA HB2 1 1 20 13576 1 1 1 ALA HB3 H -6.378 11.545 -8.843 1.00 . A A . 1 ALA HB3 1 1 20 13577 1 1 1 ALA N N -9.586 11.513 -7.841 1.00 . A A . 1 ALA N 1 1 20 13578 1 1 1 ALA O O -6.455 10.148 -6.987 1.00 . A A . 1 ALA O 1 1 20 13579 1 1 2 THR C C -7.807 7.252 -5.565 1.00 . A A . 2 THR C 1 1 20 13580 1 1 2 THR CA C -7.983 8.718 -5.190 1.00 . A A . 2 THR CA 1 1 20 13581 1 1 2 THR CB C -8.942 8.842 -3.992 1.00 . A A . 2 THR CB 1 1 20 13582 1 1 2 THR CG2 C -8.252 8.437 -2.697 1.00 . A A . 2 THR CG2 1 1 20 13583 1 1 2 THR H H -9.447 9.475 -6.497 1.00 . A A . 2 THR H 1 1 20 13584 1 1 2 THR HA H -7.023 9.131 -4.915 1.00 . A A . 2 THR HA 1 1 20 13585 1 1 2 THR HB H -9.787 8.189 -4.156 1.00 . A A . 2 THR HB 1 1 20 13586 1 1 2 THR HG1 H -9.470 10.439 -2.956 1.00 . A A . 2 THR HG1 1 1 20 13587 1 1 2 THR HG21 H -7.195 8.649 -2.771 1.00 . A A . 2 THR HG21 1 1 20 13588 1 1 2 THR HG22 H -8.396 7.380 -2.527 1.00 . A A . 2 THR HG22 1 1 20 13589 1 1 2 THR HG23 H -8.675 8.995 -1.874 1.00 . A A . 2 THR HG23 1 1 20 13590 1 1 2 THR N N -8.487 9.465 -6.330 1.00 . A A . 2 THR N 1 1 20 13591 1 1 2 THR O O -8.719 6.442 -5.406 1.00 . A A . 2 THR O 1 1 20 13592 1 1 2 THR OG1 O -9.406 10.197 -3.886 1.00 . A A . 2 THR OG1 1 1 20 13593 1 1 3 CYS C C -5.723 4.755 -5.414 1.00 . A A . 3 CYS C 1 1 20 13594 1 1 3 CYS CA C -6.346 5.583 -6.534 1.00 . A A . 3 CYS CA 1 1 20 13595 1 1 3 CYS CB C -5.433 5.658 -7.752 1.00 . A A . 3 CYS CB 1 1 20 13596 1 1 3 CYS H H -5.965 7.631 -6.223 1.00 . A A . 3 CYS H 1 1 20 13597 1 1 3 CYS HA H -7.276 5.120 -6.826 1.00 . A A . 3 CYS HA 1 1 20 13598 1 1 3 CYS HB2 H -4.485 6.095 -7.468 1.00 . A A . 3 CYS HB2 1 1 20 13599 1 1 3 CYS HB3 H -5.271 4.666 -8.146 1.00 . A A . 3 CYS HB3 1 1 20 13600 1 1 3 CYS N N -6.644 6.933 -6.097 1.00 . A A . 3 CYS N 1 1 20 13601 1 1 3 CYS O O -4.815 5.211 -4.716 1.00 . A A . 3 CYS O 1 1 20 13602 1 1 3 CYS SG S -6.134 6.685 -9.075 1.00 . A A . 3 CYS SG 1 1 20 13603 1 1 4 LYS C C -5.561 1.237 -4.793 1.00 . A A . 4 LYS C 1 1 20 13604 1 1 4 LYS CA C -5.750 2.633 -4.212 1.00 . A A . 4 LYS CA 1 1 20 13605 1 1 4 LYS CB C -6.755 2.600 -3.045 1.00 . A A . 4 LYS CB 1 1 20 13606 1 1 4 LYS CD C -6.163 0.404 -1.910 1.00 . A A . 4 LYS CD 1 1 20 13607 1 1 4 LYS CE C -7.513 -0.212 -2.242 1.00 . A A . 4 LYS CE 1 1 20 13608 1 1 4 LYS CG C -6.253 1.918 -1.769 1.00 . A A . 4 LYS CG 1 1 20 13609 1 1 4 LYS H H -6.956 3.244 -5.833 1.00 . A A . 4 LYS H 1 1 20 13610 1 1 4 LYS HA H -4.797 2.995 -3.852 1.00 . A A . 4 LYS HA 1 1 20 13611 1 1 4 LYS HB2 H -7.023 3.615 -2.794 1.00 . A A . 4 LYS HB2 1 1 20 13612 1 1 4 LYS HB3 H -7.644 2.080 -3.374 1.00 . A A . 4 LYS HB3 1 1 20 13613 1 1 4 LYS HD2 H -5.467 0.167 -2.701 1.00 . A A . 4 LYS HD2 1 1 20 13614 1 1 4 LYS HD3 H -5.805 -0.014 -0.979 1.00 . A A . 4 LYS HD3 1 1 20 13615 1 1 4 LYS HE2 H -8.153 -0.132 -1.376 1.00 . A A . 4 LYS HE2 1 1 20 13616 1 1 4 LYS HE3 H -7.950 0.335 -3.064 1.00 . A A . 4 LYS HE3 1 1 20 13617 1 1 4 LYS HG2 H -5.273 2.303 -1.533 1.00 . A A . 4 LYS HG2 1 1 20 13618 1 1 4 LYS HG3 H -6.933 2.153 -0.962 1.00 . A A . 4 LYS HG3 1 1 20 13619 1 1 4 LYS HZ1 H -6.574 -2.087 -2.137 1.00 . A A . 4 LYS HZ1 1 1 20 13620 1 1 4 LYS HZ2 H -7.255 -1.732 -3.649 1.00 . A A . 4 LYS HZ2 1 1 20 13621 1 1 4 LYS HZ3 H -8.254 -2.161 -2.357 1.00 . A A . 4 LYS HZ3 1 1 20 13622 1 1 4 LYS N N -6.230 3.539 -5.246 1.00 . A A . 4 LYS N 1 1 20 13623 1 1 4 LYS NZ N -7.394 -1.645 -2.623 1.00 . A A . 4 LYS NZ 1 1 20 13624 1 1 4 LYS O O -6.455 0.697 -5.445 1.00 . A A . 4 LYS O 1 1 20 13625 1 1 5 ALA C C -3.000 -1.275 -4.108 1.00 . A A . 5 ALA C 1 1 20 13626 1 1 5 ALA CA C -4.076 -0.677 -4.998 1.00 . A A . 5 ALA CA 1 1 20 13627 1 1 5 ALA CB C -3.607 -0.633 -6.446 1.00 . A A . 5 ALA CB 1 1 20 13628 1 1 5 ALA H H -3.741 1.145 -3.985 1.00 . A A . 5 ALA H 1 1 20 13629 1 1 5 ALA HA H -4.966 -1.287 -4.941 1.00 . A A . 5 ALA HA 1 1 20 13630 1 1 5 ALA HB1 H -4.325 -1.141 -7.072 1.00 . A A . 5 ALA HB1 1 1 20 13631 1 1 5 ALA HB2 H -2.648 -1.122 -6.528 1.00 . A A . 5 ALA HB2 1 1 20 13632 1 1 5 ALA HB3 H -3.516 0.395 -6.763 1.00 . A A . 5 ALA HB3 1 1 20 13633 1 1 5 ALA N N -4.404 0.658 -4.529 1.00 . A A . 5 ALA N 1 1 20 13634 1 1 5 ALA O O -2.098 -0.564 -3.673 1.00 . A A . 5 ALA O 1 1 20 13635 1 1 6 GLU C C -0.776 -3.229 -3.673 1.00 . A A . 6 GLU C 1 1 20 13636 1 1 6 GLU CA C -2.129 -3.240 -2.982 1.00 . A A . 6 GLU CA 1 1 20 13637 1 1 6 GLU CB C -2.552 -4.687 -2.702 1.00 . A A . 6 GLU CB 1 1 20 13638 1 1 6 GLU CD C -4.749 -4.163 -1.564 1.00 . A A . 6 GLU CD 1 1 20 13639 1 1 6 GLU CG C -4.059 -4.899 -2.692 1.00 . A A . 6 GLU CG 1 1 20 13640 1 1 6 GLU H H -3.845 -3.079 -4.194 1.00 . A A . 6 GLU H 1 1 20 13641 1 1 6 GLU HA H -2.057 -2.698 -2.051 1.00 . A A . 6 GLU HA 1 1 20 13642 1 1 6 GLU HB2 H -2.120 -5.331 -3.452 1.00 . A A . 6 GLU HB2 1 1 20 13643 1 1 6 GLU HB3 H -2.168 -4.975 -1.734 1.00 . A A . 6 GLU HB3 1 1 20 13644 1 1 6 GLU HG2 H -4.465 -4.548 -3.629 1.00 . A A . 6 GLU HG2 1 1 20 13645 1 1 6 GLU HG3 H -4.259 -5.955 -2.588 1.00 . A A . 6 GLU HG3 1 1 20 13646 1 1 6 GLU N N -3.103 -2.566 -3.828 1.00 . A A . 6 GLU N 1 1 20 13647 1 1 6 GLU O O -0.700 -3.410 -4.891 1.00 . A A . 6 GLU O 1 1 20 13648 1 1 6 GLU OE1 O -4.486 -4.494 -0.390 1.00 . A A . 6 GLU OE1 1 1 20 13649 1 1 6 GLU OE2 O -5.567 -3.260 -1.849 1.00 . A A . 6 GLU OE2 1 1 20 13650 1 1 7 CYS C C 1.943 -4.265 -4.184 1.00 . A A . 7 CYS C 1 1 20 13651 1 1 7 CYS CA C 1.624 -2.956 -3.465 1.00 . A A . 7 CYS CA 1 1 20 13652 1 1 7 CYS CB C 2.667 -2.691 -2.372 1.00 . A A . 7 CYS CB 1 1 20 13653 1 1 7 CYS H H 0.141 -2.849 -1.946 1.00 . A A . 7 CYS H 1 1 20 13654 1 1 7 CYS HA H 1.655 -2.151 -4.184 1.00 . A A . 7 CYS HA 1 1 20 13655 1 1 7 CYS HB2 H 2.362 -1.831 -1.795 1.00 . A A . 7 CYS HB2 1 1 20 13656 1 1 7 CYS HB3 H 2.726 -3.552 -1.723 1.00 . A A . 7 CYS HB3 1 1 20 13657 1 1 7 CYS N N 0.277 -3.000 -2.907 1.00 . A A . 7 CYS N 1 1 20 13658 1 1 7 CYS O O 1.858 -5.341 -3.593 1.00 . A A . 7 CYS O 1 1 20 13659 1 1 7 CYS SG S 4.345 -2.361 -3.017 1.00 . A A . 7 CYS SG 1 1 20 13660 1 1 8 PRO C C 3.769 -6.166 -5.698 1.00 . A A . 8 PRO C 1 1 20 13661 1 1 8 PRO CA C 2.620 -5.363 -6.291 1.00 . A A . 8 PRO CA 1 1 20 13662 1 1 8 PRO CB C 3.022 -4.775 -7.647 1.00 . A A . 8 PRO CB 1 1 20 13663 1 1 8 PRO CD C 2.401 -2.937 -6.255 1.00 . A A . 8 PRO CD 1 1 20 13664 1 1 8 PRO CG C 2.408 -3.418 -7.678 1.00 . A A . 8 PRO CG 1 1 20 13665 1 1 8 PRO HA H 1.759 -6.005 -6.413 1.00 . A A . 