NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
373152 | 1dqb | 4630 | cing | 4-filtered-FRED | STAR | entry | full | 672 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dqb # This FRED archive file contains, for PDB entry <1dqb>: # # - 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_1dqb _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1dqb _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 9677.51 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 $THROMBOMODULIN A . 1 1 2 . 2 $SUGAR__N_ACETYL_D_GLUCOSAMINE_ B . 1 1 3 . 2 $SUGAR__N_ACETYL_D_GLUCOSAMINE_ C . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 NAG 1 NAG 1 1 3 2 NAG 1 NAG 1 1 stop_ save_ save_THROMBOMODULIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name THROMBOMODULIN _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HMEPVDPCFRANCEYQCQPLNQTSYLCVCAEGFAPIPHEPHRCQMFCNQTACPADCDPNTQASCECPEGYILDDGFICTDIDE _Entity.Number_of_monomers 83 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 HIS . 1 1 2 MET . 1 1 3 GLU . 1 1 4 PRO . 1 1 5 VAL . 1 1 6 ASP . 1 1 7 PRO . 1 1 8 CYS . 1 1 9 PHE . 1 1 10 ARG . 1 1 11 ALA . 1 1 12 ASN . 1 1 13 CYS . 1 1 14 GLU . 1 1 15 TYR . 1 1 16 GLN . 1 1 17 CYS . 1 1 18 GLN . 1 1 19 PRO . 1 1 20 LEU . 1 1 21 ASN . 1 1 22 GLN . 1 1 23 THR . 1 1 24 SER . 1 1 25 TYR . 1 1 26 LEU . 1 1 27 CYS . 1 1 28 VAL . 1 1 29 CYS . 1 1 30 ALA . 1 1 31 GLU . 1 1 32 GLY . 1 1 33 PHE . 1 1 34 ALA . 1 1 35 PRO . 1 1 36 ILE . 1 1 37 PRO . 1 1 38 HIS . 1 1 39 GLU . 1 1 40 PRO . 1 1 41 HIS . 1 1 42 ARG . 1 1 43 CYS . 1 1 44 GLN . 1 1 45 MET . 1 1 46 PHE . 1 1 47 CYS . 1 1 48 ASN . 1 1 49 GLN . 1 1 50 THR . 1 1 51 ALA . 1 1 52 CYS . 1 1 53 PRO . 1 1 54 ALA . 1 1 55 ASP . 1 1 56 CYS . 1 1 57 ASP . 1 1 58 PRO . 1 1 59 ASN . 1 1 60 THR . 1 1 61 GLN . 1 1 62 ALA . 1 1 63 SER . 1 1 64 CYS . 1 1 65 GLU . 1 1 66 CYS . 1 1 67 PRO . 1 1 68 GLU . 1 1 69 GLY . 1 1 70 TYR . 1 1 71 ILE . 1 1 72 LEU . 1 1 73 ASP . 1 1 74 ASP . 1 1 75 GLY . 1 1 76 PHE . 1 1 77 ILE . 1 1 78 CYS . 1 1 79 THR . 1 1 80 ASP . 1 1 81 ILE . 1 1 82 ASP . 1 1 83 GLU . 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 HIS 1 1 1 1 MET 2 2 1 1 GLU 3 3 1 1 PRO 4 4 1 1 VAL 5 5 1 1 ASP 6 6 1 1 PRO 7 7 1 1 CYS 8 8 1 1 PHE 9 9 1 1 ARG 10 10 1 1 ALA 11 11 1 1 ASN 12 12 1 1 CYS 13 13 1 1 GLU 14 14 1 1 TYR 15 15 1 1 GLN 16 16 1 1 CYS 17 17 1 1 GLN 18 18 1 1 PRO 19 19 1 1 LEU 20 20 1 1 ASN 21 21 1 1 GLN 22 22 1 1 THR 23 23 1 1 SER 24 24 1 1 TYR 25 25 1 1 LEU 26 26 1 1 CYS 27 27 1 1 VAL 28 28 1 1 CYS 29 29 1 1 ALA 30 30 1 1 GLU 31 31 1 1 GLY 32 32 1 1 PHE 33 33 1 1 ALA 34 34 1 1 PRO 35 35 1 1 ILE 36 36 1 1 PRO 37 37 1 1 HIS 38 38 1 1 GLU 39 39 1 1 PRO 40 40 1 1 HIS 41 41 1 1 ARG 42 42 1 1 CYS 43 43 1 1 GLN 44 44 1 1 MET 45 45 1 1 PHE 46 46 1 1 CYS 47 47 1 1 ASN 48 48 1 1 GLN 49 49 1 1 THR 50 50 1 1 ALA 51 51 1 1 CYS 52 52 1 1 PRO 53 53 1 1 ALA 54 54 1 1 ASP 55 55 1 1 CYS 56 56 1 1 ASP 57 57 1 1 PRO 58 58 1 1 ASN 59 59 1 1 THR 60 60 1 1 GLN 61 61 1 1 ALA 62 62 1 1 SER 63 63 1 1 CYS 64 64 1 1 GLU 65 65 1 1 CYS 66 66 1 1 PRO 67 67 1 1 GLU 68 68 1 1 GLY 69 69 1 1 TYR 70 70 1 1 ILE 71 71 1 1 LEU 72 72 1 1 ASP 73 73 1 1 ASP 74 74 1 1 GLY 75 75 1 1 PHE 76 76 1 1 ILE 77 77 1 1 CYS 78 78 1 1 THR 79 79 1 1 ASP 80 80 1 1 ILE 81 81 1 1 ASP 82 82 1 1 GLU 83 83 1 1 stop_ save_ save_SUGAR__N_ACETYL_D_GLUCOSAMINE_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "SUGAR N ACETYL D GLUCOSAMINE " _Entity.Type non-polymer 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 NAG $NAG 1 2 stop_ save_ save_NAG _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NAG _Chem_comp.Type non-polymer save_ save_Discover_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 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 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 MET H 1 2 MET HN 1 1 1 1 2 1 1 2 MET HA 1 2 MET HA 1 1 2 1 1 1 1 2 MET HA 1 2 MET HA 1 1 2 1 2 1 1 3 GLU H 1 3 GLU- HN 1 1 3 1 1 1 1 2 MET QB 1 2 MET HB1 1 1 3 1 2 1 1 3 GLU HA 1 3 GLU- HA 1 1 4 1 1 1 1 2 MET QB 1 2 MET HB1 1 1 4 1 2 1 1 3 GLU QG 1 3 GLU- HG* 1 1 5 1 1 1 1 3 GLU H 1 3 GLU- HN 1 1 5 1 2 1 1 3 GLU HA 1 3 GLU- HA 1 1 6 1 1 1 1 3 GLU H 1 3 GLU- HN 1 1 6 1 2 1 1 3 GLU HB2 1 3 GLU- HB2 1 1 7 1 1 1 1 3 GLU H 1 3 GLU- HN 1 1 7 1 2 1 1 3 GLU HB3 1 3 GLU- HB1 1 1 8 1 1 1 1 3 GLU H 1 3 GLU- HN 1 1 8 1 2 1 1 3 GLU QG 1 3 GLU- HG* 1 1 9 1 1 1 1 3 GLU HA 1 3 GLU- HA 1 1 9 1 2 1 1 3 GLU QG 1 3 GLU- HG* 1 1 10 1 1 1 1 3 GLU HA 1 3 GLU- HA 1 1 10 1 2 1 1 4 PRO QD 1 4 PRO HD1 1 1 11 1 1 1 1 3 GLU HB2 1 3 GLU- HB2 1 1 11 1 2 1 1 10 ARG QG 1 10 ARG+ HG2 1 1 12 1 1 1 1 3 GLU QG 1 3 GLU- HG* 1 1 12 1 2 1 1 5 VAL HA 1 5 VAL HA 1 1 13 1 1 1 1 4 PRO HA 1 4 PRO HA 1 1 13 1 2 1 1 5 VAL H 1 5 VAL HN 1 1 14 1 1 1 1 4 PRO HA 1 4 PRO HA 1 1 14 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1 15 1 1 1 1 4 PRO QB 1 4 PRO HB* 1 1 15 1 2 1 1 5 VAL H 1 5 VAL HN 1 1 16 1 1 1 1 4 PRO QD 1 4 PRO HD1 1 1 16 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 17 1 1 1 1 4 PRO QG 1 4 PRO HG* 1 1 17 1 2 1 1 5 VAL H 1 5 VAL HN 1 1 18 1 1 1 1 5 VAL H 1 5 VAL HN 1 1 18 1 2 1 1 5 VAL HB 1 5 VAL HB 1 1 19 1 1 1 1 5 VAL H 1 5 VAL HN 1 1 19 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1 20 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1 20 1 2 1 1 5 VAL HB 1 5 VAL HB 1 1 21 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1 21 1 2 1 1 6 ASP H 1 6 ASP- HN 1 1 22 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1 22 1 2 1 1 10 ARG QG 1 10 ARG+ HG1 1 1 23 1 1 1 1 5 VAL HB 1 5 VAL HB 1 1 23 1 2 1 1 6 ASP H 1 6 ASP- HN 1 1 24 1 1 1 1 5 VAL QG 1 5 VAL HG* 1 1 24 1 2 1 1 6 ASP H 1 6 ASP- HN 1 1 25 1 1 1 1 5 VAL QG 1 5 VAL HG* 1 1 25 1 2 1 1 9 PHE QB 1 9 PHE HB2 1 1 26 1 1 1 1 5 VAL QG 1 5 VAL HG* 1 1 26 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 27 1 1 1 1 6 ASP H 1 6 ASP- HN 1 1 27 1 2 1 1 6 ASP HA 1 6 ASP- HA 1 1 28 1 1 1 1 6 ASP H 1 6 ASP- HN 1 1 28 1 2 1 1 6 ASP HB2 1 6 ASP- HB1 1 1 29 1 1 1 1 6 ASP H 1 6 ASP- HN 1 1 29 1 2 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 30 1 1 1 1 6 ASP H 1 6 ASP- HN 1 1 30 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 31 1 1 1 1 6 ASP HA 1 6 ASP- HA 1 1 31 1 2 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 32 1 1 1 1 6 ASP HA 1 6 ASP- HA 1 1 32 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 33 1 1 1 1 6 ASP HB2 1 6 ASP- HB1 1 1 33 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 34 1 1 1 1 6 ASP HB2 1 6 ASP- HB1 1 1 34 1 2 1 1 8 CYS HA 1 8 CYS HA 1 1 35 1 1 1 1 6 ASP HB2 1 6 ASP- HB1 1 1 35 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 36 1 1 1 1 6 ASP HB2 1 6 ASP- HB1 1 1 36 1 2 1 1 9 PHE QB 1 9 PHE HB1 1 1 37 1 1 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 37 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 38 1 1 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 38 1 2 1 1 8 CYS HA 1 8 CYS HA 1 1 39 1 1 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 39 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 40 1 1 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 40 1 2 1 1 9 PHE QB 1 9 PHE HB2 1 1 41 1 1 1 1 6 ASP HB3 1 6 ASP- HB2 1 1 41 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 42 1 1 1 1 7 PRO HA 1 7 PRO HA 1 1 42 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 43 1 1 1 1 7 PRO QB 1 7 PRO HB* 1 1 43 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 44 1 1 1 1 7 PRO QD 1 7 PRO HD* 1 1 44 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 45 1 1 1 1 7 PRO QG 1 7 PRO HG* 1 1 45 1 2 1 1 8 CYS H 1 8 CYS HN 1 1 46 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 46 1 2 1 1 8 CYS HA 1 8 CYS HA 1 1 47 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 47 1 2 1 1 8 CYS HB2 1 8 CYS HB1 1 1 48 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 48 1 2 1 1 8 CYS HB3 1 8 CYS HB2 1 1 49 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 49 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 50 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 50 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1 51 1 1 1 1 8 CYS H 1 8 CYS HN 1 1 51 1 2 1 1 25 TYR QB 1 25 TYR HB2 1 1 52 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 52 1 2 1 1 8 CYS HB2 1 8 CYS HB1 1 1 53 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 53 1 2 1 1 8 CYS HB3 1 8 CYS HB2 1 1 54 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 54 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 55 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 55 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1 56 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 56 1 2 1 1 17 CYS QB 1 17 CYS HB* 1 1 57 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 57 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 58 1 1 1 1 8 CYS HA 1 8 CYS HA 1 1 58 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1 59 1 1 1 1 8 CYS HB2 1 8 CYS HB1 1 1 59 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 60 1 1 1 1 8 CYS HB2 1 8 CYS HB1 1 1 60 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1 61 1 1 1 1 8 CYS HB3 1 8 CYS HB2 1 1 61 1 2 1 1 9 PHE H 1 9 PHE HN 1 1 62 1 1 1 1 8 CYS HB3 1 8 CYS HB2 1 1 62 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1 63 1 1 1 1 9 PHE H 1 9 PHE HN 1 1 63 1 2 1 1 9 PHE HA 1 9 PHE HA 1 1 64 1 1 1 1 9 PHE H 1 9 PHE HN 1 1 64 1 2 1 1 9 PHE QB 1 9 PHE HB1 1 1 65 1 1 1 1 9 PHE H 1 9 PHE HN 1 1 65 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 66 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1 66 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 67 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1 67 1 2 1 1 9 PHE QE 1 9 PHE HE* 1 1 68 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1 68 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1 69 1 1 1 1 9 PHE HA 1 9 PHE HA 1 1 69 1 2 1 1 11 ALA H 1 11 ALA HN 1 1 70 1 1 1 1 9 PHE QB 1 9 PHE HB1 1 1 70 1 2 1 1 9 PHE QD 1 9 PHE HD* 1 1 71 1 1 1 1 9 PHE QB 1 9 PHE HB2 1 1 71 1 2 1 1 9 PHE QE 1 9 PHE HE* 1 1 72 1 1 1 1 9 PHE QB 1 9 PHE HB2 1 1 72 1 2 1 1 10 ARG H 1 10 ARG+ HN 1 1 73 1 1 1 1 9 PHE QD 1 9 PHE HD* 1 1 73 1 2 1 1 10 ARG HA 1 10 ARG+ HA 1 1 74 1 1 1 1 9 PHE QD 1 9 PHE HD* 1 1 74 1 2 1 1 10 ARG QB 1 10 ARG+ HB2 1 1 75 1 1 1 1 9 PHE QD 1 9 PHE HD* 1 1 75 1 2 1 1 10 ARG QG 1 10 ARG+ HG1 1 1 76 1 1 1 1 9 PHE QE 1 9 PHE HE* 1 1 76 1 2 1 1 10 ARG QB 1 10 ARG+ HB2 1 1 77 1 1 1 1 9 PHE QE 1 9 PHE HE* 1 1 77 1 2 1 1 10 ARG QG 1 10 ARG+ HG2 1 1 78 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1 78 1 2 1 1 10 ARG HA 1 10 ARG+ HA 1 1 79 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1 79 1 2 1 1 10 ARG QG 1 10 ARG+ HG2 1 1 80 1 1 1 1 10 ARG H 1 10 ARG+ HN 1 1 80 1 2 1 1 11 ALA H 1 11 ALA HN 1 1 81 1 1 1 1 10 ARG HA 1 10 ARG+ HA 1 1 81 1 2 1 1 10 ARG QD 1 10 ARG+ HD* 1 1 82 1 1 1 1 10 ARG HA 1 10 ARG+ HA 1 1 82 1 2 1 1 10 ARG QG 1 10 ARG+ HG1 1 1 83 1 1 1 1 10 ARG HA 1 10 ARG+ HA 1 1 83 1 2 1 1 11 ALA H 1 11 ALA HN 1 1 84 1 1 1 1 10 ARG QB 1 10 ARG+ HB2 1 1 84 1 2 1 1 10 ARG QD 1 10 ARG+ HD* 1 1 85 1 1 1 1 10 ARG QB 1 10 ARG+ HB2 1 1 85 1 2 1 1 11 ALA H 1 11 ALA HN 1 1 86 1 1 1 1 10 ARG QD 1 10 ARG+ HD* 1 1 86 1 2 1 1 11 ALA H 1 11 ALA HN 1 1 87 1 1 1 1 11 ALA H 1 11 ALA HN 1 1 87 1 2 1 1 11 ALA HA 1 11 ALA HA 1 1 88 1 1 1 1 11 ALA H 1 11 ALA HN 1 1 88 1 2 1 1 11 ALA MB 1 11 ALA HB* 1 1 89 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1 89 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 90 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1 90 1 2 1 1 12 ASN QB 1 12 ASN HB* 1 1 91 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1 91 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 92 1 1 1 1 11 ALA HA 1 11 ALA HA 1 1 92 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1 93 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1 93 1 2 1 1 12 ASN H 1 12 ASN HN 1 1 94 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1 94 1 2 1 1 13 CYS H 1 13 CYS HN 1 1 95 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1 95 1 2 1 1 17 CYS QB 1 17 CYS HB* 1 1 96 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1 96 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 97 1 1 1 1 11 ALA MB 1 11 ALA HB* 1 1 97 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1 98 1 1 1 1 12 ASN H 1 12 ASN HN 1 1 98 1 2 1 1 12 ASN HA 1 12 ASN HA 1 1 99 1 1 1 1 12 ASN H 1 12 ASN HN 1 1 99 1 2 1 1 13 CYS H 1 13 CYS HN 1 1 100 1 1 1 1 12 ASN HA 1 12 ASN HA 1 1 100 1 2 1 1 13 CYS H 1 13 CYS HN 1 1 101 1 1 1 1 12 ASN QB 1 12 ASN HB* 1 1 101 1 2 1 1 13 CYS H 1 13 CYS HN 1 1 102 1 1 1 1 12 ASN QB 1 12 ASN HB* 1 1 102 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 103 1 1 1 1 13 CYS H 1 13 CYS HN 1 1 103 1 2 1 1 13 CYS HA 1 13 CYS HA 1 1 104 1 1 1 1 13 CYS H 1 13 CYS HN 1 1 104 1 2 1 1 13 CYS QB 1 13 CYS HB2 1 1 105 1 1 1 1 13 CYS H 1 13 CYS HN 1 1 105 1 2 1 1 14 GLU H 1 14 GLU- HN 1 1 106 1 1 1 1 13 CYS H 1 13 CYS HN 1 1 106 1 2 1 1 27 CYS HB2 1 27 CYS HB1 1 1 107 1 1 1 1 13 CYS HA 1 13 CYS HA 1 1 107 1 2 1 1 14 GLU H 1 14 GLU- HN 1 1 108 1 1 1 1 13 CYS HA 1 13 CYS HA 1 1 108 1 2 1 1 27 CYS HB2 1 27 CYS HB1 1 1 109 1 1 1 1 13 CYS HA 1 13 CYS HA 1 1 109 1 2 1 1 41 HIS HB2 1 41 HISD HB2 1 1 110 1 1 1 1 13 CYS QB 1 13 CYS HB2 1 1 110 1 2 1 1 14 GLU H 1 14 GLU- HN 1 1 111 1 1 1 1 13 CYS QB 1 13 CYS HB1 1 1 111 1 2 1 1 16 GLN HA 1 16 GLN HA 1 1 112 1 1 1 1 13 CYS QB 1 13 CYS HB1 1 1 112 1 2 1 1 16 GLN QG 1 16 GLN HG* 1 1 113 1 1 1 1 13 CYS QB 1 13 CYS HB1 1 1 113 1 2 1 1 17 CYS H 1 17 CYS HN 1 1 114 1 1 1 1 13 CYS QB 1 13 CYS HB1 1 1 114 1 2 1 1 17 CYS QB 1 17 CYS HB* 1 1 115 1 1 1 1 13 CYS QB 1 13 CYS HB2 1 1 115 1 2 1 1 27 CYS HA 1 27 CYS HA 1 1 116 1 1 1 1 14 GLU H 1 14 GLU- HN 1 1 116 1 2 1 1 14 GLU HA 1 14 GLU- HA 1 1 117 1 1 1 1 14 GLU H 1 14 GLU- HN 1 1 117 1 2 1 1 14 GLU HB2 1 14 GLU- HB1 1 1 118 1 1 1 1 14 GLU H 1 14 GLU- HN 1 1 118 1 2 1 1 14 GLU HB3 1 14 GLU- HB2 1 1 119 1 1 1 1 14 GLU H 1 14 GLU- HN 1 1 119 1 2 1 1 14 GLU QG 1 14 GLU- HG* 1 1 120 1 1 1 1 14 GLU H 1 14 GLU- HN 1 1 120 1 2 1 1 41 HIS HB2 1 41 HISD HB2 1 1 121 1 1 1 1 14 GLU HA 1 14 GLU- HA 1 1 121 1 2 1 1 14 GLU HB2 1 14 GLU- HB1 1 1 122 1 1 1 1 14 GLU HA 1 14 GLU- HA 1 1 122 1 2 1 1 14 GLU HB3 1 14 GLU- HB2 1 1 123 1 1 1 1 14 GLU HA 1 14 GLU- HA 1 1 123 1 2 1 1 15 TYR H 1 15 TYR HN 1 1 124 1 1 1 1 14 GLU HA 1 14 GLU- HA 1 1 124 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 125 1 1 1 1 14 GLU HB2 1 14 GLU- HB1 1 1 125 1 2 1 1 15 TYR H 1 15 TYR HN 1 1 126 1 1 1 1 14 GLU HB2 1 14 GLU- HB1 1 1 126 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 127 1 1 1 1 14 GLU HB3 1 14 GLU- HB2 1 1 127 1 2 1 1 15 TYR H 1 15 TYR HN 1 1 128 1 1 1 1 14 GLU HB3 1 14 GLU- HB2 1 1 128 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 129 1 1 1 1 14 GLU HB3 1 14 GLU- HB2 1 1 129 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 130 1 1 1 1 14 GLU QG 1 14 GLU- HG* 1 1 130 1 2 1 1 15 TYR H 1 15 TYR HN 1 1 131 1 1 1 1 15 TYR H 1 15 TYR HN 1 1 131 1 2 1 1 15 TYR HA 1 15 TYR HA 1 1 132 1 1 1 1 15 TYR H 1 15 TYR HN 1 1 132 1 2 1 1 15 TYR HB2 1 15 TYR HB2 1 1 133 1 1 1 1 15 TYR H 1 15 TYR HN 1 1 133 1 2 1 1 15 TYR HB3 1 15 TYR HB1 1 1 134 1 1 1 1 15 TYR H 1 15 TYR HN 1 1 134 1 2 1 1 15 TYR QD 1 15 TYR HD* 1 1 135 1 1 1 1 15 TYR H 1 15 TYR HN 1 1 135 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 136 1 1 1 1 15 TYR HA 1 15 TYR HA 1 1 136 1 2 1 1 15 TYR HB2 1 15 TYR HB2 1 1 137 1 1 1 1 15 TYR HA 1 15 TYR HA 1 1 137 1 2 1 1 15 TYR QD 1 15 TYR HD* 1 1 138 1 1 1 1 15 TYR HA 1 15 TYR HA 1 1 138 1 2 1 1 15 TYR QE 1 15 TYR HE* 1 1 139 1 1 1 1 15 TYR HA 1 15 TYR HA 1 1 139 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 140 1 1 1 1 15 TYR HB2 1 15 TYR HB2 1 1 140 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 141 1 1 1 1 15 TYR HB3 1 15 TYR HB1 1 1 141 1 2 1 1 15 TYR QD 1 15 TYR HD* 1 1 142 1 1 1 1 15 TYR HB3 1 15 TYR HB1 1 1 142 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 143 1 1 1 1 15 TYR HB3 1 15 TYR HB1 1 1 143 1 2 1 1 29 CYS H 1 29 CYS HN 1 1 144 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 144 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 145 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 145 1 2 1 1 16 GLN HA 1 16 GLN HA 1 1 146 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 146 1 2 1 1 16 GLN QB 1 16 GLN HB1 1 1 147 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 147 1 2 1 1 16 GLN QG 1 16 GLN HG* 1 1 148 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 148 1 2 1 1 28 VAL HB 1 28 VAL HB 1 1 149 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 149 1 2 1 1 28 VAL QG 1 28 VAL HG2* 1 1 150 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 150 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 151 1 1 1 1 15 TYR QD 1 15 TYR HD* 1 1 151 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 152 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 152 1 2 1 1 16 GLN H 1 16 GLN HN 1 1 153 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 153 1 2 1 1 16 GLN QB 1 16 GLN HB1 1 1 154 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 154 1 2 1 1 16 GLN QG 1 16 GLN HG* 1 1 155 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 155 1 2 1 1 28 VAL HB 1 28 VAL HB 1 1 156 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 156 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 157 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 157 1 2 1 1 30 ALA HA 1 30 ALA HA 1 1 158 1 1 1 1 15 TYR QE 1 15 TYR HE* 1 1 158 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 159 1 1 1 1 16 GLN H 1 16 GLN HN 1 1 159 1 2 1 1 16 GLN QG 1 16 GLN HG* 1 1 160 1 1 1 1 16 GLN H 1 16 GLN HN 1 1 160 1 2 1 1 17 CYS H 1 17 CYS HN 1 1 161 1 1 1 1 16 GLN H 1 16 GLN HN 1 1 161 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 162 1 1 1 1 16 GLN H 1 16 GLN HN 1 1 162 1 2 1 1 28 VAL HB 1 28 VAL HB 1 1 163 1 1 1 1 16 GLN H 1 16 GLN HN 1 1 163 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 164 1 1 1 1 16 GLN HA 1 16 GLN HA 1 1 164 1 2 1 1 16 GLN QG 1 16 GLN HG* 1 1 165 1 1 1 1 16 GLN HA 1 16 GLN HA 1 1 165 1 2 1 1 17 CYS H 1 17 CYS HN 1 1 166 1 1 1 1 16 GLN HA 1 16 GLN HA 1 1 166 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 167 1 1 1 1 16 GLN QB 1 16 GLN HB2 1 1 167 1 2 1 1 16 GLN HE21 1 16 GLN HE21 1 1 168 1 1 1 1 16 GLN QB 1 16 GLN HB2 1 1 168 1 2 1 1 16 GLN HE22 1 16 GLN HE22 1 1 169 1 1 1 1 16 GLN QB 1 16 GLN HB2 1 1 169 1 2 1 1 17 CYS H 1 17 CYS HN 1 1 170 1 1 1 1 16 GLN QB 1 16 GLN HB2 1 1 170 1 2 1 1 28 VAL HB 1 28 VAL HB 1 1 171 1 1 1 1 16 GLN QB 1 16 GLN HB1 1 1 171 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 172 1 1 1 1 16 GLN QG 1 16 GLN HG* 1 1 172 1 2 1 1 17 CYS H 1 17 CYS HN 1 1 173 1 1 1 1 17 CYS H 1 17 CYS HN 1 1 173 1 2 1 1 17 CYS QB 1 17 CYS HB* 1 1 174 1 1 1 1 17 CYS H 1 17 CYS HN 1 1 174 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 175 1 1 1 1 17 CYS H 1 17 CYS HN 1 1 175 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 176 1 1 1 1 17 CYS HA 1 17 CYS HA 1 1 176 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 177 1 1 1 1 17 CYS HA 1 17 CYS HA 1 1 177 1 2 1 1 27 CYS HA 1 27 CYS HA 1 1 178 1 1 1 1 17 CYS HA 1 17 CYS HA 1 1 178 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 179 1 1 1 1 17 CYS HA 1 17 CYS HA 1 1 179 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 180 1 1 1 1 17 CYS QB 1 17 CYS HB* 1 1 180 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 181 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 181 1 2 1 1 18 GLN HA 1 18 GLN HA 1 1 182 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 182 1 2 1 1 18 GLN QB 1 18 GLN HB2 1 1 183 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 183 1 2 1 1 19 PRO QD 1 19 PRO HD* 1 1 184 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 184 1 2 1 1 25 TYR QB 1 25 TYR HB2 1 1 185 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 185 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 186 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 186 1 2 1 1 26 LEU HG 1 26 LEU HG 1 1 187 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 187 1 2 1 1 27 CYS HA 1 27 CYS HA 1 1 188 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 188 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 189 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 189 1 2 1 1 28 VAL QG 1 28 VAL HG2* 1 1 190 1 1 1 1 18 GLN HA 1 18 GLN HA 1 1 190 1 2 1 1 18 GLN QG 1 18 GLN HG* 1 1 191 1 1 1 1 18 GLN QB 1 18 GLN HB1 1 1 191 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 192 1 1 1 1 18 GLN QB 1 18 GLN HB2 1 1 192 1 2 1 1 26 LEU QB 1 26 LEU HB1 1 1 193 1 1 1 1 18 GLN HE21 1 18 GLN HE21 1 1 193 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 194 1 1 1 1 18 GLN HE22 1 18 GLN HE22 1 1 194 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 195 1 1 1 1 18 GLN QG 1 18 GLN HG* 1 1 195 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 196 1 1 1 1 18 GLN QG 1 18 GLN HG* 1 1 196 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 197 1 1 1 1 19 PRO HA 1 19 PRO HA 1 1 197 1 2 1 1 25 TYR QB 1 25 TYR HB2 1 1 198 1 1 1 1 19 PRO HA 1 19 PRO HA 1 1 198 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 199 1 1 1 1 19 PRO QB 1 19 PRO HB* 1 1 199 1 2 1 1 20 LEU H 1 20 LEU HN 1 1 200 1 1 1 1 19 PRO QB 1 19 PRO HB* 1 1 200 1 2 1 1 21 ASN H 1 21 ASN HN 1 1 201 1 1 1 1 19 PRO QB 1 19 PRO HB* 1 1 201 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 202 1 1 1 1 19 PRO QG 1 19 PRO HG* 1 1 202 1 2 1 1 20 LEU H 1 20 LEU HN 1 1 203 1 1 1 1 19 PRO QG 1 19 PRO HG* 1 1 203 1 2 1 1 25 TYR QB 1 25 TYR HB2 1 1 204 1 1 1 1 19 PRO QG 1 19 PRO HG* 1 1 204 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 205 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 205 1 2 1 1 20 LEU HA 1 20 LEU HA 1 1 206 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 206 1 2 1 1 20 LEU QD 1 20 LEU HD* 1 1 207 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 207 1 2 1 1 21 ASN H 1 21 ASN HN 1 1 208 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 208 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 209 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 209 1 2 1 1 25 