8 PRO HA 1 1 20 13666 1 1 8 PRO HB2 H 4.099 -4.722 -7.714 1.00 . A A . 8 PRO HB2 1 1 20 13667 1 1 8 PRO HB3 H 2.638 -5.398 -8.441 1.00 . A A . 8 PRO HB3 1 1 20 13668 1 1 8 PRO HD2 H 3.318 -2.414 -6.027 1.00 . A A . 8 PRO HD2 1 1 20 13669 1 1 8 PRO HD3 H 1.547 -2.300 -6.075 1.00 . A A . 8 PRO HD3 1 1 20 13670 1 1 8 PRO HG2 H 3.003 -2.759 -8.293 1.00 . A A . 8 PRO HG2 1 1 20 13671 1 1 8 PRO HG3 H 1.399 -3.479 -8.058 1.00 . A A . 8 PRO HG3 1 1 20 13672 1 1 8 PRO N N 2.300 -4.184 -5.479 1.00 . A A . 8 PRO N 1 1 20 13673 1 1 8 PRO O O 3.734 -7.392 -5.658 1.00 . A A . 8 PRO O 1 1 20 13674 1 1 9 THR C C 5.702 -6.332 -3.130 1.00 . A A . 9 THR C 1 1 20 13675 1 1 9 THR CA C 5.940 -6.093 -4.619 1.00 . A A . 9 THR CA 1 1 20 13676 1 1 9 THR CB C 7.198 -5.223 -4.804 1.00 . A A . 9 THR CB 1 1 20 13677 1 1 9 THR CG2 C 7.602 -5.155 -6.269 1.00 . A A . 9 THR CG2 1 1 20 13678 1 1 9 THR H H 4.745 -4.483 -5.277 1.00 . A A . 9 THR H 1 1 20 13679 1 1 9 THR HA H 6.102 -7.041 -5.111 1.00 . A A . 9 THR HA 1 1 20 13680 1 1 9 THR HB H 8.008 -5.663 -4.241 1.00 . A A . 9 THR HB 1 1 20 13681 1 1 9 THR HG1 H 6.147 -3.901 -3.767 1.00 . A A . 9 THR HG1 1 1 20 13682 1 1 9 THR HG21 H 6.805 -4.705 -6.843 1.00 . A A . 9 THR HG21 1 1 20 13683 1 1 9 THR HG22 H 7.791 -6.152 -6.637 1.00 . A A . 9 THR HG22 1 1 20 13684 1 1 9 THR HG23 H 8.498 -4.559 -6.369 1.00 . A A . 9 THR HG23 1 1 20 13685 1 1 9 THR N N 4.782 -5.459 -5.225 1.00 . A A . 9 THR N 1 1 20 13686 1 1 9 THR O O 6.557 -6.022 -2.298 1.00 . A A . 9 THR O 1 1 20 13687 1 1 9 THR OG1 O 6.950 -3.895 -4.310 1.00 . A A . 9 THR OG1 1 1 20 13688 1 1 10 TRP C C 3.350 -8.386 -1.290 1.00 . A A . 10 TRP C 1 1 20 13689 1 1 10 TRP CA C 4.178 -7.114 -1.410 1.00 . A A . 10 TRP CA 1 1 20 13690 1 1 10 TRP CB C 3.377 -5.929 -0.861 1.00 . A A . 10 TRP CB 1 1 20 13691 1 1 10 TRP CD1 C 2.171 -6.489 1.327 1.00 . A A . 10 TRP CD1 1 1 20 13692 1 1 10 TRP CD2 C 4.089 -5.367 1.592 1.00 . A A . 10 TRP CD2 1 1 20 13693 1 1 10 TRP CE2 C 3.540 -5.615 2.863 1.00 . A A . 10 TRP CE2 1 1 20 13694 1 1 10 TRP CE3 C 5.295 -4.670 1.504 1.00 . A A . 10 TRP CE3 1 1 20 13695 1 1 10 TRP CG C 3.208 -5.948 0.626 1.00 . A A . 10 TRP CG 1 1 20 13696 1 1 10 TRP CH2 C 5.337 -4.504 3.917 1.00 . A A . 10 TRP CH2 1 1 20 13697 1 1 10 TRP CZ2 C 4.161 -5.186 4.037 1.00 . A A . 10 TRP CZ2 1 1 20 13698 1 1 10 TRP CZ3 C 5.904 -4.244 2.666 1.00 . A A . 10 TRP CZ3 1 1 20 13699 1 1 10 TRP H H 3.881 -7.078 -3.502 1.00 . A A . 10 TRP H 1 1 20 13700 1 1 10 TRP HA H 5.088 -7.225 -0.840 1.00 . A A . 10 TRP HA 1 1 20 13701 1 1 10 TRP HB2 H 3.881 -5.012 -1.124 1.00 . A A . 10 TRP HB2 1 1 20 13702 1 1 10 TRP HB3 H 2.394 -5.934 -1.308 1.00 . A A . 10 TRP HB3 1 1 20 13703 1 1 10 TRP HD1 H 1.329 -6.997 0.873 1.00 . A A . 10 TRP HD1 1 1 20 13704 1 1 10 TRP HE1 H 1.772 -6.623 3.389 1.00 . A A . 10 TRP HE1 1 1 20 13705 1 1 10 TRP HE3 H 5.749 -4.459 0.547 1.00 . A A . 10 TRP HE3 1 1 20 13706 1 1 10 TRP HH2 H 5.849 -4.150 4.800 1.00 . A A . 10 TRP HH2 1 1 20 13707 1 1 10 TRP HZ2 H 3.742 -5.376 5.013 1.00 . A A . 10 TRP HZ2 1 1 20 13708 1 1 10 TRP HZ3 H 6.833 -3.696 2.617 1.00 . A A . 10 TRP HZ3 1 1 20 13709 1 1 10 TRP N N 4.533 -6.862 -2.796 1.00 . A A . 10 TRP N 1 1 20 13710 1 1 10 TRP NE1 N 2.370 -6.306 2.675 1.00 . A A . 10 TRP NE1 1 1 20 13711 1 1 10 TRP O O 2.304 -8.516 -1.922 1.00 . A A . 10 TRP O 1 1 20 13712 1 1 11 ASP C C 3.432 -11.036 1.190 1.00 . A A . 11 ASP C 1 1 20 13713 1 1 11 ASP CA C 3.127 -10.569 -0.228 1.00 . A A . 11 ASP CA 1 1 20 13714 1 1 11 ASP CB C 3.559 -11.631 -1.249 1.00 . A A . 11 ASP CB 1 1 20 13715 1 1 11 ASP CG C 2.555 -12.769 -1.375 1.00 . A A . 11 ASP CG 1 1 20 13716 1 1 11 ASP H H 4.652 -9.130 0.020 1.00 . A A . 11 ASP H 1 1 20 13717 1 1 11 ASP HA H 2.065 -10.391 -0.321 1.00 . A A . 11 ASP HA 1 1 20 13718 1 1 11 ASP HB2 H 3.667 -11.166 -2.218 1.00 . A A . 11 ASP HB2 1 1 20 13719 1 1 11 ASP HB3 H 4.509 -12.046 -0.946 1.00 . A A . 11 ASP HB3 1 1 20 13720 1 1 11 ASP N N 3.819 -9.305 -0.461 1.00 . A A . 11 ASP N 1 1 20 13721 1 1 11 ASP O O 4.026 -12.091 1.411 1.00 . A A . 11 ASP O 1 1 20 13722 1 1 11 ASP OD1 O 2.207 -13.382 -0.344 1.00 . A A . 11 ASP OD1 1 1 20 13723 1 1 11 ASP OD2 O 2.121 -13.050 -2.511 1.00 . A A . 11 ASP OD2 1 1 20 13724 1 1 12 SER C C 2.377 -9.664 4.443 1.00 . A A . 12 SER C 1 1 20 13725 1 1 12 SER CA C 3.303 -10.496 3.562 1.00 . A A . 12 SER CA 1 1 20 13726 1 1 12 SER CB C 4.762 -10.192 3.929 1.00 . A A . 12 SER CB 1 1 20 13727 1 1 12 SER H H 2.615 -9.370 1.915 1.00 . A A . 12 SER H 1 1 20 13728 1 1 12 SER HA H 3.104 -11.543 3.732 1.00 . A A . 12 SER HA 1 1 20 13729 1 1 12 SER HB2 H 4.969 -9.150 3.736 1.00 . A A . 12 SER HB2 1 1 20 13730 1 1 12 SER HB3 H 4.915 -10.399 4.978 1.00 . A A . 12 SER HB3 1 1 20 13731 1 1 12 SER HG H 5.163 -11.560 2.577 1.00 . A A . 12 SER HG 1 1 20 13732 1 1 12 SER N N 3.057 -10.209 2.156 1.00 . A A . 12 SER N 1 1 20 13733 1 1 12 SER O O 1.812 -8.662 3.997 1.00 . A A . 12 SER O 1 1 20 13734 1 1 12 SER OG O 5.665 -10.981 3.173 1.00 . A A . 12 SER OG 1 1 20 13735 1 1 13 VAL C C 2.164 -8.135 7.156 1.00 . A A . 13 VAL C 1 1 20 13736 1 1 13 VAL CA C 1.404 -9.357 6.642 1.00 . A A . 13 VAL CA 1 1 20 13737 1 1 13 VAL CB C 1.009 -10.265 7.829 1.00 . A A . 13 VAL CB 1 1 20 13738 1 1 13 VAL CG1 C 0.163 -9.510 8.842 1.00 . A A . 13 VAL CG1 1 1 20 13739 1 1 13 VAL CG2 C 0.272 -11.501 7.333 1.00 . A A . 13 VAL CG2 1 1 20 13740 1 1 13 VAL H H 2.724 -10.869 5.992 1.00 . A A . 13 VAL H 1 1 20 13741 1 1 13 VAL HA H 0.502 -9.032 6.131 1.00 . A A . 13 VAL HA 1 1 20 13742 1 1 13 VAL HB H 1.913 -10.589 8.322 1.00 . A A . 13 VAL HB 1 1 20 13743 1 1 13 VAL HG11 H -0.880 -9.740 8.683 1.00 . A A . 13 VAL HG11 1 1 20 13744 1 1 13 VAL HG12 H 0.320 -8.448 8.722 1.00 . A A . 13 VAL HG12 1 1 20 13745 1 1 13 VAL HG13 H 0.449 -9.805 9.841 1.00 . A A . 13 VAL HG13 1 1 20 13746 1 1 13 VAL HG21 H 0.460 -11.633 6.278 1.00 . A A . 13 VAL HG21 1 1 20 13747 1 1 13 VAL HG22 H -0.788 -11.379 7.497 1.00 . A A . 13 VAL HG22 1 1 20 13748 1 1 13 VAL HG23 H 0.622 -12.369 7.872 1.00 . A A . 13 VAL HG23 1 1 20 13749 1 1 13 VAL N N 2.238 -10.073 5.693 1.00 . A A . 13 VAL N 1 1 20 13750 1 1 13 VAL O O 3.305 -8.250 7.604 1.00 . A A . 13 VAL O 1 1 20 13751 1 1 14 CYS C C 2.338 -5.675 9.013 1.00 . A A . 14 CYS C 1 1 20 13752 1 1 14 CYS CA C 2.165 -5.730 7.500 1.00 . A A . 14 CYS CA 1 1 20 13753 1 1 14 CYS CB C 1.340 -4.530 7.035 1.00 . A A . 14 CYS CB 1 1 20 13754 1 1 14 CYS H H 0.636 -6.943 6.681 1.00 . A A . 14 CYS H 1 1 20 13755 1 1 14 CYS HA H 3.140 -5.676 7.040 1.00 . A A . 14 CYS HA 1 1 20 13756 1 1 14 CYS HB2 H 1.493 -4.386 5.976 1.00 . A A . 14 CYS HB2 1 1 20 13757 1 1 14 CYS HB3 H 0.294 -4.729 7.219 1.00 . A A . 14 CYS HB3 1 1 20 13758 1 1 14 CYS N N 1.540 -6.972 7.065 1.00 . A A . 14 CYS N 1 1 20 13759 1 1 14 CYS O O 1.425 -5.997 9.772 1.00 . A A . 14 CYS O 1 1 20 13760 1 1 14 CYS SG S 1.764 -2.969 7.873 1.00 . A A . 14 CYS SG 1 1 20 13761 1 1 15 ILE C C 3.801 -3.634 11.248 1.00 . A A . 15 ILE C 1 1 20 13762 1 1 15 ILE CA C 3.823 -5.111 10.852 1.00 . A A . 15 ILE CA 1 1 20 13763 1 1 15 ILE CB C 5.204 -5.721 11.189 1.00 . A A . 15 ILE CB 1 1 20 13764 1 1 15 ILE CD1 C 4.204 -8.061 11.438 1.00 . A A . 15 ILE CD1 1 1 20 13765 1 1 15 ILE CG1 C 5.257 -7.197 10.773 1.00 . A A . 15 ILE CG1 1 1 20 13766 1 1 15 ILE CG2 C 5.513 -5.573 12.674 1.00 . A A . 15 ILE CG2 1 1 20 13767 1 1 15 ILE H H 4.193 -4.992 8.779 1.00 . A A . 15 ILE H 1 1 20 13768 1 1 15 ILE HA H 3.065 -5.640 11.413 1.00 . A A . 15 ILE HA 1 1 20 13769 1 1 15 ILE HB H 5.955 -5.174 10.637 1.00 . A A . 15 ILE HB 1 1 20 13770 1 1 15 ILE HD11 H 4.674 -8.930 11.874 1.00 . A A . 15 ILE HD11 1 1 20 13771 1 1 15 ILE HD12 H 3.479 -8.375 10.701 1.00 . A A . 15 ILE HD12 1 1 20 13772 1 1 15 ILE HD13 H 3.708 -7.493 12.211 1.00 . A A . 15 ILE HD13 1 1 20 13773 1 1 15 ILE HG12 H 5.115 -7.268 9.706 1.00 . A A . 15 ILE HG12 1 1 20 13774 1 1 15 ILE HG13 H 6.227 -7.599 11.029 1.00 . A A . 15 ILE HG13 1 1 20 13775 1 1 15 ILE HG21 H 5.217 -4.589 13.006 1.00 . A A . 15 ILE HG21 1 1 20 13776 1 1 15 ILE HG22 H 6.573 -5.705 12.836 1.00 . A A . 15 ILE HG22 1 1 20 13777 1 1 15 ILE HG23 H 4.968 -6.321 13.230 1.00 . A A . 15 ILE HG23 1 1 20 13778 1 1 15 ILE N N 3.516 -5.243 9.438 1.00 . A A . 15 ILE N 1 1 20 13779 1 1 15 ILE O O 3.308 -3.266 12.315 1.00 . A A . 15 ILE O 1 1 20 13780 1 1 16 ASN C C 4.099 -0.624 9.276 1.00 . A A . 16 ASN C 1 1 20 13781 1 1 16 ASN CA C 4.392 -1.355 10.587 1.00 . A A . 16 ASN CA 1 1 20 13782 1 1 16 ASN CB C 5.776 -0.970 11.135 1.00 . A A . 16 ASN CB 1 1 20 13783 1 1 16 ASN CG C 5.870 0.480 11.585 1.00 . A A . 16 ASN CG 1 1 20 13784 1 1 16 ASN H H 4.697 -3.155 9.531 1.00 . A A . 16 ASN H 1 1 20 13785 1 1 16 ASN HA H 3.634 -1.095 11.312 1.00 . A A . 16 ASN HA 1 1 20 13786 1 1 16 ASN HB2 H 6.003 -1.599 11.982 1.00 . A A . 16 ASN HB2 1 1 20 13787 1 1 16 ASN HB3 H 6.515 -1.135 10.365 1.00 . A A . 16 ASN HB3 1 1 20 13788 1 1 16 ASN HD21 H 5.955 -0.092 13.485 1.00 . A A . 16 ASN HD21 1 1 20 13789 1 1 16 ASN HD22 H 6.014 1.613 13.208 1.00 . A A . 16 ASN HD22 1 1 20 13790 1 1 16 ASN N N 4.334 -2.795 10.364 1.00 . A A . 16 ASN N 1 1 20 13791 1 1 16 ASN ND2 N 5.956 0.688 12.890 1.00 . A A . 16 ASN ND2 1 1 20 13792 1 1 16 ASN O O 4.277 -1.191 8.198 1.00 . A A . 16 ASN O 1 1 20 13793 1 1 16 ASN OD1 O 5.869 1.403 10.772 1.00 . A A . 16 ASN OD1 1 1 20 13794 1 1 17 LYS C C 4.525 1.703 7.325 1.00 . A A . 17 LYS C 1 1 20 13795 1 1 17 LYS CA C 3.296 1.417 8.195 1.00 . A A . 17 LYS CA 1 1 20 13796 1 1 17 LYS CB C 2.643 2.740 8.619 1.00 . A A . 17 LYS CB 1 1 20 13797 1 1 17 LYS CD C 1.491 4.871 7.925 1.00 . A A . 17 LYS CD 1 1 20 13798 1 1 17 LYS CE C 0.671 5.565 6.842 1.00 . A A . 17 LYS CE 1 1 20 13799 1 1 17 LYS CG C 2.020 3.519 7.466 1.00 . A A . 17 LYS CG 1 1 20 13800 1 1 17 LYS H H 3.501 1.005 10.262 1.00 . A A . 17 LYS H 1 1 20 13801 1 1 17 LYS HA H 2.585 0.854 7.610 1.00 . A A . 17 LYS HA 1 1 20 13802 1 1 17 LYS HB2 H 1.867 2.529 9.340 1.00 . A A . 17 LYS HB2 1 1 20 13803 1 1 17 LYS HB3 H 3.392 3.365 9.083 1.00 . A A . 17 LYS HB3 1 1 20 13804 1 1 17 LYS HD2 H 0.865 4.724 8.793 1.00 . A A . 17 LYS HD2 1 1 20 13805 1 1 17 LYS HD3 H 2.328 5.502 8.188 1.00 . A A . 17 LYS HD3 1 1 20 13806 1 1 17 LYS HE2 H -0.180 4.945 6.603 1.00 . A A . 17 LYS HE2 1 1 20 13807 1 1 17 LYS HE3 H 0.325 6.513 7.226 1.00 . A A . 17 LYS HE3 1 1 20 13808 1 1 17 LYS HG2 H 2.771 3.678 6.706 1.00 . A A . 17 LYS HG2 1 1 20 13809 1 1 17 LYS HG3 H 1.204 2.943 7.054 1.00 . A A . 17 LYS HG3 1 1 20 13810 1 1 17 LYS HZ1 H 0.940 6.470 4.969 1.00 . A A . 17 LYS HZ1 1 1 20 13811 1 1 17 LYS HZ2 H 1.589 4.910 5.081 1.00 . A A . 17 LYS HZ2 1 1 20 13812 1 1 17 LYS HZ3 H 2.381 6.208 5.822 1.00 . A A . 17 LYS HZ3 1 1 20 13813 1 1 17 LYS N N 3.633 0.617 9.372 1.00 . A A . 17 LYS N 1 1 20 13814 1 1 17 LYS NZ N 1.452 5.803 5.599 1.00 . A A . 17 LYS NZ 1 1 20 13815 1 1 17 LYS O O 4.410 1.776 6.102 1.00 . A A . 17 LYS O 1 1 20 13816 1 1 18 LYS C C 7.178 1.196 6.068 1.00 . A A . 18 LYS C 1 1 20 13817 1 1 18 LYS CA C 6.934 2.175 7.230 1.00 . A A . 18 LYS CA 1 1 20 13818 1 1 18 LYS CB C 8.136 2.196 8.184 1.00 . A A . 18 LYS CB 1 1 20 13819 1 1 18 LYS CD C 9.289 3.295 10.136 1.00 . A A . 18 LYS CD 1 1 20 13820 1 1 18 LYS CE C 10.561 3.601 9.359 1.00 . A A . 18 LYS CE 1 1 20 13821 1 1 18 LYS CG C 8.064 3.296 9.232 1.00 . A A . 18 LYS CG 1 1 20 13822 1 1 18 LYS H H 5.712 1.815 8.939 1.00 . A A . 18 LYS H 1 1 20 13823 1 1 18 LYS HA H 6.820 3.164 6.810 1.00 . A A . 18 LYS HA 1 1 20 13824 1 1 18 LYS HB2 H 8.192 1.246 8.694 1.00 . A A . 18 LYS HB2 1 1 20 13825 1 1 18 LYS HB3 H 9.036 2.337 7.605 1.00 . A A . 18 LYS HB3 1 1 20 13826 1 1 18 LYS HD2 H 9.159 4.043 10.902 1.00 . A A . 18 LYS HD2 1 1 20 13827 1 1 18 LYS HD3 H 9.384 2.321 10.594 1.00 . A A . 18 LYS HD3 1 1 20 13828 1 1 18 LYS HE2 H 10.689 2.852 8.592 1.00 . A A . 18 LYS HE2 1 1 20 13829 1 1 18 LYS HE3 H 10.460 4.573 8.898 1.00 . A A . 18 LYS HE3 1 1 20 13830 1 1 18 LYS HG2 H 8.001 4.251 8.733 1.00 . A A . 18 LYS HG2 1 1 20 13831 1 1 18 LYS HG3 H 7.182 3.145 9.837 1.00 . A A . 18 LYS HG3 1 1 20 13832 1 1 18 LYS HZ1 H 12.629 3.574 9.658 1.00 . A A . 18 LYS HZ1 1 1 20 13833 1 1 18 LYS HZ2 H 11.753 2.776 10.865 1.00 . A A . 18 LYS HZ2 1 1 20 13834 1 1 18 LYS HZ3 H 11.781 4.467 10.819 1.00 . A A . 18 LYS HZ3 1 1 20 13835 1 1 18 LYS N N 5.690 1.877 7.958 1.00 . A A . 18 LYS N 1 1 20 13836 1 1 18 LYS NZ N 11.765 3.605 10.237 1.00 . A A . 18 LYS NZ 1 1 20 13837 1 1 18 LYS O O 7.291 1.635 4.924 1.00 . A A . 18 LYS O 1 1 20 13838 1 1 19 PRO C C 6.498 -0.956 4.099 1.00 . A A . 19 PRO C 1 1 20 13839 1 1 19 PRO CA C 7.473 -1.133 5.260 1.00 . A A . 19 PRO CA 1 1 20 13840 1 1 19 PRO CB C 7.195 -2.459 5.969 1.00 . A A . 19 PRO CB 1 1 20 13841 1 1 19 PRO CD C 7.151 -0.782 7.649 1.00 . A A . 19 PRO CD 1 1 20 13842 1 1 19 PRO CG C 7.568 -2.201 7.382 1.00 . A A . 