TYR QB 1 25 TYR HB2 1 1 210 1 1 1 1 20 LEU H 1 20 LEU HN 1 1 210 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 211 1 1 1 1 20 LEU HA 1 20 LEU HA 1 1 211 1 2 1 1 20 LEU HG 1 20 LEU HG 1 1 212 1 1 1 1 20 LEU HA 1 20 LEU HA 1 1 212 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 213 1 1 1 1 20 LEU QB 1 20 LEU HB* 1 1 213 1 2 1 1 21 ASN H 1 21 ASN HN 1 1 214 1 1 1 1 20 LEU QB 1 20 LEU HB* 1 1 214 1 2 1 1 24 SER H 1 24 SER HN 1 1 215 1 1 1 1 20 LEU QB 1 20 LEU HB* 1 1 215 1 2 1 1 24 SER HA 1 24 SER HA 1 1 216 1 1 1 1 20 LEU QB 1 20 LEU HB* 1 1 216 1 2 1 1 24 SER QB 1 24 SER HB1 1 1 217 1 1 1 1 20 LEU QB 1 20 LEU HB* 1 1 217 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 218 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 218 1 2 1 1 21 ASN H 1 21 ASN HN 1 1 219 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 219 1 2 1 1 24 SER H 1 24 SER HN 1 1 220 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 220 1 2 1 1 24 SER HA 1 24 SER HA 1 1 221 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 221 1 2 1 1 24 SER QB 1 24 SER HB1 1 1 222 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 222 1 2 1 1 25 TYR H 1 25 TYR HN 1 1 223 1 1 1 1 20 LEU QD 1 20 LEU HD* 1 1 223 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 224 1 1 1 1 20 LEU HG 1 20 LEU HG 1 1 224 1 2 1 1 21 ASN H 1 21 ASN HN 1 1 225 1 1 1 1 20 LEU HG 1 20 LEU HG 1 1 225 1 2 1 1 24 SER QB 1 24 SER HB1 1 1 226 1 1 1 1 21 ASN H 1 21 ASN HN 1 1 226 1 2 1 1 21 ASN HA 1 21 ASN HA 1 1 227 1 1 1 1 21 ASN H 1 21 ASN HN 1 1 227 1 2 1 1 21 ASN HB3 1 21 ASN HB2 1 1 228 1 1 1 1 21 ASN H 1 21 ASN HN 1 1 228 1 2 1 1 24 SER H 1 24 SER HN 1 1 229 1 1 1 1 21 ASN H 1 21 ASN HN 1 1 229 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 230 1 1 1 1 21 ASN HA 1 21 ASN HA 1 1 230 1 2 1 1 21 ASN HB2 1 21 ASN HB1 1 1 231 1 1 1 1 21 ASN HA 1 21 ASN HA 1 1 231 1 2 1 1 21 ASN HB3 1 21 ASN HB2 1 1 232 1 1 1 1 21 ASN HA 1 21 ASN HA 1 1 232 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 233 1 1 1 1 21 ASN HA 1 21 ASN HA 1 1 233 1 2 1 1 23 THR H 1 23 THR HN 1 1 234 1 1 1 1 21 ASN HB3 1 21 ASN HB2 1 1 234 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 235 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 235 1 2 1 1 22 GLN QG 1 22 GLN HG* 1 1 236 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 236 1 2 1 1 23 THR H 1 23 THR HN 1 1 237 1 1 1 1 22 GLN HA 1 22 GLN HA 1 1 237 1 2 1 1 22 GLN QG 1 22 GLN HG* 1 1 238 1 1 1 1 22 GLN HA 1 22 GLN HA 1 1 238 1 2 1 1 23 THR H 1 23 THR HN 1 1 239 1 1 1 1 22 GLN QB 1 22 GLN HB* 1 1 239 1 2 1 1 23 THR H 1 23 THR HN 1 1 240 1 1 1 1 22 GLN QB 1 22 GLN HB* 1 1 240 1 2 1 1 24 SER H 1 24 SER HN 1 1 241 1 1 1 1 23 THR H 1 23 THR HN 1 1 241 1 2 1 1 23 THR HA 1 23 THR HA 1 1 242 1 1 1 1 23 THR H 1 23 THR HN 1 1 242 1 2 1 1 23 THR MG 1 23 THR HG2* 1 1 243 1 1 1 1 23 THR HA 1 23 THR HA 1 1 243 1 2 1 1 24 SER H 1 24 SER HN 1 1 244 1 1 1 1 23 THR HB 1 23 THR HB 1 1 244 1 2 1 1 25 TYR HA 1 25 TYR HA 1 1 245 1 1 1 1 24 SER H 1 24 SER HN 1 1 245 1 2 1 1 24 SER HA 1 24 SER HA 1 1 246 1 1 1 1 24 SER H 1 24 SER HN 1 1 246 1 2 1 1 24 SER QB 1 24 SER HB1 1 1 247 1 1 1 1 24 SER H 1 24 SER HN 1 1 247 1 2 1 1 25 TYR H 1 25 TYR HN 1 1 248 1 1 1 1 24 SER HA 1 24 SER HA 1 1 248 1 2 1 1 25 TYR H 1 25 TYR HN 1 1 249 1 1 1 1 24 SER HA 1 24 SER HA 1 1 249 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 250 1 1 1 1 24 SER QB 1 24 SER HB2 1 1 250 1 2 1 1 25 TYR H 1 25 TYR HN 1 1 251 1 1 1 1 24 SER QB 1 24 SER HB1 1 1 251 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 252 1 1 1 1 25 TYR H 1 25 TYR HN 1 1 252 1 2 1 1 25 TYR QB 1 25 TYR HB1 1 1 253 1 1 1 1 25 TYR H 1 25 TYR HN 1 1 253 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 254 1 1 1 1 25 TYR H 1 25 TYR HN 1 1 254 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 255 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1 255 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 256 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1 256 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1 257 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1 257 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 258 1 1 1 1 25 TYR HA 1 25 TYR HA 1 1 258 1 2 1 1 26 LEU QB 1 26 LEU HB1 1 1 259 1 1 1 1 25 TYR QB 1 25 TYR HB1 1 1 259 1 2 1 1 25 TYR QD 1 25 TYR HD* 1 1 260 1 1 1 1 25 TYR QB 1 25 TYR HB1 1 1 260 1 2 1 1 25 TYR QE 1 25 TYR HE* 1 1 261 1 1 1 1 25 TYR QB 1 25 TYR HB1 1 1 261 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 262 1 1 1 1 25 TYR QD 1 25 TYR HD* 1 1 262 1 2 1 1 26 LEU H 1 26 LEU HN 1 1 263 1 1 1 1 25 TYR QD 1 25 TYR HD* 1 1 263 1 2 1 1 26 LEU QB 1 26 LEU HB1 1 1 264 1 1 1 1 26 LEU H 1 26 LEU HN 1 1 264 1 2 1 1 26 LEU MD1 1 26 LEU HD1* 1 1 265 1 1 1 1 26 LEU H 1 26 LEU HN 1 1 265 1 2 1 1 26 LEU MD2 1 26 LEU HD2* 1 1 266 1 1 1 1 26 LEU H 1 26 LEU HN 1 1 266 1 2 1 1 26 LEU HG 1 26 LEU HG 1 1 267 1 1 1 1 26 LEU H 1 26 LEU HN 1 1 267 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 268 1 1 1 1 26 LEU HA 1 26 LEU HA 1 1 268 1 2 1 1 26 LEU MD2 1 26 LEU HD2* 1 1 269 1 1 1 1 26 LEU HA 1 26 LEU HA 1 1 269 1 2 1 1 26 LEU HG 1 26 LEU HG 1 1 270 1 1 1 1 26 LEU HA 1 26 LEU HA 1 1 270 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 271 1 1 1 1 26 LEU QB 1 26 LEU HB1 1 1 271 1 2 1 1 26 LEU MD1 1 26 LEU HD1* 1 1 272 1 1 1 1 26 LEU QB 1 26 LEU HB2 1 1 272 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 273 1 1 1 1 26 LEU MD1 1 26 LEU HD1* 1 1 273 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 274 1 1 1 1 26 LEU MD2 1 26 LEU HD2* 1 1 274 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 275 1 1 1 1 26 LEU MD2 1 26 LEU HD2* 1 1 275 1 2 1 1 27 CYS HA 1 27 CYS HA 1 1 276 1 1 1 1 26 LEU HG 1 26 LEU HG 1 1 276 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 277 1 1 1 1 27 CYS H 1 27 CYS HN 1 1 277 1 2 1 1 27 CYS HB2 1 27 CYS HB1 1 1 278 1 1 1 1 27 CYS H 1 27 CYS HN 1 1 278 1 2 1 1 27 CYS HB3 1 27 CYS HB2 1 1 279 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 279 1 2 1 1 27 CYS HB2 1 27 CYS HB1 1 1 280 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 280 1 2 1 1 27 CYS HB3 1 27 CYS HB2 1 1 281 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 281 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 282 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 282 1 2 1 1 28 VAL QG 1 28 VAL HG1* 1 1 283 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 283 1 2 1 1 41 HIS HA 1 41 HISD HA 1 1 284 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 284 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 285 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 285 1 2 1 1 41 HIS HA 1 41 HISD HA 1 1 286 1 1 1 1 27 CYS HB3 1 27 CYS HB2 1 1 286 1 2 1 1 28 VAL H 1 28 VAL HN 1 1 287 1 1 1 1 28 VAL H 1 28 VAL HN 1 1 287 1 2 1 1 28 VAL HA 1 28 VAL HA 1 1 288 1 1 1 1 28 VAL H 1 28 VAL HN 1 1 288 1 2 1 1 28 VAL HB 1 28 VAL HB 1 1 289 1 1 1 1 28 VAL H 1 28 VAL HN 1 1 289 1 2 1 1 28 VAL QG 1 28 VAL HG2* 1 1 290 1 1 1 1 28 VAL HA 1 28 VAL HA 1 1 290 1 2 1 1 29 CYS H 1 29 CYS HN 1 1 291 1 1 1 1 28 VAL HB 1 28 VAL HB 1 1 291 1 2 1 1 29 CYS H 1 29 CYS HN 1 1 292 1 1 1 1 28 VAL QG 1 28 VAL HG2* 1 1 292 1 2 1 1 29 CYS H 1 29 CYS HN 1 1 293 1 1 1 1 29 CYS H 1 29 CYS HN 1 1 293 1 2 1 1 29 CYS HA 1 29 CYS HA 1 1 294 1 1 1 1 29 CYS H 1 29 CYS HN 1 1 294 1 2 1 1 29 CYS HB2 1 29 CYS HB1 1 1 295 1 1 1 1 29 CYS H 1 29 CYS HN 1 1 295 1 2 1 1 29 CYS HB3 1 29 CYS HB2 1 1 296 1 1 1 1 29 CYS H 1 29 CYS HN 1 1 296 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 297 1 1 1 1 29 CYS HA 1 29 CYS HA 1 1 297 1 2 1 1 29 CYS HB3 1 29 CYS HB2 1 1 298 1 1 1 1 29 CYS HA 1 29 CYS HA 1 1 298 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 299 1 1 1 1 29 CYS HA 1 29 CYS HA 1 1 299 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 300 1 1 1 1 29 CYS HB2 1 29 CYS HB1 1 1 300 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 301 1 1 1 1 29 CYS HB2 1 29 CYS HB1 1 1 301 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 302 1 1 1 1 29 CYS HB3 1 29 CYS HB2 1 1 302 1 2 1 1 30 ALA H 1 30 ALA HN 1 1 303 1 1 1 1 29 CYS HB3 1 29 CYS HB2 1 1 303 1 2 1 1 33 PHE H 1 33 PHE HN 1 1 304 1 1 1 1 29 CYS HB3 1 29 CYS HB2 1 1 304 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 305 1 1 1 1 30 ALA H 1 30 ALA HN 1 1 305 1 2 1 1 30 ALA HA 1 30 ALA HA 1 1 306 1 1 1 1 30 ALA H 1 30 ALA HN 1 1 306 1 2 1 1 30 ALA MB 1 30 ALA HB* 1 1 307 1 1 1 1 30 ALA H 1 30 ALA HN 1 1 307 1 2 1 1 31 GLU H 1 31 GLU- HN 1 1 308 1 1 1 1 30 ALA H 1 30 ALA HN 1 1 308 1 2 1 1 33 PHE HB2 1 33 PHE HB2 1 1 309 1 1 1 1 30 ALA HA 1 30 ALA HA 1 1 309 1 2 1 1 31 GLU H 1 31 GLU- HN 1 1 310 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 310 1 2 1 1 31 GLU H 1 31 GLU- HN 1 1 311 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 311 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 312 1 1 1 1 30 ALA MB 1 30 ALA HB* 1 1 312 1 2 1 1 33 PHE QE 1 33 PHE HE* 1 1 313 1 1 1 1 31 GLU H 1 31 GLU- HN 1 1 313 1 2 1 1 31 GLU HA 1 31 GLU- HA 1 1 314 1 1 1 1 31 GLU H 1 31 GLU- HN 1 1 314 1 2 1 1 31 GLU HB2 1 31 GLU- HB1 1 1 315 1 1 1 1 31 GLU H 1 31 GLU- HN 1 1 315 1 2 1 1 31 GLU HB3 1 31 GLU- HB2 1 1 316 1 1 1 1 31 GLU H 1 31 GLU- HN 1 1 316 1 2 1 1 31 GLU QG 1 31 GLU- HG* 1 1 317 1 1 1 1 31 GLU H 1 31 GLU- HN 1 1 317 1 2 1 1 32 GLY H 1 32 GLY HN 1 1 318 1 1 1 1 31 GLU HA 1 31 GLU- HA 1 1 318 1 2 1 1 31 GLU HB2 1 31 GLU- HB1 1 1 319 1 1 1 1 31 GLU HA 1 31 GLU- HA 1 1 319 1 2 1 1 31 GLU HB3 1 31 GLU- HB2 1 1 320 1 1 1 1 31 GLU HA 1 31 GLU- HA 1 1 320 1 2 1 1 32 GLY H 1 32 GLY HN 1 1 321 1 1 1 1 31 GLU HA 1 31 GLU- HA 1 1 321 1 2 1 1 33 PHE H 1 33 PHE HN 1 1 322 1 1 1 1 31 GLU HB2 1 31 GLU- HB1 1 1 322 1 2 1 1 32 GLY H 1 32 GLY HN 1 1 323 1 1 1 1 31 GLU HB3 1 31 GLU- HB2 1 1 323 1 2 1 1 32 GLY H 1 32 GLY HN 1 1 324 1 1 1 1 31 GLU QG 1 31 GLU- HG* 1 1 324 1 2 1 1 32 GLY H 1 32 GLY HN 1 1 325 1 1 1 1 32 GLY H 1 32 GLY HN 1 1 325 1 2 1 1 33 PHE H 1 33 PHE HN 1 1 326 1 1 1 1 32 GLY QA 1 32 GLY HA1 1 1 326 1 2 1 1 33 PHE H 1 33 PHE HN 1 1 327 1 1 1 1 32 GLY QA 1 32 GLY HA2 1 1 327 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 328 1 1 1 1 32 GLY QA 1 32 GLY HA1 1 1 328 1 2 1 1 46 PHE QD 1 46 PHE HD* 1 1 329 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 329 1 2 1 1 33 PHE HA 1 33 PHE HA 1 1 330 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 330 1 2 1 1 33 PHE HB2 1 33 PHE HB2 1 1 331 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 331 1 2 1 1 33 PHE HB3 1 33 PHE HB1 1 1 332 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 332 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 333 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 333 1 2 1 1 33 PHE QE 1 33 PHE HE* 1 1 334 1 1 1 1 33 PHE H 1 33 PHE HN 1 1 334 1 2 1 1 46 PHE H 1 46 PHE HN 1 1 335 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 335 1 2 1 1 33 PHE QD 1 33 PHE HD* 1 1 336 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 336 1 2 1 1 33 PHE QE 1 33 PHE HE* 1 1 337 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 337 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 338 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 338 1 2 1 1 34 ALA MB 1 34 ALA HB* 1 1 339 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 339 1 2 1 1 43 CYS HA 1 43 CYS HA 1 1 340 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 340 1 2 1 1 43 CYS QB 1 43 CYS HB2 1 1 341 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 341 1 2 1 1 45 MET QB 1 45 MET HB* 1 1 342 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 342 1 2 1 1 46 PHE H 1 46 PHE HN 1 1 343 1 1 1 1 33 PHE HA 1 33 PHE HA 1 1 343 1 2 1 1 46 PHE QD 1 46 PHE HD* 1 1 344 1 1 1 1 33 PHE HB2 1 33 PHE HB2 1 1 344 1 2 1 1 33 PHE QE 1 33 PHE HE* 1 1 345 1 1 1 1 33 PHE HB2 1 33 PHE HB2 1 1 345 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 346 1 1 1 1 33 PHE HB3 1 33 PHE HB1 1 1 346 1 2 1 1 34 ALA H 1 34 ALA HN 1 1 347 1 1 1 1 33 PHE HB3 1 33 PHE HB1 1 1 347 1 2 1 1 43 CYS QB 1 43 CYS HB2 1 1 348 1 1 1 1 33 PHE HB3 1 33 PHE HB1 1 1 348 1 2 1 1 45 MET HA 1 45 MET HA 1 1 349 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 349 1 2 1 1 43 CYS HA 1 43 CYS HA 1 1 350 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 350 1 2 1 1 43 CYS QB 1 43 CYS HB1 1 1 351 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 351 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 352 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 352 1 2 1 1 44 GLN HA 1 44 GLN HA 1 1 353 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 353 1 2 1 1 45 MET H 1 45 MET HN 1 1 354 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 354 1 2 1 1 45 MET HA 1 45 MET HA 1 1 355 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 355 1 2 1 1 45 MET QB 1 45 MET HB* 1 1 356 1 1 1 1 33 PHE QD 1 33 PHE HD* 1 1 356 1 2 1 1 45 MET QG 1 45 MET HG* 1 1 357 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 357 1 2 1 1 43 CYS QB 1 43 CYS HB1 1 1 358 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 358 1 2 1 1 44 GLN HA 1 44 GLN HA 1 1 359 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 359 1 2 1 1 45 MET H 1 45 MET HN 1 1 360 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 360 1 2 1 1 45 MET HA 1 45 MET HA 1 1 361 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 361 1 2 1 1 45 MET QB 1 45 MET HB* 1 1 362 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 362 1 2 1 1 45 MET ME 1 45 MET HE* 1 1 363 1 1 1 1 33 PHE QE 1 33 PHE HE* 1 1 363 1 2 1 1 45 MET QG 1 45 MET HG* 1 1 364 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 364 1 2 1 1 43 CYS HA 1 43 CYS HA 1 1 365 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 365 1 2 1 1 45 MET HA 1 45 MET HA 1 1 366 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 366 1 2 1 1 46 PHE H 1 46 PHE HN 1 1 367 1 1 1 1 34 ALA H 1 34 ALA HN 1 1 367 1 2 1 1 46 PHE QB 1 46 PHE HB1 1 1 368 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 368 1 2 1 1 35 PRO HD2 1 35 PRO HD1 1 1 369 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 369 1 2 1 1 35 PRO HD3 1 35 PRO HD2 1 1 370 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 370 1 2 1 1 46 PHE QB 1 46 PHE HB1 1 1 371 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 371 1 2 1 1 46 PHE QD 1 46 PHE HD* 1 1 372 1 1 1 1 34 ALA MB 1 34 ALA HB* 1 1 372 1 2 1 1 46 PHE QE 1 46 PHE HE* 1 1 373 1 1 1 1 35 PRO HA 1 35 PRO HA 1 1 373 1 2 1 1 36 ILE H 1 36 ILE HN 1 1 374 1 1 1 1 35 PRO QB 1 35 PRO HB* 1 1 374 1 2 1 1 36 ILE H 1 36 ILE HN 1 1 375 1 1 1 1 35 PRO QG 1 35 PRO HG* 1 1 375 1 2 1 1 40 PRO HA 1 40 PRO HA 1 1 376 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 376 1 2 1 1 36 ILE HB 1 36 ILE HB 1 1 377 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 377 1 2 1 1 36 ILE QG 1 36 ILE HG1* 1 1 378 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 378 1 2 1 1 42 ARG QB 1 42 ARG+ HB1 1 1 379 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 379 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 380 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 380 1 2 1 1 43 CYS HA 1 43 CYS HA 1 1 381 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 381 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 382 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 382 1 2 1 1 44 GLN QB 1 44 GLN HB2 1 1 383 1 1 1 1 36 ILE H 1 36 ILE HN 1 1 383 1 2 1 1 46 PHE HA 1 46 PHE HA 1 1 384 1 1 1 1 36 ILE HA 1 36 ILE HA 1 1 384 1 2 1 1 36 ILE MD 1 36 ILE HD1* 1 1 385 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 385 1 2 1 1 37 PRO QB 1 37 PRO HB1 1 1 386 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 386 1 2 1 1 38 HIS HD2 1 38 HISD HD2 1 1 387 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 387 1 2 1 1 38 HIS HE1 1 38 HISD HE1 1 1 388 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 388 1 2 1 1 39 GLU H 1 39 GLU- HN 1 1 389 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 389 1 2 1 1 42 ARG QB 1 42 ARG+ HB1 1 1 390 1 1 1 1 36 ILE MD 1 36 ILE HD1* 1 1 390 1 2 1 1 44 GLN QB 1 44 GLN HB1 1 1 391 1 1 1 1 36 ILE QG 1 36 ILE HG1* 1 1 391 1 2 1 1 36 ILE MG 1 36 ILE HG2* 1 1 392 1 1 1 1 36 ILE QG 1 36 ILE HG1* 1 1 392 1 2 1 1 37 PRO QB 1 37 PRO HB1 1 1 393 1 1 1 1 36 ILE QG 1 36 ILE HG1* 1 1 393 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 394 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 394 1 2 1 1 42 ARG H 1 42 ARG+ HN 1 1 395 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 395 1 2 1 1 42 ARG QB 1 42 ARG+ HB1 1 1 396 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 396 1 2 1 1 42 ARG HD2 1 42 ARG+ HD2 1 1 397 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 397 1 2 1 1 42 ARG HD3 1 42 ARG+ HD1 1 1 398 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 398 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 399 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 399 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 400 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 400 1 2 1 1 44 GLN HA 1 44 GLN HA 1 1 401 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 401 1 2 1 1 44 GLN QB 1 44 GLN HB1 1 1 402 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 402 1 2 1 1 44 GLN HE21 1 44 GLN HE21 1 1 403 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 403 1 2 1 1 44 GLN HE22 1 44 GLN HE22 1 1 404 1 1 1 1 36 ILE MG 1 36 ILE HG2* 1 1 404 1 2 1 1 44 GLN QG 1 44 GLN HG* 1 1 405 1 1 1 1 37 PRO QB 1 37 PRO HB2 1 1 405 1 2 1 1 38 HIS HD2 1 38 HISD HD2 1 1 406 1 1 1 1 38 HIS HA 1 38 HISD HA 1 1 406 1 2 1 1 39 GLU H 1 39 GLU- HN 1 1 407 1 1 1 1 38 HIS HB2 1 38 HISD HB1 1 1 407 1 2 1 1 38 HIS HD2 1 38 HISD HD2 1 1 408 1 1 1 1 38 HIS HB2 1 38 HISD HB1 1 1 408 1 2 1 1 39 GLU H 1 39 GLU- HN 1 1 409 1 1 1 1 38 HIS HB2 1 38 HISD HB1 1 1 409 1 2 1 1 39 GLU HA 1 39 GLU- HA 1 1 410 1 1 1 1 38 HIS HD2 1 38 HISD HD2 1 1 410 1 2 1 1 39 GLU QG 1 39 GLU- HG1 1 1 411 1 1 1 1 39 GLU H 1 39 GLU- HN 1 1 411 1 2 1 1 39 GLU HA 1 39 GLU- HA 1 1 412 1 1 1 1 39 GLU H 1 39 GLU- HN 1 1 412 1 2 1 1 39 GLU HB2 1 39 GLU- HB2 1 1 413 1 1 1 1 39 GLU H 1 39 GLU- HN 1 1 413 1 2 1 1 39 GLU HB3 1 39 GLU- HB1 1 1 414 1 1 1 1 39 GLU H 1 39 GLU- HN 1 1 414 1 2 1 1 39 GLU QG 1 39 GLU- HG1 1 1 415 1 1 1 1 39 GLU H 1 39 GLU- HN 1 1 415 1 2 1 1 40 PRO QD 1 40 PRO HD* 1 1 416 1 1 1 1 39 GLU HA 1 39 GLU- HA 1 1 416 1 2 1 1 39 GLU HB2 1 39 GLU- HB2 1 1 417 1 1 1 1 39 GLU HA 1 39 GLU- HA 1 1 417 1 2 1 1 40 PRO QG 1 40 PRO HG* 1 1 418 1 1 1 1 39 GLU HA 1 39 GLU- HA 1 1 418 1 2 1 1 41 HIS HE1 1 41 HISD HE1 1 1 419 1 1 1 1 39 GLU HB2 1 39 GLU- HB2 1 1 419 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 420 1 1 1 1 39 GLU HB2 1 39 GLU- HB2 1 1 420 1 2 1 1 41 HIS HE1 1 41 HISD HE1 1 1 421 1 1 1 1 39 GLU HB2 1 39 GLU- HB2 1 1 421 1 2 1 1 42 ARG HD3 1 42 ARG+ HD1 1 1 422 1 1 1 1 39 GLU HB3 1 39 GLU- HB1 1 1 422 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 423 1 1 1 1 39 GLU HB3 1 39 GLU- HB1 1 1 423 1 2 1 1 41 HIS HE1 1 41 HISD HE1 1 1 424 1 1 1 1 39 GLU QG 1 39 GLU- HG1 1 1 424 1 2 1 1 41 HIS HE1 1 41 HISD HE1 1 1 425 1 1 1 1 40 PRO HA 1 40 PRO HA 1 1 425 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 426 1 1 1 1 40 PRO QB 1 40 PRO HB* 1 1 426 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 427 1 1 1 1 40 PRO QD 1 40 PRO HD* 1 1 427 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 428 1 1 1 1 40 PRO QG 1 40 PRO HG* 1 1 428 1 2 1 1 41 HIS H 1 41 HISD HN 1 1 429 1 1 1 1 41 HIS H 1 41 HISD HN 1 1 429 1 2 1 1 41 HIS HA 1 41 HISD HA 1 1 430 1 1 1 1 41 HIS H 1 41 HISD HN 1 1 430 1 2 1 1 41 HIS HB2 1 41 HISD HB2 1 1 431 1 1 1 1 41 HIS H 1 41 HISD HN 1 1 431 1 2 1 1 41 HIS HB3 1 41 HISD HB1 1 1 432 1 1 1 1 41 HIS H 1 41 HISD HN 1 1 432 1 2 1 1 42 ARG H 1 42 ARG+ HN 1 1 433 1 1 1 1 41 HIS H 1 41 HISD HN 1 1 433 1 2 1 1 42 ARG QG 1 42 ARG+ HG2 1 1 434 1 1 1 1 41 HIS HA 1 41 HISD HA 1 1 434 1 2 1 1 41 HIS HB2 1 41 HISD HB2 1 1 435 1 1 1 1 41 HIS HA 1 41 HISD HA 1 1 435 1 2 1 1 41 HIS HB3 1 41 HISD HB1 1 1 436 1 1 1 1 41 HIS HA 1 41 HISD HA 1 1 436 1 2 1 1 42 ARG H 1 42 ARG+ HN 1 1 437 1 1 1 1 41 HIS HB2 1 41 HISD HB2 1 1 437 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 438 1 1 1 1 41 HIS HB2 1 41 HISD HB2 1 1 438 1 2 1 1 42 ARG H 1 42 ARG+ HN 1 1 439 1 1 1 1 41 HIS HB3 1 41 HISD HB1 1 1 439 1 2 1 1 41 HIS HD2 1 41 HISD HD2 1 1 440 1 1 1 1 41 HIS HB3 1 41 HISD HB1 1 1 440 1 2 1 1 42 ARG H 1 42 ARG+ HN 1 1 441 1 1 1 1 41 HIS HD2 1 41 HISD HD2 1 1 441 1 2 1 1 42 ARG QG 1 42 ARG+ HG1 1 1 442 1 1 1 1 41 HIS HE1 1 41 HISD HE1 1 1 442 1 2 1 1 42 ARG HD2 1 42 ARG+ HD2 1 1 443 1 1 1 1 41 HIS HE1 1 41 HISD HE1 1 1 443 1 2 1 1 42 ARG HD3 1 42 ARG+ HD1 1 1 444 1 1 1 1 41 HIS HE1 1 41 HISD HE1 1 1 444 1 2 1 1 42 ARG QG 1 42 ARG+ HG1 1 1 445 1 1 1 1 42 ARG H 1 42 ARG+ HN 1 1 445 1 2 1 1 42 ARG HA 1 42 ARG+ HA 1 1 446 1 1 1 1 42 ARG H 1 42 ARG+ HN 1 1 446 1 2 1 1 42 ARG QG 1 42 ARG+ HG1 1 1 447 1 1 1 1 42 ARG HA 1 42 ARG+ HA 1 1 447 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 448 1 1 1 1 42 ARG QB 1 42 ARG+ HB1 1 1 448 1 2 1 1 42 ARG HD3 1 42 ARG+ HD1 1 1 449 1 1 1 1 42 ARG QB 1 42 ARG+ HB2 1 1 449 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 450 1 1 1 1 42 ARG QG 1 42 ARG+ HG1 1 1 450 1 2 1 1 43 CYS H 1 43 CYS HN 1 1 451 1 1 1 1 43 CYS H 1 43 CYS HN 1 1 451 1 2 1 1 43 CYS QB 1 43 CYS HB1 1 1 452 1 1 1 1 43 CYS H 1 43 CYS HN 1 1 452 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 453 1 1 1 1 43 CYS HA 1 43 CYS HA 1 1 453 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 454 1 1 1 1 43 CYS QB 1 43 CYS HB1 1 1 454 1 2 1 1 44 GLN H 1 44 GLN HN 1 1 455 1 1 1 1 43 CYS QB 1 43 CYS HB2 1 1 455 1 2 1 1 44 GLN HA 1 44 GLN HA 1 1 456 1 1 1 1 44 GLN H 1 44 GLN HN 1 1 456 1 2 1 1 44 GLN HA 1 44 GLN HA 1 1 457 1 1 1 1 44 GLN H 1 44 GLN HN 1 1 457 1 2 1 1 44 GLN QG 1 44 GLN HG* 1 1 458 1 1 1 1 44 GLN HA 1 44 GLN HA 1 1 458 1 2 1 1 44 GLN QG 1 44 GLN HG* 1 1 459 1 1 1 1 44 GLN HA 1 44 GLN HA 1 1 459 1 2 1 1 45 MET H 1 45 MET HN 1 1 460 1 1 1 1 44 GLN QB 1 44 GLN HB1 1 1 460 1 2 1 1 45 MET H 1 45 MET HN 1 1 461 1 1 1 1 44 GLN QG 1 44 GLN HG* 1 1 461 1 2 1 1 45 MET H 1 45 MET HN 1 1 462 1 1 1 1 45 MET