19 PRO CG 1 1 20 13843 1 1 19 PRO HA H 8.488 -1.117 4.892 1.00 . A A . 19 PRO HA 1 1 20 13844 1 1 19 PRO HB2 H 6.147 -2.705 5.876 1.00 . A A . 19 PRO HB2 1 1 20 13845 1 1 19 PRO HB3 H 7.793 -3.246 5.535 1.00 . A A . 19 PRO HB3 1 1 20 13846 1 1 19 PRO HD2 H 6.135 -0.750 8.013 1.00 . A A . 19 PRO HD2 1 1 20 13847 1 1 19 PRO HD3 H 7.822 -0.319 8.358 1.00 . A A . 19 PRO HD3 1 1 20 13848 1 1 19 PRO HG2 H 7.038 -2.880 8.034 1.00 . A A . 19 PRO HG2 1 1 20 13849 1 1 19 PRO HG3 H 8.634 -2.309 7.509 1.00 . A A . 19 PRO HG3 1 1 20 13850 1 1 19 PRO N N 7.258 -0.136 6.324 1.00 . A A . 19 PRO N 1 1 20 13851 1 1 19 PRO O O 6.871 -1.065 2.928 1.00 . A A . 19 PRO O 1 1 20 13852 1 1 20 CYS C C 4.493 0.760 2.603 1.00 . A A . 20 CYS C 1 1 20 13853 1 1 20 CYS CA C 4.200 -0.474 3.455 1.00 . A A . 20 CYS CA 1 1 20 13854 1 1 20 CYS CB C 2.849 -0.332 4.161 1.00 . A A . 20 CYS CB 1 1 20 13855 1 1 20 CYS H H 5.025 -0.595 5.394 1.00 . A A . 20 CYS H 1 1 20 13856 1 1 20 CYS HA H 4.177 -1.345 2.815 1.00 . A A . 20 CYS HA 1 1 20 13857 1 1 20 CYS HB2 H 2.678 -1.208 4.767 1.00 . A A . 20 CYS HB2 1 1 20 13858 1 1 20 CYS HB3 H 2.881 0.538 4.801 1.00 . A A . 20 CYS HB3 1 1 20 13859 1 1 20 CYS N N 5.248 -0.675 4.443 1.00 . A A . 20 CYS N 1 1 20 13860 1 1 20 CYS O O 4.473 0.695 1.373 1.00 . A A . 20 CYS O 1 1 20 13861 1 1 20 CYS SG S 1.418 -0.148 3.048 1.00 . A A . 20 CYS SG 1 1 20 13862 1 1 21 VAL C C 6.294 2.926 1.637 1.00 . A A . 21 VAL C 1 1 20 13863 1 1 21 VAL CA C 5.104 3.122 2.566 1.00 . A A . 21 VAL CA 1 1 20 13864 1 1 21 VAL CB C 5.412 4.273 3.549 1.00 . A A . 21 VAL CB 1 1 20 13865 1 1 21 VAL CG1 C 5.697 5.567 2.799 1.00 . A A . 21 VAL CG1 1 1 20 13866 1 1 21 VAL CG2 C 4.263 4.468 4.524 1.00 . A A . 21 VAL CG2 1 1 20 13867 1 1 21 VAL H H 4.809 1.862 4.247 1.00 . A A . 21 VAL H 1 1 20 13868 1 1 21 VAL HA H 4.241 3.399 1.971 1.00 . A A . 21 VAL HA 1 1 20 13869 1 1 21 VAL HB H 6.294 4.010 4.115 1.00 . A A . 21 VAL HB 1 1 20 13870 1 1 21 VAL HG11 H 5.891 6.358 3.508 1.00 . A A . 21 VAL HG11 1 1 20 13871 1 1 21 VAL HG12 H 4.841 5.827 2.194 1.00 . A A . 21 VAL HG12 1 1 20 13872 1 1 21 VAL HG13 H 6.560 5.432 2.164 1.00 . A A . 21 VAL HG13 1 1 20 13873 1 1 21 VAL HG21 H 4.599 4.243 5.525 1.00 . A A . 21 VAL HG21 1 1 20 13874 1 1 21 VAL HG22 H 3.452 3.806 4.259 1.00 . A A . 21 VAL HG22 1 1 20 13875 1 1 21 VAL HG23 H 3.923 5.492 4.479 1.00 . A A . 21 VAL HG23 1 1 20 13876 1 1 21 VAL N N 4.790 1.878 3.263 1.00 . A A . 21 VAL N 1 1 20 13877 1 1 21 VAL O O 6.293 3.417 0.512 1.00 . A A . 21 VAL O 1 1 20 13878 1 1 22 ALA C C 8.105 1.156 0.046 1.00 . A A . 22 ALA C 1 1 20 13879 1 1 22 ALA CA C 8.486 1.922 1.309 1.00 . A A . 22 ALA CA 1 1 20 13880 1 1 22 ALA CB C 9.507 1.139 2.120 1.00 . A A . 22 ALA CB 1 1 20 13881 1 1 22 ALA H H 7.233 1.821 3.018 1.00 . A A . 22 ALA H 1 1 20 13882 1 1 22 ALA HA H 8.926 2.868 1.028 1.00 . A A . 22 ALA HA 1 1 20 13883 1 1 22 ALA HB1 H 10.503 1.441 1.832 1.00 . A A . 22 ALA HB1 1 1 20 13884 1 1 22 ALA HB2 H 9.383 0.083 1.932 1.00 . A A . 22 ALA HB2 1 1 20 13885 1 1 22 ALA HB3 H 9.361 1.338 3.171 1.00 . A A . 22 ALA HB3 1 1 20 13886 1 1 22 ALA N N 7.298 2.195 2.109 1.00 . A A . 22 ALA N 1 1 20 13887 1 1 22 ALA O O 8.582 1.458 -1.052 1.00 . A A . 22 ALA O 1 1 20 13888 1 1 23 CYS C C 5.999 0.260 -1.894 1.00 . A A . 23 CYS C 1 1 20 13889 1 1 23 CYS CA C 6.755 -0.626 -0.913 1.00 . A A . 23 CYS CA 1 1 20 13890 1 1 23 CYS CB C 5.838 -1.749 -0.416 1.00 . A A . 23 CYS CB 1 1 20 13891 1 1 23 CYS H H 6.870 -0.005 1.108 1.00 . A A . 23 CYS H 1 1 20 13892 1 1 23 CYS HA H 7.614 -1.055 -1.407 1.00 . A A . 23 CYS HA 1 1 20 13893 1 1 23 CYS HB2 H 6.257 -2.172 0.485 1.00 . A A . 23 CYS HB2 1 1 20 13894 1 1 23 CYS HB3 H 4.866 -1.335 -0.193 1.00 . A A . 23 CYS HB3 1 1 20 13895 1 1 23 CYS N N 7.225 0.175 0.208 1.00 . A A . 23 CYS N 1 1 20 13896 1 1 23 CYS O O 6.282 0.272 -3.094 1.00 . A A . 23 CYS O 1 1 20 13897 1 1 23 CYS SG S 5.601 -3.111 -1.607 1.00 . A A . 23 CYS SG 1 1 20 13898 1 1 24 CYS C C 5.059 2.972 -2.833 1.00 . A A . 24 CYS C 1 1 20 13899 1 1 24 CYS CA C 4.224 1.904 -2.145 1.00 . A A . 24 CYS CA 1 1 20 13900 1 1 24 CYS CB C 3.184 2.548 -1.237 1.00 . A A . 24 CYS CB 1 1 20 13901 1 1 24 CYS H H 4.882 0.938 -0.389 1.00 . A A . 24 CYS H 1 1 20 13902 1 1 24 CYS HA H 3.715 1.320 -2.897 1.00 . A A . 24 CYS HA 1 1 20 13903 1 1 24 CYS HB2 H 3.685 3.031 -0.412 1.00 . A A . 24 CYS HB2 1 1 20 13904 1 1 24 CYS HB3 H 2.626 3.283 -1.792 1.00 . A A . 24 CYS HB3 1 1 20 13905 1 1 24 CYS N N 5.046 1.001 -1.360 1.00 . A A . 24 CYS N 1 1 20 13906 1 1 24 CYS O O 4.801 3.328 -3.978 1.00 . A A . 24 CYS O 1 1 20 13907 1 1 24 CYS SG S 2.003 1.353 -0.544 1.00 . A A . 24 CYS SG 1 1 20 13908 1 1 25 LYS C C 7.696 3.994 -3.876 1.00 . A A . 25 LYS C 1 1 20 13909 1 1 25 LYS CA C 6.914 4.520 -2.677 1.00 . A A . 25 LYS CA 1 1 20 13910 1 1 25 LYS CB C 7.852 5.063 -1.594 1.00 . A A . 25 LYS CB 1 1 20 13911 1 1 25 LYS CD C 7.285 7.417 -2.329 1.00 . A A . 25 LYS CD 1 1 20 13912 1 1 25 LYS CE C 6.131 7.482 -1.333 1.00 . A A . 25 LYS CE 1 1 20 13913 1 1 25 LYS CG C 8.390 6.459 -1.885 1.00 . A A . 25 LYS CG 1 1 20 13914 1 1 25 LYS H H 6.213 3.166 -1.212 1.00 . A A . 25 LYS H 1 1 20 13915 1 1 25 LYS HA H 6.276 5.324 -3.015 1.00 . A A . 25 LYS HA 1 1 20 13916 1 1 25 LYS HB2 H 7.316 5.096 -0.657 1.00 . A A . 25 LYS HB2 1 1 20 13917 1 1 25 LYS HB3 H 8.691 4.391 -1.493 1.00 . A A . 25 LYS HB3 1 1 20 13918 1 1 25 LYS HD2 H 7.706 8.405 -2.434 1.00 . A A . 25 LYS HD2 1 1 20 13919 1 1 25 LYS HD3 H 6.904 7.086 -3.285 1.00 . A A . 25 LYS HD3 1 1 20 13920 1 1 25 LYS HE2 H 5.310 8.012 -1.791 1.00 . A A . 25 LYS HE2 1 1 20 13921 1 1 25 LYS HE3 H 5.818 6.473 -1.104 1.00 . A A . 25 LYS HE3 1 1 20 13922 1 1 25 LYS HG2 H 8.848 6.849 -0.989 1.00 . A A . 25 LYS HG2 1 1 20 13923 1 1 25 LYS HG3 H 9.130 6.390 -2.668 1.00 . A A . 25 LYS HG3 1 1 20 13924 1 1 25 LYS HZ1 H 5.664 8.648 0.331 1.00 . A A . 25 LYS HZ1 1 1 20 13925 1 1 25 LYS HZ2 H 7.237 8.882 -0.249 1.00 . A A . 25 LYS HZ2 1 1 20 13926 1 1 25 LYS HZ3 H 6.857 7.484 0.624 1.00 . A A . 25 LYS HZ3 1 1 20 13927 1 1 25 LYS N N 6.055 3.486 -2.130 1.00 . A A . 25 LYS N 1 1 20 13928 1 1 25 LYS NZ N 6.500 8.172 -0.068 1.00 . A A . 25 LYS NZ 1 1 20 13929 1 1 25 LYS O O 7.840 4.696 -4.876 1.00 . A A . 25 LYS O 1 1 20 13930 1 1 26 LYS C C 7.968 1.931 -6.082 1.00 . A A . 26 LYS C 1 1 20 13931 1 1 26 LYS CA C 8.918 2.167 -4.907 1.00 . A A . 