H 1 45 MET HN 1 1 462 1 2 1 1 45 MET QB 1 45 MET HB* 1 1 463 1 1 1 1 45 MET HA 1 45 MET HA 1 1 463 1 2 1 1 45 MET QG 1 45 MET HG* 1 1 464 1 1 1 1 45 MET HA 1 45 MET HA 1 1 464 1 2 1 1 46 PHE H 1 46 PHE HN 1 1 465 1 1 1 1 45 MET QB 1 45 MET HB* 1 1 465 1 2 1 1 46 PHE H 1 46 PHE HN 1 1 466 1 1 1 1 45 MET QB 1 45 MET HB* 1 1 466 1 2 1 1 65 GLU QG 1 65 GLU- HG* 1 1 467 1 1 1 1 45 MET ME 1 45 MET HE* 1 1 467 1 2 1 1 47 CYS HA 1 47 CYS HA 1 1 468 1 1 1 1 45 MET ME 1 45 MET HE* 1 1 468 1 2 1 1 52 CYS QB 1 52 CYS HB2 1 1 469 1 1 1 1 45 MET ME 1 45 MET HE* 1 1 469 1 2 1 1 66 CYS HB2 1 66 CYS HB1 1 1 470 1 1 1 1 45 MET ME 1 45 MET HE* 1 1 470 1 2 1 1 77 ILE QG 1 77 ILE HG11 1 1 471 1 1 1 1 45 MET ME 1 45 MET HE* 1 1 471 1 2 1 1 78 CYS QB 1 78 CYS HB* 1 1 472 1 1 1 1 45 MET QG 1 45 MET HG* 1 1 472 1 2 1 1 66 CYS HB2 1 66 CYS HB1 1 1 473 1 1 1 1 45 MET QG 1 45 MET HG* 1 1 473 1 2 1 1 78 CYS HA 1 78 CYS HA 1 1 474 1 1 1 1 46 PHE H 1 46 PHE HN 1 1 474 1 2 1 1 46 PHE HA 1 46 PHE HA 1 1 475 1 1 1 1 46 PHE H 1 46 PHE HN 1 1 475 1 2 1 1 46 PHE QB 1 46 PHE HB1 1 1 476 1 1 1 1 46 PHE HA 1 46 PHE HA 1 1 476 1 2 1 1 47 CYS H 1 47 CYS HN 1 1 477 1 1 1 1 46 PHE QB 1 46 PHE HB1 1 1 477 1 2 1 1 46 PHE QE 1 46 PHE HE* 1 1 478 1 1 1 1 47 CYS H 1 47 CYS HN 1 1 478 1 2 1 1 47 CYS HA 1 47 CYS HA 1 1 479 1 1 1 1 47 CYS H 1 47 CYS HN 1 1 479 1 2 1 1 47 CYS QB 1 47 CYS HB* 1 1 480 1 1 1 1 47 CYS QB 1 47 CYS HB* 1 1 480 1 2 1 1 52 CYS QB 1 52 CYS HB2 1 1 481 1 1 1 1 47 CYS QB 1 47 CYS HB* 1 1 481 1 2 1 1 78 CYS H 1 78 CYS HN 1 1 482 1 1 1 1 48 ASN H 1 48 ASN HN 1 1 482 1 2 1 1 48 ASN HA 1 48 ASN HA 1 1 483 1 1 1 1 48 ASN H 1 48 ASN HN 1 1 483 1 2 1 1 48 ASN QB 1 48 ASN HB* 1 1 484 1 1 1 1 48 ASN QB 1 48 ASN HB* 1 1 484 1 2 1 1 49 GLN H 1 49 GLN HN 1 1 485 1 1 1 1 49 GLN H 1 49 GLN HN 1 1 485 1 2 1 1 49 GLN QG 1 49 GLN HG* 1 1 486 1 1 1 1 49 GLN HA 1 49 GLN HA 1 1 486 1 2 1 1 49 GLN QG 1 49 GLN HG* 1 1 487 1 1 1 1 49 GLN QB 1 49 GLN HB* 1 1 487 1 2 1 1 51 ALA H 1 51 ALA HN 1 1 488 1 1 1 1 49 GLN QG 1 49 GLN HG* 1 1 488 1 2 1 1 51 ALA H 1 51 ALA HN 1 1 489 1 1 1 1 50 THR H 1 50 THR HN 1 1 489 1 2 1 1 50 THR HA 1 50 THR HA 1 1 490 1 1 1 1 50 THR H 1 50 THR HN 1 1 490 1 2 1 1 50 THR MG 1 50 THR HG2* 1 1 491 1 1 1 1 50 THR HA 1 50 THR HA 1 1 491 1 2 1 1 51 ALA H 1 51 ALA HN 1 1 492 1 1 1 1 51 ALA H 1 51 ALA HN 1 1 492 1 2 1 1 52 CYS H 1 52 CYS HN 1 1 493 1 1 1 1 51 ALA HA 1 51 ALA HA 1 1 493 1 2 1 1 52 CYS H 1 52 CYS HN 1 1 494 1 1 1 1 51 ALA MB 1 51 ALA HB* 1 1 494 1 2 1 1 52 CYS H 1 52 CYS HN 1 1 495 1 1 1 1 51 ALA MB 1 51 ALA HB* 1 1 495 1 2 1 1 80 ASP H 1 80 ASP- HN 1 1 496 1 1 1 1 52 CYS H 1 52 CYS HN 1 1 496 1 2 1 1 52 CYS HA 1 52 CYS HA 1 1 497 1 1 1 1 52 CYS H 1 52 CYS HN 1 1 497 1 2 1 1 80 ASP H 1 80 ASP- HN 1 1 498 1 1 1 1 52 CYS QB 1 52 CYS HB2 1 1 498 1 2 1 1 80 ASP QB 1 80 ASP- HB1 1 1 499 1 1 1 1 53 PRO HA 1 53 PRO HA 1 1 499 1 2 1 1 54 ALA H 1 54 ALA HN 1 1 500 1 1 1 1 53 PRO HA 1 53 PRO HA 1 1 500 1 2 1 1 77 ILE QG 1 77 ILE HG12 1 1 501 1 1 1 1 53 PRO QB 1 53 PRO HB* 1 1 501 1 2 1 1 54 ALA H 1 54 ALA HN 1 1 502 1 1 1 1 53 PRO QG 1 53 PRO HG* 1 1 502 1 2 1 1 54 ALA H 1 54 ALA HN 1 1 503 1 1 1 1 53 PRO QG 1 53 PRO HG* 1 1 503 1 2 1 1 80 ASP HA 1 80 ASP- HA 1 1 504 1 1 1 1 54 ALA H 1 54 ALA HN 1 1 504 1 2 1 1 54 ALA HA 1 54 ALA HA 1 1 505 1 1 1 1 54 ALA H 1 54 ALA HN 1 1 505 1 2 1 1 54 ALA MB 1 54 ALA HB* 1 1 506 1 1 1 1 54 ALA H 1 54 ALA HN 1 1 506 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 507 1 1 1 1 54 ALA HA 1 54 ALA HA 1 1 507 1 2 1 1 55 ASP H 1 55 ASP- HN 1 1 508 1 1 1 1 54 ALA MB 1 54 ALA HB* 1 1 508 1 2 1 1 55 ASP H 1 55 ASP- HN 1 1 509 1 1 1 1 54 ALA MB 1 54 ALA HB* 1 1 509 1 2 1 1 55 ASP HB3 1 55 ASP- HB2 1 1 510 1 1 1 1 54 ALA MB 1 54 ALA HB* 1 1 510 1 2 1 1 64 CYS QB 1 64 CYS HB* 1 1 511 1 1 1 1 54 ALA MB 1 54 ALA HB* 1 1 511 1 2 1 1 75 GLY HA3 1 75 GLY HA1 1 1 512 1 1 1 1 54 ALA MB 1 54 ALA HB* 1 1 512 1 2 1 1 76 PHE QB 1 76 PHE HB* 1 1 513 1 1 1 1 55 ASP H 1 55 ASP- HN 1 1 513 1 2 1 1 55 ASP HA 1 55 ASP- HA 1 1 514 1 1 1 1 55 ASP H 1 55 ASP- HN 1 1 514 1 2 1 1 55 ASP HB2 1 55 ASP- HB1 1 1 515 1 1 1 1 55 ASP H 1 55 ASP- HN 1 1 515 1 2 1 1 55 ASP HB3 1 55 ASP- HB2 1 1 516 1 1 1 1 55 ASP H 1 55 ASP- HN 1 1 516 1 2 1 1 56 CYS H 1 56 CYS HN 1 1 517 1 1 1 1 55 ASP HA 1 55 ASP- HA 1 1 517 1 2 1 1 56 CYS H 1 56 CYS HN 1 1 518 1 1 1 1 56 CYS H 1 56 CYS HN 1 1 518 1 2 1 1 56 CYS HA 1 56 CYS HA 1 1 519 1 1 1 1 56 CYS H 1 56 CYS HN 1 1 519 1 2 1 1 56 CYS HB2 1 56 CYS HB1 1 1 520 1 1 1 1 56 CYS H 1 56 CYS HN 1 1 520 1 2 1 1 56 CYS HB3 1 56 CYS HB2 1 1 521 1 1 1 1 56 CYS H 1 56 CYS HN 1 1 521 1 2 1 1 57 ASP H 1 57 ASP- HN 1 1 522 1 1 1 1 56 CYS HA 1 56 CYS HA 1 1 522 1 2 1 1 57 ASP H 1 57 ASP- HN 1 1 523 1 1 1 1 56 CYS HB3 1 56 CYS HB2 1 1 523 1 2 1 1 57 ASP H 1 57 ASP- HN 1 1 524 1 1 1 1 57 ASP H 1 57 ASP- HN 1 1 524 1 2 1 1 57 ASP HA 1 57 ASP- HA 1 1 525 1 1 1 1 57 ASP H 1 57 ASP- HN 1 1 525 1 2 1 1 57 ASP HB2 1 57 ASP- HB1 1 1 526 1 1 1 1 57 ASP H 1 57 ASP- HN 1 1 526 1 2 1 1 57 ASP HB3 1 57 ASP- HB2 1 1 527 1 1 1 1 57 ASP H 1 57 ASP- HN 1 1 527 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 528 1 1 1 1 57 ASP HA 1 57 ASP- HA 1 1 528 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 529 1 1 1 1 57 ASP HB2 1 57 ASP- HB1 1 1 529 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 530 1 1 1 1 57 ASP HB3 1 57 ASP- HB2 1 1 530 1 2 1 1 60 THR MG 1 60 THR HG2* 1 1 531 1 1 1 1 57 ASP HB3 1 57 ASP- HB2 1 1 531 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 532 1 1 1 1 58 PRO HA 1 58 PRO HA 1 1 532 1 2 1 1 59 ASN H 1 59 ASN HN 1 1 533 1 1 1 1 58 PRO QB 1 58 PRO HB* 1 1 533 1 2 1 1 59 ASN H 1 59 ASN HN 1 1 534 1 1 1 1 58 PRO QD 1 58 PRO HD* 1 1 534 1 2 1 1 59 ASN H 1 59 ASN HN 1 1 535 1 1 1 1 59 ASN H 1 59 ASN HN 1 1 535 1 2 1 1 59 ASN HA 1 59 ASN HA 1 1 536 1 1 1 1 59 ASN H 1 59 ASN HN 1 1 536 1 2 1 1 59 ASN QB 1 59 ASN HB1 1 1 537 1 1 1 1 59 ASN H 1 59 ASN HN 1 1 537 1 2 1 1 59 ASN HD21 1 59 ASN HD21 1 1 538 1 1 1 1 59 ASN H 1 59 ASN HN 1 1 538 1 2 1 1 60 THR H 1 60 THR HN 1 1 539 1 1 1 1 59 ASN HA 1 59 ASN HA 1 1 539 1 2 1 1 60 THR H 1 60 THR HN 1 1 540 1 1 1 1 59 ASN QB 1 59 ASN HB2 1 1 540 1 2 1 1 59 ASN HD21 1 59 ASN HD21 1 1 541 1 1 1 1 59 ASN QB 1 59 ASN HB2 1 1 541 1 2 1 1 60 THR H 1 60 THR HN 1 1 542 1 1 1 1 59 ASN QB 1 59 ASN HB2 1 1 542 1 2 1 1 60 THR HA 1 60 THR HA 1 1 543 1 1 1 1 59 ASN QB 1 59 ASN HB1 1 1 543 1 2 1 1 60 THR MG 1 60 THR HG2* 1 1 544 1 1 1 1 60 THR H 1 60 THR HN 1 1 544 1 2 1 1 60 THR HA 1 60 THR HA 1 1 545 1 1 1 1 60 THR H 1 60 THR HN 1 1 545 1 2 1 1 60 THR HB 1 60 THR HB 1 1 546 1 1 1 1 60 THR H 1 60 THR HN 1 1 546 1 2 1 1 60 THR MG 1 60 THR HG2* 1 1 547 1 1 1 1 60 THR H 1 60 THR HN 1 1 547 1 2 1 1 61 GLN H 1 61 GLN HN 1 1 548 1 1 1 1 60 THR HA 1 60 THR HA 1 1 548 1 2 1 1 60 THR HB 1 60 THR HB 1 1 549 1 1 1 1 60 THR HA 1 60 THR HA 1 1 549 1 2 1 1 61 GLN H 1 61 GLN HN 1 1 550 1 1 1 1 60 THR MG 1 60 THR HG2* 1 1 550 1 2 1 1 61 GLN H 1 61 GLN HN 1 1 551 1 1 1 1 60 THR MG 1 60 THR HG2* 1 1 551 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 552 1 1 1 1 61 GLN H 1 61 GLN HN 1 1 552 1 2 1 1 61 GLN HA 1 61 GLN HA 1 1 553 1 1 1 1 61 GLN H 1 61 GLN HN 1 1 553 1 2 1 1 61 GLN QB 1 61 GLN HB* 1 1 554 1 1 1 1 61 GLN H 1 61 GLN HN 1 1 554 1 2 1 1 61 GLN QG 1 61 GLN HG* 1 1 555 1 1 1 1 61 GLN HA 1 61 GLN HA 1 1 555 1 2 1 1 61 GLN QG 1 61 GLN HG* 1 1 556 1 1 1 1 61 GLN HA 1 61 GLN HA 1 1 556 1 2 1 1 62 ALA H 1 62 ALA HN 1 1 557 1 1 1 1 61 GLN QB 1 61 GLN HB* 1 1 557 1 2 1 1 62 ALA H 1 62 ALA HN 1 1 558 1 1 1 1 61 GLN QG 1 61 GLN HG* 1 1 558 1 2 1 1 62 ALA HA 1 62 ALA HA 1 1 559 1 1 1 1 62 ALA H 1 62 ALA HN 1 1 559 1 2 1 1 62 ALA HA 1 62 ALA HA 1 1 560 1 1 1 1 62 ALA H 1 62 ALA HN 1 1 560 1 2 1 1 62 ALA MB 1 62 ALA HB* 1 1 561 1 1 1 1 62 ALA H 1 62 ALA HN 1 1 561 1 2 1 1 63 SER H 1 63 SER HN 1 1 562 1 1 1 1 62 ALA HA 1 62 ALA HA 1 1 562 1 2 1 1 63 SER H 1 63 SER HN 1 1 563 1 1 1 1 62 ALA MB 1 62 ALA HB* 1 1 563 1 2 1 1 63 SER H 1 63 SER HN 1 1 564 1 1 1 1 63 SER H 1 63 SER HN 1 1 564 1 2 1 1 63 SER HA 1 63 SER HA 1 1 565 1 1 1 1 63 SER H 1 63 SER HN 1 1 565 1 2 1 1 63 SER QB 1 63 SER HB* 1 1 566 1 1 1 1 63 SER H 1 63 SER HN 1 1 566 1 2 1 1 64 CYS H 1 64 CYS HN 1 1 567 1 1 1 1 63 SER HA 1 63 SER HA 1 1 567 1 2 1 1 64 CYS H 1 64 CYS HN 1 1 568 1 1 1 1 63 SER QB 1 63 SER HB* 1 1 568 1 2 1 1 64 CYS H 1 64 CYS HN 1 1 569 1 1 1 1 63 SER QB 1 63 SER HB* 1 1 569 1 2 1 1 64 CYS HA 1 64 CYS HA 1 1 570 1 1 1 1 64 CYS H 1 64 CYS HN 1 1 570 1 2 1 1 64 CYS HA 1 64 CYS HA 1 1 571 1 1 1 1 64 CYS H 1 64 CYS HN 1 1 571 1 2 1 1 64 CYS QB 1 64 CYS HB* 1 1 572 1 1 1 1 64 CYS HA 1 64 CYS HA 1 1 572 1 2 1 1 65 GLU H 1 65 GLU- HN 1 1 573 1 1 1 1 64 CYS QB 1 64 CYS HB* 1 1 573 1 2 1 1 65 GLU H 1 65 GLU- HN 1 1 574 1 1 1 1 64 CYS QB 1 64 CYS HB* 1 1 574 1 2 1 1 72 LEU QD 1 72 LEU HD1* 1 1 575 1 1 1 1 65 GLU H 1 65 GLU- HN 1 1 575 1 2 1 1 65 GLU HA 1 65 GLU- HA 1 1 576 1 1 1 1 65 GLU H 1 65 GLU- HN 1 1 576 1 2 1 1 65 GLU HB2 1 65 GLU- HB1 1 1 577 1 1 1 1 65 GLU H 1 65 GLU- HN 1 1 577 1 2 1 1 65 GLU HB3 1 65 GLU- HB2 1 1 578 1 1 1 1 65 GLU H 1 65 GLU- HN 1 1 578 1 2 1 1 65 GLU QG 1 65 GLU- HG* 1 1 579 1 1 1 1 65 GLU H 1 65 GLU- HN 1 1 579 1 2 1 1 66 CYS H 1 66 CYS HN 1 1 580 1 1 1 1 65 GLU HA 1 65 GLU- HA 1 1 580 1 2 1 1 65 GLU HB2 1 65 GLU- HB1 1 1 581 1 1 1 1 65 GLU HA 1 65 GLU- HA 1 1 581 1 2 1 1 65 GLU QG 1 65 GLU- HG* 1 1 582 1 1 1 1 65 GLU HA 1 65 GLU- HA 1 1 582 1 2 1 1 66 CYS H 1 66 CYS HN 1 1 583 1 1 1 1 65 GLU HB2 1 65 GLU- HB1 1 1 583 1 2 1 1 66 CYS H 1 66 CYS HN 1 1 584 1 1 1 1 65 GLU HB3 1 65 GLU- HB2 1 1 584 1 2 1 1 66 CYS H 1 66 CYS HN 1 1 585 1 1 1 1 65 GLU HB3 1 65 GLU- HB2 1 1 585 1 2 1 1 66 CYS HA 1 66 CYS HA 1 1 586 1 1 1 1 65 GLU QG 1 65 GLU- HG* 1 1 586 1 2 1 1 66 CYS H 1 66 CYS HN 1 1 587 1 1 1 1 66 CYS H 1 66 CYS HN 1 1 587 1 2 1 1 66 CYS HA 1 66 CYS HA 1 1 588 1 1 1 1 66 CYS H 1 66 CYS HN 1 1 588 1 2 1 1 66 CYS HB2 1 66 CYS HB1 1 1 589 1 1 1 1 66 CYS H 1 66 CYS HN 1 1 589 1 2 1 1 66 CYS HB3 1 66 CYS HB2 1 1 590 1 1 1 1 66 CYS HA 1 66 CYS HA 1 1 590 1 2 1 1 66 CYS HB3 1 66 CYS HB2 1 1 591 1 1 1 1 66 CYS HB2 1 66 CYS HB1 1 1 591 1 2 1 1 70 TYR H 1 70 TYR HN 1 1 592 1 1 1 1 67 PRO HA 1 67 PRO HA 1 1 592 1 2 1 1 67 PRO HB3 1 67 PRO HB2 1 1 593 1 1 1 1 67 PRO HA 1 67 PRO HA 1 1 593 1 2 1 1 68 GLU H 1 68 GLU- HN 1 1 594 1 1 1 1 67 PRO HB2 1 67 PRO HB1 1 1 594 1 2 1 1 68 GLU H 1 68 GLU- HN 1 1 595 1 1 1 1 67 PRO QD 1 67 PRO HD* 1 1 595 1 2 1 1 70 TYR QD 1 70 TYR HD* 1 1 596 1 1 1 1 67 PRO QD 1 67 PRO HD* 1 1 596 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 597 1 1 1 1 67 PRO QG 1 67 PRO HG* 1 1 597 1 2 1 1 68 GLU QG 1 68 GLU- HG* 1 1 598 1 1 1 1 68 GLU H 1 68 GLU- HN 1 1 598 1 2 1 1 68 GLU HA 1 68 GLU- HA 1 1 599 1 1 1 1 68 GLU H 1 68 GLU- HN 1 1 599 1 2 1 1 68 GLU QB 1 68 GLU- HB* 1 1 600 1 1 1 1 68 GLU H 1 68 GLU- HN 1 1 600 1 2 1 1 68 GLU QG 1 68 GLU- HG* 1 1 601 1 1 1 1 68 GLU H 1 68 GLU- HN 1 1 601 1 2 1 1 70 TYR H 1 70 TYR HN 1 1 602 1 1 1 1 68 GLU HA 1 68 GLU- HA 1 1 602 1 2 1 1 68 GLU QG 1 68 GLU- HG* 1 1 603 1 1 1 1 68 GLU HA 1 68 GLU- HA 1 1 603 1 2 1 1 69 GLY H 1 69 GLY HN 1 1 604 1 1 1 1 68 GLU QB 1 68 GLU- HB* 1 1 604 1 2 1 1 69 GLY H 1 69 GLY HN 1 1 605 1 1 1 1 68 GLU QG 1 68 GLU- HG* 1 1 605 1 2 1 1 69 GLY H 1 69 GLY HN 1 1 606 1 1 1 1 69 GLY H 1 69 GLY HN 1 1 606 1 2 1 1 69 GLY HA2 1 69 GLY HA1 1 1 607 1 1 1 1 69 GLY H 1 69 GLY HN 1 1 607 1 2 1 1 69 GLY HA3 1 69 GLY HA2 1 1 608 1 1 1 1 69 GLY H 1 69 GLY HN 1 1 608 1 2 1 1 70 TYR H 1 70 TYR HN 1 1 609 1 1 1 1 69 GLY HA2 1 69 GLY HA1 1 1 609 1 2 1 1 70 TYR H 1 70 TYR HN 1 1 610 1 1 1 1 69 GLY HA3 1 69 GLY HA2 1 1 610 1 2 1 1 70 TYR H 1 70 TYR HN 1 1 611 1 1 1 1 70 TYR H 1 70 TYR HN 1 1 611 1 2 1 1 70 TYR HA 1 70 TYR HA 1 1 612 1 1 1 1 70 TYR H 1 70 TYR HN 1 1 612 1 2 1 1 70 TYR QB 1 70 TYR HB* 1 1 613 1 1 1 1 70 TYR QB 1 70 TYR HB* 1 1 613 1 2 1 1 71 ILE QG 1 71 ILE HG1* 1 1 614 1 1 1 1 70 TYR QD 1 70 TYR HD* 1 1 614 1 2 1 1 71 ILE HB 1 71 ILE HB 1 1 615 1 1 1 1 70 TYR QD 1 70 TYR HD* 1 1 615 1 2 1 1 71 ILE QG 1 71 ILE HG1* 1 1 616 1 1 1 1 70 TYR QE 1 70 TYR HE* 1 1 616 1 2 1 1 71 ILE HB 1 71 ILE HB 1 1 617 1 1 1 1 71 ILE H 1 71 ILE HN 1 1 617 1 2 1 1 71 ILE HB 1 71 ILE HB 1 1 618 1 1 1 1 71 ILE HA 1 71 ILE HA 1 1 618 1 2 1 1 71 ILE QG 1 71 ILE HG1* 1 1 619 1 1 1 1 72 LEU H 1 72 LEU HN 1 1 619 1 2 1 1 72 LEU HA 1 72 LEU HA 1 1 620 1 1 1 1 72 LEU H 1 72 LEU HN 1 1 620 1 2 1 1 72 LEU HB2 1 72 LEU HB2 1 1 621 1 1 1 1 72 LEU H 1 72 LEU HN 1 1 621 1 2 1 1 72 LEU QD 1 72 LEU HD1* 1 1 622 1 1 1 1 72 LEU H 1 72 LEU HN 1 1 622 1 2 1 1 73 ASP H 1 73 ASP- HN 1 1 623 1 1 1 1 72 LEU HA 1 72 LEU HA 1 1 623 1 2 1 1 72 LEU HB2 1 72 LEU HB2 1 1 624 1 1 1 1 72 LEU HA 1 72 LEU HA 1 1 624 1 2 1 1 72 LEU QD 1 72 LEU HD1* 1 1 625 1 1 1 1 72 LEU HA 1 72 LEU HA 1 1 625 1 2 1 1 73 ASP H 1 73 ASP- HN 1 1 626 1 1 1 1 72 LEU HA 1 72 LEU HA 1 1 626 1 2 1 1 73 ASP QB 1 73 ASP- HB* 1 1 627 1 1 1 1 72 LEU HB2 1 72 LEU HB2 1 1 627 1 2 1 1 72 LEU QD 1 72 LEU HD1* 1 1 628 1 1 1 1 72 LEU HB3 1 72 LEU HB1 1 1 628 1 2 1 1 72 LEU QD 1 72 LEU HD1* 1 1 629 1 1 1 1 72 LEU QD 1 72 LEU HD2* 1 1 629 1 2 1 1 73 ASP HA 1 73 ASP- HA 1 1 630 1 1 1 1 72 LEU QD 1 72 LEU HD2* 1 1 630 1 2 1 1 76 PHE QB 1 76 PHE HB* 1 1 631 1 1 1 1 72 LEU QD 1 72 LEU HD1* 1 1 631 1 2 1 1 76 PHE QD 1 76 PHE HD* 1 1 632 1 1 1 1 72 LEU QD 1 72 LEU HD1* 1 1 632 1 2 1 1 76 PHE QE 1 76 PHE HE* 1 1 633 1 1 1 1 73 ASP H 1 73 ASP- HN 1 1 633 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 634 1 1 1 1 73 ASP HA 1 73 ASP- HA 1 1 634 1 2 1 1 74 ASP H 1 74 ASP- HN 1 1 635 1 1 1 1 73 ASP QB 1 73 ASP- HB* 1 1 635 1 2 1 1 74 ASP H 1 74 ASP- HN 1 1 636 1 1 1 1 74 ASP H 1 74 ASP- HN 1 1 636 1 2 1 1 74 ASP HA 1 74 ASP- HA 1 1 637 1 1 1 1 74 ASP H 1 74 ASP- HN 1 1 637 1 2 1 1 74 ASP QB 1 74 ASP- HB* 1 1 638 1 1 1 1 74 ASP H 1 74 ASP- HN 1 1 638 1 2 1 1 76 PHE H 1 76 PHE HN 1 1 639 1 1 1 1 74 ASP H 1 74 ASP- HN 1 1 639 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 640 1 1 1 1 74 ASP HA 1 74 ASP- HA 1 1 640 1 2 1 1 75 GLY H 1 75 GLY HN 1 1 641 1 1 1 1 74 ASP QB 1 74 ASP- HB* 1 1 641 1 2 1 1 75 GLY H 1 75 GLY HN 1 1 642 1 1 1 1 75 GLY H 1 75 GLY HN 1 1 642 1 2 1 1 75 GLY HA2 1 75 GLY HA2 1 1 643 1 1 1 1 75 GLY H 1 75 GLY HN 1 1 643 1 2 1 1 75 GLY HA3 1 75 GLY HA1 1 1 644 1 1 1 1 75 GLY H 1 75 GLY HN 1 1 644 1 2 1 1 76 PHE H 1 76 PHE HN 1 1 645 1 1 1 1 75 GLY H 1 75 GLY HN 1 1 645 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 646 1 1 1 1 75 GLY HA2 1 75 GLY HA2 1 1 646 1 2 1 1 76 PHE H 1 76 PHE HN 1 1 647 1 1 1 1 75 GLY HA3 1 75 GLY HA1 1 1 647 1 2 1 1 76 PHE H 1 76 PHE HN 1 1 648 1 1 1 1 76 PHE H 1 76 PHE HN 1 1 648 1 2 1 1 76 PHE HA 1 76 PHE HA 1 1 649 1 1 1 1 76 PHE H 1 76 PHE HN 1 1 649 1 2 1 1 76 PHE QB 1 76 PHE HB* 1 1 650 1 1 1 1 76 PHE H 1 76 PHE HN 1 1 650 1 2 1 1 77 ILE H 1 77 ILE HN 1 1 651 1 1 1 1 76 PHE H 1 76 PHE HN 1 1 651 1 2 1 1 77 ILE HA 1 77 ILE HA 1 1 652 1 1 1 1 76 PHE H 1 76 PHE HN 1 1 652 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 653 1 1 1 1 76 PHE HA 1 76 PHE HA 1 1 653 1 2 1 1 76 PHE QD 1 76 PHE HD* 1 1 654 1 1 1 1 76 PHE HA 1 76 PHE HA 1 1 654 1 2 1 1 77 ILE H 1 77 ILE HN 1 1 655 1 1 1 1 77 ILE H 1 77 ILE HN 1 1 655 1 2 1 1 77 ILE HA 1 77 ILE HA 1 1 656 1 1 1 1 77 ILE H 1 77 ILE HN 1 1 656 1 2 1 1 77 ILE HB 1 77 ILE HB 1 1 657 1 1 1 1 77 ILE H 1 77 ILE HN 1 1 657 1 2 1 1 77 ILE MG 1 77 ILE HG2* 1 1 658 1 1 1 1 77 ILE HA 1 77 ILE HA 1 1 658 1 2 1 1 77 ILE QG 1 77 ILE HG11 1 1 659 1 1 1 1 77 ILE HA 1 77 ILE HA 1 1 659 1 2 1 1 78 CYS H 1 78 CYS HN 1 1 660 1 1 1 1 77 ILE HB 1 77 ILE HB 1 1 660 1 2 1 1 78 CYS H 1 78 CYS HN 1 1 661 1 1 1 1 77 ILE MG 1 77 ILE HG2* 1 1 661 1 2 1 1 78 CYS H 1 78 CYS HN 1 1 662 1 1 1 1 78 CYS H 1 78 CYS HN 1 1 662 1 2 1 1 78 CYS QB 1 78 CYS HB* 1 1 663 1 1 1 1 79 THR HA 1 79 THR HA 1 1 663 1 2 1 1 80 ASP H 1 80 ASP- HN 1 1 664 1 1 1 1 81 ILE H 1 81 ILE HN 1 1 664 1 2 1 1 82 ASP H 1 82 ASP- HN 1 1 665 1 1 1 1 81 ILE HA 1 81 ILE HA 1 1 665 1 2 1 1 82 ASP H 1 82 ASP- HN 1 1 666 1 1 1 1 81 ILE MG 1 81 ILE HG2* 1 1 666 1 2 1 1 82 ASP H 1 82 ASP- HN 1 1 667 1 1 1 1 81 ILE MG 1 81 ILE HG2* 1 1 667 1 2 1 1 82 ASP HB2 1 82 ASP- HB1 1 1 668 1 1 1 1 82 ASP H 1 82 ASP- HN 1 1 668 1 2 1 1 82 ASP HA 1 82 ASP- HA 1 1 669 1 1 1 1 82 ASP H 1 82 ASP- HN 1 1 669 1 2 1 1 82 ASP HB2 1 82 ASP- HB1 1 1 670 1 1 1 1 82 ASP H 1 82 ASP- HN 1 1 670 1 2 1 1 82 ASP HB3 1 82 ASP- HB2 1 1 671 1 1 1 1 82 ASP H 1 82 ASP- HN 1 1 671 1 2 1 1 83 GLU H 1 83 GL-C HN 1 1 672 1 1 1 1 82 ASP HA 1 82 ASP- HA 1 1 672 1 2 1 1 83 GLU H 1 83 GL-C 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 . . . . . 3.0 1.8 3.0 1 1 2 1 . . . . . 3.0 1.8 3.0 1 1 3 1 . . . . . 4.0 1.8 4.0 1 1 4 1 . . . . . 3.0 1.8 3.0 1 1 5 1 . . . . . 3.0 1.8 3.0 1 1 6 1 . . . . . 4.0 1.8 4.0 1 1 7 1 . . . . . 4.0 1.8 4.0 1 1 8 1 . . . . . 5.0 1.8 5.0 1 1 9 1 . . . . . 3.0 1.8 3.0 1 1 10 1 . . . . . . 1.8 3.0 1 1 11 1 . . . . . 4.0 1.8 4.0 1 1 12 1 . . . . . 4.0 1.8 4.0 1 1 13 1 . . . . . 3.0 1.8 3.0 1 1 14 1 . . . . . 5.0 1.8 5.0 1 1 15 1 . . . . . 4.0 1.8 4.0 1 1 16 1 . . . . . 5.0 1.8 5.0 1 1 17 1 . . . . . 4.0 1.8 4.0 1 1 18 1 . . . . . 3.0 1.8 3.0 1 1 19 1 . . . . . 4.0 1.8 4.0 1 1 20 1 . . . . . 3.0 1.8 3.0 1 1 21 1 . . . . . 3.0 1.8 3.0 1 1 22 1 . . . . . 4.0 1.8 4.0 1 1 23 1 . . . . . 4.0 1.8 4.0 1 1 24 1 . . . . . 5.0 1.8 5.0 1 1 25 1 . . . . . 5.0 1.8 5.0 1 1 26 1 . . . . . 5.0 1.8 5.0 1 1 27 1 . . . . . 3.0 1.8 3.0 1 1 28 1 . . . . . 4.0 1.8 4.0 1 1 29 1 . . . . . 4.0 1.8 4.0 1 1 30 1 . . . . . 4.0 1.8 4.0 1 1 31 1 . . . . . 3.0 1.8 3.0 1 1 32 1 . . . . . 4.0 1.8 4.0 1 1 33 1 . . . . . 5.0 1.8 5.0 1 1 34 1 . . . . . 5.0 1.8 5.0 1 1 35 1 . . . . . 4.0 1.8 4.0 1 1 36 1 . . . . . 4.0 1.8 4.0 1 1 37 1 . . . . . 5.0 1.8 5.0 1 1 38 1 . . . . . 5.0 1.8 5.0 1 1 39 1 . . . . . 4.0 1.8 4.0 1 1 40 1 . . . . . 3.0 1.8 3.0 1 1 41 1 . . . . . 5.0 1.8 5.0 1 1 42 1 . . . . . 4.0 1.8 4.0 1 1 43 1 . . . . . 4.0 1.8 4.0 1 1 44 1 . . . . . 4.0 1.8 4.0 1 1 45 1 . . . . . 4.0 1.8 4.0 1 1 46 1 . . . . . 3.0 1.8 3.0 1 1 47 1 . . . . . 3.0 1.8 3.0 1 1 48 1 . . . . . 3.0 1.8 3.0 1 1 49 1 . . . . . 3.0 1.8 3.0 1 1 50 1 . . . . . 5.5 1.8 5.5 1 1 51 1 . . . . . 5.0 1.8 5.0 1 1 52 1 . . . . . 3.0 1.8 3.0 1 1 53 1 . . . . . 3.0 1.8 3.0 1 1 54 1 . . . . . 4.0 1.8 4.0 1 1 55 1 . . . . . 3.0 1.8 3.0 1 1 56 1 . . . . . 4.0 1.8 4.0 1 1 57 1 . . . . . 4.0 1.8 4.0 1 1 58 1 . . . . . 5.0 1.8 5.0 1 1 59 1 . . . . . 4.0 1.8 4.0 1 1 60 1 . . . . . 5.0 1.8 5.0 1 1 61 1 . . . . . 4.0 1.8 4.0 1 1 62 1 . . . . . 5.0 1.8 5.0 1 1 63 1 . . . . . 3.0 1.8 3.0 1 1 64 1 . . . . . 3.0 1.8 3.0 1 1 65 1 . . . . . 5.0 1.8 5.0 1 1 66 1 . . . . . 3.0 1.8 3.0 1 1 67 1 . . . . . 5.0 1.8 5.0 1 1 68 1 . . . . . 3.0 1.8 3.0 1 1 69 1 . . . . . 4.0 1.8 4.0 1 1 70 1 . . . . . . 1.8 3.0 1 1 71 1 . . . . . 4.0 1.8 4.0 1 1 72 1 . . . . . 4.0 1.8 4.0 1 1 73 1 . . . . . 5.0 1.8 5.0 1 1 74 1 . . . . . 5.0 1.8 5.0 1 1 75 1 . . . . . 4.0 1.8 4.0 1 1 76 1 . . . . . 5.0 1.8 5.0 1 1 77 1 . . . . . 5.0 1.8 5.0 1 1 78 1 . . . . . 3.0 1.8 3.0 1 1 79 1 . . . . . 5.0 1.8 5.0 1 1 80 1 . . . . . 3.0 1.8 3.0 1 1 81 1 . . . . . 4.0 1.8 4.0 1 1 82 1 . . . . . 3.0 1.8 3.0 1 1 83 1 . . . . . 3.0 1.8 3.0 1 1 84 1 . . . . . 3.0 1.8 3.0 1 1 85 1 . . . . . 4.0 1.8 4.0 1 1 86 1 . . . . . 5.0 1.8 5.0 1 1 87 1 . . . . . 3.0 1.8 3.0 1 1 88 1 . . . . . 3.0 1.8 3.0 1 1 89 1 . . . . . 4.0 1.8 4.0 1 1 90 1 . . . . . 5.0 1.8 5.0 1 1 91 1 . . . . . 4.0 1.8 4.0 1 1 92 1 . . . . . 4.0 1.8 4.0 1 1 93 1 . . . . . 4.0 1.8 4.0 1 1 94 1 . . . . . 4.0 1.8 4.0 1 1 95 1 . . . . . 5.0 1.8 5.0 1 1 96 1 . . . . . 4.0 1.8 4.0 1 1 97 1 . . . . . 4.0 1.8 4.0 1 1 98 1 . . . . . 3.0 1.8 3.0 1 1 99 1 . . . . . 5.0 1.8 5.0 1 1 100 1 . . . . . 3.0 1.8 3.0 1 1 101 1 . . . . . 4.0 1.8 4.0 1 1 102 1 . . . . . 5.0 1.8 5.0 1 1 103 1 . . . . . 3.0 1.8 3.0 1 1 104 1 . . . . . . 1.8 3.0 1 1 105 1 . . . . . 4.0 1.8 4.0 1 1 106 1 . . . . . 5.0 1.8 5.0 1 1 107 1 . . . . . 3.0 1.8 3.0 1 1 108 1 . . . . . 3.0 1.8 3.0 1 1 109 1 . . . . . 4.0 1.8 4.0 1 1 110 1 . . . . . 4.0 1.8 4.0 1 1 111 1 . . . . . 3.0 1.8 3.0 1 1 112 1 . . . . . 3.0 1.8 3.0 1 1 113 1 . . . . . 5.0 1.8 5.0 1 1 114 1 . . . . . 5.0 1.8 5.0 1 1 115 1 . . . . . 4.0 1.8 4.0 1 1 116 1 . . . . . 3.0 1.8 3.0 1 1 117 1 . . . . . 3.0 1.8 3.0 1 1 118 1 . . . . . 3.0 1.8 3.0 1 1 119 1 . . . . . 4.0 1.8 4.0 1 1 120 1 . . . . . 4.0 1.8 4.0 1 1 121 1 . . . . . 3.0 1.8 3.0 1 1 122 1 . . . . . 3.0 1.8 3.0 1 1 123 1 . . . . . 4.0 1.8 4.0 1 1 124 1 . . . . . 5.0 1.8 5.0 1 1 125 1 . . . . . 4.0 1.8 4.0 1 1 126 1 . . . . . 4.0 1.8 4.0 1 1 127 1 . . . . . 4.0 1.8 4.0 1 1 128 1 . . . . . 4.0 1.8 4.0 1 1 129 1 . . . . . 4.0 1.8 4.0 1 1 130 1 . . . . . 4.0 1.8 4.0 1 1 131 1 . . . . . 3.0 1.8 3.0 1 1 132 1 . . . . . 3.0 1.8 3.0 1 1 133 1 . . . . . 3.0 1.8 3.0 1 1 134 1 . . . . . 4.0 1.8 4.0 1 1 135 1 . . . . . 4.0 1.8 4.0 1 1 136 1 . . . . . 3.0 1.8 3.0 1 1 137 1 . . . . . 3.0 1.8 3.0 1 1 138 1 . . . . . 4.0 1.8 4.0 1 1 139 1 . . . . . 3.0 1.8 3.0 1 1 140 1 . . . . . 3.0 1.8 3.0 1 1 141 1 . . . . . 3.0 1.8 3.0 1 1 142 1 . . . . . 3.0 1.8 3.0 1 1 143 1 . . . . . 5.0 1.8 5.0 1 1 144 1 . . . . . 4.0 1.8 4.0 1 1 145 1 . . . . . 5.0 1.8 5.0 1 1 146 1 . . . . . . 1.8 3.0 1 1 147 1 . . . . . 5.0 1.8 5.0 1 1 148 1 . . . . . 4.0 1.8 4.0 1 1 149 1 . . . . . . 1.8 4.0 1 1 150 1 . . . . . 4.0 1.8 4.0 1 1 151 1 . . . . . 5.0 1.8 5.0 1 1 152 1 . . . . . 5.0 1.8 5.0 1 1 153 1 . . . . . 4.0 1.8 4.0 1 1 154 1 . . . . . 5.0 1.8 5.0 1 1 155 1 . . . . . 5.0 1.8 5.0 1 1 156 1 . . . . . 5.0 1.8 5.0 1 1 157 1 . . . . . 3.0 1.8 3.0 1 1 158 1 . . . . . 4.0 1.8 4.0 1 1 159 1 . . . . . 4.0 1.8 4.0 1 1 160 1 . . . . . 5.0 1.8 5.0 1 1 161 1 . . . . . 4.0 1.8 4.0 1 1 162 1 . . . . . 5.0 1.8 5.0 1 1 163 1 . . . . . 5.0 1.8 5.0 1 1 164 1 . . . . . 3.0 1.8 3.0 1 1 165 1 . . . . . 3.0 1.8 3.0 1 1 166 1 . . . . . 4.0 1.8 4.0 1 1 167 1 . . . . . 4.0 1.8 4.0 1 1 168 1 . . . . . 4.0 1.8 4.0 1 1 169 1 . . . . . 3.0 1.8 3.0 1 1 170 1 . . . . . 4.0 1.8 4.0 1 1 171 1 . . . . . 4.0 1.8 4.0 1 1 172 1 . . . . . 3.0 1.8 3.0 1 1 173 1 . . . . . 3.0 1.8 3.0 1 1 174 1 . . . . . 5.0 1.8 5.0 1 1 175 1 . . . . . 5.0 1.8 5.0 1 1 176 1 . . . . . 3.0 1.8 3.0 1 1 177 1 . . . . . 3.0 1.8 3.0 1 1 178 1 . . . . . 4.0 1.8 4.0 1 1 179 1 . . . . . 4.0 1.8 4.0 1 1 180 1 . . . . . 4.0 1.8 4.0 1 1 181 1 . . . . . 3.0 1.8 3.0 1 1 182 1 . . . . . 3.0 1.8 3.0 1 1 183 1 . . . . . 5.0 1.8 5.0 1 1 184 1 . . . . . 5.0 1.8 5.0 1 1 185 1 . . . . . 4.0 1.8 4.0 1 1 186 1 . . . . . 4.0 1.8 4.0 1 1 187 1 . . . . . 4.0 1.8 4.0 1 1 188 1 . . . . . 4.0 1.8 4.0 1 1 189 1 . . . . . . 1.8 4.0 1 1 190 1 . . . . . 4.0 1.8 4.0 1 1 191 1 . . . . . . 1.8 4.0 1 1 192 1 . . . . . 4.0 1.8 4.0 1 1 193 1 . . . . . 4.0 1.8 4.0 1 1 194 1 . . . . . 4.0 1.8 4.0 1 1 195 1 . . . . . 4.0 1.8 4.0 1 1 196 1 . . . . . 5.0 1.8 5.0 1 1 197 1 . . . . . 4.0 1.8 4.0 1 1 198 1 . . . . . 5.0 1.8 5.0 1 1 199 1 . . . . . 4.0 1.8 4.0 1 1 200 1 . . . . . 4.0 1.8 4.0 1 1 201 1 . . . . . 4.0 1.8 4.0 1 1 202 1 . . . . . 5.0 1.8 5.0 1 1 203 1 . . . . . 4.0 1.8 4.0 1 1 204 1 . . . . . 4.0 1.8 4.0 1 1 205 1 . . . . . 3.0 1.8 3.0 1 1 206 1 . . . . . 4.0 1.8 4.0 1 1 207 1 . . . . . 3.0 1.8 3.0 1 1 208 1 . . . . . 3.0 1.8 3.0 1 1 209 1 . . . . . 4.0 1.8 4.0 1 1 210 1 . . . . . 4.0 1.8 4.0 1 1 211 1 . . . . . 4.0 1.8 4.0 1 1 212 1 . . . . . 5.0 1.8 5.0 1 1 213 1 . . . . . 4.0 1.8 4.0 1 1 214 1 . . . . . 5.0 1.8 5.0 1 1 215 1 . . . . . 4.0 1.8 4.0 1 1 216 1 . . . . . 4.0 1.8 4.0 1 1 217 1 . . . . . 4.0 1.8 4.0 1 1 218 1 . . . . . 5.0 1.8 5.0 1 1 219 1 . . . . . 5.0 1.8 5.0 1 1 220 1 . . . . . 5.0 1.8 5.0 1 1 221 1 . . . . . 4.0 1.8 4.0 1 1 222 1 . . . . . 5.0 1.8 5.0 1 1 223 1 . . . . . 5.0 1.8 5.0 1 1 224 1 . . . . . 3.0 1.8 3.0 1 1 225 1 . . . . . 4.0 1.8 4.0 1 1 226 1 . . . . . 3.0 1.8 3.0 1 1 227 1 . . . . . 4.0 1.8 4.0 1 1 228 1 . . . . . 4.0 1.8 4.0 1 1 229 1 . . . . . 5.0 1.8 5.0 1 1 230 1 . . . . . 3.0 1.8 3.0 1 1 231 1 . . . . . 3.0 1.8 3.0 1 1 232 1 . . . . . 4.0 1.8 4.0 1 1 233 1 . . . . . 4.0 1.8 4.0 1 1 234 1 . . . . . 4.0 1.8 4.0 1 1 235 1 . . . . . 5.0 1.8 5.0 1 1 236 1 . . . . . 5.0 1.8 5.0 1 1 237 1 . . . . . 4.0 1.8 4.0 1 1 238 1 . . . . . 5.0 1.8 5.0 1 1 239 1 . . . . . 4.0 1.8 4.0 1 1 240 1 . . . . . 4.0 1.8 4.0 1 1 241 1 . . . . . 3.0 1.8 3.0 1 1 242 1 . . . . . 4.0 1.8 4.0 1 1 243 1 . . . . . 3.0 1.8 3.0 1 1 244 1 . . . . . 3.0 1.8 3.0 1 1 245 1 . . . . . 3.0 1.8 3.0 1 1 246 1 . . . . . . 1.8 3.0 1 1 247 1 . . . . . 4.0 1.8 4.0 1 1 248 1 . . . . . 3.0 1.8 3.0 1 1 249 1 . . . . . 4.0 1.8 4.0 1 1 250 1 . . . . . . 1.8 3.0 1 1 251 1 . . . . . 5.0 1.8 5.0 1 1 252 1 . . . . . 3.0 1.8 3.0 1 1 253 1 . . . . . 4.0 1.8 4.0 1 1 254 1 . . . . . 5.0 1.8 5.0 1 1 255 1 . . . . . 4.0 1.8 4.0 1 1 256 1 . . . . . 4.0 1.8 4.0 1 1 257 1 . . . . . 3.0 1.8 3.0 1 1 258 1 . . . . . 3.0 1.8 3.0 1 1 259 1 . . . . . 3.0 1.8 3.0 1 1 260 1 . . . . . 4.0 1.8 4.0 1 1 261 1 . . . . . 4.0 1.8 4.0 1 1 262 1 . . . . . 4.0 1.8 4.0 1 1 263 1 . . . . . 5.0 1.8 5.0 1 1 264 1 . . . . . 4.0 1.8 4.0 1 1 265 1 . . . . . 5.0 1.8 5.0 1 1 266 1 . . . . . 3.0 1.8 3.0 1 1 267 1 . . . . . 5.0 1.8 5.0 1 1 268 1 . . . . . 4.0 1.8 4.0 1 1 269 1 . . . . . 4.0 1.8 4.0 1 1 270 1 . . . . . 3.0 1.8 3.0 1 1 271 1 . . . . . 3.0 1.8 3.0 1 1 272 1 . . . . . . 1.8 4.0 1 1 273 1 . . . . . 5.0 1.8 5.0 1 1 274 1 . . . . . 4.0 1.8 4.0 1 1 275 1 . . . . . 5.0 1.8 5.0 1 1 276 1 . . . . . 3.0 1.8 3.0 1 1 277 1 . . . . . 3.0 1.8 3.0 1 1 278 1 . . . . . 4.0 1.8 4.0 1 1 279 1 . . . . . 3.0 1.8 3.0 1 1 280 1 . . . . . 3.0 1.8 3.0 1 1 281 1 . . . . . 3.0 1.8 3.0 1 1 282 1 . . . . . 5.0 1.8 5.0 1 1 283 1 . . . . . 5.0 1.8 5.0 1 1 284 1 . . . . . 4.0 1.8 4.0 1 1 285 1 . . . . . 3.0 1.8 3.0 1 1 286 1 . . . . . 4.0 1.8 4.0 1 1 287 1 . . . . . 3.0 1.8 3.0 1 1 288 1 . . . . . 4.0 1.8 4.0 1 1 289 1 . . . . . 4.0 1.8 4.0 1 1 290 1 . . . . . 3.0 1.8 3.0 1 1 291 1 . . . . . 3.0 1.8 3.0 1 1 292 1 . . . . . 4.0 1.8 4.0 1 1 293 1 . . . . . 3.0 1.8 3.0 1 1 294 1 . . . . . 3.0 1.8 3.0 1 1 295 1 . . . . . 4.0 1.8 4.0 1 1 296 1 . . . . . 5.0 1.8 5.0 1 1 297 1 . . . . . 3.0 1.8 3.0 1 1 298 1 . . . . . 3.0 1.8 3.0 1 1 299 1 . . . . . 5.0 1.8 5.0 1 1 300 1 . . . . . 3.0 1.8 3.0 1 1 301 1 . . . . . 5.0 1.8 5.0 1 1 302 1 . . . . . 3.0 1.8 3.0 1 1 303 1 . . . . . 4.0 1.8 4.0 1 1 304 1 . . . . . 4.0 1.8 4.0 1 1 305 1 . . . . . 3.0 1.8 3.0 1 1 306 1 . . . . . 3.0 1.8 3.0 1 1 307 1 . . . . . 5.0 1.8 5.0 1 1 308 1 . . . . . 4.0 1.8 4.0 1 1 309 1 . . . . . 3.0 1.8 3.0 1 1 310 1 . . . . . 4.0 1.8 4.0 1 1 311 1 . . . . . 4.0 1.8 4.0 1 1 312 1 . . . . . 5.0 1.8 5.0 1 1 313 1 . . . . . 3.0 1.8 3.0 1 1 314 1 . . . . . 3.0 1.8 3.0 1 1 315 1 . . . . . 3.0 1.8 3.0 1 1 316 1 . . . . . 4.0 1.8 4.0 1 1 317 1 . . . . . 5.0 1.8 5.0 1 1 318 1 . . . . . 3.0 1.8 3.0 1 1 319 1 . . . . . 3.0 1.8 3.0 1 1 320 1 . . . . . 3.0 1.8 3.0 1 1 321 1 . . . . . 3.0 1.8 3.0 1 1 322 1 . . . . . 4.0 1.8 4.0 1 1 323 1 . . . . . 4.0 1.8 4.0 1 1 324 1 . . . . . 4.0 1.8 4.0 1 1 325 1 . . . . . 3.0 1.8 3.0 1 1 326 1 . . . . . 3.0 1.8 3.0 1 1 327 1 . . . . . 5.0 1.8 5.0 1 1 328 1 . . . . . 5.0 1.8 5.0 1 1 329 1 . . . . . 3.0 1.8 3.0 1 1 330 1 . . . . . 3.0 1.8 3.0 1 1 331 1 . . . . . 4.0 1.8 4.0 1 1 332 1 . . . . . 4.0 1.8 4.0 1 1 333 1 . . . . . 5.0 1.8 5.0 1 1 334 1 . . . . . 4.0 1.8 4.0 1 1 335 1 . . . . . 4.0 1.8 4.0 1 1 336 1 . . . . . 5.0 1.8 5.0 1 1 337 1 . . . . . 3.0 1.8 3.0 1 1 338 1 . . . . . 5.0 1.8 5.0 1 1 339 1 . . . . . 4.0 1.8 4.0 1 1 340 1 . . . . . 4.0 1.8 4.0 1 1 341 1 . . . . . 4.0 1.8 4.0 1 1 342 1 . . . . . 3.0 1.8 3.0 1 1 343 1 . . . . . 5.0 1.8 5.0 1 1 344 1 . . . . . 5.0 1.8 5.0 1 1 345 1 . . . . . 5.0 1.8 5.0 1 1 346 1 . . . . . 4.0 1.8 4.0 1 1 347 1 . . . . . 4.0 1.8 4.0 1 1 348 1 . . . . . 4.0 1.8 4.0 1 1 349 1 . . . . . 5.0 1.8 5.0 1 1 350 1 . . . . . 4.0 1.8 4.0 1 1 351 1 . . . . . 5.0 1.8 5.0 1 1 352 1 . . . . . 4.0 1.8 4.0 1 1 353 1 . . . . . 4.0 1.8 4.0 1 1 354 1 . . . . . 4.0 1.8 4.0 1 1 355 1 . . . . . 5.0 1.8 5.0 1 1 356 1 . . . . . 5.0 1.8 5.0 1 1 357 1 . . . . . 5.0 1.8 5.0 1 1 358 1 . . . . . 5.0 1.8 5.0 1 1 359 1 . . . . . 4.0 1.8 4.0 1 1 360 1 . . . . . 5.0 1.8 5.0 1 1 361 1 . . . . . 4.0 1.8 4.0 1 1 362 1 . . . . . 5.0 1.8 5.0 1 1 363 1 . . . . . 4.0 1.8 4.0 1 1 364 1 . . . . . 5.0 1.8 5.0 1 1 365 1 . . . . . 4.0 1.8 4.0 1 1 366 1 . . . . . 4.0 1.8 4.0 1 1 367 1 . . . . . 4.0 1.8 4.0 1 1 368 1 . . . . . 4.0 1.8 4.0 1 1 369 1 . . . . . 4.0 1.8 4.0 1 1 370 1 . . . . . 4.0 1.8 4.0 1 1 371 1 . . . . . 5.0 1.8 5.0 1 1 372 1 . . . . . 5.0 1.8 5.0 1 1 373 1 . . . . . 3.0 1.8 3.0 1 1 374 1 . . . . . 4.0 1.8 4.0 1 1 375 1 . . . . . 4.0 1.8 4.0 1 1 376 1 . . . . . 3.0 1.8 3.0 1 1 377 1 . . . . . 4.0 1.8 4.0 1 1 378 1 . . . . . 4.0 1.8 4.0 1 1 379 1 . . . . . 5.0 1.8 5.0 1 1 380 1 . . . . . 4.0 1.8 4.0 1 1 381 1 . . . . . 4.0 1.8 4.0 1 1 382 1 . . . . . 4.0 1.8 4.0 1 1 383 1 . . . . . 4.0 1.8 4.0 1 1 384 1 . . . . . 4.0 1.8 4.0 1 1 385 1 . . . . . 4.0 1.8 4.0 1 1 386 1 . . . . . 5.0 1.8 5.0 1 1 387 1 . . . . . 5.0 1.8 5.0 1 1 388 1 . . . . . 4.0 1.8 4.0 1 1 389 1 . . . . . 4.0 1.8 4.0 1 1 390 1 . . . . . 4.0 1.8 4.0 1 1 391 1 . . . . . 3.0 1.8 3.0 1 1 392 1 . . . . . 4.0 1.8 4.0 1 1 393 1 . . . . . 5.0 1.8 5.0 1 1 394 1 . . . . . 5.0 1.8 5.0 1 1 395 1 . . . . . 4.0 1.8 4.0 1 1 396 1 . . . . . 4.0 1.8 4.0 1 1 397 1 . . . . . 5.0 1.8 5.0 1 1 398 1 . . . . . 5.0 1.8 5.0 1 1 399 1 . . . . . 4.0 1.8 4.0 1 1 400 1 . . . . . 5.0 1.8 5.0 1 1 401 1 . . . . . 4.0 1.8 4.0 1 1 402 1 . . . . . 5.0 1.8 5.0 1 1 403 1 . . . . . 5.0 1.8 5.0 1 1 404 1 . . . . . 5.0 1.8 5.0 1 1 405 1 . . . . . 4.0 1.8 4.0 1 1 406 1 . . . . . 3.0 1.8 3.0 1 1 407 1 . . . . . 4.0 1.8 4.0 1 1 408 1 . . . . . 3.0 1.8 3.0 1 1 409 1 . . . . . 4.0 1.8 4.0 1 1 410 1 . . . . . 4.0 1.8 4.0 1 1 411 1 . . . . . 3.0 1.8 3.0 1 1 412 1 . . . . . 3.0 1.8 3.0 1 1 413 1 . . . . . 4.0 1.8 4.0 1 1 414 1 . . . . . 4.0 1.8 4.0 1 1 415 1 . . . . . 4.0 1.8 4.0 1 1 416 1 . . . . . 3.0 1.8 3.0 1 1 417 1 . . . . . 5.0 1.8 5.0 1 1 418 1 . . . . . 5.0 1.8 5.0 1 1 419 1 . . . . . 4.0 1.8 4.0 1 1 420 1 . . . . . 4.0 1.8 4.0 1 1 421 1 . . . . . 4.0 1.8 4.0 1 1 422 1 . . . . . 4.0 1.8 4.0 1 1 423 1 . . . . . 4.0 1.8 4.0 1 1 424 1 . . . . . 4.0 1.8 4.0 1 1 425 1 . . . . . 3.0 1.8 3.0 1 1 426 1 . . . . . 4.0 1.8 4.0 1 1 427 1 . . . . . 5.0 1.8 5.0 1 1 428 1 . . . . . 5.0 1.8 5.0 1 1 429 1 . . . . . 3.0 1.8 3.0 1 1 430 1 . . . . . 4.0 1.8 4.0 1 1 431 1 . . . . . 4.0 1.8 4.0 1 1 432 1 . . . . . 3.0 1.8 3.0 1 1 433 1 . . . . . 5.0 1.8 5.0 1 1 434 1 . . . . . 3.0 1.8 3.0 1 1 435 1 . . . . . 3.0 1.8 3.0 1 1 436 1 . . . . . 3.0 1.8 3.0 1 1 437 1 . . . . . 4.0 1.8 4.0 1 1 438 1 . . . . . 4.0 1.8 4.0 1 1 439 1 . . . . . 4.0 1.8 4.0 1 1 440 1 . . . . . 5.0 1.8 5.0 1 1 441 1 . . . . . 4.0 1.8 4.0 1 1 442 1 . . . . . 5.0 1.8 5.0 1 1 443 1 . . . . . 5.0 1.8 5.0 1 1 444 1 . . . . . 5.0 1.8 5.0 1 1 445 1 . . . . . 3.0 1.8 3.0 1 1 446 1 . . . . . 4.0 1.8 4.0 1 1 447 1 . . . . . 3.0 1.8 3.0 1 1 448 1 . . . . . 3.0 1.8 3.0 1 1 449 1 . . . . . 3.0 1.8 3.0 1 1 450 1 . . . . . 4.0 1.8 4.0 1 1 451 1 . . . . . 3.0 1.8 3.0 1 1 452 1 . . . . . 5.0 1.8 5.0 1 1 453 1 . . . . . 3.0 1.8 3.0 1 1 454 1 . . . . . 4.0 1.8 4.0 1 1 455 1 . . . . . 4.0 1.8 4.0 1 1 456 1 . . . . . 3.0 1.8 3.0 1 1 457 1 . . . . . 4.0 1.8 4.0 1 1 458 1 . . . . . 4.0 1.8 4.0 1 1 459 1 . . . . . 3.0 1.8 3.0 1 1 460 1 . . . . . 4.0 1.8 4.0 1 1 461 1 . . . . . 4.0 1.8 4.0 1 1 462 1 . . . . . 3.0 1.8 3.0 1 1 463 1 . . . . . 4.0 1.8 4.0 1 1 464 1 . . . . . 3.0 1.8 3.0 1 1 465 1 . . . . . 4.0 1.8 4.0 1 1 466 1 . . . . . 4.0 1.8 4.0 1 1 467 1 . . . . . 4.0 1.8 4.0 1 1 468 1 . . . . . 5.0 1.8 5.0 1 1 469 1 . . . . . 4.0 1.8 4.0 1 1 470 1 . . . . . 4.0 1.8 4.0 1 1 471 1 . . . . . 5.0 1.8 5.0 1 1 472 1 . . . . . 4.0 1.8 4.0 1 1 473 1 . . . . . 4.0 1.8 4.0 1 1 474 1 . . . . . 3.0 1.8 3.0 1 1 475 1 . . . . . 3.0 1.8 3.0 1 1 476 1 . . . . . 3.0 1.8 3.0 1 1 477 1 . . . . . 4.0 1.8 4.0 1 1 478 1 . . . . . 3.0 1.8 3.0 1 1 479 1 . . . . . 3.0 1.8 3.0 1 1 480 1 . . . . . 4.0 1.8 4.0 1 1 481 1 . . . . . 5.0 1.8 5.0 1 1 482 1 . . . . . 3.0 1.8 3.0 1 1 483 1 . . . . . 3.0 1.8 3.0 1 1 484 1 . . . . . 4.0 1.8 4.0 1 1 485 1 . . . . . 4.0 1.8 4.0 1 1 486 1 . . . . . 4.0 1.8 4.0 1 1 487 1 . . . . . 5.0 1.8 5.0 1 1 488 1 . . . . . 4.0 1.8 4.0 1 1 489 1 . . . . . 3.0 1.8 3.0 1 1 490 1 . . . . . 4.0 1.8 4.0 1 1 491 1 . . . . . 4.0 1.8 4.0 1 1 492 1 . . . . . 5.0 1.8 5.0 1 1 493 1 . . . . . 3.0 1.8 3.0 1 1 494 1 . . . . . 4.0 1.8 4.0 1 1 495 1 . . . . . 5.0 1.8 5.0 1 1 496 1 . . . . . 3.0 1.8 3.0 1 1 497 1 . . . . . 4.0 1.8 4.0 1 1 498 1 . . . . . 3.0 1.8 3.0 1 1 499 1 . . . . . 3.0 1.8 3.0 1 1 500 1 . . . . . 4.0 1.8 4.0 1 1 501 1 . . . . . 4.0 1.8 4.0 1 1 502 1 . . . . . 4.0 1.8 4.0 1 1 503 1 . . . . . 4.0 1.8 4.0 1 1 504 1 . . . . . 3.0 1.8 3.0 1 1 505 1 . . . . . 3.0 1.8 3.0 1 1 506 1 . . . . . 4.0 1.8 4.0 1 1 507 1 . . . . . 3.0 1.8 3.0 1 1 508 1 . . . . . 3.0 1.8 3.0 1 1 509 1 . . . . . 5.0 1.8 5.0 1 1 510 1 . . . . . 5.0 1.8 5.0 1 1 511 1 . . . . . 4.0 1.8 4.0 1 1 512 1 . . . . . 5.0 1.8 5.0 1 1 513 1 . . . . . 3.0 1.8 3.0 1 1 514 1 . . . . . 3.0 1.8 3.0 1 1 515 1 . . . . . 3.0 1.8 3.0 1 1 516 1 . . . . . 3.0 1.8 3.0 1 1 517 1 . . . . . 3.0 1.8 3.0 1 1 518 1 . . . . . 3.0 1.8 3.0 1 1 519 1 . . . . . 3.0 1.8 3.0 1 1 520 1 . . . . . 3.0 1.8 3.0 1 1 521 1 . . . . . 5.0 1.8 5.0 1 1 522 1 . . . . . 3.0 1.8 3.0 1 1 523 1 . . . . . 3.0 1.8 3.0 1 1 524 1 . . . . . 3.0 1.8 3.0 1 1 525 1 . . . . . 3.0 1.8 3.0 1 1 526 1 . . . . . 3.0 1.8 3.0 1 1 527 1 . . . . . 4.0 1.8 4.0 1 1 528 1 . . . . . 4.0 1.8 4.0 1 1 529 1 . . . . . 4.0 1.8 4.0 1 1 530 1 . . . . . 5.0 1.8 5.0 1 1 531 1 . . . . . 4.0 1.8 4.0 1 1 532 1 . . . . . 4.0 1.8 4.0 1 1 533 1 . . . . . 3.0 1.8 3.0 1 1 534 1 . . . . . 4.0 1.8 4.0 1 1 535 1 . . . . . 3.0 1.8 3.0 1 1 536 1 . . . . . 3.0 1.8 3.0 1 1 537 1 . . . . . 5.0 1.8 5.0 1 1 538 1 . . . . . 3.0 1.8 3.0 1 1 539 1 . . . . . 3.0 1.8 3.0 1 1 540 1 . . . . . 3.0 1.8 3.0 1 1 541 1 . . . . . 3.0 1.8 3.0 1 1 542 1 . . . . . 4.0 1.8 4.0 1 1 543 1 . . . . . . 1.8 4.0 1 1 544 1 . . . . . 3.0 1.8 3.0 1 1 545 1 . . . . . 4.0 1.8 4.0 1 1 546 1 . . . . . 4.0 1.8 4.0 1 1 547 1 . . . . . 3.0 1.8 3.0 1 1 548 1 . . . . . 3.0 1.8 3.0 1 1 549 1 . . . . . 3.0 1.8 3.0 1 1 550 1 . . . . . 5.0 1.8 5.0 1 1 551 1 . . . . . 5.0 1.8 5.0 1 1 552 1 . . . . . 3.0 1.8 3.0 1 1 553 1 . . . . . 3.0 1.8 3.0 1 1 554 1 . . . . . 4.0 1.8 4.0 1 1 555 1 . . . . . 4.0 1.8 4.0 1 1 556 1 . . . . . 3.0 1.8 3.0 1 1 557 1 . . . . . 4.0 1.8 4.0 1 1 558 1 . . . . . 4.0 1.8 4.0 1 1 559 1 . . . . . 3.0 1.8 3.0 1 1 560 1 . . . . . 3.0 1.8 3.0 1 1 561 1 . . . . . 4.0 1.8 4.0 1 1 562 1 . . . . . 3.0 1.8 3.0 1 1 563 1 . . . . . 4.0 1.8 4.0 1 1 564 1 . . . . . 3.0 1.8 3.0 1 1 565 1 . . . . . 3.0 1.8 3.0 1 1 566 1 . . . . . 3.0 1.8 3.0 1 1 567 1 . . . . . 3.0 1.8 3.0 1 1 568 1 . . . . . 5.0 1.8 5.0 1 1 569 1 . . . . . 4.0 1.8 4.0 1 1 570 1 . . . . . 3.0 1.8 3.0 1 1 571 1 . . . . . 3.0 1.8 3.0 1 1 572 1 . . . . . 3.0 1.8 3.0 1 1 573 1 . . . . . 4.0 1.8 4.0 1 1 574 1 . . . . . 4.0 1.8 4.0 1 1 575 1 . . . . . 3.0 1.8 3.0 1 1 576 1 . . . . . 3.0 1.8 3.0 1 1 577 1 . . . . . 3.0 1.8 3.0 1 1 578 1 . . . . . 4.0 1.8 4.0 1 1 579 1 . . . . . 3.0 1.8 3.0 1 1 580 1 . . . . . 3.0 1.8 3.0 1 1 581 1 . . . . . 3.0 1.8 3.0 1 1 582 1 . . . . . 3.0 1.8 3.0 1 1 583 1 . . . . . 4.0 1.8 4.0 1 1 584 1 . . . . . 4.0 1.8 4.0 1 1 585 1 . . . . . 4.0 1.8 4.0 1 1 586 1 . . . . . 4.0 1.8 4.0 1 1 587 1 . . . . . 3.0 1.8 3.0 1 1 588 1 . . . . . 3.0 1.8 3.0 1 1 589 1 . . . . . 4.0 1.8 4.0 1 1 590 1 . . . . . 3.0 1.8 3.0 1 1 591 1 . . . . . 4.0 1.8 4.0 1 1 592 1 . . . . . 3.0 1.8 3.0 1 1 593 1 . . . . . 3.0 1.8 3.0 1 1 594 1 . . . . . 3.0 1.8 3.0 1 1 595 1 . . . . . 5.0 1.8 5.0 1 1 596 1 . . . . . 5.0 1.8 5.0 1 1 597 1 . . . . . 5.0 1.8 5.0 1 1 598 1 . . . . . 3.0 1.8 3.0 1 1 599 1 . . . . . 3.0 1.8 3.0 1 1 600 1 . . . . . 3.0 1.8 3.0 1 1 601 1 . . . . . 4.0 1.8 4.0 1 1 602 1 . . . . . 3.0 1.8 3.0 1 1 603 1 . . . . . 3.0 1.8 3.0 1 1 604 1 . . . . . 4.0 1.8 4.0 1 1 605 1 . . . . . 5.0 1.8 5.0 1 1 606 1 . . . . . 3.0 1.8 3.0 1 1 607 1 . . . . . 3.0 1.8 3.0 1 1 608 1 . . . . . 4.0 1.8 4.0 1 1 609 1 . . . . . 4.0 1.8 4.0 1 1 610 1 . . . . . 4.0 1.8 4.0 1 1 611 1 . . . . . 3.0 1.8 3.0 1 1 612 1 . . . . . 3.0 1.8 3.0 1 1 613 1 . . . . . 5.0 1.8 5.0 1 1 614 1 . . . . . 5.0 1.8 5.0 1 1 615 1 . . . . . 5.0 1.8 5.0 1 1 616 1 . . . . . 5.0 1.8 5.0 1 1 617 1 . . . . . 3.0 1.8 3.0 1 1 618 1 . . . . . 4.0 1.8 4.0 1 1 619 1 . . . . . 3.0 1.8 3.0 1 1 620 1 . . . . . 3.0 1.8 3.0 1 1 621 1 . . . . . 5.0 1.8 5.0 1 1 622 1 . . . . . 5.0 1.8 5.0 1 1 623 1 . . . . . 3.0 1.8 3.0 1 1 624 1 . . . . . 4.0 1.8 4.0 1 1 625 1 . . . . . 3.0 1.8 3.0 1 1 626 1 . . . . . 4.0 1.8 4.0 1 1 627 1 . . . . . 3.0 1.8 3.0 1 1 628 1 . . . . . 3.0 1.8 3.0 1 1 629 1 . . . . . 5.0 1.8 5.0 1 1 630 1 . . . . . 5.0 1.8 5.0 1 1 631 1 . . . . . 5.0 1.8 5.0 1 1 632 1 . . . . . 5.0 1.8 5.0 1 1 633 1 . . . . . 4.0 1.8 4.0 1 1 634 1 . . . . . 3.0 1.8 3.0 1 1 635 1 . . . . . 3.0 1.8 3.0 1 1 636 1 . . . . . 3.0 1.8 3.0 1 1 637 1 . . . . . 3.0 1.8 3.0 1 1 638 1 . . . . . 5.0 1.8 5.0 1 1 639 1 . . . . . 5.0 1.8 5.0 1 1 640 1 . . . . . 3.0 1.8 3.0 1 1 641 1 . . . . . 4.0 1.8 4.0 1 1 642 1 . . . . . 3.0 1.8 3.0 1 1 643 1 . . . . . 3.0 1.8 3.0 1 1 644 1 . . . . . 3.0 1.8 3.0 1 1 645 1 . . . . . 5.0 1.8 5.0 1 1 646 1 . . . . . 3.0 1.8 3.0 1 1 647 1 . . . . . 3.0 1.8 3.0 1 1 648 1 . . . . . 3.0 1.8 3.0 1 1 649 1 . . . . . 3.0 1.8 3.0 1 1 650 1 . . . . . 3.0 1.8 3.0 1 1 651 1 . . . . . 3.0 1.8 3.0 1 1 652 1 . . . . . 5.0 1.8 5.0 1 1 653 1 . . . . . 4.0 1.8 4.0 1 1 654 1 . . . . . 3.0 1.8 3.0 1 1 655 1 . . . . . 3.0 1.8 3.0 1 1 656 1 . . . . . 3.0 1.8 3.0 1 1 657 1 . . . . . 4.0 1.8 4.0 1 1 658 1 . . . . . 3.0 1.8 3.0 1 1 659 1 . . . . . 3.0 1.8 3.0 1 1 660 1 . . . . . 4.0 1.8 4.0 1 1 661 1 . . . . . 4.0 1.8 4.0 1 1 662 1 . . . . . 3.0 1.8 3.0 1 1 663 1 . . . . . 3.0 1.8 3.0 1 1 664 1 . . . . . 4.0 1.8 4.0 1 1 665 1 . . . . . 3.0 1.8 3.0 1 1 666 1 . . . . . 5.0 1.8 5.0 1 1 667 1 . . . . . 5.0 1.8 5.0 1 1 668 1 . . . . . 3.0 1.8 3.0 1 1 669 1 . . . . . 4.0 1.8 4.0 1 1 670 1 . . . . . 3.0 1.8 3.0 1 1 671 1 . . . . . 5.0 1.8 5.0 1 1 672 1 . . . . . 4.0 1.8 4.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 HIS C C 4.294 1.011 23.895 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 5.505 1.861 24.290 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 6.560 1.773 23.186 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 5.823 2.101 20.771 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 5.724 4.336 20.670 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 6.174 2.578 21.978 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H 6.943 1.928 25.754 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H 5.363 1.696 26.331 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H 6.190 0.416 25.580 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H 5.173 2.893 24.397 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H 7.519 2.128 23.564 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H 6.703 0.733 22.895 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD2 H 5.773 1.065 20.493 1.00 . A A . 1 HIS HD2 1 1 1 14 1 1 1 HIS HE1 H 5.591 5.351 20.306 1.00 . A A . 1 HIS HE1 1 1 1 15 1 1 1 HIS HE2 H 5.182 3.189 18.970 1.00 . A A . 1 HIS HE2 1 1 1 16 1 1 1 HIS N N 6.039 1.445 25.581 1.00 . A A . 1 HIS N 1 1 1 17 1 1 1 HIS ND1 N 6.116 4.049 21.923 1.00 . A A . 1 HIS ND1 1 1 1 18 1 1 1 HIS NE2 N 5.523 3.251 19.908 1.00 . A A . 1 HIS NE2 1 1 1 19 1 1 1 HIS O O 3.188 1.506 23.716 1.00 . A A . 1 HIS O 1 1 1 20 1 1 2 MET C C 2.423 -1.321 23.314 1.00 . A A . 2 MET C 1 1 1 21 1 1 2 MET CA C 3.624 -1.263 24.261 1.00 . A A . 2 MET CA 1 1 1 22 1 1 2 MET CB C 3.171 -0.875 25.670 1.00 . A A . 2 MET CB 1 1 1 23 1 1 2 MET CE C 5.041 -3.420 28.034 1.00 . A A . 2 MET CE 1 1 1 24 1 1 2 MET CG C 4.242 -1.181 26.718 1.00 . A A . 2 MET CG 1 1 1 25 1 1 2 MET H H 5.446 -0.592 23.355 1.00 . A A . 2 MET H 1 1 1 26 1 1 2 MET HA H 4.129 -2.229 24.263 1.00 . A A . 2 MET HA 1 1 1 27 1 1 2 MET HB2 H 2.929 0.187 25.695 1.00 . A A . 2 MET HB2 1 1 1 28 1 1 2 MET HB3 H 2.255 -1.408 25.925 1.00 . A A . 2 MET HB3 1 1 1 29 1 1 2 MET HE1 H 5.891 -2.969 27.522 1.00 . A A . 2 MET HE1 1 1 1 30 1 1 2 MET HE2 H 4.806 -4.370 27.553 1.00 . A A . 2 MET HE2 1 1 1 31 1 1 2 MET HE3 H 5.318 -3.612 29.070 1.00 . A A . 2 MET HE3 1 1 1 32 1 1 2 MET HG2 H 5.119 -1.619 26.242 1.00 . A A . 2 MET HG2 1 1 1 33 1 1 2 MET HG3 H 4.564 -0.261 27.206 1.00 . A A . 2 MET HG3 1 1 1 34 1 1 2 MET N N 4.587 -0.296 23.771 1.00 . A A . 2 MET N 1 1 1 35 1 1 2 MET O O 2.451 -0.818 22.198 1.00 . A A . 2 MET O 1 1 1 36 1 1 2 MET SD S 3.618 -2.319 27.965 1.00 . A A . 2 MET SD 1 1 1 37 1 1 3 GLU C C -0.810 -3.027 23.829 1.00 . A A . 3 GLU C 1 1 1 38 1 1 3 GLU CA C 0.281 -2.355 22.988 1.00 . A A . 3 GLU CA 1 1 1 39 1 1 3 GLU CB C 0.796 -3.317 21.916 1.00 . A A . 3 GLU CB 1 1 1 40 1 1 3 GLU CD C 2.374 -5.224 21.426 1.00 . A A . 3 GLU CD 1 1 1 41 1 1 3 GLU CG C 1.819 -4.292 22.505 1.00 . A A . 3 GLU CG 1 1 1 42 1 1 3 GLU H H 1.352 -2.187 24.822 1.00 . A A . 3 GLU H 1 1 1 43 1 1 3 GLU HA H -0.074 -1.417 22.574 1.00 . A A . 3 GLU HA 1 1 1 44 1 1 3 GLU HB2 H -0.043 -3.876 21.497 1.00 . A A . 3 GLU HB2 1 1 1 45 1 1 3 GLU HB3 H 1.256 -2.748 21.105 1.00 . A A . 3 GLU HB3 1 1 1 46 1 1 3 GLU HG2 H 2.649 -3.746 22.952 1.00 . A A . 3 GLU HG2 1 1 1 47 1 1 3 GLU HG3 H 1.356 -4.886 23.294 1.00 . A A . 3 GLU HG3 1 1 1 48 1 1 3 GLU N N 1.374 -1.972 23.846 1.00 . A A . 3 GLU N 1 1 1 49 1 1 3 GLU O O -0.559 -3.976 24.562 1.00 . A A . 3 GLU O 1 1 1 50 1 1 3 GLU OE1 O 3.253 -4.796 20.679 1.00 . A A . 3 GLU OE1 1 1 1 51 1 1 3 GLU OE2 O 1.926 -6.367 21.348 1.00 . A A . 3 GLU OE2 1 1 1 52 1 1 4 PRO C C -3.522 -4.245 22.671 1.00 . A A . 4 PRO C 1 1 1 53 1 1 4 PRO CA C -3.255 -3.273 23.831 1.00 . A A . 4 PRO CA 1 1 1 54 1 1 4 PRO CB C -4.390 -2.250 23.880 1.00 . A A . 4 PRO CB 1 1 1 55 1 1 4 PRO CD C -2.266 -1.069 23.436 1.00 . A A . 4 PRO CD 1 1 1 56 1 1 4 PRO CG C -3.776 -0.878 23.573 1.00 . A A . 4 PRO CG 1 1 1 57 1 1 4 PRO HA H -3.205 -3.841 24.760 1.00 . A A . 4 PRO HA 1 1 1 58 1 1 4 PRO HB2 H -5.156 -2.496 23.146 1.00 . A A . 4 PRO HB2 1 1 1 59 1 1 4 PRO HB3 H -4.862 -2.247 24.862 1.00 . A A . 4 PRO HB3 1 1 1 60 1 1 4 PRO HD2 H -1.948 -0.803 22.429 1.00 . A A . 4 PRO HD2 1 1 1 61 1 1 4 PRO HD3 H -1.713 -0.466 24.156 1.00 . A A . 4 PRO HD3 1 1 1 62 1 1 4 PRO HG2 H -4.185 -0.485 22.643 1.00 . A A . 4 PRO HG2 1 1 1 63 1 1 4 PRO HG3 H -4.000 -0.170 24.369 1.00 . A A . 4 PRO HG3 1 1 1 64 1 1 4 PRO N N -2.039 -2.482 23.684 1.00 . A A . 4 PRO N 1 1 1 65 1 1 4 PRO O O -4.629 -4.741 22.499 1.00 . A A . 4 PRO O 1 1 1 66 1 1 5 VAL C C -3.982 -4.560 19.948 1.00 . A A . 5 VAL C 1 1 1 67 1 1 5 VAL CA C -2.531 -4.631 20.447 1.00 . A A . 5 VAL CA 1 1 1 68 1 1 5 VAL CB C -1.960 -5.989 20.072 1.00 . A A . 5 VAL CB 1 1 1 69 1 1 5 VAL CG1 C -1.946 -6.217 18.560 1.00 . A A . 5 VAL CG1 1 1 1 70 1 1 5 VAL CG2 C -0.574 -6.201 20.681 1.00 . A A . 5 VAL CG2 1 1 1 71 1 1 5 VAL H H -1.554 -4.534 22.339 1.00 . A A . 5 VAL H 1 1 1 72 1 1 5 VAL HA H -1.927 -3.828 20.019 1.00 . A A . 5 VAL HA 1 1 1 73 1 1 5 VAL HB H -2.644 -6.705 20.510 1.00 . A A . 5 VAL HB 1 1 1 74 1 1 5 VAL HG11 H -1.269 -7.031 18.301 1.00 . A A . 5 VAL HG11 1 1 1 75 1 1 5 VAL HG12 H -2.938 -6.482 18.199 1.00 . A A . 5 VAL HG12 1 1 1 76 1 1 5 VAL HG13 H -1.622 -5.322 18.030 1.00 . A A . 5 VAL HG13 1 1 1 77 1 1 5 VAL HG21 H 0.166 -5.574 20.183 1.00 . A A . 5 VAL HG21 1 1 1 78 1 1 5 VAL HG22 H -0.571 -5.950 21.742 1.00 . A A . 5 VAL HG22 1 1 1 79 1 1 5 VAL HG23 H -0.258 -7.240 20.581 1.00 . A A . 5 VAL HG23 1 1 1 80 1 1 5 VAL N N -2.445 -4.487 21.894 1.00 . A A . 5 VAL N 1 1 1 81 1 1 5 VAL O O -4.810 -5.415 20.237 1.00 . A A . 5 VAL O 1 1 1 82 1 1 6 ASP C C -6.594 -3.565 19.806 1.00 . A A . 6 ASP C 1 1 1 83 1 1 6 ASP CA C -5.390 -2.670 19.465 1.00 . A A . 6 ASP CA 1 1 1 84 1 1 6 ASP CB C -5.659 -1.683 18.323 1.00 . A A . 6 ASP CB 1 1 1 85 1 1 6 ASP CG C -5.717 -0.262 18.891 1.00 . A A . 6 ASP CG 1 1 1 86 1 1 6 ASP H H -3.474 -3.199 18.584 1.00 . A A . 6 ASP H 1 1 1 87 1 1 6 ASP HA H -5.131 -2.091 20.346 1.00 . A A . 6 ASP HA 1 1 1 88 1 1 6 ASP HB2 H -4.862 -1.733 17.584 1.00 . A A . 6 ASP HB2 1 1 1 89 1 1 6 ASP HB3 H -6.598 -1.871 17.807 1.00 . A A . 6 ASP HB3 1 1 1 90 1 1 6 ASP N N -4.217 -3.483 19.184 1.00 . A A . 