26 LYS CA 1 1 20 13932 1 1 26 LYS CB C 9.622 0.856 -4.509 1.00 . A A . 26 LYS CB 1 1 20 13933 1 1 26 LYS CD C 9.655 -1.659 -4.685 1.00 . A A . 26 LYS CD 1 1 20 13934 1 1 26 LYS CE C 9.939 -2.101 -3.260 1.00 . A A . 26 LYS CE 1 1 20 13935 1 1 26 LYS CG C 8.794 -0.404 -4.733 1.00 . A A . 26 LYS CG 1 1 20 13936 1 1 26 LYS H H 8.022 2.225 -2.981 1.00 . A A . 26 LYS H 1 1 20 13937 1 1 26 LYS HA H 9.665 2.887 -5.212 1.00 . A A . 26 LYS HA 1 1 20 13938 1 1 26 LYS HB2 H 10.531 0.764 -5.083 1.00 . A A . 26 LYS HB2 1 1 20 13939 1 1 26 LYS HB3 H 9.876 0.908 -3.460 1.00 . A A . 26 LYS HB3 1 1 20 13940 1 1 26 LYS HD2 H 9.140 -2.457 -5.200 1.00 . A A . 26 LYS HD2 1 1 20 13941 1 1 26 LYS HD3 H 10.594 -1.457 -5.182 1.00 . A A . 26 LYS HD3 1 1 20 13942 1 1 26 LYS HE2 H 10.720 -2.847 -3.275 1.00 . A A . 26 LYS HE2 1 1 20 13943 1 1 26 LYS HE3 H 10.269 -1.244 -2.690 1.00 . A A . 26 LYS HE3 1 1 20 13944 1 1 26 LYS HG2 H 8.039 -0.469 -3.964 1.00 . A A . 26 LYS HG2 1 1 20 13945 1 1 26 LYS HG3 H 8.318 -0.342 -5.701 1.00 . A A . 26 LYS HG3 1 1 20 13946 1 1 26 LYS HZ1 H 9.008 -3.373 -1.892 1.00 . A A . 26 LYS HZ1 1 1 20 13947 1 1 26 LYS HZ2 H 8.133 -3.151 -3.326 1.00 . A A . 26 LYS HZ2 1 1 20 13948 1 1 26 LYS HZ3 H 8.177 -1.924 -2.160 1.00 . A A . 26 LYS HZ3 1 1 20 13949 1 1 26 LYS N N 8.179 2.753 -3.792 1.00 . A A . 26 LYS N 1 1 20 13950 1 1 26 LYS NZ N 8.732 -2.676 -2.613 1.00 . A A . 26 LYS NZ 1 1 20 13951 1 1 26 LYS O O 8.373 1.974 -7.241 1.00 . A A . 26 LYS O 1 1 20 13952 1 1 27 ALA C C 5.137 2.783 -7.334 1.00 . A A . 27 ALA C 1 1 20 13953 1 1 27 ALA CA C 5.672 1.460 -6.780 1.00 . A A . 27 ALA CA 1 1 20 13954 1 1 27 ALA CB C 4.542 0.619 -6.206 1.00 . A A . 27 ALA CB 1 1 20 13955 1 1 27 ALA H H 6.435 1.678 -4.818 1.00 . A A . 27 ALA H 1 1 20 13956 1 1 27 ALA HA H 6.128 0.905 -7.587 1.00 . A A . 27 ALA HA 1 1 20 13957 1 1 27 ALA HB1 H 4.642 -0.400 -6.548 1.00 . A A . 27 ALA HB1 1 1 20 13958 1 1 27 ALA HB2 H 3.594 1.018 -6.535 1.00 . A A . 27 ALA HB2 1 1 20 13959 1 1 27 ALA HB3 H 4.588 0.642 -5.127 1.00 . A A . 27 ALA HB3 1 1 20 13960 1 1 27 ALA N N 6.694 1.691 -5.763 1.00 . A A . 27 ALA N 1 1 20 13961 1 1 27 ALA O O 4.178 2.802 -8.109 1.00 . A A . 27 ALA O 1 1 20 13962 1 1 28 LYS C C 4.069 5.681 -6.828 1.00 . A A . 28 LYS C 1 1 20 13963 1 1 28 LYS CA C 5.433 5.228 -7.372 1.00 . A A . 28 LYS CA 1 1 20 13964 1 1 28 LYS CB C 5.471 5.320 -8.906 1.00 . A A . 28 LYS CB 1 1 20 13965 1 1 28 LYS CD C 5.807 6.742 -10.949 1.00 . A A . 28 LYS CD 1 1 20 13966 1 1 28 LYS CE C 6.065 8.145 -11.474 1.00 . A A . 28 LYS CE 1 1 20 13967 1 1 28 LYS CG C 5.638 6.735 -9.439 1.00 . A A . 28 LYS CG 1 1 20 13968 1 1 28 LYS H H 6.545 3.769 -6.326 1.00 . A A . 28 LYS H 1 1 20 13969 1 1 28 LYS HA H 6.185 5.894 -6.976 1.00 . A A . 28 LYS HA 1 1 20 13970 1 1 28 LYS HB2 H 6.297 4.724 -9.268 1.00 . A A . 28 LYS HB2 1 1 20 13971 1 1 28 LYS HB3 H 4.550 4.916 -9.300 1.00 . A A . 28 LYS HB3 1 1 20 13972 1 1 28 LYS HD2 H 6.644 6.112 -11.212 1.00 . A A . 28 LYS HD2 1 1 20 13973 1 1 28 LYS HD3 H 4.907 6.357 -11.404 1.00 . A A . 28 LYS HD3 1 1 20 13974 1 1 28 LYS HE2 H 5.204 8.760 -11.258 1.00 . A A . 28 LYS HE2 1 1 20 13975 1 1 28 LYS HE3 H 6.932 8.550 -10.973 1.00 . A A . 28 LYS HE3 1 1 20 13976 1 1 28 LYS HG2 H 4.762 7.311 -9.183 1.00 . A A . 28 LYS HG2 1 1 20 13977 1 1 28 LYS HG3 H 6.510 7.181 -8.984 1.00 . A A . 28 LYS HG3 1 1 20 13978 1 1 28 LYS HZ1 H 7.258 7.784 -13.150 1.00 . A A . 28 LYS HZ1 1 1 20 13979 1 1 28 LYS HZ2 H 6.236 9.122 -13.313 1.00 . A A . 28 LYS HZ2 1 1 20 13980 1 1 28 LYS HZ3 H 5.604 7.557 -13.425 1.00 . A A . 28 LYS HZ3 1 1 20 13981 1 1 28 LYS N N 5.784 3.877 -6.935 1.00 . A A . 28 LYS N 1 1 20 13982 1 1 28 LYS NZ N 6.307 8.153 -12.944 1.00 . A A . 28 LYS NZ 1 1 20 13983 1 1 28 LYS O O 3.331 6.415 -7.492 1.00 . A A . 28 LYS O 1 1 20 13984 1 1 29 PHE C C 2.814 6.755 -3.913 1.00 . A A . 29 PHE C 1 1 20 13985 1 1 29 PHE CA C 2.513 5.683 -4.953 1.00 . A A . 29 PHE CA 1 1 20 13986 1 1 29 PHE CB C 1.784 4.499 -4.306 1.00 . A A . 29 PHE CB 1 1 20 13987 1 1 29 PHE CD1 C 1.750 2.793 -6.152 1.00 . A A . 29 PHE CD1 1 1 20 13988 1 1 29 PHE CD2 C -0.333 3.618 -5.340 1.00 . A A . 29 PHE CD2 1 1 20 13989 1 1 29 PHE CE1 C 1.080 1.983 -7.050 1.00 . A A . 29 PHE CE1 1 1 20 13990 1 1 29 PHE CE2 C -1.007 2.810 -6.234 1.00 . A A . 29 PHE CE2 1 1 20 13991 1 1 29 PHE CG C 1.055 3.621 -5.289 1.00 . A A . 29 PHE CG 1 1 20 13992 1 1 29 PHE CZ C -0.300 1.991 -7.090 1.00 . A A . 29 PHE CZ 1 1 20 13993 1 1 29 PHE H H 4.395 4.718 -5.104 1.00 . A A . 29 PHE H 1 1 20 13994 1 1 29 PHE HA H 1.876 6.114 -5.713 1.00 . A A . 29 PHE HA 1 1 20 13995 1 1 29 PHE HB2 H 2.504 3.887 -3.787 1.00 . A A . 29 PHE HB2 1 1 20 13996 1 1 29 PHE HB3 H 1.060 4.874 -3.593 1.00 . A A . 29 PHE HB3 1 1 20 13997 1 1 29 PHE HD1 H 2.829 2.786 -6.123 1.00 . A A . 29 PHE HD1 1 1 20 13998 1 1 29 PHE HD2 H -0.889 4.261 -4.673 1.00 . A A . 29 PHE HD2 1 1 20 13999 1 1 29 PHE HE1 H 1.637 1.343 -7.718 1.00 . A A . 29 PHE HE1 1 1 20 14000 1 1 29 PHE HE2 H -2.087 2.817 -6.262 1.00 . A A . 29 PHE HE2 1 1 20 14001 1 1 29 PHE HZ H -0.824 1.357 -7.790 1.00 . A A . 29 PHE HZ 1 1 20 14002 1 1 29 PHE N N 3.757 5.278 -5.601 1.00 . A A . 29 PHE N 1 1 20 14003 1 1 29 PHE O O 3.885 6.751 -3.306 1.00 . A A . 29 PHE O 1 1 20 14004 1 1 30 SER C C 2.296 8.296 -1.370 1.00 . A A . 30 SER C 1 1 20 14005 1 1 30 SER CA C 2.045 8.784 -2.800 1.00 . A A . 30 SER CA 1 1 20 14006 1 1 30 SER CB C 0.807 9.683 -2.852 1.00 . A A . 30 SER CB 1 1 20 14007 1 1 30 SER H H 1.062 7.631 -4.268 1.00 . A A . 30 SER H 1 1 20 14008 1 1 30 SER HA H 2.900 9.355 -3.119 1.00 . A A . 30 SER HA 1 1 20 14009 1 1 30 SER HB2 H -0.013 9.195 -2.346 1.00 . A A . 30 SER HB2 1 1 20 14010 1 1 30 SER HB3 H 1.024 10.622 -2.365 1.00 . A A . 30 SER HB3 1 1 20 14011 1 1 30 SER HG H 0.437 10.897 -4.363 1.00 . A A . 30 SER HG 1 1 20 14012 1 1 30 SER N N 1.882 7.678 -3.737 1.00 . A A . 30 SER N 1 1 20 14013 1 1 30 SER O O 3.240 8.745 -0.710 1.00 . A A . 30 SER O 1 1 20 14014 1 1 30 SER OG O 0.430 9.941 -4.199 1.00 . A A . 30 SER OG 1 1 20 14015 1 1 31 ASP C C 0.951 5.471 0.582 1.00 . A A . 31 ASP C 1 1 20 14016 1 1 31 ASP CA C 1.618 6.833 0.454 1.00 . A A . 31 ASP CA 1 1 20 14017 1 1 31 ASP CB C 1.033 7.786 1.500 1.00 . A A . 31 ASP CB 1 1 20 14018 1 1 31 ASP CG C 1.230 7.266 2.914 1.00 . A A . 31 ASP CG 1 1 20 14019 1 1 31 ASP H H 0.741 7.041 -1.473 1.00 . A A . 