6 ASP N 1 1 1 91 1 1 6 ASP O O -6.799 -3.949 20.951 1.00 . A A . 6 ASP O 1 1 1 92 1 1 6 ASP OD1 O -4.685 0.237 19.336 1.00 . A A . 6 ASP OD1 1 1 1 93 1 1 6 ASP OD2 O -6.796 0.329 18.879 1.00 . A A . 6 ASP OD2 1 1 1 94 1 1 7 PRO C C -5.644 -4.826 17.220 1.00 . A A . 7 PRO C 1 1 1 95 1 1 7 PRO CA C -7.059 -4.928 17.797 1.00 . A A . 7 PRO CA 1 1 1 96 1 1 7 PRO CB C -8.097 -4.772 16.681 1.00 . A A . 7 PRO CB 1 1 1 97 1 1 7 PRO CD C -8.631 -3.187 18.491 1.00 . A A . 7 PRO CD 1 1 1 98 1 1 7 PRO CG C -9.128 -3.737 17.152 1.00 . A A . 7 PRO CG 1 1 1 99 1 1 7 PRO HA H -7.169 -5.899 18.281 1.00 . A A . 7 PRO HA 1 1 1 100 1 1 7 PRO HB2 H -7.617 -4.419 15.770 1.00 . A A . 7 PRO HB2 1 1 1 101 1 1 7 PRO HB3 H -8.577 -5.725 16.462 1.00 . A A . 7 PRO HB3 1 1 1 102 1 1 7 PRO HD2 H -8.466 -2.111 18.448 1.00 . A A . 7 PRO HD2 1 1 1 103 1 1 7 PRO HD3 H -9.342 -3.397 19.290 1.00 . A A . 7 PRO HD3 1 1 1 104 1 1 7 PRO HG2 H -9.223 -2.934 16.422 1.00 . A A . 7 PRO HG2 1 1 1 105 1 1 7 PRO HG3 H -10.109 -4.198 17.266 1.00 . A A . 7 PRO HG3 1 1 1 106 1 1 7 PRO N N -7.379 -3.878 18.752 1.00 . A A . 7 PRO N 1 1 1 107 1 1 7 PRO O O -4.792 -5.677 17.442 1.00 . A A . 7 PRO O 1 1 1 108 1 1 8 CYS C C -3.183 -2.932 16.359 1.00 . A A . 8 CYS C 1 1 1 109 1 1 8 CYS CA C -4.310 -3.638 15.595 1.00 . A A . 8 CYS CA 1 1 1 110 1 1 8 CYS CB C -4.740 -2.971 14.288 1.00 . A A . 8 CYS CB 1 1 1 111 1 1 8 CYS H H -6.083 -2.954 16.498 1.00 . A A . 8 CYS H 1 1 1 112 1 1 8 CYS HA H -3.996 -4.652 15.371 1.00 . A A . 8 CYS HA 1 1 1 113 1 1 8 CYS HB2 H -5.818 -3.103 14.186 1.00 . A A . 8 CYS HB2 1 1 1 114 1 1 8 CYS HB3 H -4.540 -1.900 14.270 1.00 . A A . 8 CYS HB3 1 1 1 115 1 1 8 CYS N N -5.461 -3.730 16.463 1.00 . A A . 8 CYS N 1 1 1 116 1 1 8 CYS O O -2.499 -3.543 17.171 1.00 . A A . 8 CYS O 1 1 1 117 1 1 8 CYS SG S -3.967 -3.724 12.845 1.00 . A A . 8 CYS SG 1 1 1 118 1 1 9 PHE C C -0.763 -1.655 17.024 1.00 . A A . 9 PHE C 1 1 1 119 1 1 9 PHE CA C -1.958 -0.820 16.598 1.00 . A A . 9 PHE CA 1 1 1 120 1 1 9 PHE CB C -2.513 -0.048 17.761 1.00 . A A . 9 PHE CB 1 1 1 121 1 1 9 PHE CD1 C -0.493 1.502 17.536 1.00 . A A . 9 PHE CD1 1 1 1 122 1 1 9 PHE CD2 C -1.624 1.281 19.741 1.00 . A A . 9 PHE CD2 1 1 1 123 1 1 9 PHE CE1 C 0.438 2.441 18.105 1.00 . A A . 9 PHE CE1 1 1 1 124 1 1 9 PHE CE2 C -0.696 2.220 20.313 1.00 . A A . 9 PHE CE2 1 1 1 125 1 1 9 PHE CG C -1.530 0.922 18.349 1.00 . A A . 9 PHE CG 1 1 1 126 1 1 9 PHE CZ C 0.334 2.802 19.494 1.00 . A A . 9 PHE CZ 1 1 1 127 1 1 9 PHE H H -3.831 -1.132 15.686 1.00 . A A . 9 PHE H 1 1 1 128 1 1 9 PHE HA H -1.661 -0.152 15.797 1.00 . A A . 9 PHE HA 1 1 1 129 1 1 9 PHE HB2 H -3.374 0.464 17.346 1.00 . A A . 9 PHE HB2 1 1 1 130 1 1 9 PHE HB3 H -2.845 -0.752 18.522 1.00 . A A . 9 PHE HB3 1 1 1 131 1 1 9 PHE HD1 H -0.406 1.229 16.495 1.00 . A A . 9 PHE HD1 1 1 1 132 1 1 9 PHE HD2 H -2.390 0.838 20.359 1.00 . A A . 9 PHE HD2 1 1 1 133 1 1 9 PHE HE1 H 1.215 2.874 17.492 1.00 . A A . 9 PHE HE1 1 1 1 134 1 1 9 PHE HE2 H -0.772 2.488 21.357 1.00 . A A . 9 PHE HE2 1 1 1 135 1 1 9 PHE HZ H 1.026 3.512 19.922 1.00 . A A . 9 PHE HZ 1 1 1 136 1 1 9 PHE N N -3.051 -1.621 16.071 1.00 . A A . 9 PHE N 1 1 1 137 1 1 9 PHE O O -0.182 -1.508 18.091 1.00 . A A . 9 PHE O 1 1 1 138 1 1 10 ARG C C 0.823 -4.502 15.149 1.00 . A A . 10 ARG C 1 1 1 139 1 1 10 ARG CA C 0.635 -3.461 16.266 1.00 . A A . 10 ARG CA 1 1 1 140 1 1 10 ARG CB C 0.498 -4.118 17.613 1.00 . A A . 10 ARG CB 1 1 1 141 1 1 10 ARG CD C 3.032 -4.100 17.819 1.00 . A A . 10 ARG CD 1 1 1 142 1 1 10 ARG CG C 1.690 -3.698 18.432 1.00 . A A . 10 ARG CG 1 1 1 143 1 1 10 ARG CZ C 4.048 -5.923 16.650 1.00 . A A . 10 ARG CZ 1 1 1 144 1 1 10 ARG H H -1.218 -2.583 15.420 1.00 . A A . 10 ARG H 1 1 1 145 1 1 10 ARG HA H 1.484 -2.802 16.330 1.00 . A A . 10 ARG HA 1 1 1 146 1 1 10 ARG HB2 H -0.404 -3.749 18.112 1.00 . A A . 10 ARG HB2 1 1 1 147 1 1 10 ARG HB3 H 0.396 -5.199 17.522 1.00 . A A . 10 ARG HB3 1 1 1 148 1 1 10 ARG HD2 H 3.293 -3.463 16.973 1.00 . A A . 10 ARG HD2 1 1 1 149 1 1 10 ARG HD3 H 3.839 -4.060 18.550 1.00 . A A . 10 ARG HD3 1 1 1 150 1 1 10 ARG HE H 2.174 -6.035 17.472 1.00 . A A . 10 ARG HE 1 1 1 151 1 1 10 ARG HG2 H 1.630 -2.624 18.556 1.00 . A A . 10 ARG HG2 1 1 1 152 1 1 10 ARG HG3 H 1.551 -4.109 19.394 1.00 . A A . 10 ARG HG3 1 1 1 153 1 1 10 ARG HH11 H 5.205 -4.528 15.746 1.00 . A A . 10 ARG HH11 1 1 1 154 1 1 10 ARG HH12 H 4.197 -5.457 14.686 1.00 . A A . 10 ARG HH12 1 1 1 155 1 1 10 ARG HH21 H 4.097 -7.779 17.459 1.00 . A A . 10 ARG HH21 1 1 1 156 1 1 10 ARG HH22 H 5.616 -7.182 16.881 1.00 . A A . 10 ARG HH22 1 1 1 157 1 1 10 ARG N N -0.469 -2.539 16.075 1.00 . A A . 10 ARG N 1 1 1 158 1 1 10 ARG NE N 2.978 -5.460 17.322 1.00 . A A . 10 ARG NE 1 1 1 159 1 1 10 ARG NH1 N 4.523 -5.246 15.608 1.00 . A A . 10 ARG NH1 1 1 1 160 1 1 10 ARG NH2 N 4.635 -7.055 17.028 1.00 . A A . 10 ARG NH2 1 1 1 161 1 1 10 ARG O O 1.830 -5.195 15.077 1.00 . A A . 10 ARG O 1 1 1 162 1 1 11 ALA C C 0.159 -6.905 13.739 1.00 . A A . 11 ALA C 1 1 1 163 1 1 11 ALA CA C -0.873 -5.835 14.105 1.00 . A A . 11 ALA CA 1 1 1 164 1 1 11 ALA CB C -1.929 -5.722 13.013 1.00 . A A . 11 ALA CB 1 1 1 165 1 1 11 ALA H H -0.593 -3.652 14.122 1.00 . A A . 11 ALA H 1 1 1 166 1 1 11 ALA HA H -1.364 -6.082 15.047 1.00 . A A . 11 ALA HA 1 1 1 167 1 1 11 ALA HB1 H -1.837 -4.771 12.489 1.00 . A A . 11 ALA HB1 1 1 1 168 1 1 11 ALA HB2 H -1.835 -6.524 12.283 1.00 . A A . 11 ALA HB2 1 1 1 169 1 1 11 ALA HB3 H -2.923 -5.797 13.454 1.00 . A A . 11 ALA HB3 1 1 1 170 1 1 11 ALA N N -0.208 -4.557 14.298 1.00 . A A . 11 ALA N 1 1 1 171 1 1 11 ALA O O 0.603 -7.686 14.571 1.00 . A A . 11 ALA O 1 1 1 172 1 1 12 ASN C C 1.726 -5.870 10.588 1.00 . A A . 12 ASN C 1 1 1 173 1 1 12 ASN CA C 1.766 -6.284 12.062 1.00 . A A . 12 ASN CA 1 1 1 174 1 1 12 ASN CB C 2.899 -7.285 12.299 1.00 . A A . 12 ASN CB 1 1 1 175 1 1 12 ASN CG C 4.180 -6.547 12.695 1.00 . A A . 12 ASN CG 1 1 1 176 1 1 12 ASN H H -0.111 -7.266 11.745 1.00 . A A . 12 ASN H 1 1 1 177 1 1 12 ASN HA H 1.888 -5.397 12.683 1.00 . A A . 12 ASN HA 1 1 1 178 1 1 12 ASN HB2 H 2.634 -7.982 13.093 1.00 . A A . 12 ASN HB2 1 1 1 179 1 1 12 ASN HB3 H 3.092 -7.867 11.398 1.00 . A A . 12 ASN HB3 1 1 1 180 1 1 12 ASN HD21 H 3.749 -4.830 11.689 1.00 . A A . 12 ASN HD21 1 1 1 181 1 1 12 ASN HD22 H 5.384 -5.431 11.491 1.00 . A A . 12 ASN HD22 1 1 1 182 1 1 12 ASN N N 0.500 -6.883 12.437 1.00 . A A . 12 ASN N 1 1 1 183 1 1 12 ASN ND2 N 4.463 -5.510 11.885 1.00 . A A . 12 ASN ND2 1 1 1 184 1 1 12 ASN O O 2.577 -6.247 9.791 1.00 . A A . 12 ASN O 1 1 1 185 1 1 12 ASN OD1 O 4.854 -6.893 13.657 1.00 . A A . 12 ASN OD1 1 1 1 186 1 1 13 CYS C C 2.266 -3.563 9.131 1.00 . A A . 13 CYS C 1 1 1 187 1 1 13 CYS CA C 0.807 -3.994 9.310 1.00 . A A . 13 CYS CA 1 1 1 188 1 1 13 CYS CB C -0.102 -2.826 9.703 1.00 . A A . 13 CYS CB 1 1 1 189 1 1 13 CYS H H -0.227 -5.268 10.630 1.00 . A A . 13 CYS H 1 1 1 190 1 1 13 CYS HA H 0.453 -4.416 8.367 1.00 . A A . 13 CYS HA 1 1 1 191 1 1 13 CYS HB2 H 0.257 -2.295 10.587 1.00 . A A . 13 CYS HB2 1 1 1 192 1 1 13 CYS HB3 H -0.140 -2.115 8.877 1.00 . A A . 13 CYS HB3 1 1 1 193 1 1 13 CYS N N 0.684 -5.069 10.281 1.00 . A A . 13 CYS N 1 1 1 194 1 1 13 CYS O O 2.903 -2.982 10.002 1.00 . A A . 13 CYS O 1 1 1 195 1 1 13 CYS SG S -1.774 -3.424 10.036 1.00 . A A . 13 CYS SG 1 1 1 196 1 1 14 GLU C C 3.973 -1.851 7.567 1.00 . A A . 14 GLU C 1 1 1 197 1 1 14 GLU CA C 3.968 -3.379 7.418 1.00 . A A . 14 GLU CA 1 1 1 198 1 1 14 GLU CB C 4.170 -3.807 5.967 1.00 . A A . 14 GLU CB 1 1 1 199 1 1 14 GLU CD C 5.885 -2.462 4.737 1.00 . A A . 14 GLU CD 1 1 1 200 1 1 14 GLU CG C 5.637 -3.739 5.542 1.00 . A A . 14 GLU CG 1 1 1 201 1 1 14 GLU H H 2.204 -4.648 7.462 1.00 . A A . 14 GLU H 1 1 1 202 1 1 14 GLU HA H 4.765 -3.793 8.029 1.00 . A A . 14 GLU HA 1 1 1 203 1 1 14 GLU HB2 H 3.802 -4.825 5.835 1.00 . A A . 14 GLU HB2 1 1 1 204 1 1 14 GLU HB3 H 3.569 -3.177 5.320 1.00 . A A . 14 GLU HB3 1 1 1 205 1 1 14 GLU HG2 H 6.291 -3.743 6.414 1.00 . A A . 14 GLU HG2 1 1 1 206 1 1 14 GLU HG3 H 5.899 -4.600 4.927 1.00 . A A . 14 GLU HG3 1 1 1 207 1 1 14 GLU N N 2.730 -3.938 7.931 1.00 . A A . 14 GLU N 1 1 1 208 1 1 14 GLU O O 4.613 -1.302 8.455 1.00 . A A . 14 GLU O 1 1 1 209 1 1 14 GLU OE1 O 6.208 -1.441 5.342 1.00 . A A . 14 GLU OE1 1 1 1 210 1 1 14 GLU OE2 O 5.753 -2.504 3.515 1.00 . A A . 14 GLU OE2 1 1 1 211 1 1 15 TYR C C 1.569 -0.393 8.243 1.00 . A A . 15 TYR C 1 1 1 212 1 1 15 TYR CA C 2.504 -0.020 7.091 1.00 . A A . 15 TYR CA 1 1 1 213 1 1 15 TYR CB C 1.798 0.652 5.905 1.00 . A A . 15 TYR CB 1 1 1 214 1 1 15 TYR CD1 C 2.619 3.059 6.007 1.00 . A A . 15 TYR CD1 1 1 1 215 1 1 15 TYR CD2 C 0.261 2.571 6.634 1.00 . A A . 15 TYR CD2 1 1 1 216 1 1 15 TYR CE1 C 2.402 4.457 6.274 1.00 . A A . 15 TYR CE1 1 1 1 217 1 1 15 TYR CE2 C 0.041 3.968 6.902 1.00 . A A . 15 TYR CE2 1 1 1 218 1 1 15 TYR CG C 1.551 2.109 6.186 1.00 . A A . 15 TYR CG 1 1 1 219 1 1 15 TYR CZ C 1.113 4.909 6.725 1.00 . A A . 15 TYR CZ 1 1 1 220 1 1 15 TYR H H 3.204 -1.478 5.693 1.00 . A A . 15 TYR H 1 1 1 221 1 1 15 TYR HA H 3.238 0.669 7.493 1.00 . A A . 15 TYR HA 1 1 1 222 1 1 15 TYR HB2 H 2.444 0.592 5.038 1.00 . A A . 15 TYR HB2 1 1 1 223 1 1 15 TYR HB3 H 0.860 0.145 5.653 1.00 . A A . 15 TYR HB3 1 1 1 224 1 1 15 TYR HD1 H 3.588 2.720 5.673 1.00 . A A . 15 TYR HD1 1 1 1 225 1 1 15 TYR HD2 H -0.546 1.867 6.769 1.00 . A A . 15 TYR HD2 1 1 1 226 1 1 15 TYR HE1 H 3.206 5.165 6.132 1.00 . A A . 15 TYR HE1 1 1 1 227 1 1 15 TYR HE2 H -0.930 4.309 7.231 1.00 . A A . 15 TYR HE2 1 1 1 228 1 1 15 TYR HH H 0.213 6.340 7.631 1.00 . A A . 15 TYR HH 1 1 1 229 1 1 15 TYR N N 3.227 -1.200 6.652 1.00 . A A . 15 TYR N 1 1 1 230 1 1 15 TYR O O 1.959 -1.021 9.217 1.00 . A A . 15 TYR O 1 1 1 231 1 1 15 TYR OH O 0.907 6.248 6.992 1.00 . A A . 15 TYR OH 1 1 1 232 1 1 16 GLN C C -1.865 -0.463 9.063 1.00 . A A . 16 GLN C 1 1 1 233 1 1 16 GLN CA C -0.502 0.200 9.253 1.00 . A A . 16 GLN CA 1 1 1 234 1 1 16 GLN CB C -0.672 1.679 9.587 1.00 . A A . 16 GLN CB 1 1 1 235 1 1 16 GLN CD C -0.218 3.267 11.469 1.00 . A A . 16 GLN CD 1 1 1 236 1 1 16 GLN CG C -0.754 1.883 11.101 1.00 . A A . 16 GLN CG 1 1 1 237 1 1 16 GLN H H 0.161 0.500 7.191 1.00 . A A . 16 GLN H 1 1 1 238 1 1 16 GLN HA H 0.017 -0.307 10.064 1.00 . A A . 16 GLN HA 1 1 1 239 1 1 16 GLN HB2 H 0.184 2.218 9.223 1.00 . A A . 16 GLN HB2 1 1 1 240 1 1 16 GLN HB3 H -1.567 2.048 9.065 1.00 . A A . 16 GLN HB3 1 1 1 241 1 1 16 GLN HE21 H -1.959 4.129 10.859 1.00 . A A . 16 GLN HE21 1 1 1 242 1 1 16 GLN HE22 H -0.530 5.139 10.738 1.00 . A A . 16 GLN HE22 1 1 1 243 1 1 16 GLN HG2 H -1.776 1.793 11.468 1.00 . A A . 16 GLN HG2 1 1 1 244 1 1 16 GLN HG3 H -0.156 1.121 11.606 1.00 . A A . 16 GLN HG3 1 1 1 245 1 1 16 GLN N N 0.323 0.060 8.074 1.00 . A A . 16 GLN N 1 1 1 246 1 1 16 GLN NE2 N -0.970 4.268 10.978 1.00 . A A . 16 GLN NE2 1 1 1 247 1 1 16 GLN O O -2.065 -1.362 8.257 1.00 . A A . 16 GLN O 1 1 1 248 1 1 16 GLN OE1 O 0.795 3.411 12.143 1.00 . A A . 16 GLN OE1 1 1 1 249 1 1 17 CYS C C -5.144 0.484 9.762 1.00 . A A . 17 CYS C 1 1 1 250 1 1 17 CYS CA C -4.060 -0.554 10.046 1.00 . A A . 17 CYS CA 1 1 1 251 1 1 17 CYS CB C -4.231 -1.140 11.444 1.00 . A A . 17 CYS CB 1 1 1 252 1 1 17 CYS H H -2.236 0.588 10.588 1.00 . A A . 17 CYS H 1 1 1 253 1 1 17 CYS HA H -4.085 -1.385 9.340 1.00 . A A . 17 CYS HA 1 1 1 254 1 1 17 CYS HB2 H -3.273 -1.203 11.962 1.00 . A A . 17 CYS HB2 1 1 1 255 1 1 17 CYS HB3 H -4.891 -0.529 12.059 1.00 . A A . 17 CYS HB3 1 1 1 256 1 1 17 CYS N N -2.756 0.056 9.917 1.00 . A A . 17 CYS N 1 1 1 257 1 1 17 CYS O O -4.873 1.658 9.537 1.00 . A A . 17 CYS O 1 1 1 258 1 1 17 CYS SG S -4.922 -2.799 11.317 1.00 . A A . 17 CYS SG 1 1 1 259 1 1 18 GLN C C -7.838 1.509 11.043 1.00 . A A . 18 GLN C 1 1 1 260 1 1 18 GLN CA C -7.515 0.854 9.688 1.00 . A A . 18 GLN CA 1 1 1 261 1 1 18 GLN CB C -8.697 0.017 9.204 1.00 . A A . 18 GLN CB 1 1 1 262 1 1 18 GLN CD C -9.095 1.804 7.470 1.00 . A A . 18 GLN CD 1 1 1 263 1 1 18 GLN CG C -9.117 0.301 7.760 1.00 . A A . 18 GLN CG 1 1 1 264 1 1 18 GLN H H -6.596 -0.997 9.664 1.00 . A A . 18 GLN H 1 1 1 265 1 1 18 GLN HA H -7.238 1.624 8.970 1.00 . A A . 18 GLN HA 1 1 1 266 1 1 18 GLN HB2 H -8.484 -1.050 9.321 1.00 . A A . 18 GLN HB2 1 1 1 267 1 1 18 GLN HB3 H -9.521 0.234 9.865 1.00 . A A . 18 GLN HB3 1 1 1 268 1 1 18 GLN HE21 H -7.664 1.641 6.029 1.00 . A A . 18 GLN HE21 1 1 1 269 1 1 18 GLN HE22 H -7.520 3.033 7.084 1.00 . A A . 18 GLN HE22 1 1 1 270 1 1 18 GLN HG2 H -8.461 -0.206 7.054 1.00 . A A . 18 GLN HG2 1 1 1 271 1 1 18 GLN HG3 H -10.126 -0.078 7.591 1.00 . A A . 18 GLN HG3 1 1 1 272 1 1 18 GLN N N -6.384 -0.030 9.790 1.00 . A A . 18 GLN N 1 1 1 273 1 1 18 GLN NE2 N -7.996 2.194 6.800 1.00 . A A . 18 GLN NE2 1 1 1 274 1 1 18 GLN O O -8.309 2.639 11.104 1.00 . A A . 18 GLN O 1 1 1 275 1 1 18 GLN OE1 O -10.004 2.544 7.825 1.00 . A A . 18 GLN OE1 1 1 1 276 1 1 19 PRO C C -9.474 -0.873 11.970 1.00 . A A . 19 PRO C 1 1 1 277 1 1 19 PRO CA C -8.009 -0.629 12.286 1.00 . A A . 19 PRO CA 1 1 1 278 1 1 19 PRO CB C -7.803 -0.950 13.757 1.00 . A A . 19 PRO CB 1 1 1 279 1 1 19 PRO CD C -6.833 1.260 13.278 1.00 . A A . 19 PRO CD 1 1 1 280 1 1 19 PRO CG C -6.879 0.137 14.321 1.00 . A A . 19 PRO CG 1 1 1 281 1 1 19 PRO HA H -7.396 -1.280 11.662 1.00 . A A . 19 PRO HA 1 1 1 282 1 1 19 PRO HB2 H -8.770 -0.937 14.262 1.00 . A A . 19 PRO HB2 1 1 1 283 1 1 19 PRO HB3 H -7.394 -1.950 13.866 1.00 . A A . 19 PRO HB3 1 1 1 284 1 1 19 PRO HD2 H -7.312 2.167 13.649 1.00 . A A . 19 PRO HD2 1 1 1 285 1 1 19 PRO HD3 H -5.809 1.499 12.993 1.00 . A A . 19 PRO HD3 1 1 1 286 1 1 19 PRO HG2 H -7.259 0.504 15.274 1.00 . A A . 19 PRO HG2 1 1 1 287 1 1 19 PRO HG3 H -5.882 -0.270 14.490 1.00 . A A . 19 PRO HG3 1 1 1 288 1 1 19 PRO N N -7.564 0.747 12.131 1.00 . A A . 19 PRO N 1 1 1 289 1 1 19 PRO O O -10.362 -0.121 12.348 1.00 . A A . 19 PRO O 1 1 1 290 1 1 20 LEU C C -11.419 -2.899 9.966 1.00 . A A . 20 LEU C 1 1 1 291 1 1 20 LEU CA C -10.737 -2.896 11.334 1.00 . A A . 20 LEU CA 1 1 1 292 1 1 20 LEU CB C -11.719 -2.516 12.455 1.00 . A A . 20 LEU CB 1 1 1 293 1 1 20 LEU CD1 C -12.896 -4.577 13.301 1.00 . A A . 20 LEU CD1 1 1 1 294 1 1 20 LEU CD2 C -14.200 -2.475 12.851 1.00 . A A . 20 LEU CD2 1 1 1 295 1 1 20 LEU CG C -13.009 -3.331 12.419 1.00 . A A . 20 LEU CG 1 1 1 296 1 1 20 LEU H H -8.921 -2.169 10.532 1.00 . A A . 20 LEU H 1 1 1 297 1 1 20 LEU HA H -10.296 -3.852 11.566 1.00 . A A . 20 LEU HA 1 1 1 298 1 1 20 LEU HB2 H -11.242 -2.658 13.423 1.00 . A A . 20 LEU HB2 1 1 1 299 1 1 20 LEU HB3 H -12.009 -1.474 12.369 1.00 . A A . 20 LEU HB3 1 1 1 300 1 1 20 LEU HD11 H -11.975 -5.121 13.098 1.00 . A A . 20 LEU HD11 1 1 1 301 1 1 20 LEU HD12 H -12.896 -4.304 14.356 1.00 . A A . 20 LEU HD12 1 1 1 302 1 1 20 LEU HD13 H -13.735 -5.252 13.132 1.00 . A A . 20 LEU HD13 1 1 1 303 1 1 20 LEU HD21 H -14.476 -2.686 13.884 1.00 . A A . 20 LEU HD21 1 1 1 304 1 1 20 LEU HD22 H -13.963 -1.414 12.774 1.00 . A A . 20 LEU HD22 1 1 1 305 1 1 20 LEU HD23 H -15.069 -2.673 12.223 1.00 . A A . 20 LEU HD23 1 1 1 306 1 1 20 LEU HG H -13.183 -3.633 11.389 1.00 . A A . 20 LEU HG 1 1 1 307 1 1 20 LEU N N -9.617 -1.981 11.224 1.00 . A A . 20 LEU N 1 1 1 308 1 1 20 LEU O O -11.232 -3.737 9.095 1.00 . A A . 20 LEU O 1 1 1 309 1 1 21 ASN C C -13.880 -2.595 8.347 1.00 . A A . 21 ASN C 1 1 1 310 1 1 21 ASN CA C -13.552 -1.732 9.560 1.00 . A A . 21 ASN CA 1 1 1 311 1 1 21 ASN CB C -13.952 -0.282 9.279 1.00 . A A . 21 ASN CB 1 1 1 312 1 1 21 ASN CG C -15.010 0.186 10.280 1.00 . A A . 21 ASN CG 1 1 1 313 1 1 21 ASN H H -11.640 -1.144 10.448 1.00 . A A . 21 ASN H 1 1 1 314 1 1 21 ASN HA H -14.076 -2.129 10.428 1.00 . A A . 21 ASN HA 1 1 1 315 1 1 21 ASN HB2 H -13.084 0.376 9.361 1.00 . A A . 21 ASN HB2 1 1 1 316 1 1 21 ASN HB3 H -14.366 -0.193 8.271 1.00 . A A . 21 ASN HB3 1 1 1 317 1 1 21 ASN HD21 H -15.839 1.526 8.982 1.00 . A A . 21 ASN HD21 1 1 1 318 1 1 21 ASN N N -12.136 -1.784 9.878 1.00 . A A . 21 ASN N 1 1 1 319 1 1 21 ASN ND2 N -15.568 1.359 9.930 1.00 . A A . 21 ASN ND2 1 1 1 320 1 1 21 ASN O O -13.492 -2.305 7.222 1.00 . A A . 21 ASN O 1 1 1 321 1 1 21 ASN OD1 O -15.293 -0.463 11.280 1.00 . A A . 21 ASN OD1 1 1 1 322 1 1 22 GLN C C -13.982 -4.719 6.532 1.00 . A A . 22 GLN C 1 1 1 323 1 1 22 GLN CA C -15.038 -4.616 7.639 1.00 . A A . 22 GLN CA 1 1 1 324 1 1 22 GLN CB C -16.388 -4.199 7.052 1.00 . A A . 22 GLN CB 1 1 1 325 1 1 22 GLN CD C -17.407 -2.736 5.291 1.00 . A A . 22 GLN CD 1 1 1 326 1 1 22 GLN CG C -16.320 -2.836 6.364 1.00 . A A . 22 GLN CG 1 1 1 327 1 1 22 GLN H H -14.908 -3.815 9.615 1.00 . A A . 22 GLN H 1 1 1 328 1 1 22 GLN HA H -15.121 -5.583 8.136 1.00 . A A . 22 GLN HA 1 1 1 329 1 1 22 GLN HB2 H -16.723 -4.952 6.339 1.00 . A A . 22 GLN HB2 1 1 1 330 1 1 22 GLN HB3 H -17.136 -4.169 7.845 1.00 . A A . 22 GLN HB3 1 1 1 331 1 1 22 GLN HE21 H -16.493 -4.188 4.196 1.00 . A A . 22 GLN HE21 1 1 1 332 1 1 22 GLN HE22 H -18.226 -4.047 3.969 1.00 . A A . 22 GLN HE22 1 1 1 333 1 1 22 GLN HG2 H -16.464 -2.034 7.088 1.00 . A A . 22 GLN HG2 1 1 1 334 1 1 22 GLN HG3 H -15.346 -2.690 5.896 1.00 . A A . 22 GLN HG3 1 1 1 335 1 1 22 GLN N N -14.630 -3.669 8.666 1.00 . A A . 22 GLN N 1 1 1 336 1 1 22 GLN NE2 N -17.372 -3.749 4.406 1.00 . A A . 22 GLN NE2 1 1 1 337 1 1 22 GLN O O -14.291 -4.794 5.349 1.00 . A A . 22 GLN O 1 1 1 338 1 1 22 GLN OE1 O -18.212 -1.813 5.271 1.00 . A A . 22 GLN OE1 1 1 1 339 1 1 23 THR C C -12.387 -6.728 8.426 1.00 . A A . 23 THR C 1 1 1 340 1 1 23 THR CA C -12.048 -5.998 7.127 1.00 . A A . 23 THR CA 1 1 1 341 1 1 23 THR CB C -10.537 -5.830 6.963 1.00 . A A . 23 THR CB 1 1 1 342 1 1 23 THR CG2 C -9.945 -6.879 6.021 1.00 . A A . 23 THR CG2 1 1 1 343 1 1 23 THR H H -12.277 -3.860 7.269 1.00 . A A . 23 THR H 1 1 1 344 1 1 23 THR HA H -12.483 -6.582 6.346 1.00 . A A . 23 THR HA 1 1 1 345 1 1 23 THR HB H -10.057 -5.908 7.939 1.00 . A A . 23 THR HB 1 1 1 346 1 1 23 THR HG1 H -9.943 -4.032 7.201 1.00 . A A . 23 THR HG1 1 1 1 347 1 1 23 THR HG21 H -9.761 -7.814 6.549 1.00 . A A . 23 THR HG21 1 1 1 348 1 1 23 THR HG22 H -10.624 -7.086 5.194 1.00 . A A . 23 THR HG22 1 1 1 349 1 1 23 THR HG23 H -8.999 -6.536 5.603 1.00 . A A . 23 THR HG23 1 1 1 350 1 1 23 THR N N -12.722 -4.716 7.004 1.00 . A A . 23 THR N 1 1 1 351 1 1 23 THR O O -12.538 -7.943 8.485 1.00 . A A . 23 THR O 1 1 1 352 1 1 23 THR OG1 O -10.253 -4.546 6.467 1.00 . A A . 23 THR OG1 1 1 1 353 1 1 24 SER C C -10.383 -6.631 10.380 1.00 . A A . 24 SER C 1 1 1 354 1 1 24 SER CA C -11.790 -6.116 10.666 1.00 . A A . 24 SER CA 1 1 1 355 1 1 24 SER CB C -12.627 -6.996 11.571 1.00 . A A . 24 SER CB 1 1 1 356 1 1 24 SER H H -12.654 -4.935 9.181 1.00 . A A . 24 SER H 1 1 1 357 1 1 24 SER HA H -11.714 -5.135 11.124 1.00 . A A . 24 SER HA 1 1 1 358 1 1 24 SER HB2 H -12.211 -7.029 12.577 1.00 . A A . 24 SER HB2 1 1 1 359 1 1 24 SER HB3 H -13.615 -6.541 11.620 1.00 . A A . 24 SER HB3 1 1 1 360 1 1 24 SER HG H -13.350 -8.760 11.648 1.00 . A A . 24 SER HG 1 1 1 361 1 1 24 SER N N -12.489 -5.876 9.442 1.00 . A A . 24 SER N 1 1 1 362 1 1 24 SER O O -10.123 -7.468 9.524 1.00 . A A . 24 SER O 1 1 1 363 1 1 24 SER OG O -12.746 -8.306 11.076 1.00 . A A . 24 SER OG 1 1 1 364 1 1 25 TYR C C -7.494 -5.814 9.840 1.00 . A A . 25 TYR C 1 1 1 365 1 1 25 TYR CA C -8.520 -5.093 10.708 1.00 . A A . 25 TYR CA 1 1 1 366 1 1 25 TYR CB C -7.825 -4.480 11.931 1.00 . A A . 25 TYR CB 1 1 1 367 1 1 25 TYR CD1 C -5.782 -5.976 12.291 1.00 . A A . 25 TYR CD1 1 1 1 368 1 1 25 TYR CD2 C -7.676 -6.103 13.898 1.00 . A A . 25 TYR CD2 1 1 1 369 1 1 25 TYR CE1 C -5.095 -7.010 13.017 1.00 . A A . 25 TYR CE1 1 1 1 370 1 1 25 TYR CE2 C -6.991 -7.135 14.629 1.00 . A A . 25 TYR CE2 1 1 1 371 1 1 25 TYR CG C -7.084 -5.525 12.719 1.00 . A A . 25 TYR CG 1 1 1 372 1 1 25 TYR CZ C -5.701 -7.592 14.185 1.00 . A A . 25 TYR CZ 1 1 1 373 1 1 25 TYR H H -9.891 -5.913 12.118 1.00 . A A . 25 TYR H 1 1 1 374 1 1 25 TYR HA H -9.037 -4.328 10.102 1.00 . A A . 25 TYR HA 1 1 1 375 1 1 25 TYR HB2 H -7.133 -3.687 11.643 1.00 . A A . 25 TYR HB2 1 1 1 376 1 1 25 TYR HB3 H -8.580 -4.030 12.577 1.00 . A A . 25 TYR HB3 1 1 1 377 1 1 25 TYR HD1 H -5.306 -5.531 11.429 1.00 . A A . 25 TYR HD1 1 1 1 378 1 1 25 TYR HD2 H -8.634 -5.750 14.249 1.00 . A A . 25 TYR HD2 1 1 1 379 1 1 25 TYR HE1 H -4.124 -7.350 12.687 1.00 . A A . 25 TYR HE1 1 1 1 380 1 1 25 TYR HE2 H -7.443 -7.564 15.511 1.00 . A A . 25 TYR HE2 1 1 1 381 1 1 25 TYR HH H -5.657 -9.284 15.085 1.00 . A A . 25 TYR HH 1 1 1 382 1 1 25 TYR N N -9.521 -6.027 11.201 1.00 . A A . 25 TYR N 1 1 1 383 1 1 25 TYR O O -7.353 -7.030 9.852 1.00 . A A . 25 TYR O 1 1 1 384 1 1 25 TYR OH O -5.047 -8.588 14.879 1.00 . A A . 25 TYR OH 1 1 1 385 1 1 26 LEU C C -4.866 -5.456 7.716 1.00 . A A . 26 LEU C 1 1 1 386 1 1 26 LEU CA C -6.397 -5.388 7.777 1.00 . A A . 26 LEU CA 1 1 1 387 1 1 26 LEU CB C -7.128 -4.476 6.788 1.00 . A A . 26 LEU CB 1 1 1 388 1 1 26 LEU CD1 C -7.375 -2.246 5.653 1.00 . A A . 26 LEU CD1 1 1 1 389 1 1 26 LEU CD2 C -6.981 -2.378 8.119 1.00 . A A . 26 LEU CD2 1 1 1 390 1 1 26 LEU CG C -6.691 -3.017 6.782 1.00 . A A . 26 LEU CG 1 1 1 391 1 1 26 LEU H H -6.900 -3.966 9.245 1.00 . A A . 26 LEU H 1 1 1 392 1 1 26 LEU HA H -6.787 -6.389 7.625 1.00 . A A . 26 LEU HA 1 1 1 393 1 1 26 LEU HB2 H -7.105 -4.894 5.781 1.00 . A A . 26 LEU HB2 1 1 1 394 1 1 26 LEU HB3 H -8.168 -4.454 7.137 1.00 . A A . 26 LEU HB3 1 1 1 395 1 1 26 LEU HD11 H -8.459 -2.288 5.756 1.00 . A A . 26 LEU HD11 1 1 1 396 1 1 26 LEU HD12 H -7.077 -1.198 5.663 1.00 . A A . 26 LEU HD12 1 1 1 397 1 1 26 LEU HD13 H -7.111 -2.662 4.681 1.00 . A A . 26 LEU HD13 1 1 1 398 1 1 26 LEU HD21 H -6.163 -2.550 8.818 1.00 . A A . 26 LEU HD21 1 1 1 399 1 1 26 LEU HD22 H -7.084 -1.311 7.954 1.00 . A A . 26 LEU HD22 1 1 1 400 1 1 26 LEU HD23 H -7.899 -2.781 8.546 1.00 . A A . 26 LEU HD23 1 1 1 401 1 1 26 LEU HG H -5.628 -2.922 6.655 1.00 . A A . 26 LEU HG 1 1 1 402 1 1 26 LEU N N -6.797 -4.949 9.090 1.00 . A A . 26 LEU N 1 1 1 403 1 1 26 LEU O O -4.225 -6.038 8.582 1.00 . A A . 26 LEU O 1 1 1 404 1 1 27 CYS C C -3.437 -2.746 5.738 1.00 . A A . 27 CYS C 1 1 1 405 1 1 27 CYS CA C -3.440 -3.726 6.913 1.00 . A A . 27 CYS CA 1 1 1 406 1 1 27 CYS CB C -2.028 -4.219 7.170 1.00 . A A . 