31 ASP H 1 1 20 14020 1 1 31 ASP HA H 2.675 6.716 0.643 1.00 . A A . 31 ASP HA 1 1 20 14021 1 1 31 ASP HB2 H 1.516 8.748 1.417 1.00 . A A . 31 ASP HB2 1 1 20 14022 1 1 31 ASP HB3 H -0.027 7.901 1.322 1.00 . A A . 31 ASP HB3 1 1 20 14023 1 1 31 ASP N N 1.468 7.372 -0.899 1.00 . A A . 31 ASP N 1 1 20 14024 1 1 31 ASP O O -0.031 5.180 -0.105 1.00 . A A . 31 ASP O 1 1 20 14025 1 1 31 ASP OD1 O 2.391 7.012 3.302 1.00 . A A . 31 ASP OD1 1 1 20 14026 1 1 31 ASP OD2 O 0.228 7.082 3.638 1.00 . A A . 31 ASP OD2 1 1 20 14027 1 1 32 GLY C C 0.341 3.161 3.059 1.00 . A A . 32 GLY C 1 1 20 14028 1 1 32 GLY CA C 0.949 3.322 1.683 1.00 . A A . 32 GLY CA 1 1 20 14029 1 1 32 GLY H H 2.268 4.942 1.985 1.00 . A A . 32 GLY H 1 1 20 14030 1 1 32 GLY HA2 H 0.188 3.130 0.941 1.00 . A A . 32 GLY HA2 1 1 20 14031 1 1 32 GLY HA3 H 1.741 2.596 1.566 1.00 . A A . 32 GLY HA3 1 1 20 14032 1 1 32 GLY N N 1.491 4.644 1.465 1.00 . A A . 32 GLY N 1 1 20 14033 1 1 32 GLY O O 0.877 3.664 4.048 1.00 . A A . 32 GLY O 1 1 20 14034 1 1 33 HIS C C -1.822 0.731 4.503 1.00 . A A . 33 HIS C 1 1 20 14035 1 1 33 HIS CA C -1.450 2.199 4.386 1.00 . A A . 33 HIS CA 1 1 20 14036 1 1 33 HIS CB C -2.705 3.071 4.531 1.00 . A A . 33 HIS CB 1 1 20 14037 1 1 33 HIS CD2 C -4.885 2.284 3.357 1.00 . A A . 33 HIS CD2 1 1 20 14038 1 1 33 HIS CE1 C -4.527 3.161 1.383 1.00 . A A . 33 HIS CE1 1 1 20 14039 1 1 33 HIS CG C -3.696 2.932 3.409 1.00 . A A . 33 HIS CG 1 1 20 14040 1 1 33 HIS H H -1.136 2.053 2.297 1.00 . A A . 33 HIS H 1 1 20 14041 1 1 33 HIS HA H -0.761 2.443 5.181 1.00 . A A . 33 HIS HA 1 1 20 14042 1 1 33 HIS HB2 H -3.210 2.805 5.447 1.00 . A A . 33 HIS HB2 1 1 20 14043 1 1 33 HIS HB3 H -2.403 4.103 4.585 1.00 . A A . 33 HIS HB3 1 1 20 14044 1 1 33 HIS HD1 H -2.735 4.014 1.870 1.00 . A A . 33 HIS HD1 1 1 20 14045 1 1 33 HIS HD2 H -5.350 1.733 4.159 1.00 . A A . 33 HIS HD2 1 1 20 14046 1 1 33 HIS HE1 H -4.641 3.431 0.344 1.00 . A A . 33 HIS HE1 1 1 20 14047 1 1 33 HIS N N -0.769 2.446 3.125 1.00 . A A . 33 HIS N 1 1 20 14048 1 1 33 HIS ND1 N -3.504 3.472 2.154 1.00 . A A . 33 HIS ND1 1 1 20 14049 1 1 33 HIS NE2 N -5.379 2.443 2.088 1.00 . A A . 33 HIS NE2 1 1 20 14050 1 1 33 HIS O O -2.419 0.153 3.601 1.00 . A A . 33 HIS O 1 1 20 14051 1 1 34 CYS C C -3.219 -1.466 6.202 1.00 . A A . 34 CYS C 1 1 20 14052 1 1 34 CYS CA C -1.749 -1.264 5.866 1.00 . A A . 34 CYS CA 1 1 20 14053 1 1 34 CYS CB C -0.874 -1.774 7.006 1.00 . A A . 34 CYS CB 1 1 20 14054 1 1 34 CYS H H -0.989 0.658 6.298 1.00 . A A . 34 CYS H 1 1 20 14055 1 1 34 CYS HA H -1.516 -1.817 4.969 1.00 . A A . 34 CYS HA 1 1 20 14056 1 1 34 CYS HB2 H -1.130 -1.245 7.913 1.00 . A A . 34 CYS HB2 1 1 20 14057 1 1 34 CYS HB3 H -1.053 -2.830 7.146 1.00 . A A . 34 CYS HB3 1 1 20 14058 1 1 34 CYS N N -1.462 0.139 5.618 1.00 . A A . 34 CYS N 1 1 20 14059 1 1 34 CYS O O -3.824 -0.639 6.884 1.00 . A A . 34 CYS O 1 1 20 14060 1 1 34 CYS SG S 0.907 -1.546 6.714 1.00 . A A . 34 CYS SG 1 1 20 14061 1 1 35 SER C C -5.359 -3.447 7.387 1.00 . A A . 35 SER C 1 1 20 14062 1 1 35 SER CA C -5.189 -2.856 5.987 1.00 . A A . 35 SER CA 1 1 20 14063 1 1 35 SER CB C -5.755 -3.805 4.929 1.00 . A A . 35 SER CB 1 1 20 14064 1 1 35 SER H H -3.262 -3.185 5.179 1.00 . A A . 35 SER H 1 1 20 14065 1 1 35 SER HA H -5.726 -1.924 5.935 1.00 . A A . 35 SER HA 1 1 20 14066 1 1 35 SER HB2 H -6.677 -4.234 5.292 1.00 . A A . 35 SER HB2 1 1 20 14067 1 1 35 SER HB3 H -5.948 -3.253 4.020 1.00 . A A . 35 SER HB3 1 1 20 14068 1 1 35 SER HG H -4.141 -4.515 4.077 1.00 . A A . 35 SER HG 1 1 20 14069 1 1 35 SER N N -3.792 -2.562 5.720 1.00 . A A . 35 SER N 1 1 20 14070 1 1 35 SER O O -4.517 -3.245 8.264 1.00 . A A . 35 SER O 1 1 20 14071 1 1 35 SER OG O -4.850 -4.854 4.642 1.00 . A A . 35 SER OG 1 1 20 14072 1 1 36 LYS C C -7.014 -6.274 8.776 1.00 . A A . 36 LYS C 1 1 20 14073 1 1 36 LYS CA C -6.704 -4.784 8.895 1.00 . A A . 36 LYS CA 1 1 20 14074 1 1 36 LYS CB C -7.863 -4.059 9.589 1.00 . A A . 36 LYS CB 1 1 20 14075 1 1 36 LYS CD C -9.269 -3.784 11.660 1.00 . A A . 36 LYS CD 1 1 20 14076 1 1 36 LYS CE C -8.847 -2.342 11.904 1.00 . A A . 36 LYS CE 1 1 20 14077 1 1 36 LYS CG C -8.167 -4.585 10.984 1.00 . A A . 36 LYS CG 1 1 20 14078 1 1 36 LYS H H -7.078 -4.306 6.866 1.00 . A A . 36 LYS H 1 1 20 14079 1 1 36 LYS HA H -5.815 -4.665 9.495 1.00 . A A . 36 LYS HA 1 1 20 14080 1 1 36 LYS HB2 H -7.619 -3.010 9.670 1.00 . A A . 36 LYS HB2 1 1 20 14081 1 1 36 LYS HB3 H -8.752 -4.167 8.986 1.00 . A A . 36 LYS HB3 1 1 20 14082 1 1 36 LYS HD2 H -10.144 -3.789 11.027 1.00 . A A . 36 LYS HD2 1 1 20 14083 1 1 36 LYS HD3 H -9.506 -4.245 12.607 1.00 . A A . 36 LYS HD3 1 1 20 14084 1 1 36 LYS HE2 H -7.961 -2.339 12.521 1.00 . A A . 36 LYS HE2 1 1 20 14085 1 1 36 LYS HE3 H -8.625 -1.879 10.954 1.00 . A A . 36 LYS HE3 1 1 20 14086 1 1 36 LYS HG2 H -8.480 -5.616 10.908 1.00 . A A . 36 LYS HG2 1 1 20 14087 1 1 36 LYS HG3 H -7.270 -4.523 11.583 1.00 . A A . 36 LYS HG3 1 1 20 14088 1 1 36 LYS HZ1 H -10.527 -2.195 13.137 1.00 . A A . 36 LYS HZ1 1 1 20 14089 1 1 36 LYS HZ2 H -10.495 -1.057 11.885 1.00 . A A . 36 LYS HZ2 1 1 20 14090 1 1 36 LYS HZ3 H -9.489 -0.862 13.231 1.00 . A A . 36 LYS HZ3 1 1 20 14091 1 1 36 LYS N N -6.443 -4.178 7.596 1.00 . A A . 36 LYS N 1 1 20 14092 1 1 36 LYS NZ N -9.914 -1.559 12.587 1.00 . A A . 36 LYS NZ 1 1 20 14093 1 1 36 LYS O O -6.485 -7.077 9.535 1.00 . A A . 36 LYS O 1 1 20 14094 1 1 37 ILE C C -7.087 -8.909 7.274 1.00 . A A . 37 ILE C 1 1 20 14095 1 1 37 ILE CA C -8.281 -8.029 7.647 1.00 . A A . 37 ILE CA 1 1 20 14096 1 1 37 ILE CB C -9.370 -8.158 6.561 1.00 . A A . 37 ILE CB 1 1 20 14097 1 1 37 ILE CD1 C -11.641 -7.251 5.836 1.00 . A A . 37 ILE CD1 1 1 20 14098 1 1 37 ILE CG1 C -10.568 -7.268 6.904 1.00 . A A . 37 ILE CG1 1 1 20 14099 1 1 37 ILE CG2 C -9.808 -9.611 6.416 1.00 . A A . 37 ILE CG2 1 1 20 14100 1 1 37 ILE H H -8.290 -5.944 7.275 1.00 . A A . 37 ILE H 1 1 20 14101 1 1 37 ILE HA H -8.694 -8.384 8.580 1.00 . A A . 37 ILE HA 1 1 20 14102 1 1 37 ILE HB H -8.949 -7.839 5.620 1.00 . A A . 37 ILE HB 1 1 20 14103 1 1 37 ILE HD11 H -11.731 -8.236 5.402 1.00 . A A . 37 ILE HD11 1 1 20 14104 1 1 37 ILE HD12 H -11.372 -6.542 5.067 1.00 . A A . 37 ILE HD12 1 1 20 14105 1 1 37 ILE HD13 H -12.583 -6.964 6.278 1.00 . A A . 37 ILE HD13 1 1 20 14106 1 1 37 ILE HG12 H -11.018 -7.621 7.819 1.00 . A A . 37 ILE HG12 1 1 20 14107 1 1 37 ILE HG13 H -10.224 -6.253 7.046 1.00 . A A . 