27 CYS CB 1 1 1 407 1 1 27 CYS H H -4.722 -5.047 5.762 1.00 . A A . 27 CYS H 1 1 1 408 1 1 27 CYS HA H -3.815 -3.228 7.804 1.00 . A A . 27 CYS HA 1 1 1 409 1 1 27 CYS HB2 H -1.769 -4.918 6.381 1.00 . A A . 27 CYS HB2 1 1 1 410 1 1 27 CYS HB3 H -1.336 -3.373 7.128 1.00 . A A . 27 CYS HB3 1 1 1 411 1 1 27 CYS N N -4.329 -4.847 6.654 1.00 . A A . 27 CYS N 1 1 1 412 1 1 27 CYS O O -3.432 -3.119 4.571 1.00 . A A . 27 CYS O 1 1 1 413 1 1 27 CYS SG S -1.865 -5.026 8.780 1.00 . A A . 27 CYS SG 1 1 1 414 1 1 28 VAL C C -1.848 -0.369 4.671 1.00 . A A . 28 VAL C 1 1 1 415 1 1 28 VAL CA C -3.292 -0.423 5.155 1.00 . A A . 28 VAL CA 1 1 1 416 1 1 28 VAL CB C -3.663 0.964 5.686 1.00 . A A . 28 VAL CB 1 1 1 417 1 1 28 VAL CG1 C -5.071 1.363 5.244 1.00 . A A . 28 VAL CG1 1 1 1 418 1 1 28 VAL CG2 C -3.506 1.093 7.202 1.00 . A A . 28 VAL CG2 1 1 1 419 1 1 28 VAL H H -3.463 -1.286 7.136 1.00 . A A . 28 VAL H 1 1 1 420 1 1 28 VAL HA H -3.938 -0.703 4.323 1.00 . A A . 28 VAL HA 1 1 1 421 1 1 28 VAL HB H -2.953 1.658 5.229 1.00 . A A . 28 VAL HB 1 1 1 422 1 1 28 VAL HG11 H -5.826 0.804 5.797 1.00 . A A . 28 VAL HG11 1 1 1 423 1 1 28 VAL HG12 H -5.246 2.425 5.416 1.00 . A A . 28 VAL HG12 1 1 1 424 1 1 28 VAL HG13 H -5.217 1.166 4.182 1.00 . A A . 28 VAL HG13 1 1 1 425 1 1 28 VAL HG21 H -3.896 0.225 7.731 1.00 . A A . 28 VAL HG21 1 1 1 426 1 1 28 VAL HG22 H -2.457 1.219 7.468 1.00 . A A . 28 VAL HG22 1 1 1 427 1 1 28 VAL HG23 H -4.044 1.968 7.567 1.00 . A A . 28 VAL HG23 1 1 1 428 1 1 28 VAL N N -3.442 -1.467 6.151 1.00 . A A . 28 VAL N 1 1 1 429 1 1 28 VAL O O -0.940 -0.964 5.236 1.00 . A A . 28 VAL O 1 1 1 430 1 1 29 CYS C C -1.163 2.667 2.957 1.00 . A A . 29 CYS C 1 1 1 431 1 1 29 CYS CA C -0.633 1.327 3.481 1.00 . A A . 29 CYS CA 1 1 1 432 1 1 29 CYS CB C 0.400 0.719 2.527 1.00 . A A . 29 CYS CB 1 1 1 433 1 1 29 CYS H H -2.013 -0.015 2.721 1.00 . A A . 29 CYS H 1 1 1 434 1 1 29 CYS HA H -0.160 1.369 4.459 1.00 . A A . 29 CYS HA 1 1 1 435 1 1 29 CYS HB2 H -0.131 0.342 1.659 1.00 . A A . 29 CYS HB2 1 1 1 436 1 1 29 CYS HB3 H 1.126 1.450 2.163 1.00 . A A . 29 CYS HB3 1 1 1 437 1 1 29 CYS N N -1.726 0.394 3.571 1.00 . A A . 29 CYS N 1 1 1 438 1 1 29 CYS O O -2.332 3.011 3.075 1.00 . A A . 29 CYS O 1 1 1 439 1 1 29 CYS SG S 1.288 -0.649 3.325 1.00 . A A . 29 CYS SG 1 1 1 440 1 1 30 ALA C C -1.356 4.537 0.547 1.00 . A A . 30 ALA C 1 1 1 441 1 1 30 ALA CA C -0.461 4.673 1.784 1.00 . A A . 30 ALA CA 1 1 1 442 1 1 30 ALA CB C 0.870 5.276 1.335 1.00 . A A . 30 ALA CB 1 1 1 443 1 1 30 ALA H H 0.686 3.083 2.756 1.00 . A A . 30 ALA H 1 1 1 444 1 1 30 ALA HA H -0.880 5.311 2.561 1.00 . A A . 30 ALA HA 1 1 1 445 1 1 30 ALA HB1 H 0.871 6.358 1.465 1.00 . A A . 30 ALA HB1 1 1 1 446 1 1 30 ALA HB2 H 1.698 4.865 1.913 1.00 . A A . 30 ALA HB2 1 1 1 447 1 1 30 ALA HB3 H 1.057 5.062 0.282 1.00 . A A . 30 ALA HB3 1 1 1 448 1 1 30 ALA N N -0.188 3.375 2.378 1.00 . A A . 30 ALA N 1 1 1 449 1 1 30 ALA O O -0.876 4.208 -0.530 1.00 . A A . 30 ALA O 1 1 1 450 1 1 31 GLU C C -3.947 3.388 -0.865 1.00 . A A . 31 GLU C 1 1 1 451 1 1 31 GLU CA C -3.680 3.814 0.590 1.00 . A A . 31 GLU CA 1 1 1 452 1 1 31 GLU CB C -4.979 4.362 1.170 1.00 . A A . 31 GLU CB 1 1 1 453 1 1 31 GLU CD C -7.310 3.651 1.749 1.00 . A A . 31 GLU CD 1 1 1 454 1 1 31 GLU CG C -5.830 3.263 1.806 1.00 . A A . 31 GLU CG 1 1 1 455 1 1 31 GLU H H -2.812 5.510 1.496 1.00 . A A . 31 GLU H 1 1 1 456 1 1 31 GLU HA H -3.354 2.966 1.177 1.00 . A A . 31 GLU HA 1 1 1 457 1 1 31 GLU HB2 H -4.738 5.126 1.907 1.00 . A A . 31 GLU HB2 1 1 1 458 1 1 31 GLU HB3 H -5.541 4.862 0.383 1.00 . A A . 31 GLU HB3 1 1 1 459 1 1 31 GLU HG2 H -5.692 2.319 1.279 1.00 . A A . 31 GLU HG2 1 1 1 460 1 1 31 GLU HG3 H -5.543 3.108 2.846 1.00 . A A . 31 GLU HG3 1 1 1 461 1 1 31 GLU N N -2.655 4.837 0.776 1.00 . A A . 31 GLU N 1 1 1 462 1 1 31 GLU O O -4.916 2.701 -1.163 1.00 . A A . 31 GLU O 1 1 1 463 1 1 31 GLU OE1 O -7.737 4.459 2.572 1.00 . A A . 31 GLU OE1 1 1 1 464 1 1 31 GLU OE2 O -8.017 3.141 0.882 1.00 . A A . 31 GLU OE2 1 1 1 465 1 1 32 GLY C C -1.394 2.352 -2.847 1.00 . A A . 32 GLY C 1 1 1 466 1 1 32 GLY CA C -2.759 3.058 -2.934 1.00 . A A . 32 GLY CA 1 1 1 467 1 1 32 GLY H H -2.438 4.535 -1.349 1.00 . A A . 32 GLY H 1 1 1 468 1 1 32 GLY HA2 H -3.557 2.320 -3.029 1.00 . A A . 32 GLY HA2 1 1 1 469 1 1 32 GLY HA3 H -2.780 3.747 -3.781 1.00 . A A . 32 GLY HA3 1 1 1 470 1 1 32 GLY N N -3.037 3.835 -1.734 1.00 . A A . 32 GLY N 1 1 1 471 1 1 32 GLY O O -0.676 2.208 -3.830 1.00 . A A . 32 GLY O 1 1 1 472 1 1 33 PHE C C -0.958 -0.265 -0.694 1.00 . A A . 33 PHE C 1 1 1 473 1 1 33 PHE CA C -0.157 0.875 -1.328 1.00 . A A . 33 PHE CA 1 1 1 474 1 1 33 PHE CB C 0.896 1.470 -0.390 1.00 . A A . 33 PHE CB 1 1 1 475 1 1 33 PHE CD1 C 1.898 3.137 -2.040 1.00 . A A . 33 PHE CD1 1 1 1 476 1 1 33 PHE CD2 C 3.368 1.422 -0.994 1.00 . A A . 33 PHE CD2 1 1 1 477 1 1 33 PHE CE1 C 3.030 3.679 -2.745 1.00 . A A . 33 PHE CE1 1 1 1 478 1 1 33 PHE CE2 C 4.501 1.959 -1.699 1.00 . A A . 33 PHE CE2 1 1 1 479 1 1 33 PHE CG C 2.065 2.013 -1.154 1.00 . A A . 33 PHE CG 1 1 1 480 1 1 33 PHE CZ C 4.331 3.088 -2.574 1.00 . A A . 33 PHE CZ 1 1 1 481 1 1 33 PHE H H -1.543 2.300 -0.796 1.00 . A A . 33 PHE H 1 1 1 482 1 1 33 PHE HA H 0.290 0.541 -2.261 1.00 . A A . 33 PHE HA 1 1 1 483 1 1 33 PHE HB2 H 0.447 2.289 0.180 1.00 . A A . 33 PHE HB2 1 1 1 484 1 1 33 PHE HB3 H 1.272 0.731 0.313 1.00 . A A . 33 PHE HB3 1 1 1 485 1 1 33 PHE HD1 H 0.919 3.566 -2.186 1.00 . A A . 33 PHE HD1 1 1 1 486 1 1 33 PHE HD2 H 3.493 0.566 -0.346 1.00 . A A . 33 PHE HD2 1 1 1 487 1 1 33 PHE HE1 H 2.904 4.529 -3.399 1.00 . A A . 33 PHE HE1 1 1 1 488 1 1 33 PHE HE2 H 5.478 1.518 -1.568 1.00 . A A . 33 PHE HE2 1 1 1 489 1 1 33 PHE HZ H 5.181 3.492 -3.103 1.00 . A A . 33 PHE HZ 1 1 1 490 1 1 33 PHE N N -1.098 1.928 -1.604 1.00 . A A . 33 PHE N 1 1 1 491 1 1 33 PHE O O -1.701 -0.073 0.261 1.00 . A A . 33 PHE O 1 1 1 492 1 1 34 ALA C C -1.525 -3.683 -1.960 1.00 . A A . 34 ALA C 1 1 1 493 1 1 34 ALA CA C -1.881 -2.399 -1.209 1.00 . A A . 34 ALA CA 1 1 1 494 1 1 34 ALA CB C -3.155 -1.765 -1.771 1.00 . A A . 34 ALA CB 1 1 1 495 1 1 34 ALA H H 0.056 -1.670 -1.792 1.00 . A A . 34 ALA H 1 1 1 496 1 1 34 ALA HA H -2.003 -2.633 -0.154 1.00 . A A . 34 ALA HA 1 1 1 497 1 1 34 ALA HB1 H -3.928 -1.702 -1.006 1.00 . A A . 34 ALA HB1 1 1 1 498 1 1 34 ALA HB2 H -2.959 -0.755 -2.133 1.00 . A A . 34 ALA HB2 1 1 1 499 1 1 34 ALA HB3 H -3.557 -2.359 -2.592 1.00 . A A . 34 ALA HB3 1 1 1 500 1 1 34 ALA N N -0.788 -1.450 -1.302 1.00 . A A . 34 ALA N 1 1 1 501 1 1 34 ALA O O -0.663 -3.706 -2.830 1.00 . A A . 34 ALA O 1 1 1 502 1 1 35 PRO C C -0.984 -6.486 -2.802 1.00 . A A . 35 PRO C 1 1 1 503 1 1 35 PRO CA C -1.673 -6.094 -1.496 1.00 . A A . 35 PRO CA 1 1 1 504 1 1 35 PRO CB C -2.854 -7.025 -1.210 1.00 . A A . 35 PRO CB 1 1 1 505 1 1 35 PRO CD C -3.651 -4.687 -1.208 1.00 . A A . 35 PRO CD 1 1 1 506 1 1 35 PRO CG C -4.080 -6.137 -0.957 1.00 . A A . 35 PRO CG 1 1 1 507 1 1 35 PRO HA H -0.947 -6.141 -0.685 1.00 . A A . 35 PRO HA 1 1 1 508 1 1 35 PRO HB2 H -3.027 -7.688 -2.058 1.00 . A A . 35 PRO HB2 1 1 1 509 1 1 35 PRO HB3 H -2.649 -7.649 -0.341 1.00 . A A . 35 PRO HB3 1 1 1 510 1 1 35 PRO HD2 H -4.216 -4.242 -2.027 1.00 . A A . 35 PRO HD2 1 1 1 511 1 1 35 PRO HD3 H -3.786 -4.074 -0.316 1.00 . A A . 35 PRO HD3 1 1 1 512 1 1 35 PRO HG2 H -4.898 -6.422 -1.618 1.00 . A A . 35 PRO HG2 1 1 1 513 1 1 35 PRO HG3 H -4.428 -6.259 0.069 1.00 . A A . 35 PRO HG3 1 1 1 514 1 1 35 PRO N N -2.241 -4.757 -1.558 1.00 . A A . 35 PRO N 1 1 1 515 1 1 35 PRO O O -1.559 -7.119 -3.679 1.00 . A A . 35 PRO O 1 1 1 516 1 1 36 ILE C C 0.951 -8.259 -3.757 1.00 . A A . 36 ILE C 1 1 1 517 1 1 36 ILE CA C 1.284 -6.752 -3.664 1.00 . A A . 36 ILE CA 1 1 1 518 1 1 36 ILE CB C 2.656 -6.477 -3.028 1.00 . A A . 36 ILE CB 1 1 1 519 1 1 36 ILE CD1 C 4.090 -8.482 -2.726 1.00 . A A . 36 ILE CD1 1 1 1 520 1 1 36 ILE CG1 C 3.809 -7.288 -3.610 1.00 . A A . 36 ILE CG1 1 1 1 521 1 1 36 ILE CG2 C 2.581 -6.605 -1.504 1.00 . A A . 36 ILE CG2 1 1 1 522 1 1 36 ILE H H 0.548 -5.234 -2.346 1.00 . A A . 36 ILE H 1 1 1 523 1 1 36 ILE HA H 1.209 -6.289 -4.646 1.00 . A A . 36 ILE HA 1 1 1 524 1 1 36 ILE HB H 2.919 -5.448 -3.232 1.00 . A A . 36 ILE HB 1 1 1 525 1 1 36 ILE HD11 H 4.823 -8.232 -1.960 1.00 . A A . 36 ILE HD11 1 1 1 526 1 1 36 ILE HD12 H 3.158 -8.749 -2.242 1.00 . A A . 36 ILE HD12 1 1 1 527 1 1 36 ILE HD13 H 4.444 -9.328 -3.312 1.00 . A A . 36 ILE HD13 1 1 1 528 1 1 36 ILE HG12 H 3.596 -7.625 -4.619 1.00 . A A . 36 ILE HG12 1 1 1 529 1 1 36 ILE HG13 H 4.700 -6.664 -3.676 1.00 . A A . 36 ILE HG13 1 1 1 530 1 1 36 ILE HG21 H 2.027 -7.494 -1.200 1.00 . A A . 36 ILE HG21 1 1 1 531 1 1 36 ILE HG22 H 3.575 -6.658 -1.057 1.00 . A A . 36 ILE HG22 1 1 1 532 1 1 36 ILE HG23 H 2.065 -5.740 -1.090 1.00 . A A . 36 ILE HG23 1 1 1 533 1 1 36 ILE N N 0.290 -6.056 -2.858 1.00 . A A . 36 ILE N 1 1 1 534 1 1 36 ILE O O 0.152 -8.778 -2.987 1.00 . A A . 36 ILE O 1 1 1 535 1 1 37 PRO C C 2.553 -10.833 -3.308 1.00 . A A . 37 PRO C 1 1 1 536 1 1 37 PRO CA C 2.025 -10.318 -4.646 1.00 . A A . 37 PRO CA 1 1 1 537 1 1 37 PRO CB C 3.188 -10.393 -5.625 1.00 . A A . 37 PRO CB 1 1 1 538 1 1 37 PRO CD C 1.893 -8.347 -6.056 1.00 . A A . 37 PRO CD 1 1 1 539 1 1 37 PRO CG C 3.000 -9.241 -6.624 1.00 . A A . 37 PRO CG 1 1 1 540 1 1 37 PRO HA H 1.217 -10.971 -4.974 1.00 . A A . 37 PRO HA 1 1 1 541 1 1 37 PRO HB2 H 4.109 -10.274 -5.048 1.00 . A A . 37 PRO HB2 1 1 1 542 1 1 37 PRO HB3 H 3.225 -11.360 -6.120 1.00 . A A . 37 PRO HB3 1 1 1 543 1 1 37 PRO HD2 H 2.218 -7.312 -5.987 1.00 . A A . 37 PRO HD2 1 1 1 544 1 1 37 PRO HD3 H 1.005 -8.377 -6.688 1.00 . A A . 37 PRO HD3 1 1 1 545 1 1 37 PRO HG2 H 3.927 -8.680 -6.746 1.00 . A A . 37 PRO HG2 1 1 1 546 1 1 37 PRO HG3 H 2.716 -9.627 -7.604 1.00 . A A . 37 PRO HG3 1 1 1 547 1 1 37 PRO N N 1.588 -8.928 -4.753 1.00 . A A . 37 PRO N 1 1 1 548 1 1 37 PRO O O 3.634 -11.405 -3.242 1.00 . A A . 37 PRO O 1 1 1 549 1 1 38 HIS C C 0.572 -11.180 -0.216 1.00 . A A . 38 HIS C 1 1 1 550 1 1 38 HIS CA C 1.249 -11.723 -1.470 1.00 . A A . 38 HIS CA 1 1 1 551 1 1 38 HIS CB C 2.319 -12.794 -1.183 1.00 . A A . 38 HIS CB 1 1 1 552 1 1 38 HIS CD2 C 4.180 -11.066 -0.705 1.00 . A A . 38 HIS CD2 1 1 1 553 1 1 38 HIS CE1 C 5.819 -12.422 -0.053 1.00 . A A . 38 HIS CE1 1 1 1 554 1 1 38 HIS CG C 3.689 -12.316 -0.775 1.00 . A A . 38 HIS CG 1 1 1 555 1 1 38 HIS H H 1.457 -9.681 -2.045 1.00 . A A . 38 HIS H 1 1 1 556 1 1 38 HIS HA H 0.468 -12.193 -2.035 1.00 . A A . 38 HIS HA 1 1 1 557 1 1 38 HIS HB2 H 1.928 -13.412 -0.365 1.00 . A A . 38 HIS HB2 1 1 1 558 1 1 38 HIS HB3 H 2.422 -13.433 -2.064 1.00 . A A . 38 HIS HB3 1 1 1 559 1 1 38 HIS HD1 H 4.741 -14.210 -0.407 1.00 . A A . 38 HIS HD1 1 1 1 560 1 1 38 HIS HD2 H 3.660 -10.176 -0.992 1.00 . A A . 38 HIS HD2 1 1 1 561 1 1 38 HIS HE1 H 6.813 -12.805 0.153 1.00 . A A . 38 HIS HE1 1 1 1 562 1 1 38 HIS N N 1.731 -10.616 -2.271 1.00 . A A . 38 HIS N 1 1 1 563 1 1 38 HIS ND1 N 4.778 -13.212 -0.361 1.00 . A A . 38 HIS ND1 1 1 1 564 1 1 38 HIS NE2 N 5.557 -11.113 -0.190 1.00 . A A . 38 HIS NE2 1 1 1 565 1 1 38 HIS O O -0.556 -10.704 -0.224 1.00 . A A . 38 HIS O 1 1 1 566 1 1 39 GLU C C -0.394 -10.529 2.328 1.00 . A A . 39 GLU C 1 1 1 567 1 1 39 GLU CA C 0.780 -11.501 2.150 1.00 . A A . 39 GLU CA 1 1 1 568 1 1 39 GLU CB C 1.827 -11.263 3.235 1.00 . A A . 39 GLU CB 1 1 1 569 1 1 39 GLU CD C 3.310 -13.045 4.181 1.00 . A A . 39 GLU CD 1 1 1 570 1 1 39 GLU CG C 3.099 -12.080 3.011 1.00 . A A . 39 GLU CG 1 1 1 571 1 1 39 GLU H H 2.285 -11.550 0.540 1.00 . A A . 39 GLU H 1 1 1 572 1 1 39 GLU HA H 0.450 -12.536 2.153 1.00 . A A . 39 GLU HA 1 1 1 573 1 1 39 GLU HB2 H 2.077 -10.202 3.230 1.00 . A A . 39 GLU HB2 1 1 1 574 1 1 39 GLU HB3 H 1.403 -11.512 4.212 1.00 . A A . 39 GLU HB3 1 1 1 575 1 1 39 GLU HG2 H 3.033 -12.652 2.086 1.00 . A A . 39 GLU HG2 1 1 1 576 1 1 39 GLU HG3 H 3.965 -11.422 2.937 1.00 . A A . 39 GLU HG3 1 1 1 577 1 1 39 GLU N N 1.369 -11.301 0.843 1.00 . A A . 39 GLU N 1 1 1 578 1 1 39 GLU O O -0.291 -9.346 2.029 1.00 . A A . 39 GLU O 1 1 1 579 1 1 39 GLU OE1 O 3.090 -12.643 5.322 1.00 . A A . 39 GLU OE1 1 1 1 580 1 1 39 GLU OE2 O 3.694 -14.188 3.937 1.00 . A A . 39 GLU OE2 1 1 1 581 1 1 40 PRO C C -2.062 -9.500 4.633 1.00 . A A . 40 PRO C 1 1 1 582 1 1 40 PRO CA C -2.574 -10.277 3.420 1.00 . A A . 40 PRO CA 1 1 1 583 1 1 40 PRO CB C -3.653 -11.273 3.856 1.00 . A A . 40 PRO CB 1 1 1 584 1 1 40 PRO CD C -1.793 -12.512 2.809 1.00 . A A . 40 PRO CD 1 1 1 585 1 1 40 PRO CG C -3.174 -12.675 3.449 1.00 . A A . 40 PRO CG 1 1 1 586 1 1 40 PRO HA H -2.964 -9.576 2.678 1.00 . A A . 40 PRO HA 1 1 1 587 1 1 40 PRO HB2 H -3.801 -11.222 4.935 1.00 . A A . 40 PRO HB2 1 1 1 588 1 1 40 PRO HB3 H -4.606 -11.042 3.381 1.00 . A A . 40 PRO HB3 1 1 1 589 1 1 40 PRO HD2 H -1.032 -13.044 3.381 1.00 . A A . 40 PRO HD2 1 1 1 590 1 1 40 PRO HD3 H -1.782 -12.880 1.783 1.00 . A A . 40 PRO HD3 1 1 1 591 1 1 40 PRO HG2 H -3.115 -13.327 4.320 1.00 . A A . 40 PRO HG2 1 1 1 592 1 1 40 PRO HG3 H -3.871 -13.127 2.743 1.00 . A A . 40 PRO HG3 1 1 1 593 1 1 40 PRO N N -1.521 -11.085 2.828 1.00 . A A . 40 PRO N 1 1 1 594 1 1 40 PRO O O -2.528 -9.669 5.753 1.00 . A A . 40 PRO O 1 1 1 595 1 1 41 HIS C C -0.809 -6.188 3.848 1.00 . A A . 41 HIS C 1 1 1 596 1 1 41 HIS CA C -1.164 -7.285 4.863 1.00 . A A . 41 HIS CA 1 1 1 597 1 1 41 HIS CB C -0.289 -7.136 6.110 1.00 . A A . 41 HIS CB 1 1 1 598 1 1 41 HIS CD2 C 2.262 -7.198 6.197 1.00 . A A . 41 HIS CD2 1 1 1 599 1 1 41 HIS CE1 C 2.661 -9.299 5.561 1.00 . A A . 41 HIS CE1 1 1 1 600 1 1 41 HIS CG C 1.066 -7.772 5.971 1.00 . A A . 41 HIS CG 1 1 1 601 1 1 41 HIS H H -0.293 -8.910 3.766 1.00 . A A . 41 HIS H 1 1 1 602 1 1 41 HIS HA H -2.213 -7.148 5.083 1.00 . A A . 41 HIS HA 1 1 1 603 1 1 41 HIS HB2 H -0.148 -6.071 6.298 1.00 . A A . 41 HIS HB2 1 1 1 604 1 1 41 HIS HB3 H -0.802 -7.565 6.973 1.00 . A A . 41 HIS HB3 1 1 1 605 1 1 41 HIS HD1 H 0.620 -9.834 5.348 1.00 . A A . 41 HIS HD1 1 1 1 606 1 1 41 HIS HD2 H 2.414 -6.183 6.515 1.00 . A A . 41 HIS HD2 1 1 1 607 1 1 41 HIS HE1 H 3.163 -10.213 5.255 1.00 . A A . 41 HIS HE1 1 1 1 608 1 1 41 HIS N N -1.073 -8.639 4.330 1.00 . A A . 41 HIS N 1 1 1 609 1 1 41 HIS ND1 N 1.327 -9.157 5.555 1.00 . A A . 41 HIS ND1 1 1 1 610 1 1 41 HIS NE2 N 3.319 -8.188 5.935 1.00 . A A . 41 HIS NE2 1 1 1 611 1 1 41 HIS O O -1.139 -5.022 4.025 1.00 . A A . 41 HIS O 1 1 1 612 1 1 42 ARG C C 0.468 -4.693 1.426 1.00 . A A . 42 ARG C 1 1 1 613 1 1 42 ARG CA C 0.968 -5.809 2.316 1.00 . A A . 42 ARG CA 1 1 1 614 1 1 42 ARG CB C 2.019 -6.572 1.524 1.00 . A A . 42 ARG CB 1 1 1 615 1 1 42 ARG CD C 3.761 -8.362 1.814 1.00 . A A . 42 ARG CD 1 1 1 616 1 1 42 ARG CG C 3.105 -7.128 2.429 1.00 . A A . 42 ARG CG 1 1 1 617 1 1 42 ARG CZ C 6.016 -8.811 2.499 1.00 . A A . 42 ARG CZ 1 1 1 618 1 1 42 ARG H H -0.351 -7.575 2.562 1.00 . A A . 42 ARG H 1 1 1 619 1 1 42 ARG HA H 1.415 -5.369 3.208 1.00 . A A . 42 ARG HA 1 1 1 620 1 1 42 ARG HB2 H 1.564 -7.348 0.914 1.00 . A A . 42 ARG HB2 1 1 1 621 1 1 42 ARG HB3 H 2.493 -5.878 0.834 1.00 . A A . 42 ARG HB3 1 1 1 622 1 1 42 ARG HD2 H 3.628 -9.246 2.430 1.00 . A A . 42 ARG HD2 1 1 1 623 1 1 42 ARG HD3 H 3.373 -8.570 0.817 1.00 . A A . 42 ARG HD3 1 1 1 624 1 1 42 ARG HE H 5.548 -7.517 0.985 1.00 . A A . 42 ARG HE 1 1 1 625 1 1 42 ARG HG2 H 3.866 -6.358 2.578 1.00 . A A . 42 ARG HG2 1 1 1 626 1 1 42 ARG HG3 H 2.658 -7.348 3.402 1.00 . A A . 42 ARG HG3 1 1 1 627 1 1 42 ARG HH11 H 5.797 -10.804 2.224 1.00 . A A . 42 ARG HH11 1 1 1 628 1 1 42 ARG HH12 H 7.378 -10.180 1.892 1.00 . A A . 42 ARG HH12 1 1 1 629 1 1 42 ARG HH21 H 5.850 -7.562 4.085 1.00 . A A . 42 ARG HH21 1 1 1 630 1 1 42 ARG HH22 H 7.298 -8.511 4.036 1.00 . A A . 42 ARG HH22 1 1 1 631 1 1 42 ARG N N -0.126 -6.631 2.788 1.00 . A A . 42 ARG N 1 1 1 632 1 1 42 ARG NE N 5.188 -8.145 1.674 1.00 . A A . 42 ARG NE 1 1 1 633 1 1 42 ARG NH1 N 6.431 -10.033 2.178 1.00 . A A . 42 ARG NH1 1 1 1 634 1 1 42 ARG NH2 N 6.421 -8.248 3.633 1.00 . A A . 42 ARG NH2 1 1 1 635 1 1 42 ARG O O -0.631 -4.690 0.883 1.00 . A A . 42 ARG O 1 1 1 636 1 1 43 CYS C C 2.821 -3.513 -0.619 1.00 . A A . 43 CYS C 1 1 1 637 1 1 43 CYS CA C 1.599 -2.994 0.134 1.00 . A A . 43 CYS CA 1 1 1 638 1 1 43 CYS CB C 1.766 -1.532 0.509 1.00 . A A . 43 CYS CB 1 1 1 639 1 1 43 CYS H H 1.876 -3.529 2.199 1.00 . A A . 43 CYS H 1 1 1 640 1 1 43 CYS HA H 0.694 -3.085 -0.466 1.00 . A A . 43 CYS HA 1 1 1 641 1 1 43 CYS HB2 H 2.183 -0.969 -0.326 1.00 . A A . 43 CYS HB2 1 1 1 642 1 1 43 CYS HB3 H 0.768 -1.148 0.696 1.00 . A A . 43 CYS HB3 1 1 1 643 1 1 43 CYS N N 1.408 -3.749 1.348 1.00 . A A . 43 CYS N 1 1 1 644 1 1 43 CYS O O 3.651 -4.243 -0.090 1.00 . A A . 43 CYS O 1 1 1 645 1 1 43 CYS SG S 2.737 -1.209 1.997 1.00 . A A . 43 CYS SG 1 1 1 646 1 1 44 GLN C C 3.955 -2.496 -3.959 1.00 . A A . 44 GLN C 1 1 1 647 1 1 44 GLN CA C 4.160 -2.887 -2.503 1.00 . A A . 44 GLN CA 1 1 1 648 1 1 44 GLN CB C 4.983 -4.168 -2.435 1.00 . A A . 44 GLN CB 1 1 1 649 1 1 44 GLN CD C 6.223 -4.738 -0.333 1.00 . A A . 44 GLN CD 1 1 1 650 1 1 44 GLN CG C 6.284 -3.971 -1.655 1.00 . A A . 44 GLN CG 1 1 1 651 1 1 44 GLN H H 2.028 -2.822 -2.369 1.00 . A A . 44 GLN H 1 1 1 652 1 1 44 GLN HA H 4.646 -2.071 -1.968 1.00 . A A . 44 GLN HA 1 1 1 653 1 1 44 GLN HB2 H 4.396 -4.967 -1.983 1.00 . A A . 44 GLN HB2 1 1 1 654 1 1 44 GLN HB3 H 5.210 -4.475 -3.456 1.00 . A A . 44 GLN HB3 1 1 1 655 1 1 44 GLN HE21 H 5.944 -6.484 -1.337 1.00 . A A . 44 GLN HE21 1 1 1 656 1 1 44 GLN HE22 H 6.723 -6.629 0.228 1.00 . A A . 44 GLN HE22 1 1 1 657 1 1 44 GLN HG2 H 7.135 -4.330 -2.233 1.00 . A A . 44 GLN HG2 1 1 1 658 1 1 44 GLN HG3 H 6.449 -2.915 -1.443 1.00 . A A . 44 GLN HG3 1 1 1 659 1 1 44 GLN N N 2.865 -3.077 -1.886 1.00 . A A . 44 GLN N 1 1 1 660 1 1 44 GLN NE2 N 6.304 -6.071 -0.495 1.00 . A A . 44 GLN NE2 1 1 1 661 1 1 44 GLN O O 4.072 -3.300 -4.876 1.00 . A A . 44 GLN O 1 1 1 662 1 1 44 GLN OE1 O 6.113 -4.165 0.744 1.00 . A A . 44 GLN OE1 1 1 1 663 1 1 45 MET C C 1.228 -1.749 -4.168 1.00 . A A . 45 MET C 1 1 1 664 1 1 45 MET CA C 2.305 -0.730 -3.758 1.00 . A A . 45 MET CA 1 1 1 665 1 1 45 MET CB C 2.059 0.617 -4.444 1.00 . A A . 45 MET CB 1 1 1 666 1 1 45 MET CE C 3.550 -0.380 -8.163 1.00 . A A . 45 MET CE 1 1 1 667 1 1 45 MET CG C 2.732 0.702 -5.815 1.00 . A A . 45 MET CG 1 1 1 668 1 1 45 MET H H 4.390 -0.580 -4.314 1.00 . A A . 45 MET H 1 1 1 669 1 1 45 MET HA H 2.292 -0.610 -2.674 1.00 . A A . 45 MET HA 1 1 1 670 1 1 45 MET HB2 H 0.990 0.797 -4.554 1.00 . A A . 45 MET HB2 1 1 1 671 1 1 45 MET HB3 H 2.438 1.417 -3.808 1.00 . A A . 45 MET HB3 1 1 1 672 1 1 45 MET HE1 H 3.810 -1.257 -8.754 1.00 . A A . 45 MET HE1 1 1 1 673 1 1 45 MET HE2 H 2.921 0.269 -8.775 1.00 . A A . 45 MET HE2 1 1 1 674 1 1 45 MET HE3 H 4.461 0.152 -7.894 1.00 . A A . 45 MET HE3 1 1 1 675 1 1 45 MET HG2 H 2.248 1.466 -6.423 1.00 . A A . 45 MET HG2 1 1 1 676 1 1 45 MET HG3 H 3.777 0.992 -5.702 1.00 . A A . 45 MET HG3 1 1 1 677 1 1 45 MET N N 3.640 -1.201 -4.098 1.00 . A A . 45 MET N 1 1 1 678 1 1 45 MET O O 1.509 -2.874 -4.562 1.00 . A A . 45 MET O 1 1 1 679 1 1 45 MET SD S 2.653 -0.873 -6.683 1.00 . A A . 45 MET SD 1 1 1 680 1 1 46 PHE C C -0.304 -1.331 -6.476 1.00 . A A . 46 PHE C 1 1 1 681 1 1 46 PHE CA C -0.951 -1.639 -5.118 1.00 . A A . 46 PHE CA 1 1 1 682 1 1 46 PHE CB C -2.254 -0.856 -4.913 1.00 . A A . 46 PHE CB 1 1 1 683 1 1 46 PHE CD1 C -2.911 -0.074 -7.251 1.00 . A A . 46 PHE CD1 1 1 1 684 1 1 46 PHE CD2 C -4.321 -1.769 -6.097 1.00 . A A . 46 PHE CD2 1 1 1 685 1 1 46 PHE CE1 C -3.799 -0.103 -8.383 1.00 . A A . 46 PHE CE1 1 1 1 686 1 1 46 PHE CE2 C -5.211 -1.800 -7.227 1.00 . A A . 46 PHE CE2 1 1 1 687 1 1 46 PHE CG C -3.170 -0.904 -6.102 1.00 . A A . 46 PHE CG 1 1 1 688 1 1 46 PHE CZ C -4.951 -0.966 -8.369 1.00 . A A . 46 PHE CZ 1 1 1 689 1 1 46 PHE H H -0.346 -0.716 -3.292 1.00 . A A . 46 PHE H 1 1 1 690 1 1 46 PHE HA H -1.107 -2.716 -5.023 1.00 . A A . 46 PHE HA 1 1 1 691 1 1 46 PHE HB2 H -2.787 -1.265 -4.058 1.00 . A A . 46 PHE HB2 1 1 1 692 1 1 46 PHE HB3 H -2.034 0.183 -4.668 1.00 . A A . 46 PHE HB3 1 1 1 693 1 1 46 PHE HD1 H -2.046 0.573 -7.263 1.00 . A A . 46 PHE HD1 1 1 1 694 1 1 46 PHE HD2 H -4.517 -2.398 -5.241 1.00 . A A . 46 PHE HD2 1 1 1 695 1 1 46 PHE HE1 H -3.603 0.522 -9.240 1.00 . A A . 46 PHE HE1 1 1 1 696 1 1 46 PHE HE2 H -6.075 -2.447 -7.219 1.00 . A A . 46 PHE HE2 1 1 1 697 1 1 46 PHE HZ H -5.620 -0.985 -9.217 1.00 . A A . 46 PHE HZ 1 1 1 698 1 1 46 PHE N N -0.030 -1.278 -4.059 1.00 . A A . 46 PHE N 1 1 1 699 1 1 46 PHE O O 0.038 -0.195 -6.781 1.00 . A A . 46 PHE O 1 1 1 700 1 1 47 CYS C C -1.011 -3.360 -9.346 1.30 . A A . 47 CYS C 1 1 1 701 1 1 47 CYS CA C -0.211 -2.226 -8.697 0.80 . A A . 47 CYS CA 1 1 1 702 1 1 47 CYS CB C 1.199 -2.186 -9.278 0.60 . A A . 47 CYS CB 1 1 1 703 1 1 47 CYS H H -0.012 -3.323 -6.863 1.00 . A A . 47 CYS H 1 1 1 704 1 1 47 CYS HA H -0.698 -1.266 -8.863 1.10 . A A . 47 CYS HA 1 1 1 705 1 1 47 CYS HB2 H 1.595 -1.182 -9.148 0.90 . A A . 47 CYS HB2 1 1 1 706 1 1 47 CYS HB3 H 1.854 -2.869 -8.737 0.90 . A A . 47 CYS HB3 1 1 1 707 1 1 47 CYS N N -0.159 -2.416 -7.259 0.60 . A A . 47 CYS N 1 1 1 708 1 1 47 CYS O O -0.457 -4.316 -9.876 1.90 . A A . 47 CYS O 1 1 1 709 1 1 47 CYS SG S 1.252 -2.579 -11.043 1.30 . A A . 47 CYS SG 1 1 1 710 1 1 48 ASN C C -3.197 -4.089 -11.367 1.90 . A A . 48 ASN C 1 1 1 711 1 1 48 ASN CA C -3.186 -4.222 -9.844 2.30 . A A . 48 ASN CA 1 1 1 712 1 1 48 ASN CB C -4.607 -4.109 -9.291 3.00 . A A . 48 ASN CB 1 1 1 713 1 1 48 ASN CG C -5.461 -5.272 -9.804 3.70 . A A . 48 ASN CG 1 1 1 714 1 1 48 ASN H H -2.738 -2.380 -8.835 2.00 . A A . 48 ASN H 1 1 1 715 1 1 48 ASN HA H -2.736 -5.177 -9.571 2.70 . A A . 48 ASN HA 1 1 1 716 1 1 48 ASN HB2 H -4.597 -4.133 -8.201 3.30 . A A . 48 ASN HB2 1 1 1 717 1 1 48 ASN HB3 H -5.067 -3.170 -9.600 3.20 . A A . 48 ASN HB3 1 1 1 718 1 1 48 ASN HD21 H -6.762 -6.395 -8.682 1.00 . A A . 48 ASN HD21 1 1 1 719 1 1 48 ASN N N -2.343 -3.190 -9.269 1.70 . A A . 48 ASN N 1 1 1 720 1 1 48 ASN ND2 N -5.808 -6.136 -8.832 4.10 . A A . 48 ASN ND2 1 1 1 721 1 1 48 ASN O O -3.493 -3.039 -11.924 2.30 . A A . 48 ASN O 1 1 1 722 1 1 48 ASN OD1 O -5.775 -5.373 -10.983 4.40 . A A . 