37 ILE HG13 1 1 20 14108 1 1 37 ILE HG21 H -10.624 -9.673 5.711 1.00 . A A . 37 ILE HG21 1 1 20 14109 1 1 37 ILE HG22 H -10.133 -9.986 7.375 1.00 . A A . 37 ILE HG22 1 1 20 14110 1 1 37 ILE HG23 H -8.979 -10.204 6.059 1.00 . A A . 37 ILE HG23 1 1 20 14111 1 1 37 ILE N N -7.887 -6.632 7.837 1.00 . A A . 37 ILE N 1 1 20 14112 1 1 37 ILE O O -6.681 -9.773 8.043 1.00 . A A . 37 ILE O 1 1 20 14113 1 1 38 LEU C C -4.089 -8.766 6.047 1.00 . A A . 38 LEU C 1 1 20 14114 1 1 38 LEU CA C -5.380 -9.466 5.643 1.00 . A A . 38 LEU CA 1 1 20 14115 1 1 38 LEU CB C -5.428 -9.674 4.126 1.00 . A A . 38 LEU CB 1 1 20 14116 1 1 38 LEU CD1 C -4.601 -12.046 4.205 1.00 . A A . 38 LEU CD1 1 1 20 14117 1 1 38 LEU CD2 C -4.511 -10.768 2.061 1.00 . A A . 38 LEU CD2 1 1 20 14118 1 1 38 LEU CG C -4.406 -10.674 3.575 1.00 . A A . 38 LEU CG 1 1 20 14119 1 1 38 LEU H H -6.887 -7.984 5.517 1.00 . A A . 38 LEU H 1 1 20 14120 1 1 38 LEU HA H -5.423 -10.427 6.134 1.00 . A A . 38 LEU HA 1 1 20 14121 1 1 38 LEU HB2 H -6.417 -10.018 3.862 1.00 . A A . 38 LEU HB2 1 1 20 14122 1 1 38 LEU HB3 H -5.258 -8.721 3.647 1.00 . A A . 38 LEU HB3 1 1 20 14123 1 1 38 LEU HD11 H -4.317 -12.811 3.497 1.00 . A A . 38 LEU HD11 1 1 20 14124 1 1 38 LEU HD12 H -5.639 -12.173 4.475 1.00 . A A . 38 LEU HD12 1 1 20 14125 1 1 38 LEU HD13 H -3.986 -12.127 5.088 1.00 . A A . 38 LEU HD13 1 1 20 14126 1 1 38 LEU HD21 H -5.513 -11.064 1.788 1.00 . A A . 38 LEU HD21 1 1 20 14127 1 1 38 LEU HD22 H -3.807 -11.502 1.696 1.00 . A A . 38 LEU HD22 1 1 20 14128 1 1 38 LEU HD23 H -4.288 -9.806 1.625 1.00 . A A . 38 LEU HD23 1 1 20 14129 1 1 38 LEU HG H -3.411 -10.333 3.821 1.00 . A A . 38 LEU HG 1 1 20 14130 1 1 38 LEU N N -6.527 -8.684 6.092 1.00 . A A . 38 LEU N 1 1 20 14131 1 1 38 LEU O O -3.002 -9.337 5.976 1.00 . A A . 38 LEU O 1 1 20 14132 1 1 39 ARG C C -2.116 -6.478 5.756 1.00 . A A . 39 ARG C 1 1 20 14133 1 1 39 ARG CA C -3.120 -6.681 6.897 1.00 . A A . 39 ARG CA 1 1 20 14134 1 1 39 ARG CB C -2.436 -7.291 8.126 1.00 . A A . 39 ARG CB 1 1 20 14135 1 1 39 ARG CD C -2.465 -5.292 9.652 1.00 . A A . 39 ARG CD 1 1 20 14136 1 1 39 ARG CG C -1.597 -6.302 8.917 1.00 . A A . 39 ARG CG 1 1 20 14137 1 1 39 ARG CZ C -0.833 -4.504 11.350 1.00 . A A . 39 ARG CZ 1 1 20 14138 1 1 39 ARG H H -5.138 -7.136 6.494 1.00 . A A . 39 ARG H 1 1 20 14139 1 1 39 ARG HA H -3.523 -5.716 7.169 1.00 . A A . 39 ARG HA 1 1 20 14140 1 1 39 ARG HB2 H -3.194 -7.691 8.783 1.00 . A A . 39 ARG HB2 1 1 20 14141 1 1 39 ARG HB3 H -1.793 -8.097 7.803 1.00 . A A . 39 ARG HB3 1 1 20 14142 1 1 39 ARG HD2 H -3.117 -4.813 8.937 1.00 . A A . 39 ARG HD2 1 1 20 14143 1 1 39 ARG HD3 H -3.060 -5.816 10.386 1.00 . A A . 39 ARG HD3 1 1 20 14144 1 1 39 ARG HE H -1.747 -3.347 9.991 1.00 . A A . 39 ARG HE 1 1 20 14145 1 1 39 ARG HG2 H -1.003 -6.843 9.639 1.00 . A A . 39 ARG HG2 1 1 20 14146 1 1 39 ARG HG3 H -0.945 -5.774 8.236 1.00 . A A . 39 ARG HG3 1 1 20 14147 1 1 39 ARG HH11 H -1.303 -6.470 11.507 1.00 . A A . 39 ARG HH11 1 1 20 14148 1 1 39 ARG HH12 H -0.111 -5.906 12.628 1.00 . A A . 39 ARG HH12 1 1 20 14149 1 1 39 ARG HH21 H -0.179 -2.588 11.482 1.00 . A A . 39 ARG HH21 1 1 20 14150 1 1 39 ARG HH22 H 0.534 -3.688 12.613 1.00 . A A . 39 ARG HH22 1 1 20 14151 1 1 39 ARG N N -4.238 -7.513 6.467 1.00 . A A . 39 ARG N 1 1 20 14152 1 1 39 ARG NE N -1.668 -4.265 10.331 1.00 . A A . 39 ARG NE 1 1 20 14153 1 1 39 ARG NH1 N -0.743 -5.724 11.873 1.00 . A A . 39 ARG NH1 1 1 20 14154 1 1 39 ARG NH2 N -0.103 -3.513 11.858 1.00 . A A . 39 ARG NH2 1 1 20 14155 1 1 39 ARG O O -0.916 -6.334 5.980 1.00 . A A . 39 ARG O 1 1 20 14156 1 1 40 ARG C C -1.541 -4.719 3.180 1.00 . A A . 40 ARG C 1 1 20 14157 1 1 40 ARG CA C -1.784 -6.211 3.362 1.00 . A A . 40 ARG CA 1 1 20 14158 1 1 40 ARG CB C -2.396 -6.823 2.097 1.00 . A A . 40 ARG CB 1 1 20 14159 1 1 40 ARG CD C -4.450 -7.414 0.778 1.00 . A A . 40 ARG CD 1 1 20 14160 1 1 40 ARG CG C -3.913 -6.845 2.088 1.00 . A A . 40 ARG CG 1 1 20 14161 1 1 40 ARG CZ C -6.863 -6.836 0.855 1.00 . A A . 40 ARG CZ 1 1 20 14162 1 1 40 ARG H H -3.593 -6.529 4.416 1.00 . A A . 40 ARG H 1 1 20 14163 1 1 40 ARG HA H -0.833 -6.688 3.553 1.00 . A A . 40 ARG HA 1 1 20 14164 1 1 40 ARG HB2 H -2.064 -6.254 1.241 1.00 . A A . 40 ARG HB2 1 1 20 14165 1 1 40 ARG HB3 H -2.043 -7.839 1.998 1.00 . A A . 40 ARG HB3 1 1 20 14166 1 1 40 ARG HD2 H -4.299 -6.684 -0.003 1.00 . A A . 40 ARG HD2 1 1 20 14167 1 1 40 ARG HD3 H -3.898 -8.311 0.540 1.00 . A A . 40 ARG HD3 1 1 20 14168 1 1 40 ARG HE H -6.110 -8.690 0.926 1.00 . A A . 40 ARG HE 1 1 20 14169 1 1 40 ARG HG2 H -4.253 -7.464 2.908 1.00 . A A . 40 ARG HG2 1 1 20 14170 1 1 40 ARG HG3 H -4.280 -5.838 2.215 1.00 . A A . 40 ARG HG3 1 1 20 14171 1 1 40 ARG HH11 H -5.646 -5.239 0.493 1.00 . A A . 40 ARG HH11 1 1 20 14172 1 1 40 ARG HH12 H -7.340 -4.879 0.659 1.00 . A A . 40 ARG HH12 1 1 20 14173 1 1 40 ARG HH21 H -8.336 -8.204 1.116 1.00 . A A . 40 ARG HH21 1 1 20 14174 1 1 40 ARG HH22 H -8.866 -6.560 1.000 1.00 . A A . 40 ARG HH22 1 1 20 14175 1 1 40 ARG N N -2.625 -6.435 4.531 1.00 . A A . 40 ARG N 1 1 20 14176 1 1 40 ARG NE N -5.878 -7.740 0.852 1.00 . A A . 40 ARG NE 1 1 20 14177 1 1 40 ARG NH1 N -6.602 -5.550 0.657 1.00 . A A . 40 ARG NH1 1 1 20 14178 1 1 40 ARG NH2 N -8.123 -7.231 1.005 1.00 . A A . 40 ARG NH2 1 1 20 14179 1 1 40 ARG O O -2.238 -3.894 3.776 1.00 . A A . 40 ARG O 1 1 20 14180 1 1 41 CYS C C -0.998 -2.353 1.032 1.00 . A A . 41 CYS C 1 1 20 14181 1 1 41 CYS CA C -0.176 -2.992 2.153 1.00 . A A . 41 CYS CA 1 1 20 14182 1 1 41 CYS CB C 1.313 -2.915 1.815 1.00 . A A . 41 CYS CB 1 1 20 14183 1 1 41 CYS H H -0.010 -5.087 1.962 1.00 . A A . 41 CYS H 1 1 20 14184 1 1 41 CYS HA H -0.352 -2.446 3.065 1.00 . A A . 41 CYS HA 1 1 20 14185 1 1 41 CYS HB2 H 1.882 -3.274 2.659 1.00 . A A . 41 CYS HB2 1 1 20 14186 1 1 41 CYS HB3 H 1.512 -3.547 0.962 1.00 . A A . 41 CYS HB3 1 1 20 14187 1 1 41 CYS N N -0.539 -4.382 2.389 1.00 . A A . 41 CYS N 1 1 20 14188 1 1 41 CYS O O -0.775 -2.633 -0.147 1.00 . A A . 41 CYS O 1 1 20 14189 1 1 41 CYS SG S 1.917 -1.246 1.420 1.00 . A A . 41 CYS SG 1 1 20 14190 1 1 42 LEU C C -2.041 0.537 0.035 1.00 . A A . 42 LEU C 1 1 20 14191 1 1 42 LEU CA C -2.741 -0.757 0.429 1.00 . A A . 42 LEU CA 1 1 20 14192 1 1 42 LEU CB C -4.131 -0.426 0.999 1.00 . A A . 42 LEU CB 1 1 20 14193 1 1 42 LEU CD1 C -4.702 -2.645 2.017 1.00 . A A . 42 LEU CD1 1 1 20 14194 1 1 42 LEU CD2 C -6.523 -1.059 1.404 1.00 . A A . 