48 ASN OD1 1 1 1 723 1 1 49 GLN C C -3.492 -5.190 -14.344 1.80 . A A . 49 GLN C 1 1 1 724 1 1 49 GLN CA C -2.334 -5.141 -13.344 2.00 . A A . 49 GLN CA 1 1 1 725 1 1 49 GLN CB C -1.362 -6.295 -13.596 2.20 . A A . 49 GLN CB 1 1 1 726 1 1 49 GLN CD C 0.856 -7.181 -12.842 3.40 . A A . 49 GLN CD 1 1 1 727 1 1 49 GLN CG C -0.468 -6.565 -12.384 2.70 . A A . 49 GLN CG 1 1 1 728 1 1 49 GLN H H -2.953 -6.113 -11.539 2.50 . A A . 49 GLN H 1 1 1 729 1 1 49 GLN HA H -1.830 -4.178 -13.421 2.50 . A A . 49 GLN HA 1 1 1 730 1 1 49 GLN HB2 H -1.922 -7.196 -13.844 2.60 . A A . 49 GLN HB2 1 1 1 731 1 1 49 GLN HB3 H -0.741 -6.069 -14.462 2.10 . A A . 49 GLN HB3 1 1 1 732 1 1 49 GLN HE21 H 1.567 -5.343 -13.345 4.10 . A A . 49 GLN HE21 1 1 1 733 1 1 49 GLN HE22 H 2.215 -6.683 -14.273 4.50 . A A . 49 GLN HE22 1 1 1 734 1 1 49 GLN HG2 H -0.260 -5.640 -11.847 2.70 . A A . 49 GLN HG2 1 1 1 735 1 1 49 GLN HG3 H -0.956 -7.249 -11.690 2.80 . A A . 49 GLN HG3 1 1 1 736 1 1 49 GLN N N -2.853 -5.228 -11.994 2.00 . A A . 49 GLN N 1 1 1 737 1 1 49 GLN NE2 N 1.614 -6.325 -13.550 4.00 . A A . 49 GLN NE2 1 1 1 738 1 1 49 GLN O O -4.533 -5.785 -14.097 2.20 . A A . 49 GLN O 1 1 1 739 1 1 49 GLN OE1 O 1.162 -8.336 -12.574 3.70 . A A . 49 GLN OE1 1 1 1 740 1 1 50 THR C C -1.310 -4.353 -16.963 1.50 . A A . 50 THR C 1 1 1 741 1 1 50 THR CA C -2.502 -5.207 -16.530 1.80 . A A . 50 THR CA 1 1 1 742 1 1 50 THR CB C -3.421 -5.472 -17.722 1.90 . A A . 50 THR CB 1 1 1 743 1 1 50 THR CG2 C -2.631 -5.722 -19.006 2.30 . A A . 50 THR CG2 1 1 1 744 1 1 50 THR H H -3.533 -3.574 -15.598 2.00 . A A . 50 THR H 1 1 1 745 1 1 50 THR HA H -2.141 -6.140 -16.096 2.10 . A A . 50 THR HA 1 1 1 746 1 1 50 THR HB H -4.082 -4.617 -17.866 2.20 . A A . 50 THR HB 1 1 1 747 1 1 50 THR HG1 H -4.489 -6.947 -18.289 2.50 . A A . 50 THR HG1 1 1 1 748 1 1 50 THR HG21 H -3.110 -6.490 -19.614 2.40 . A A . 50 THR HG21 1 1 1 749 1 1 50 THR HG22 H -1.618 -6.055 -18.781 2.60 . A A . 50 THR HG22 1 1 1 750 1 1 50 THR HG23 H -2.563 -4.813 -19.604 2.80 . A A . 50 THR HG23 1 1 1 751 1 1 50 THR N N -3.236 -4.522 -15.483 1.70 . A A . 50 THR N 1 1 1 752 1 1 50 THR O O -1.345 -3.657 -17.971 2.20 . A A . 50 THR O 1 1 1 753 1 1 50 THR OG1 O -4.236 -6.584 -17.451 2.20 . A A . 50 THR OG1 1 1 1 754 1 1 51 ALA C C -0.537 -2.098 -15.500 0.60 . A A . 51 ALA C 1 1 1 755 1 1 51 ALA CA C 0.446 -3.252 -15.723 0.60 . A A . 51 ALA CA 1 1 1 756 1 1 51 ALA CB C 1.468 -2.866 -16.790 0.70 . A A . 51 ALA CB 1 1 1 757 1 1 51 ALA H H 0.083 -5.357 -15.861 0.90 . A A . 51 ALA H 1 1 1 758 1 1 51 ALA HA H 0.932 -3.487 -14.776 0.70 . A A . 51 ALA HA 1 1 1 759 1 1 51 ALA HB1 H 2.262 -2.254 -16.361 1.20 . A A . 51 ALA HB1 1 1 1 760 1 1 51 ALA HB2 H 0.996 -2.295 -17.589 1.00 . A A . 51 ALA HB2 1 1 1 761 1 1 51 ALA HB3 H 1.923 -3.753 -17.229 1.30 . A A . 51 ALA HB3 1 1 1 762 1 1 51 ALA N N -0.259 -4.456 -16.129 0.80 . A A . 51 ALA N 1 1 1 763 1 1 51 ALA O O -1.309 -1.726 -16.376 1.10 . A A . 51 ALA O 1 1 1 764 1 1 52 CYS C C 1.764 -0.630 -14.668 0.80 . A A . 52 CYS C 1 1 1 765 1 1 52 CYS CA C 0.375 -0.392 -14.076 0.80 . A A . 52 CYS CA 1 1 1 766 1 1 52 CYS CB C 0.495 -0.092 -12.582 0.90 . A A . 52 CYS CB 1 1 1 767 1 1 52 CYS H H -0.938 -1.972 -13.498 0.90 . A A . 52 CYS H 1 1 1 768 1 1 52 CYS HA H -0.120 0.416 -14.611 0.80 . A A . 52 CYS HA 1 1 1 769 1 1 52 CYS HB2 H 0.533 0.985 -12.422 1.00 . A A . 52 CYS HB2 1 1 1 770 1 1 52 CYS HB3 H -0.388 -0.459 -12.059 1.10 . A A . 52 CYS HB3 1 1 1 771 1 1 52 CYS N N -0.448 -1.568 -14.268 0.70 . A A . 52 CYS N 1 1 1 772 1 1 52 CYS O O 2.488 -1.538 -14.278 1.20 . A A . 52 CYS O 1 1 1 773 1 1 52 CYS SG S 1.967 -0.846 -11.849 1.00 . A A . 52 CYS SG 1 1 1 774 1 1 53 PRO C C 3.489 2.126 -14.869 0.80 . A A . 53 PRO C 1 1 1 775 1 1 53 PRO CA C 3.398 0.869 -15.727 0.70 . A A . 53 PRO CA 1 1 1 776 1 1 53 PRO CB C 3.518 1.321 -17.177 0.90 . A A . 53 PRO CB 1 1 1 777 1 1 53 PRO CD C 1.210 0.573 -16.746 0.80 . A A . 53 PRO CD 1 1 1 778 1 1 53 PRO CG C 2.085 1.382 -17.707 0.90 . A A . 53 PRO CG 1 1 1 779 1 1 53 PRO HA H 4.181 0.162 -15.450 0.80 . A A . 53 PRO HA 1 1 1 780 1 1 53 PRO HB2 H 3.996 2.299 -17.239 1.00 . A A . 53 PRO HB2 1 1 1 781 1 1 53 PRO HB3 H 4.116 0.617 -17.756 1.10 . A A . 53 PRO HB3 1 1 1 782 1 1 53 PRO HD2 H 0.363 1.160 -16.393 0.80 . A A . 53 PRO HD2 1 1 1 783 1 1 53 PRO HD3 H 0.838 -0.340 -17.212 0.90 . A A . 53 PRO HD3 1 1 1 784 1 1 53 PRO HG2 H 1.755 2.420 -17.721 0.90 . A A . 53 PRO HG2 1 1 1 785 1 1 53 PRO HG3 H 2.038 0.979 -18.714 1.00 . A A . 53 PRO HG3 1 1 1 786 1 1 53 PRO N N 2.091 0.248 -15.639 0.60 . A A . 53 PRO N 1 1 1 787 1 1 53 PRO O O 2.506 2.654 -14.365 1.60 . A A . 53 PRO O 1 1 1 788 1 1 54 ALA C C 4.079 4.619 -16.001 0.90 . A A . 54 ALA C 1 1 1 789 1 1 54 ALA CA C 5.162 3.896 -15.177 0.80 . A A . 54 ALA CA 1 1 1 790 1 1 54 ALA CB C 6.472 3.774 -15.961 0.80 . A A . 54 ALA CB 1 1 1 791 1 1 54 ALA H H 5.433 1.866 -14.538 1.40 . A A . 54 ALA H 1 1 1 792 1 1 54 ALA HA H 5.333 4.467 -14.267 0.70 . A A . 54 ALA HA 1 1 1 793 1 1 54 ALA HB1 H 6.281 3.479 -16.993 1.20 . A A . 54 ALA HB1 1 1 1 794 1 1 54 ALA HB2 H 7.125 3.027 -15.511 1.40 . A A . 54 ALA HB2 1 1 1 795 1 1 54 ALA HB3 H 7.006 4.725 -15.976 1.30 . A A . 54 ALA HB3 1 1 1 796 1 1 54 ALA N N 4.754 2.558 -14.768 0.80 . A A . 54 ALA N 1 1 1 797 1 1 54 ALA O O 2.882 4.408 -15.843 1.50 . A A . 54 ALA O 1 1 1 798 1 1 55 ASP C C 2.815 7.089 -16.489 1.10 . A A . 55 ASP C 1 1 1 799 1 1 55 ASP CA C 3.743 6.462 -17.529 1.20 . A A . 55 ASP CA 1 1 1 800 1 1 55 ASP CB C 3.009 5.737 -18.647 1.40 . A A . 55 ASP CB 1 1 1 801 1 1 55 ASP CG C 1.718 6.461 -19.036 2.10 . A A . 55 ASP CG 1 1 1 802 1 1 55 ASP H H 5.548 5.414 -17.156 1.40 . A A . 55 ASP H 1 1 1 803 1 1 55 ASP HA H 4.402 7.231 -17.932 1.30 . A A . 55 ASP HA 1 1 1 804 1 1 55 ASP HB2 H 3.659 5.666 -19.518 1.80 . A A . 55 ASP HB2 1 1 1 805 1 1 55 ASP HB3 H 2.793 4.722 -18.322 1.50 . A A . 55 ASP HB3 1 1 1 806 1 1 55 ASP N N 4.597 5.495 -16.880 1.00 . A A . 55 ASP N 1 1 1 807 1 1 55 ASP O O 1.595 6.995 -16.537 1.50 . A A . 55 ASP O 1 1 1 808 1 1 55 ASP OD1 O 1.740 7.687 -19.140 2.60 . A A . 55 ASP OD1 1 1 1 809 1 1 55 ASP OD2 O 0.705 5.790 -19.233 2.80 . A A . 55 ASP OD2 1 1 1 810 1 1 56 CYS C C 2.158 9.764 -15.753 0.80 . A A . 56 CYS C 1 1 1 811 1 1 56 CYS CA C 3.046 8.894 -14.851 0.80 . A A . 56 CYS CA 1 1 1 812 1 1 56 CYS CB C 4.295 9.653 -14.402 0.90 . A A . 56 CYS CB 1 1 1 813 1 1 56 CYS H H 4.430 7.461 -15.221 1.10 . A A . 56 CYS H 1 1 1 814 1 1 56 CYS HA H 2.489 8.546 -13.981 0.70 . A A . 56 CYS HA 1 1 1 815 1 1 56 CYS HB2 H 4.394 10.544 -15.016 1.00 . A A . 56 CYS HB2 1 1 1 816 1 1 56 CYS HB3 H 4.154 9.937 -13.364 0.90 . A A . 56 CYS HB3 1 1 1 817 1 1 56 CYS N N 3.519 7.724 -15.536 0.90 . A A . 56 CYS N 1 1 1 818 1 1 56 CYS O O 1.570 9.311 -16.727 1.10 . A A . 56 CYS O 1 1 1 819 1 1 56 CYS SG S 5.872 8.756 -14.503 1.30 . A A . 56 CYS SG 1 1 1 820 1 1 57 ASP C C 1.241 12.334 -17.228 0.90 . A A . 57 ASP C 1 1 1 821 1 1 57 ASP CA C 1.003 11.882 -15.784 1.00 . A A . 57 ASP CA 1 1 1 822 1 1 57 ASP CB C 0.902 13.089 -14.851 1.10 . A A . 57 ASP CB 1 1 1 823 1 1 57 ASP CG C -0.558 13.358 -14.484 1.60 . A A . 57 ASP CG 1 1 1 824 1 1 57 ASP H H 2.818 11.427 -14.758 1.10 . A A . 57 ASP H 1 1 1 825 1 1 57 ASP HA H 0.105 11.268 -15.737 1.20 . A A . 57 ASP HA 1 1 1 826 1 1 57 ASP HB2 H 1.464 12.909 -13.935 1.10 . A A . 57 ASP HB2 1 1 1 827 1 1 57 ASP HB3 H 1.322 13.976 -15.324 1.20 . A A . 57 ASP HB3 1 1 1 828 1 1 57 ASP N N 2.107 11.048 -15.349 0.80 . A A . 57 ASP N 1 1 1 829 1 1 57 ASP O O 2.170 11.896 -17.897 1.00 . A A . 57 ASP O 1 1 1 830 1 1 57 ASP OD1 O -1.293 12.398 -14.256 2.00 . A A . 57 ASP OD1 1 1 1 831 1 1 57 ASP OD2 O -0.945 14.525 -14.433 2.20 . A A . 57 ASP OD2 1 1 1 832 1 1 58 PRO C C 1.425 15.423 -17.235 1.20 . A A . 58 PRO C 1 1 1 833 1 1 58 PRO CA C 0.737 14.509 -18.260 1.20 . A A . 58 PRO CA 1 1 1 834 1 1 58 PRO CB C -0.562 15.117 -18.812 1.40 . A A . 58 PRO CB 1 1 1 835 1 1 58 PRO CD C -1.091 12.994 -17.670 1.30 . A A . 58 PRO CD 1 1 1 836 1 1 58 PRO CG C -1.716 14.220 -18.342 1.50 . A A . 58 PRO CG 1 1 1 837 1 1 58 PRO HA H 1.436 14.319 -19.076 1.30 . A A . 58 PRO HA 1 1 1 838 1 1 58 PRO HB2 H -0.716 16.147 -18.495 1.50 . A A . 58 PRO HB2 1 1 1 839 1 1 58 PRO HB3 H -0.528 15.130 -19.902 1.70 . A A . 58 PRO HB3 1 1 1 840 1 1 58 PRO HD2 H -1.453 12.873 -16.651 1.30 . A A . 58 PRO HD2 1 1 1 841 1 1 58 PRO HD3 H -1.312 12.082 -18.224 1.40 . A A . 58 PRO HD3 1 1 1 842 1 1 58 PRO HG2 H -2.352 14.756 -17.637 1.50 . A A . 58 PRO HG2 1 1 1 843 1 1 58 PRO HG3 H -2.338 13.920 -19.185 1.70 . A A . 58 PRO HG3 1 1 1 844 1 1 58 PRO N N 0.342 13.240 -17.671 1.00 . A A . 58 PRO N 1 1 1 845 1 1 58 PRO O O 2.642 15.419 -17.095 1.50 . A A . 58 PRO O 1 1 1 846 1 1 59 ASN C C 1.626 18.058 -15.239 1.30 . A A . 59 ASN C 1 1 1 847 1 1 59 ASN CA C 0.844 17.630 -16.484 1.30 . A A . 59 ASN CA 1 1 1 848 1 1 59 ASN CB C -0.486 18.371 -16.564 1.50 . A A . 59 ASN CB 1 1 1 849 1 1 59 ASN CG C -0.407 19.491 -17.596 1.90 . A A . 59 ASN CG 1 1 1 850 1 1 59 ASN H H -0.280 15.858 -16.155 1.10 . A A . 59 ASN H 1 1 1 851 1 1 59 ASN HA H 1.480 17.818 -17.329 1.50 . A A . 59 ASN HA 1 1 1 852 1 1 59 ASN HB2 H -1.277 17.680 -16.868 1.70 . A A . 59 ASN HB2 1 1 1 853 1 1 59 ASN HB3 H -0.748 18.793 -15.593 1.70 . A A . 59 ASN HB3 1 1 1 854 1 1 59 ASN HD21 H -2.124 18.734 -18.290 2.10 . A A . 59 ASN HD21 1 1 1 855 1 1 59 ASN HD22 H -1.649 20.260 -19.032 2.50 . A A . 59 ASN HD22 1 1 1 856 1 1 59 ASN N N 0.579 16.201 -16.534 1.10 . A A . 59 ASN N 1 1 1 857 1 1 59 ASN ND2 N -1.490 19.508 -18.386 2.00 . A A . 59 ASN ND2 1 1 1 858 1 1 59 ASN O O 2.460 18.955 -15.259 1.70 . A A . 59 ASN O 1 1 1 859 1 1 59 ASN OD1 O 0.544 20.260 -17.665 2.70 . A A . 59 ASN OD1 1 1 1 860 1 1 60 THR C C 2.685 17.458 -12.097 0.90 . A A . 60 THR C 1 1 1 861 1 1 60 THR CA C 1.403 17.901 -12.833 1.20 . A A . 60 THR CA 1 1 1 862 1 1 60 THR CB C 0.178 17.538 -11.986 1.40 . A A . 60 THR CB 1 1 1 863 1 1 60 THR CG2 C -1.079 17.295 -12.825 1.40 . A A . 60 THR CG2 1 1 1 864 1 1 60 THR H H 0.835 16.499 -14.472 1.00 . A A . 60 THR H 1 1 1 865 1 1 60 THR HA H 1.457 18.977 -12.983 1.40 . A A . 60 THR HA 1 1 1 866 1 1 60 THR HB H -0.017 18.345 -11.279 1.90 . A A . 60 THR HB 1 1 1 867 1 1 60 THR HG1 H -0.041 16.462 -10.428 2.30 . A A . 60 THR HG1 1 1 1 868 1 1 60 THR HG21 H -1.221 16.230 -13.006 1.90 . A A . 60 THR HG21 1 1 1 869 1 1 60 THR HG22 H -1.012 17.798 -13.789 1.80 . A A . 60 THR HG22 1 1 1 870 1 1 60 THR HG23 H -1.965 17.665 -12.311 1.70 . A A . 60 THR HG23 1 1 1 871 1 1 60 THR N N 1.281 17.338 -14.173 1.10 . A A . 60 THR N 1 1 1 872 1 1 60 THR O O 2.862 17.750 -10.921 1.10 . A A . 60 THR O 1 1 1 873 1 1 60 THR OG1 O 0.461 16.389 -11.228 2.10 . A A . 60 THR OG1 1 1 1 874 1 1 61 GLN C C 4.215 15.472 -10.856 0.90 . A A . 61 GLN C 1 1 1 875 1 1 61 GLN CA C 4.088 15.489 -12.383 0.80 . A A . 61 GLN CA 1 1 1 876 1 1 61 GLN CB C 5.457 15.241 -13.018 1.00 . A A . 61 GLN CB 1 1 1 877 1 1 61 GLN CD C 7.548 16.429 -13.724 1.90 . A A . 61 GLN CD 1 1 1 878 1 1 61 GLN CG C 6.454 16.343 -12.658 1.40 . A A . 61 GLN CG 1 1 1 879 1 1 61 GLN H H 3.716 17.092 -13.778 1.20 . A A . 61 GLN H 1 1 1 880 1 1 61 GLN HA H 3.371 14.728 -12.692 0.70 . A A . 61 GLN HA 1 1 1 881 1 1 61 GLN HB2 H 5.843 14.275 -12.691 1.60 . A A . 61 GLN HB2 1 1 1 882 1 1 61 GLN HB3 H 5.350 15.181 -14.102 1.60 . A A . 61 GLN HB3 1 1 1 883 1 1 61 GLN HE21 H 8.636 17.621 -12.486 2.60 . A A . 61 GLN HE21 1 1 1 884 1 1 61 GLN HE22 H 9.555 16.772 -13.715 2.80 . A A . 61 GLN HE22 1 1 1 885 1 1 61 GLN HG2 H 5.950 17.307 -12.589 1.80 . A A . 61 GLN HG2 1 1 1 886 1 1 61 GLN HG3 H 6.916 16.142 -11.691 1.90 . A A . 61 GLN HG3 1 1 1 887 1 1 61 GLN N N 3.563 16.763 -12.847 0.90 . A A . 61 GLN N 1 1 1 888 1 1 61 GLN NE2 N 8.682 16.991 -13.268 2.40 . A A . 61 GLN NE2 1 1 1 889 1 1 61 GLN O O 5.299 15.583 -10.296 1.50 . A A . 61 GLN O 1 1 1 890 1 1 61 GLN OE1 O 7.374 16.020 -14.865 2.40 . A A . 61 GLN OE1 1 1 1 891 1 1 62 ALA C C 3.448 13.261 -8.874 0.90 . A A . 62 ALA C 1 1 1 892 1 1 62 ALA CA C 2.993 14.730 -8.902 1.00 . A A . 62 ALA CA 1 1 1 893 1 1 62 ALA CB C 1.555 14.791 -8.394 1.30 . A A . 62 ALA CB 1 1 1 894 1 1 62 ALA H H 2.317 15.974 -10.485 1.50 . A A . 62 ALA H 1 1 1 895 1 1 62 ALA HA H 3.616 15.355 -8.261 1.20 . A A . 62 ALA HA 1 1 1 896 1 1 62 ALA HB1 H 1.006 15.600 -8.877 1.70 . A A . 62 ALA HB1 1 1 1 897 1 1 62 ALA HB2 H 1.531 14.961 -7.318 1.60 . A A . 62 ALA HB2 1 1 1 898 1 1 62 ALA HB3 H 1.032 13.858 -8.601 1.70 . A A . 62 ALA HB3 1 1 1 899 1 1 62 ALA N N 3.031 15.323 -10.231 1.00 . A A . 62 ALA N 1 1 1 900 1 1 62 ALA O O 3.046 12.496 -8.006 1.80 . A A . 62 ALA O 1 1 1 901 1 1 63 SER C C 5.200 11.289 -11.431 0.60 . A A . 63 SER C 1 1 1 902 1 1 63 SER CA C 3.963 11.749 -10.660 0.50 . A A . 63 SER CA 1 1 1 903 1 1 63 SER CB C 2.816 12.085 -11.615 0.60 . A A . 63 SER CB 1 1 1 904 1 1 63 SER H H 5.120 13.444 -10.028 1.20 . A A . 63 SER H 1 1 1 905 1 1 63 SER HA H 3.679 10.966 -9.957 0.50 . A A . 63 SER HA 1 1 1 906 1 1 63 SER HB2 H 2.210 11.202 -11.819 1.20 . A A . 63 SER HB2 1 1 1 907 1 1 63 SER HB3 H 2.164 12.847 -11.187 0.90 . A A . 63 SER HB3 1 1 1 908 1 1 63 SER HG H 2.846 13.380 -13.015 1.60 . A A . 63 SER HG 1 1 1 909 1 1 63 SER N N 4.293 12.909 -9.857 0.60 . A A . 63 SER N 1 1 1 910 1 1 63 SER O O 5.416 11.629 -12.588 1.60 . A A . 63 SER O 1 1 1 911 1 1 63 SER OG O 3.307 12.571 -12.838 1.30 . A A . 63 SER OG 1 1 1 912 1 1 64 CYS C C 5.813 8.531 -9.257 0.50 . A A . 64 CYS C 1 1 1 913 1 1 64 CYS CA C 5.695 9.070 -10.684 0.50 . A A . 64 CYS CA 1 1 1 914 1 1 64 CYS CB C 6.648 8.325 -11.621 0.50 . A A . 64 CYS CB 1 1 1 915 1 1 64 CYS H H 6.694 10.881 -10.105 1.40 . A A . 64 CYS H 1 1 1 916 1 1 64 CYS HA H 4.663 8.968 -11.019 0.60 . A A . 64 CYS HA 1 1 1 917 1 1 64 CYS HB2 H 7.351 9.026 -12.072 0.70 . A A . 64 CYS HB2 1 1 1 918 1 1 64 CYS HB3 H 7.239 7.605 -11.055 0.70 . A A . 64 CYS HB3 1 1 1 919 1 1 64 CYS N N 5.990 10.489 -10.695 0.60 . A A . 64 CYS N 1 1 1 920 1 1 64 CYS O O 6.889 8.470 -8.674 1.10 . A A . 64 CYS O 1 1 1 921 1 1 64 CYS SG S 5.769 7.450 -12.939 1.30 . A A . 64 CYS SG 1 1 1 922 1 1 65 GLU C C 5.604 7.528 -6.604 1.00 . A A . 65 GLU C 1 1 1 923 1 1 65 GLU CA C 4.450 8.224 -7.308 1.10 . A A . 65 GLU CA 1 1 1 924 1 1 65 GLU CB C 3.095 7.624 -6.918 1.30 . A A . 65 GLU CB 1 1 1 925 1 1 65 GLU CD C 2.688 8.809 -4.750 1.90 . A A . 65 GLU CD 1 1 1 926 1 1 65 GLU CG C 2.958 7.453 -5.405 1.50 . A A . 65 GLU CG 1 1 1 927 1 1 65 GLU H H 3.896 7.824 -9.340 1.60 . A A . 65 GLU H 1 1 1 928 1 1 65 GLU HA H 4.491 9.256 -7.040 1.30 . A A . 65 GLU HA 1 1 1 929 1 1 65 GLU HB2 H 2.295 8.265 -7.288 1.50 . A A . 65 GLU HB2 1 1 1 930 1 1 65 GLU HB3 H 2.966 6.659 -7.407 1.30 . A A . 65 GLU HB3 1 1 1 931 1 1 65 GLU HG2 H 2.138 6.775 -5.169 1.70 . A A . 65 GLU HG2 1 1 1 932 1 1 65 GLU HG3 H 3.869 7.030 -4.981 1.70 . A A . 65 GLU HG3 1 1 1 933 1 1 65 GLU N N 4.631 8.149 -8.745 1.00 . A A . 65 GLU N 1 1 1 934 1 1 65 GLU O O 6.551 8.111 -6.092 1.10 . A A . 65 GLU O 1 1 1 935 1 1 65 GLU OE1 O 3.541 9.689 -4.847 1.90 . A A . 65 GLU OE1 1 1 1 936 1 1 65 GLU OE2 O 1.627 8.970 -4.149 2.40 . A A . 65 GLU OE2 1 1 1 937 1 1 66 CYS C C 7.167 4.902 -5.602 0.90 . A A . 66 CYS C 1 1 1 938 1 1 66 CYS CA C 5.686 5.289 -5.628 1.00 . A A . 66 CYS CA 1 1 1 939 1 1 66 CYS CB C 4.815 4.067 -5.910 1.20 . A A . 66 CYS CB 1 1 1 940 1 1 66 CYS H H 4.626 5.996 -7.258 1.10 . A A . 66 CYS H 1 1 1 941 1 1 66 CYS HA H 5.390 5.773 -4.699 1.10 . A A . 66 CYS HA 1 1 1 942 1 1 66 CYS HB2 H 5.458 3.241 -6.202 1.20 . A A . 66 CYS HB2 1 1 1 943 1 1 66 CYS HB3 H 4.306 3.818 -4.993 1.50 . A A . 66 CYS HB3 1 1 1 944 1 1 66 CYS N N 5.401 6.220 -6.682 1.00 . A A . 66 CYS N 1 1 1 945 1 1 66 CYS O O 7.529 3.752 -5.387 1.10 . A A . 66 CYS O 1 1 1 946 1 1 66 CYS SG S 3.532 4.251 -7.184 1.70 . A A . 66 CYS SG 1 1 1 947 1 1 67 PRO C C 7.744 7.220 -3.697 0.90 . A A . 67 PRO C 1 1 1 948 1 1 67 PRO CA C 8.684 6.659 -4.772 0.90 . A A . 67 PRO CA 1 1 1 949 1 1 67 PRO CB C 9.431 7.798 -5.477 0.90 . A A . 67 PRO CB 1 1 1 950 1 1 67 PRO CD C 8.365 6.361 -7.180 0.80 . A A . 67 PRO CD 1 1 1 951 1 1 67 PRO CG C 9.249 7.596 -6.989 0.80 . A A . 67 PRO CG 1 1 1 952 1 1 67 PRO HA H 9.398 5.992 -4.288 1.10 . A A . 67 PRO HA 1 1 1 953 1 1 67 PRO HB2 H 9.020 8.765 -5.173 1.00 . A A . 67 PRO HB2 1 1 1 954 1 1 67 PRO HB3 H 10.492 7.770 -5.217 0.80 . A A . 67 PRO HB3 1 1 1 955 1 1 67 PRO HD2 H 7.474 6.587 -7.763 0.70 . A A . 67 PRO HD2 1 1 1 956 1 1 67 PRO HD3 H 8.909 5.564 -7.688 0.90 . A A . 67 PRO HD3 1 1 1 957 1 1 67 PRO HG2 H 8.783 8.473 -7.437 0.80 . A A . 67 PRO HG2 1 1 1 958 1 1 67 PRO HG3 H 10.213 7.450 -7.476 1.00 . A A . 67 PRO HG3 1 1 1 959 1 1 67 PRO N N 8.007 5.933 -5.836 0.80 . A A . 67 PRO N 1 1 1 960 1 1 67 PRO O O 6.548 7.390 -3.893 1.30 . A A . 67 PRO O 1 1 1 961 1 1 68 GLU C C 6.838 5.952 -1.385 1.10 . A A . 68 GLU C 1 1 1 962 1 1 68 GLU CA C 8.161 6.718 -1.340 1.20 . A A . 68 GLU CA 1 1 1 963 1 1 68 GLU CB C 8.211 7.625 -0.111 1.50 . A A . 68 GLU CB 1 1 1 964 1 1 68 GLU CD C 7.637 9.849 0.882 2.80 . A A . 68 GLU CD 1 1 1 965 1 1 68 GLU CG C 7.565 8.984 -0.377 2.10 . A A . 68 GLU CG 1 1 1 966 1 1 68 GLU H H 9.093 8.204 -2.551 1.60 . A A . 68 GLU H 1 1 1 967 1 1 68 GLU HA H 8.964 5.986 -1.320 1.30 . A A . 68 GLU HA 1 1 1 968 1 1 68 GLU HB2 H 7.705 7.137 0.723 1.90 . A A . 68 GLU HB2 1 1 1 969 1 1 68 GLU HB3 H 9.247 7.768 0.195 1.90 . A A . 68 GLU HB3 1 1 1 970 1 1 68 GLU HG2 H 8.076 9.499 -1.191 2.40 . A A . 68 GLU HG2 1 1 1 971 1 1 68 GLU HG3 H 6.520 8.863 -0.664 2.50 . A A . 68 GLU HG3 1 1 1 972 1 1 68 GLU N N 8.384 7.502 -2.546 1.20 . A A . 68 GLU N 1 1 1 973 1 1 68 GLU O O 5.832 6.337 -0.803 1.20 . A A . 68 GLU O 1 1 1 974 1 1 68 GLU OE1 O 8.744 10.170 1.310 3.30 . A A . 68 GLU OE1 1 1 1 975 1 1 68 GLU OE2 O 6.585 10.193 1.419 3.40 . A A . 68 GLU OE2 1 1 1 976 1 1 69 GLY C C 9.091 3.725 -2.079 1.20 . A A . 69 GLY C 1 1 1 977 1 1 69 GLY CA C 7.650 3.705 -1.572 1.50 . A A . 69 GLY CA 1 1 1 978 1 1 69 GLY H H 6.731 4.877 -3.102 1.40 . A A . 69 GLY H 1 1 1 979 1 1 69 GLY HA2 H 7.620 3.791 -0.485 1.80 . A A . 69 GLY HA2 1 1 1 980 1 1 69 GLY HA3 H 7.138 2.798 -1.897 1.70 . A A . 69 GLY HA3 1 1 1 981 1 1 69 GLY N N 6.938 4.838 -2.128 1.20 . A A . 69 GLY N 1 1 1 982 1 1 69 GLY O O 10.047 3.716 -1.314 1.40 . A A . 69 GLY O 1 1 1 983 1 1 70 TYR C C 10.523 1.726 -3.421 0.80 . A A . 70 TYR C 1 1 1 984 1 1 70 TYR CA C 10.088 2.984 -4.187 0.80 . A A . 70 TYR CA 1 1 1 985 1 1 70 TYR CB C 11.295 3.823 -4.617 0.60 . A A . 70 TYR CB 1 1 1 986 1 1 70 TYR CD1 C 11.942 5.173 -2.551 1.30 . A A . 70 TYR CD1 1 1 1 987 1 1 70 TYR CD2 C 13.431 3.333 -3.317 1.50 . A A . 70 TYR CD2 1 1 1 988 1 1 70 TYR CE1 C 12.846 5.455 -1.468 1.40 . A A . 70 TYR CE1 1 1 1 989 1 1 70 TYR CE2 C 14.329 3.602 -2.227 1.70 . A A . 70 TYR CE2 1 1 1 990 1 1 70 TYR CG C 12.229 4.111 -3.481 0.70 . A A . 70 TYR CG 1 1 1 991 1 1 70 TYR CZ C 14.039 4.668 -1.305 1.10 . A A . 70 TYR CZ 1 1 1 992 1 1 70 TYR H H 8.547 4.438 -3.898 1.00 . A A . 70 TYR H 1 1 1 993 1 1 70 TYR HA H 9.533 2.664 -5.069 0.90 . A A . 70 TYR HA 1 1 1 994 1 1 70 TYR HB2 H 11.848 3.300 -5.397 0.60 . A A . 70 TYR HB2 1 1 1 995 1 1 70 TYR HB3 H 10.957 4.769 -5.041 0.60 . A A . 70 TYR HB3 1 1 1 996 1 1 70 TYR HD1 H 11.043 5.762 -2.666 2.10 . A A . 70 TYR HD1 1 1 1 997 1 1 70 TYR HD2 H 13.667 2.555 -4.027 2.30 . A A . 70 TYR HD2 1 1 1 998 1 1 70 TYR HE1 H 12.632 6.259 -0.779 2.10 . A A . 70 TYR HE1 1 1 1 999 1 1 70 TYR HE2 H 15.214 2.997 -2.094 2.50 . A A . 70 TYR HE2 1 1 1 1000 1 1 70 TYR HH H 15.240 5.819 -0.355 1.50 . A A . 70 TYR HH 1 1 1 1001 1 1 70 TYR N N 9.157 3.801 -3.422 0.90 . A A . 70 TYR N 1 1 1 1002 1 1 70 TYR O O 10.795 1.737 -2.228 1.10 . A A . 70 TYR O 1 1 1 1003 1 1 70 TYR OH O 14.904 4.937 -0.265 1.30 . A A . 70 TYR OH 1 1 1 1004 1 1 71 ILE C C 11.375 0.191 -6.462 0.90 . A A . 71 ILE C 1 1 1 1005 1 1 71 ILE CA C 11.771 0.443 -5.005 1.00 . A A . 71 ILE CA 1 1 1 1006 1 1 71 ILE CB C 12.575 -0.732 -4.444 1.20 . A A . 71 ILE CB 1 1 1 1007 1 1 71 ILE CD1 C 12.539 -0.312 -1.940 1.80 . A A . 71 ILE CD1 1 1 1 1008 1 1 71 ILE CG1 C 13.383 -0.311 -3.215 1.40 . A A . 71 ILE CG1 1 1 1 1009 1 1 71 ILE CG2 C 13.491 -1.332 -5.511 1.80 . A A . 71 ILE CG2 1 1 1 1010 1 1 71 ILE H H 9.822 -0.016 -4.239 1.10 . A A . 71 ILE H 1 1 1 1011 1 1 71 ILE HA H 12.342 1.370 -4.943 1.20 . A A . 71 ILE HA 1 1 1 1012 1 1 71 ILE HB H 11.870 -1.502 -4.131 1.70 . A A . 71 ILE HB 1 1 1 1013 1 1 71 ILE HD11 H 12.757 -1.187 -1.328 2.20 . A A . 71 ILE HD11 1 1 1 1014 1 1 71 ILE HD12 H 11.477 -0.324 -2.180 2.30 . A A . 71 ILE HD12 1 1 1 1015 1 1 71 ILE HD13 H 12.742 0.576 -1.341 2.10 . A A . 71 ILE HD13 1 1 1 1016 1 1 71 ILE HG12 H 14.228 -0.988 -3.089 1.60 . A A . 71 ILE HG12 1 1 1 1017 1 1 71 ILE HG13 H 13.805 0.680 -3.374 1.70 . A A . 71 ILE HG13 1 1 1 1018 1 1 71 ILE HG21 H 13.024 -2.199 -5.978 2.30 . A A . 71 ILE HG21 1 1 1 1019 1 1 71 ILE HG22 H 14.438 -1.651 -5.076 2.20 . A A . 71 ILE HG22 1 1 1 1020 1 1 71 ILE HG23 H 13.704 -0.602 -6.292 2.20 . A A . 71 ILE HG23 1 1 1 1021 1 1 71 ILE N N 10.577 0.638 -4.209 0.90 . A A . 71 ILE N 1 1 1 1022 1 1 71 ILE O O 11.509 -0.905 -6.992 0.90 . A A . 71 ILE O 1 1 1 1023 1 1 72 LEU C C 12.230 0.675 -9.063 0.80 . A A . 72 LEU C 1 1 1 1024 1 1 72 LEU CA C 11.206 1.632 -8.446 0.80 . A A . 72 LEU CA 1 1 1 1025 1 1 72 LEU CB C 11.718 3.070 -8.518 0.80 . A A . 72 LEU CB 1 1 1 1026 1 1 72 LEU CD1 C 9.563 3.887 -9.318 0.60 . A A . 72 LEU CD1 1 1 1 1027 1 1 72 LEU CD2 C 11.614 5.258 -9.769 0.70 . A A . 72 LEU CD2 1 1 1 1028 1 1 72 LEU CG C 11.040 3.848 -9.629 0.70 . A A . 72 LEU CG 1 1 1 1029 1 1 72 LEU H H 10.241 1.875 -6.562 0.90 . A A . 72 LEU H 1 1 1 1030 1 1 72 LEU HA H 10.283 1.543 -9.015 0.80 . A A . 72 LEU HA 1 1 1 1031 1 1 72 LEU HB2 H 11.575 3.571 -7.560 1.00 . A A . 72 LEU HB2 1 1 1 1032 1 1 72 LEU HB3 H 12.771 3.083 -8.732 1.00 . A A . 72 LEU HB3 1 1 1 1033 1 1 72 LEU HD11 H 9.155 4.863 -9.569 1.10 . A A . 72 LEU HD11 1 1 1 1034 1 1 72 LEU HD12 H 9.425 3.700 -8.253 1.10 . A A . 72 LEU HD12 1 1 1 1035 1 1 72 LEU HD13 H 9.051 3.107 -9.877 1.20 . A A . 72 LEU HD13 1 1 1 1036 1 1 72 LEU HD21 H 12.242 5.510 -8.915 1.40 . A A . 72 LEU HD21 1 1 1 1037 1 1 72 LEU HD22 H 10.815 5.997 -9.831 1.20 . A A . 