42 LEU CD2 1 1 20 14195 1 1 42 LEU CG C -5.141 -1.576 1.036 1.00 . A A . 42 LEU CG 1 1 20 14196 1 1 42 LEU H H -2.041 -1.266 2.365 1.00 . A A . 42 LEU H 1 1 20 14197 1 1 42 LEU HA H -2.846 -1.385 -0.445 1.00 . A A . 42 LEU HA 1 1 20 14198 1 1 42 LEU HB2 H -3.998 -0.069 2.011 1.00 . A A . 42 LEU HB2 1 1 20 14199 1 1 42 LEU HB3 H -4.556 0.379 0.412 1.00 . A A . 42 LEU HB3 1 1 20 14200 1 1 42 LEU HD11 H -3.677 -2.468 2.307 1.00 . A A . 42 LEU HD11 1 1 20 14201 1 1 42 LEU HD12 H -4.782 -3.616 1.551 1.00 . A A . 42 LEU HD12 1 1 20 14202 1 1 42 LEU HD13 H -5.335 -2.612 2.891 1.00 . A A . 42 LEU HD13 1 1 20 14203 1 1 42 LEU HD21 H -6.986 -1.736 2.107 1.00 . A A . 42 LEU HD21 1 1 20 14204 1 1 42 LEU HD22 H -7.132 -0.992 0.514 1.00 . A A . 42 LEU HD22 1 1 20 14205 1 1 42 LEU HD23 H -6.434 -0.081 1.853 1.00 . A A . 42 LEU HD23 1 1 20 14206 1 1 42 LEU HG H -5.202 -2.027 0.056 1.00 . A A . 42 LEU HG 1 1 20 14207 1 1 42 LEU N N -1.923 -1.468 1.406 1.00 . A A . 42 LEU N 1 1 20 14208 1 1 42 LEU O O -1.789 1.391 0.884 1.00 . A A . 42 LEU O 1 1 20 14209 1 1 43 CYS C C -2.051 2.885 -2.258 1.00 . A A . 43 CYS C 1 1 20 14210 1 1 43 CYS CA C -1.056 1.888 -1.700 1.00 . A A . 43 CYS CA 1 1 20 14211 1 1 43 CYS CB C -0.014 1.543 -2.761 1.00 . A A . 43 CYS CB 1 1 20 14212 1 1 43 CYS H H -1.952 -0.016 -1.882 1.00 . A A . 43 CYS H 1 1 20 14213 1 1 43 CYS HA H -0.556 2.334 -0.854 1.00 . A A . 43 CYS HA 1 1 20 14214 1 1 43 CYS HB2 H -0.502 1.089 -3.608 1.00 . A A . 43 CYS HB2 1 1 20 14215 1 1 43 CYS HB3 H 0.474 2.452 -3.082 1.00 . A A . 43 CYS HB3 1 1 20 14216 1 1 43 CYS N N -1.728 0.689 -1.235 1.00 . A A . 43 CYS N 1 1 20 14217 1 1 43 CYS O O -2.963 2.520 -2.999 1.00 . A A . 43 CYS O 1 1 20 14218 1 1 43 CYS SG S 1.275 0.404 -2.179 1.00 . A A . 43 CYS SG 1 1 20 14219 1 1 44 THR C C -1.924 6.262 -3.101 1.00 . A A . 44 THR C 1 1 20 14220 1 1 44 THR CA C -2.731 5.198 -2.382 1.00 . A A . 44 THR CA 1 1 20 14221 1 1 44 THR CB C -3.511 5.855 -1.238 1.00 . A A . 44 THR CB 1 1 20 14222 1 1 44 THR CG2 C -4.948 5.363 -1.205 1.00 . A A . 44 THR CG2 1 1 20 14223 1 1 44 THR H H -1.111 4.372 -1.318 1.00 . A A . 44 THR H 1 1 20 14224 1 1 44 THR HA H -3.439 4.766 -3.074 1.00 . A A . 44 THR HA 1 1 20 14225 1 1 44 THR HB H -3.517 6.922 -1.410 1.00 . A A . 44 THR HB 1 1 20 14226 1 1 44 THR HG1 H -1.951 5.885 -0.021 1.00 . A A . 44 THR HG1 1 1 20 14227 1 1 44 THR HG21 H -5.120 4.699 -2.039 1.00 . A A . 44 THR HG21 1 1 20 14228 1 1 44 THR HG22 H -5.619 6.206 -1.271 1.00 . A A . 44 THR HG22 1 1 20 14229 1 1 44 THR HG23 H -5.125 4.833 -0.281 1.00 . A A . 44 THR HG23 1 1 20 14230 1 1 44 THR N N -1.865 4.142 -1.908 1.00 . A A . 44 THR N 1 1 20 14231 1 1 44 THR O O -0.844 6.651 -2.651 1.00 . A A . 44 THR O 1 1 20 14232 1 1 44 THR OG1 O -2.867 5.580 0.017 1.00 . A A . 44 THR OG1 1 1 20 14233 1 1 45 LYS C C -2.810 8.389 -5.947 1.00 . A A . 45 LYS C 1 1 20 14234 1 1 45 LYS CA C -1.808 7.754 -5.003 1.00 . A A . 45 LYS CA 1 1 20 14235 1 1 45 LYS CB C -0.635 7.185 -5.809 1.00 . A A . 45 LYS CB 1 1 20 14236 1 1 45 LYS CD C 0.174 6.145 -7.943 1.00 . A A . 45 LYS CD 1 1 20 14237 1 1 45 LYS CE C -0.203 5.817 -9.376 1.00 . A A . 45 LYS CE 1 1 20 14238 1 1 45 LYS CG C -1.041 6.547 -7.128 1.00 . A A . 45 LYS CG 1 1 20 14239 1 1 45 LYS H H -3.329 6.374 -4.502 1.00 . A A . 45 LYS H 1 1 20 14240 1 1 45 LYS HA H -1.437 8.509 -4.325 1.00 . A A . 45 LYS HA 1 1 20 14241 1 1 45 LYS HB2 H 0.058 7.985 -6.022 1.00 . A A . 45 LYS HB2 1 1 20 14242 1 1 45 LYS HB3 H -0.132 6.437 -5.213 1.00 . A A . 45 LYS HB3 1 1 20 14243 1 1 45 LYS HD2 H 0.880 6.962 -7.944 1.00 . A A . 45 LYS HD2 1 1 20 14244 1 1 45 LYS HD3 H 0.627 5.275 -7.490 1.00 . A A . 45 LYS HD3 1 1 20 14245 1 1 45 LYS HE2 H 0.676 5.463 -9.893 1.00 . A A . 45 LYS HE2 1 1 20 14246 1 1 45 LYS HE3 H -0.953 5.040 -9.368 1.00 . A A . 45 LYS HE3 1 1 20 14247 1 1 45 LYS HG2 H -1.633 5.667 -6.925 1.00 . A A . 45 LYS HG2 1 1 20 14248 1 1 45 LYS HG3 H -1.626 7.256 -7.695 1.00 . A A . 45 LYS HG3 1 1 20 14249 1 1 45 LYS HZ1 H -1.104 7.711 -9.412 1.00 . A A . 45 LYS HZ1 1 1 20 14250 1 1 45 LYS HZ2 H -1.519 6.723 -10.723 1.00 . A A . 45 LYS HZ2 1 1 20 14251 1 1 45 LYS HZ3 H 0.004 7.449 -10.664 1.00 . A A . 45 LYS HZ3 1 1 20 14252 1 1 45 LYS N N -2.457 6.726 -4.211 1.00 . A A . 45 LYS N 1 1 20 14253 1 1 45 LYS NZ N -0.742 7.006 -10.094 1.00 . A A . 45 LYS NZ 1 1 20 14254 1 1 45 LYS O O -3.882 7.836 -6.189 1.00 . A A . 45 LYS O 1 1 20 14255 1 1 46 GLU C C -3.187 9.641 -8.822 1.00 . A A . 46 GLU C 1 1 20 14256 1 1 46 GLU CA C -3.307 10.236 -7.416 1.00 . A A . 46 GLU CA 1 1 20 14257 1 1 46 GLU CB C -2.934 11.719 -7.421 1.00 . A A . 46 GLU CB 1 1 20 14258 1 1 46 GLU CD C -0.942 13.070 -6.656 1.00 . A A . 46 GLU CD 1 1 20 14259 1 1 46 GLU CG C -1.438 11.958 -7.556 1.00 . A A . 46 GLU CG 1 1 20 14260 1 1 46 GLU H H -1.578 9.919 -6.256 1.00 . A A . 46 GLU H 1 1 20 14261 1 1 46 GLU HA H -4.326 10.132 -7.078 1.00 . A A . 46 GLU HA 1 1 20 14262 1 1 46 GLU HB2 H -3.432 12.203 -8.249 1.00 . A A . 46 GLU HB2 1 1 20 14263 1 1 46 GLU HB3 H -3.267 12.167 -6.497 1.00 . A A . 46 GLU HB3 1 1 20 14264 1 1 46 GLU HG2 H -0.917 11.047 -7.297 1.00 . A A . 46 GLU HG2 1 1 20 14265 1 1 46 GLU HG3 H -1.218 12.218 -8.582 1.00 . A A . 46 GLU HG3 1 1 20 14266 1 1 46 GLU N N -2.452 9.533 -6.484 1.00 . A A . 46 GLU N 1 1 20 14267 1 1 46 GLU O O -2.079 9.351 -9.297 1.00 . A A . 46 GLU O 1 1 20 14268 1 1 46 GLU OE1 O -1.335 14.234 -6.875 1.00 . A A . 46 GLU OE1 1 1 20 14269 1 1 46 GLU OE2 O -0.169 12.767 -5.719 1.00 . A A . 46 GLU OE2 1 1 20 14270 1 1 47 CYS C C -5.793 9.045 -11.368 1.00 . A A . 47 CYS C 1 1 20 14271 1 1 47 CYS CA C -4.371 8.941 -10.838 1.00 . A A . 47 CYS CA 1 1 20 14272 1 1 47 CYS CB C -3.847 7.495 -10.927 1.00 . A A . 47 CYS CB 1 1 20 14273 1 1 47 CYS H H -5.169 9.721 -9.048 1.00 . A A . 47 CYS H 1 1 20 14274 1 1 47 CYS HA H -3.741 9.571 -11.440 1.00 . A A . 47 CYS HA 1 1 20 14275 1 1 47 CYS HB2 H -3.394 7.355 -11.896 1.00 . A A . 47 CYS HB2 1 1 20 14276 1 1 47 CYS HB3 H -3.088 7.359 -10.169 1.00 . A A . 47 CYS HB3 1 1 20 14277 1 1 47 CYS N N -4.324 9.470 -9.480 1.00 . A A . 47 CYS N 1 1 20 14278 1 1 47 CYS O O -6.012 8.738 -12.553 1.00 . A A . 47 CYS O 1 1 20 14279 1 1 47 CYS OXT O -6.676 9.463 -10.580 1.00 . A A . 47 CYS OXT 1 1 20 14280 1 1 47 CYS SG S -5.076 6.162 -10.718 1.00 . A A . 47 CYS SG 1 1 stop_ save_
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