72 LEU HD22 1 1 1 1038 1 1 72 LEU HD23 H 12.220 5.341 -10.672 1.20 . A A . 72 LEU HD23 1 1 1 1039 1 1 72 LEU HG H 11.187 3.316 -10.569 0.70 . A A . 72 LEU HG 1 1 1 1040 1 1 72 LEU N N 10.875 1.289 -7.067 0.80 . A A . 72 LEU N 1 1 1 1041 1 1 72 LEU O O 13.254 0.346 -8.476 0.90 . A A . 72 LEU O 1 1 1 1042 1 1 73 ASP C C 12.478 0.008 -12.681 1.20 . A A . 73 ASP C 1 1 1 1043 1 1 73 ASP CA C 12.349 0.958 -11.480 1.00 . A A . 73 ASP CA 1 1 1 1044 1 1 73 ASP CB C 13.707 1.580 -11.181 1.50 . A A . 73 ASP CB 1 1 1 1045 1 1 73 ASP CG C 14.294 2.252 -12.424 2.00 . A A . 73 ASP CG 1 1 1 1046 1 1 73 ASP H H 11.214 -0.493 -10.391 0.80 . A A . 73 ASP H 1 1 1 1047 1 1 73 ASP HA H 11.601 1.713 -11.712 1.20 . A A . 73 ASP HA 1 1 1 1048 1 1 73 ASP HB2 H 13.595 2.314 -10.385 1.90 . A A . 73 ASP HB2 1 1 1 1049 1 1 73 ASP HB3 H 14.382 0.799 -10.834 1.90 . A A . 73 ASP HB3 1 1 1 1050 1 1 73 ASP N N 11.866 0.259 -10.291 0.90 . A A . 73 ASP N 1 1 1 1051 1 1 73 ASP O O 13.376 0.119 -13.507 1.70 . A A . 73 ASP O 1 1 1 1052 1 1 73 ASP OD1 O 13.872 3.360 -12.749 2.80 . A A . 73 ASP OD1 1 1 1 1053 1 1 73 ASP OD2 O 15.170 1.658 -13.051 2.30 . A A . 73 ASP OD2 1 1 1 1054 1 1 74 ASP C C 10.789 -0.165 -14.909 1.40 . A A . 74 ASP C 1 1 1 1055 1 1 74 ASP CA C 10.843 -1.338 -13.913 1.80 . A A . 74 ASP CA 1 1 1 1056 1 1 74 ASP CB C 9.454 -1.859 -13.526 2.60 . A A . 74 ASP CB 1 1 1 1057 1 1 74 ASP CG C 9.572 -3.223 -12.843 3.20 . A A . 74 ASP CG 1 1 1 1058 1 1 74 ASP H H 11.322 -1.311 -11.794 1.40 . A A . 74 ASP H 1 1 1 1059 1 1 74 ASP HA H 11.419 -2.153 -14.346 2.30 . A A . 74 ASP HA 1 1 1 1060 1 1 74 ASP HB2 H 8.972 -1.171 -12.833 3.00 . A A . 74 ASP HB2 1 1 1 1061 1 1 74 ASP HB3 H 8.811 -1.964 -14.399 3.10 . A A . 74 ASP HB3 1 1 1 1062 1 1 74 ASP N N 11.523 -0.935 -12.696 1.30 . A A . 74 ASP N 1 1 1 1063 1 1 74 ASP O O 11.761 0.550 -15.115 1.80 . A A . 74 ASP O 1 1 1 1064 1 1 74 ASP OD1 O 10.498 -3.964 -13.166 3.70 . A A . 74 ASP OD1 1 1 1 1065 1 1 74 ASP OD2 O 8.734 -3.528 -11.996 3.60 . A A . 74 ASP OD2 1 1 1 1066 1 1 75 GLY C C 9.934 2.413 -15.587 1.10 . A A . 75 GLY C 1 1 1 1067 1 1 75 GLY CA C 9.282 1.200 -16.229 1.10 . A A . 75 GLY CA 1 1 1 1068 1 1 75 GLY H H 8.931 -0.765 -15.430 1.30 . A A . 75 GLY H 1 1 1 1069 1 1 75 GLY HA2 H 9.623 1.101 -17.240 1.30 . A A . 75 GLY HA2 1 1 1 1070 1 1 75 GLY HA3 H 8.197 1.311 -16.222 1.50 . A A . 75 GLY HA3 1 1 1 1071 1 1 75 GLY N N 9.595 -0.023 -15.510 1.00 . A A . 75 GLY N 1 1 1 1072 1 1 75 GLY O O 10.921 2.988 -16.030 1.40 . A A . 75 GLY O 1 1 1 1073 1 1 76 PHE C C 8.466 4.008 -12.555 0.80 . A A . 76 PHE C 1 1 1 1074 1 1 76 PHE CA C 9.514 3.882 -13.677 0.90 . A A . 76 PHE CA 1 1 1 1075 1 1 76 PHE CB C 9.505 5.136 -14.552 1.00 . A A . 76 PHE CB 1 1 1 1076 1 1 76 PHE CD1 C 12.002 5.515 -14.182 1.80 . A A . 76 PHE CD1 1 1 1 1077 1 1 76 PHE CD2 C 10.435 7.437 -13.975 2.00 . A A . 76 PHE CD2 1 1 1 1078 1 1 76 PHE CE1 C 13.110 6.383 -13.880 2.50 . A A . 76 PHE CE1 1 1 1 1079 1 1 76 PHE CE2 C 11.540 8.308 -13.673 2.70 . A A . 76 PHE CE2 1 1 1 1080 1 1 76 PHE CG C 10.661 6.038 -14.232 1.20 . A A . 76 PHE CG 1 1 1 1081 1 1 76 PHE CZ C 12.878 7.780 -13.625 2.80 . A A . 76 PHE CZ 1 1 1 1082 1 1 76 PHE H H 8.553 2.004 -14.334 1.00 . A A . 76 PHE H 1 1 1 1083 1 1 76 PHE HA H 10.496 3.723 -13.232 0.80 . A A . 76 PHE HA 1 1 1 1084 1 1 76 PHE HB2 H 9.555 4.859 -15.605 1.60 . A A . 76 PHE HB2 1 1 1 1085 1 1 76 PHE HB3 H 8.575 5.685 -14.407 1.30 . A A . 76 PHE HB3 1 1 1 1086 1 1 76 PHE HD1 H 12.179 4.466 -14.373 2.30 . A A . 76 PHE HD1 1 1 1 1087 1 1 76 PHE HD2 H 9.432 7.835 -14.011 2.50 . A A . 76 PHE HD2 1 1 1 1088 1 1 76 PHE HE1 H 14.114 5.986 -13.845 3.20 . A A . 76 PHE HE1 1 1 1 1089 1 1 76 PHE HE2 H 11.365 9.357 -13.484 3.50 . A A . 76 PHE HE2 1 1 1 1090 1 1 76 PHE HZ H 13.707 8.432 -13.397 3.50 . A A . 76 PHE HZ 1 1 1 1091 1 1 76 PHE N N 9.242 2.710 -14.497 0.90 . A A . 76 PHE N 1 1 1 1092 1 1 76 PHE O O 8.020 5.091 -12.196 0.80 . A A . 76 PHE O 1 1 1 1093 1 1 77 ILE C C 5.695 3.002 -11.787 0.70 . A A . 77 ILE C 1 1 1 1094 1 1 77 ILE CA C 6.848 2.298 -12.518 0.80 . A A . 77 ILE CA 1 1 1 1095 1 1 77 ILE CB C 6.892 0.788 -12.312 0.90 . A A . 77 ILE CB 1 1 1 1096 1 1 77 ILE CD1 C 6.130 -1.476 -13.148 1.20 . A A . 77 ILE CD1 1 1 1 1097 1 1 77 ILE CG1 C 5.878 0.032 -13.169 1.10 . A A . 77 ILE CG1 1 1 1 1098 1 1 77 ILE CG2 C 6.794 0.434 -10.840 0.90 . A A . 77 ILE CG2 1 1 1 1099 1 1 77 ILE H H 8.885 2.187 -11.940 0.80 . A A . 77 ILE H 1 1 1 1100 1 1 77 ILE HA H 6.810 2.455 -13.594 0.80 . A A . 77 ILE HA 1 1 1 1101 1 1 77 ILE HB H 7.875 0.468 -12.648 0.90 . A A . 77 ILE HB 1 1 1 1102 1 1 77 ILE HD11 H 5.202 -2.030 -13.294 1.50 . A A . 77 ILE HD11 1 1 1 1103 1 1 77 ILE HD12 H 6.558 -1.784 -12.194 1.60 . A A . 77 ILE HD12 1 1 1 1104 1 1 77 ILE HD13 H 6.822 -1.766 -13.938 1.70 . A A . 77 ILE HD13 1 1 1 1105 1 1 77 ILE HG12 H 4.872 0.235 -12.816 1.30 . A A . 77 ILE HG12 1 1 1 1106 1 1 77 ILE HG13 H 5.927 0.391 -14.197 1.10 . A A . 77 ILE HG13 1 1 1 1107 1 1 77 ILE HG21 H 7.154 1.267 -10.236 1.10 . A A . 77 ILE HG21 1 1 1 1108 1 1 77 ILE HG22 H 7.410 -0.439 -10.625 1.40 . A A . 77 ILE HG22 1 1 1 1109 1 1 77 ILE HG23 H 5.763 0.218 -10.569 1.40 . A A . 77 ILE HG23 1 1 1 1110 1 1 77 ILE N N 8.116 2.814 -12.040 0.80 . A A . 77 ILE N 1 1 1 1111 1 1 77 ILE O O 5.868 4.062 -11.197 0.80 . A A . 77 ILE O 1 1 1 1112 1 1 78 CYS C C 2.509 3.280 -10.813 0.70 . A A . 78 CYS C 1 1 1 1113 1 1 78 CYS CA C 3.655 2.269 -10.696 0.50 . A A . 78 CYS CA 1 1 1 1114 1 1 78 CYS CB C 4.451 2.482 -9.403 0.40 . A A . 78 CYS CB 1 1 1 1115 1 1 78 CYS H H 4.246 1.907 -12.715 0.50 . A A . 78 CYS H 1 1 1 1116 1 1 78 CYS HA H 3.231 1.265 -10.715 0.60 . A A . 78 CYS HA 1 1 1 1117 1 1 78 CYS HB2 H 3.968 1.949 -8.586 0.70 . A A . 78 CYS HB2 1 1 1 1118 1 1 78 CYS HB3 H 5.449 2.055 -9.510 0.70 . A A . 78 CYS HB3 1 1 1 1119 1 1 78 CYS N N 4.518 2.355 -11.863 0.50 . A A . 78 CYS N 1 1 1 1120 1 1 78 CYS O O 2.246 4.073 -9.917 1.70 . A A . 78 CYS O 1 1 1 1121 1 1 78 CYS SG S 4.612 4.214 -8.914 1.00 . A A . 78 CYS SG 1 1 1 1122 1 1 79 THR C C 0.197 3.875 -13.637 0.90 . A A . 79 THR C 1 1 1 1123 1 1 79 THR CA C 0.699 4.045 -12.202 0.70 . A A . 79 THR CA 1 1 1 1124 1 1 79 THR CB C 1.083 5.505 -11.955 0.90 . A A . 79 THR CB 1 1 1 1125 1 1 79 THR CG2 C 2.385 5.877 -12.664 1.60 . A A . 79 THR CG2 1 1 1 1126 1 1 79 THR H H 2.121 2.507 -12.660 1.30 . A A . 79 THR H 1 1 1 1127 1 1 79 THR HA H -0.076 3.716 -11.511 0.80 . A A . 79 THR HA 1 1 1 1128 1 1 79 THR HB H 1.186 5.682 -10.885 0.70 . A A . 79 THR HB 1 1 1 1129 1 1 79 THR HG1 H -0.018 6.195 -13.350 2.00 . A A . 79 THR HG1 1 1 1 1130 1 1 79 THR HG21 H 2.244 5.905 -13.744 2.00 . A A . 79 THR HG21 1 1 1 1131 1 1 79 THR HG22 H 3.169 5.152 -12.445 2.20 . A A . 79 THR HG22 1 1 1 1132 1 1 79 THR HG23 H 2.735 6.859 -12.345 2.10 . A A . 79 THR HG23 1 1 1 1133 1 1 79 THR N N 1.845 3.183 -11.978 0.70 . A A . 79 THR N 1 1 1 1134 1 1 79 THR O O 0.273 4.778 -14.461 1.50 . A A . 79 THR O 1 1 1 1135 1 1 79 THR OG1 O 0.050 6.338 -12.416 1.70 . A A . 79 THR OG1 1 1 1 1136 1 1 80 ASP C C -2.395 3.742 -14.654 1.10 . A A . 80 ASP C 1 1 1 1137 1 1 80 ASP CA C -1.747 2.468 -14.085 1.20 . A A . 80 ASP CA 1 1 1 1138 1 1 80 ASP CB C -2.379 2.028 -12.755 1.70 . A A . 80 ASP CB 1 1 1 1139 1 1 80 ASP CG C -3.838 2.478 -12.617 2.40 . A A . 80 ASP CG 1 1 1 1140 1 1 80 ASP H H 0.273 1.846 -13.843 0.80 . A A . 80 ASP H 1 1 1 1141 1 1 80 ASP HA H -1.825 1.677 -14.831 1.50 . A A . 80 ASP HA 1 1 1 1142 1 1 80 ASP HB2 H -2.345 0.940 -12.669 1.80 . A A . 80 ASP HB2 1 1 1 1143 1 1 80 ASP HB3 H -1.811 2.450 -11.923 2.10 . A A . 80 ASP HB3 1 1 1 1144 1 1 80 ASP N N -0.318 2.653 -13.874 0.80 . A A . 80 ASP N 1 1 1 1145 1 1 80 ASP O O -3.046 4.508 -13.955 1.90 . A A . 80 ASP O 1 1 1 1146 1 1 80 ASP OD1 O -4.719 1.780 -13.113 2.90 . A A . 80 ASP OD1 1 1 1 1147 1 1 80 ASP OD2 O -4.073 3.524 -12.013 2.90 . A A . 80 ASP OD2 1 1 1 1148 1 1 81 ILE C C -4.502 3.641 -16.843 1.60 . A A . 81 ILE C 1 1 1 1149 1 1 81 ILE CA C -3.220 4.493 -16.781 1.30 . A A . 81 ILE CA 1 1 1 1150 1 1 81 ILE CB C -2.694 4.700 -18.201 1.70 . A A . 81 ILE CB 1 1 1 1151 1 1 81 ILE CD1 C -4.396 4.546 -20.082 3.00 . A A . 81 ILE CD1 1 1 1 1152 1 1 81 ILE CG1 C -3.714 5.453 -19.057 2.50 . A A . 81 ILE CG1 1 1 1 1153 1 1 81 ILE CG2 C -2.314 3.364 -18.840 1.90 . A A . 81 ILE CG2 1 1 1 1154 1 1 81 ILE H H -1.204 4.066 -16.234 1.50 . A A . 81 ILE H 1 1 1 1155 1 1 81 ILE HA H -3.442 5.457 -16.330 1.50 . A A . 81 ILE HA 1 1 1 1156 1 1 81 ILE HB H -1.793 5.311 -18.140 2.20 . A A . 81 ILE HB 1 1 1 1157 1 1 81 ILE HD11 H -3.741 4.364 -20.933 3.20 . A A . 81 ILE HD11 1 1 1 1158 1 1 81 ILE HD12 H -5.314 5.000 -20.455 3.40 . A A . 81 ILE HD12 1 1 1 1159 1 1 81 ILE HD13 H -4.651 3.582 -19.642 3.30 . A A . 81 ILE HD13 1 1 1 1160 1 1 81 ILE HG12 H -4.468 5.904 -18.411 2.70 . A A . 81 ILE HG12 1 1 1 1161 1 1 81 ILE HG13 H -3.219 6.276 -19.573 3.00 . A A . 81 ILE HG13 1 1 1 1162 1 1 81 ILE HG21 H -2.137 3.482 -19.910 2.20 . A A . 81 ILE HG21 1 1 1 1163 1 1 81 ILE HG22 H -3.109 2.630 -18.708 2.30 . A A . 81 ILE HG22 1 1 1 1164 1 1 81 ILE HG23 H -1.407 2.962 -18.389 2.30 . A A . 81 ILE HG23 1 1 1 1165 1 1 81 ILE N N -2.155 3.919 -15.968 1.00 . A A . 81 ILE N 1 1 1 1166 1 1 81 ILE O O -5.392 3.902 -17.642 2.40 . A A . 81 ILE O 1 1 1 1167 1 1 82 ASP C C -6.604 1.653 -16.867 2.70 . A A . 82 ASP C 1 1 1 1168 1 1 82 ASP CA C -5.168 1.382 -16.411 2.60 . A A . 82 ASP CA 1 1 1 1169 1 1 82 ASP CB C -5.158 0.350 -15.283 3.50 . A A . 82 ASP CB 1 1 1 1170 1 1 82 ASP CG C -5.397 -1.049 -15.855 3.90 . A A . 82 ASP CG 1 1 1 1171 1 1 82 ASP H H -4.153 2.759 -15.065 2.10 . A A . 82 ASP H 1 1 1 1172 1 1 82 ASP HA H -4.581 1.036 -17.262 3.00 . A A . 82 ASP HA 1 1 1 1173 1 1 82 ASP HB2 H -4.201 0.357 -14.763 3.90 . A A . 82 ASP HB2 1 1 1 1174 1 1 82 ASP HB3 H -5.937 0.571 -14.554 3.90 . A A . 82 ASP HB3 1 1 1 1175 1 1 82 ASP N N -4.554 2.622 -15.970 1.90 . A A . 82 ASP N 1 1 1 1176 1 1 82 ASP O O -6.915 1.657 -18.052 3.30 . A A . 82 ASP O 1 1 1 1177 1 1 82 ASP OD1 O -5.253 -1.223 -17.065 4.20 . A A . 82 ASP OD1 1 1 1 1178 1 1 82 ASP OD2 O -5.726 -1.950 -15.084 4.50 . A A . 82 ASP OD2 1 1 1 1179 1 1 83 GLU C C -9.364 1.401 -17.284 1.00 . A A . 83 GLU C 1 1 1 1180 1 1 83 GLU CA C -8.760 1.259 -15.884 1.00 . A A . 83 GLU CA 1 1 1 1181 1 1 83 GLU CB C -9.674 1.915 -14.848 1.00 . A A . 83 GLU CB 1 1 1 1182 1 1 83 GLU CD C -11.489 0.191 -14.829 1.00 . A A . 83 GLU CD 1 1 1 1183 1 1 83 GLU CG C -10.406 0.879 -13.995 1.00 . A A . 83 GLU CG 1 1 1 1184 1 1 83 GLU H H -7.185 2.468 -15.081 1.00 . A A . 83 GLU H 1 1 1 1185 1 1 83 GLU HA H -8.611 0.202 -15.661 1.00 . A A . 83 GLU HA 1 1 1 1186 1 1 83 GLU HB2 H -9.085 2.568 -14.204 1.00 . A A . 83 GLU HB2 1 1 1 1187 1 1 83 GLU HB3 H -10.402 2.551 -15.353 1.00 . A A . 83 GLU HB3 1 1 1 1188 1 1 83 GLU HG2 H -9.711 0.125 -13.626 1.00 . A A . 83 GLU HG2 1 1 1 1189 1 1 83 GLU HG3 H -10.872 1.352 -13.131 1.00 . A A . 83 GLU HG3 1 1 1 1190 1 1 83 GLU N N -7.450 1.881 -15.846 1.00 . A A . 83 GLU N 1 1 1 1191 1 1 83 GLU O O -9.528 0.386 -17.959 1.00 . A A . 83 GLU O 1 1 1 1192 1 1 83 GLU OXT O -9.663 2.525 -17.682 1.00 . A A . 83 GLU OXT 1 1 1 1193 1 1 83 GLU OE1 O -11.158 -0.724 -15.581 1.00 . A A . 83 GLU OE1 1 1 1 1194 1 1 83 GLU OE2 O -12.651 0.578 -14.715 1.00 . A A . 83 GLU OE2 1 1 1 1195 2 2 1 NAG C1 C -15.720 2.386 10.943 1.00 . B A . 121 NAG C1 1 1 1 1196 2 2 1 NAG C2 C -14.576 3.391 10.829 1.00 . B A . 121 NAG C2 1 1 1 1197 2 2 1 NAG C3 C -15.066 4.825 11.023 1.00 . B A . 121 NAG C3 1 1 1 1198 2 2 1 NAG C4 C -16.172 4.910 12.076 1.00 . B A . 121 NAG C4 1 1 1 1199 2 2 1 NAG C5 C -17.283 3.880 11.848 1.00 . B A . 121 NAG C5 1 1 1 1200 2 2 1 NAG C6 C -18.623 4.557 11.556 1.00 . B A . 121 NAG C6 1 1 1 1201 2 2 1 NAG C7 C -12.275 3.197 11.469 1.00 . B A . 121 NAG C7 1 1 1 1202 2 2 1 NAG C8 C -11.581 1.840 11.340 1.00 . B A . 121 NAG C8 1 1 1 1203 2 2 1 NAG H1 H -15.710 1.878 11.908 1.00 . B A . 121 NAG H1 1 1 1 1204 2 2 1 NAG H2 H -14.079 3.290 9.865 1.00 . B A . 121 NAG H2 1 1 1 1205 2 2 1 NAG H3 H -14.230 5.454 11.326 1.00 . B A . 121 NAG H3 1 1 1 1206 2 2 1 NAG H4 H -16.603 5.911 12.063 1.00 . B A . 121 NAG H4 1 1 1 1207 2 2 1 NAG H5 H -17.382 3.262 12.740 1.00 . B A . 121 NAG H5 1 1 1 1208 2 2 1 NAG H61 H -18.550 5.201 10.680 1.00 . B A . 121 NAG H61 1 1 1 1209 2 2 1 NAG H62 H -18.941 5.171 12.399 1.00 . B A . 121 NAG H62 1 1 1 1210 2 2 1 NAG H81 H -12.096 1.102 11.955 1.00 . B A . 121 NAG H81 1 1 1 1211 2 2 1 NAG H82 H -11.598 1.509 10.301 1.00 . B A . 121 NAG H82 1 1 1 1212 2 2 1 NAG H83 H -10.545 1.920 11.669 1.00 . B A . 121 NAG H83 1 1 1 1213 2 2 1 NAG HN2 H -13.824 2.816 12.753 1.00 . B A . 121 NAG HN2 1 1 1 1214 2 2 1 NAG HO3 H -15.953 6.160 9.988 1.00 . B A . 121 NAG HO3 1 1 1 1215 2 2 1 NAG HO4 H -16.101 5.271 13.948 1.00 . B A . 121 NAG HO4 1 1 1 1216 2 2 1 NAG HO6 H -20.350 4.060 10.917 1.00 . B A . 121 NAG HO6 1 1 1 1217 2 2 1 NAG N2 N -13.567 3.092 11.827 1.00 . B A . 121 NAG N2 1 1 1 1218 2 2 1 NAG O3 O -15.541 5.327 9.799 1.00 . B A . 121 NAG O3 1 1 1 1219 2 2 1 NAG O4 O -15.614 4.718 13.351 1.00 . B A . 121 NAG O4 1 1 1 1220 2 2 1 NAG O5 O -16.949 3.047 10.764 1.00 . B A . 121 NAG O5 1 1 1 1221 2 2 1 NAG O6 O -19.621 3.599 11.311 1.00 . B A . 121 NAG O6 1 1 1 1222 2 2 1 NAG O7 O -11.684 4.250 11.258 1.00 . B A . 121 NAG O7 1 1 1 1223 3 2 1 NAG C1 C -4.750 -6.677 -8.002 1.00 . C A . 148 NAG C1 1 1 1 1224 3 2 1 NAG C2 C -5.169 -6.643 -6.539 1.00 . C A . 148 NAG C2 1 1 1 1225 3 2 1 NAG C3 C -4.823 -7.923 -5.770 1.00 . C A . 148 NAG C3 1 1 1 1226 3 2 1 NAG C4 C -3.559 -8.638 -6.265 1.00 . C A . 148 NAG C4 1 1 1 1227 3 2 1 NAG C5 C -3.306 -8.482 -7.767 1.00 . C A . 148 NAG C5 1 1 1 1228 3 2 1 NAG C6 C -2.922 -9.812 -8.417 1.00 . C A . 148 NAG C6 1 1 1 1229 3 2 1 NAG C7 C -3.202 -5.484 -5.757 1.00 . C A . 148 NAG C7 1 1 1 1230 3 2 1 NAG C8 C -2.754 -4.672 -4.540 1.00 . C A . 148 NAG C8 1 1 1 1231 3 2 1 NAG H1 H -3.880 -6.038 -8.153 1.00 . C A . 148 NAG H1 1 1 1 1232 3 2 1 NAG H2 H -6.241 -6.454 -6.472 1.00 . C A . 148 NAG H2 1 1 1 1233 3 2 1 NAG H3 H -4.693 -7.671 -4.718 1.00 . C A . 148 NAG H3 1 1 1 1234 3 2 1 NAG H4 H -3.648 -9.700 -6.034 1.00 . C A . 148 NAG H4 1 1 1 1235 3 2 1 NAG H5 H -2.502 -7.764 -7.922 1.00 . C A . 148 NAG H5 1 1 1 1236 3 2 1 NAG H61 H -3.278 -10.653 -7.823 1.00 . C A . 148 NAG H61 1 1 1 1237 3 2 1 NAG H62 H -1.841 -9.900 -8.516 1.00 . C A . 148 NAG H62 1 1 1 1238 3 2 1 NAG H81 H -2.945 -3.611 -4.703 1.00 . C A . 148 NAG H81 1 1 1 1239 3 2 1 NAG H82 H -3.303 -4.996 -3.656 1.00 . C A . 148 NAG H82 1 1 1 1240 3 2 1 NAG H83 H -1.687 -4.815 -4.370 1.00 . C A . 148 NAG H83 1 1 1 1241 3 2 1 NAG HN2 H -5.076 -4.680 -5.713 1.00 . C A . 148 NAG HN2 1 1 1 1242 3 2 1 NAG HO3 H -5.548 -9.688 -5.781 1.00 . C A . 148 NAG HO3 1 1 1 1243 3 2 1 NAG HO4 H -1.705 -8.212 -6.141 1.00 . C A . 148 NAG HO4 1 1 1 1244 3 2 1 NAG HO6 H -3.149 -10.709 -10.086 1.00 . C A . 148 NAG HO6 1 1 1 1245 3 2 1 NAG N2 N -4.538 -5.496 -5.915 1.00 . C A . 148 NAG N2 1 1 1 1246 3 2 1 NAG O3 O -5.908 -8.813 -5.844 1.00 . C A . 148 NAG O3 1 1 1 1247 3 2 1 NAG O4 O -2.446 -8.164 -5.552 1.00 . C A . 148 NAG O4 1 1 1 1248 3 2 1 NAG O5 O -4.465 -7.995 -8.393 1.00 . C A . 148 NAG O5 1 1 1 1249 3 2 1 NAG O6 O -3.488 -9.913 -9.700 1.00 . C A . 148 NAG O6 1 1 1 1250 3 2 1 NAG O7 O -2.399 -6.042 -6.495 1.00 . C A . 148 NAG O7 1 1 2 1251 1 1 1 HIS C C 3.132 -9.520 27.299 1.00 . A A . 1 HIS C 1 1 2 1252 1 1 1 HIS CA C 3.507 -10.924 27.775 1.00 . A A . 1 HIS CA 1 1 2 1253 1 1 1 HIS CB C 4.432 -11.574 26.745 1.00 . A A . 1 HIS CB 1 1 2 1254 1 1 1 HIS CD2 C 5.285 -13.303 28.407 1.00 . A A . 1 HIS CD2 1 1 2 1255 1 1 1 HIS CE1 C 7.453 -13.377 27.853 1.00 . A A . 1 HIS CE1 1 1 2 1256 1 1 1 HIS CG C 5.474 -12.439 27.394 1.00 . A A . 1 HIS CG 1 1 2 1257 1 1 1 HIS H1 H 1.557 -11.428 27.374 1.00 . A A . 1 HIS H1 1 1 2 1258 1 1 1 HIS H2 H 2.538 -12.733 27.843 1.00 . A A . 1 HIS H2 1 1 2 1259 1 1 1 HIS H3 H 2.009 -11.609 29.001 1.00 . A A . 1 HIS H3 1 1 2 1260 1 1 1 HIS HA H 4.028 -10.830 28.727 1.00 . A A . 1 HIS HA 1 1 2 1261 1 1 1 HIS HB2 H 3.845 -12.176 26.051 1.00 . A A . 1 HIS HB2 1 1 2 1262 1 1 1 HIS HB3 H 4.923 -10.802 26.152 1.00 . A A . 1 HIS HB3 1 1 2 1263 1 1 1 HIS HD2 H 4.351 -13.502 28.898 1.00 . A A . 1 HIS HD2 1 1 2 1264 1 1 1 HIS HE1 H 8.508 -13.636 27.831 1.00 . A A . 1 HIS HE1 1 1 2 1265 1 1 1 HIS HE2 H 6.736 -14.600 29.431 1.00 . A A . 1 HIS HE2 1 1 2 1266 1 1 1 HIS N N 2.317 -11.732 28.015 1.00 . A A . 1 HIS N 1 1 2 1267 1 1 1 HIS ND1 N 6.898 -12.479 27.019 1.00 . A A . 1 HIS ND1 1 1 2 1268 1 1 1 HIS NE2 N 6.581 -13.922 28.713 1.00 . A A . 1 HIS NE2 1 1 2 1269 1 1 1 HIS O O 3.594 -8.514 27.823 1.00 . A A . 1 HIS O 1 1 2 1270 1 1 2 MET C C 1.860 -7.173 25.776 1.00 . A A . 2 MET C 1 1 2 1271 1 1 2 MET CA C 2.411 -8.501 25.257 1.00 . A A . 2 MET CA 1 1 2 1272 1 1 2 MET CB C 1.664 -8.904 23.987 1.00 . A A . 2 MET CB 1 1 2 1273 1 1 2 MET CE C 4.062 -10.347 20.947 1.00 . A A . 2 MET CE 1 1 2 1274 1 1 2 MET CG C 2.493 -9.841 23.107 1.00 . A A . 2 MET CG 1 1 2 1275 1 1 2 MET H H 1.539 -10.212 26.213 1.00 . A A . 2 MET H 1 1 2 1276 1 1 2 MET HA H 3.480 -8.401 25.069 1.00 . A A . 2 MET HA 1 1 2 1277 1 1 2 MET HB2 H 0.724 -9.388 24.252 1.00 . A A . 2 MET HB2 1 1 2 1278 1 1 2 MET HB3 H 1.406 -8.004 23.428 1.00 . A A . 2 MET HB3 1 1 2 1279 1 1 2 MET HE1 H 3.420 -10.950 20.304 1.00 . A A . 2 MET HE1 1 1 2 1280 1 1 2 MET HE2 H 4.461 -10.982 21.738 1.00 . A A . 2 MET HE2 1 1 2 1281 1 1 2 MET HE3 H 4.892 -9.964 20.352 1.00 . A A . 2 MET HE3 1 1 2 1282 1 1 2 MET HG2 H 3.332 -10.244 23.675 1.00 . A A . 2 MET HG2 1 1 2 1283 1 1 2 MET HG3 H 1.887 -10.687 22.783 1.00 . A A . 2 MET HG3 1 1 2 1284 1 1 2 MET N N 2.264 -9.525 26.271 1.00 . A A . 2 MET N 1 1 2 1285 1 1 2 MET O O 1.140 -7.111 26.765 1.00 . A A . 2 MET O 1 1 2 1286 1 1 2 MET SD S 3.125 -8.983 21.657 1.00 . A A . 2 MET SD 1 1 2 1287 1 1 3 GLU C C -0.138 -5.408 24.960 1.00 . A A . 3 GLU C 1 1 2 1288 1 1 3 GLU CA C 1.297 -5.190 24.443 1.00 . A A . 3 GLU CA 1 1 2 1289 1 1 3 GLU CB C 1.334 -5.313 22.919 1.00 . A A . 3 GLU CB 1 1 2 1290 1 1 3 GLU CD C 3.576 -4.237 23.199 1.00 . A A . 3 GLU CD 1 1 2 1291 1 1 3 GLU CG C 2.762 -5.238 22.377 1.00 . A A . 3 GLU CG 1 1 2 1292 1 1 3 GLU H H 3.230 -5.976 24.879 1.00 . A A . 3 GLU H 1 1 2 1293 1 1 3 GLU HA H 1.653 -4.208 24.744 1.00 . A A . 3 GLU HA 1 1 2 1294 1 1 3 GLU HB2 H 0.885 -6.262 22.617 1.00 . A A . 3 GLU HB2 1 1 2 1295 1 1 3 GLU HB3 H 0.737 -4.512 22.477 1.00 . A A . 3 GLU HB3 1 1 2 1296 1 1 3 GLU HG2 H 3.245 -6.214 22.427 1.00 . A A . 3 GLU HG2 1 1 2 1297 1 1 3 GLU HG3 H 2.760 -4.921 21.334 1.00 . A A . 3 GLU HG3 1 1 2 1298 1 1 3 GLU N N 2.252 -6.122 25.032 1.00 . A A . 3 GLU N 1 1 2 1299 1 1 3 GLU O O -0.559 -6.521 25.251 1.00 . A A . 3 GLU O 1 1 2 1300 1 1 3 GLU OE1 O 3.242 -3.053 23.180 1.00 . A A . 3 GLU OE1 1 1 2 1301 1 1 3 GLU OE2 O 4.535 -4.653 23.847 1.00 . A A . 3 GLU OE2 1 1 2 1302 1 1 4 PRO C C -3.103 -4.749 24.042 1.00 . A A . 4 PRO C 1 1 2 1303 1 1 4 PRO CA C -2.313 -4.285 25.271 1.00 . A A . 4 PRO CA 1 1 2 1304 1 1 4 PRO CB C -2.685 -2.828 25.541 1.00 . A A . 4 PRO CB 1 1 2 1305 1 1 4 PRO CD C -0.296 -2.945 24.941 1.00 . A A . 4 PRO CD 1 1 2 1306 1 1 4 PRO CG C -1.467 -1.986 25.147 1.00 . A A . 4 PRO CG 1 1 2 1307 1 1 4 PRO HA H -2.554 -4.921 26.123 1.00 . A A . 4 PRO HA 1 1 2 1308 1 1 4 PRO HB2 H -3.559 -2.539 24.957 1.00 . A A . 4 PRO HB2 1 1 2 1309 1 1 4 PRO HB3 H -2.927 -2.684 26.594 1.00 . A A . 4 PRO HB3 1 1 2 1310 1 1 4 PRO HD2 H 0.157 -2.814 23.958 1.00 . A A . 4 PRO HD2 1 1 2 1311 1 1 4 PRO HD3 H 0.472 -2.806 25.701 1.00 . A A . 4 PRO HD3 1 1 2 1312 1 1 4 PRO HG2 H -1.673 -1.453 24.220 1.00 . A A . 4 PRO HG2 1 1 2 1313 1 1 4 PRO HG3 H -1.234 -1.262 25.924 1.00 . A A . 4 PRO HG3 1 1 2 1314 1 1 4 PRO N N -0.871 -4.272 25.051 1.00 . A A . 4 PRO N 1 1 2 1315 1 1 4 PRO O O -4.220 -4.314 23.790 1.00 . A A . 4 PRO O 1 1 2 1316 1 1 5 VAL C C -3.769 -4.986 21.337 1.00 . A A . 5 VAL C 1 1 2 1317 1 1 5 VAL CA C -2.477 -5.625 21.854 1.00 . A A . 5 VAL CA 1 1 2 1318 1 1 5 VAL CB C -2.374 -7.045 21.310 1.00 . A A . 5 VAL CB 1 1 2 1319 1 1 5 VAL CG1 C -2.100 -7.044 19.806 1.00 . A A . 5 VAL CG1 1 1 2 1320 1 1 5 VAL CG2 C -1.333 -7.881 22.058 1.00 . A A . 5 VAL CG2 1 1 2 1321 1 1 5 VAL H H -1.797 -6.255 23.774 1.00 . A A . 5 VAL H 1 1 2 1322 1 1 5 VAL HA H -1.624 -5.025 21.536 1.00 . A A . 5 VAL HA 1 1 2 1323 1 1 5 VAL HB H -3.348 -7.492 21.478 1.00 . A A . 5 VAL HB 1 1 2 1324 1 1 5 VAL HG11 H -1.448 -7.873 19.530 1.00 . A A . 5 VAL HG11 1 1 2 1325 1 1 5 VAL HG12 H -3.027 -7.144 19.242 1.00 . A A . 5 VAL HG12 1 1 2 1326 1 1 5 VAL HG13 H -1.616 -6.117 19.499 1.00 . A A . 5 VAL HG13 1 1 2 1327 1 1 5 VAL HG21 H -0.590 -8.281 21.368 1.00 . A A . 5 VAL HG21 1 1 2 1328 1 1 5 VAL HG22 H -0.808 -7.291 22.808 1.00 . A A . 5 VAL HG22 1 1 2 1329 1 1 5 VAL HG23 H -1.805 -8.722 22.565 1.00 . A A . 5 VAL HG23 1 1 2 1330 1 1 5 VAL N N -2.442 -5.658 23.305 1.00 . A A . 5 VAL N 1 1 2 1331 1 1 5 VAL O O -4.873 -5.277 21.780 1.00 . A A . 5 VAL O 1 1 2 1332 1 1 6 ASP C C -5.673 -4.753 19.307 1.00 . A A . 6 ASP C 1 1 2 1333 1 1 6 ASP CA C -4.511 -3.753 19.350 1.00 . A A . 6 ASP CA 1 1 2 1334 1 1 6 ASP CB C -3.808 -3.693 17.994 1.00 . A A . 6 ASP CB 1 1 2 1335 1 1 6 ASP CG C -3.638 -5.100 17.415 1.00 . A A . 6 ASP CG 1 1 2 1336 1 1 6 ASP H H -2.612 -3.698 20.300 1.00 . A A . 6 ASP H 1 1 2 1337 1 1 6 ASP HA H -4.902 -2.776 19.630 1.00 . A A . 6 ASP HA 1 1 2 1338 1 1 6 ASP HB2 H -4.374 -3.083 17.298 1.00 . A A . 6 ASP HB2 1 1 2 1339 1 1 6 ASP HB3 H -2.826 -3.234 18.092 1.00 . A A . 6 ASP HB3 1 1 2 1340 1 1 6 ASP N N -3.524 -4.099 20.358 1.00 . A A . 6 ASP N 1 1 2 1341 1 1 6 ASP O O -5.515 -5.947 19.531 1.00 . A A . 6 ASP O 1 1 2 1342 1 1 6 ASP OD1 O -4.643 -5.715 17.064 1.00 . A A . 6 ASP OD1 1 1 2 1343 1 1 6 ASP OD2 O -2.502 -5.563 17.323 1.00 . A A . 6 ASP OD2 1 1 2 1344 1 1 7 PRO C C -6.625 -3.493 16.620 1.00 . A A . 7 PRO C 1 1 2 1345 1 1 7 PRO CA C -7.451 -4.237 17.675 1.00 . A A . 7 PRO CA 1 1 2 1346 1 1 7 PRO CB C -8.827 -3.579 17.819 1.00 . A A . 7 PRO CB 1 1 2 1347 1 1 7 PRO CD C -7.659 -3.474 19.991 1.00 . A A . 7 PRO CD 1 1 2 1348 1 1 7 PRO CG C -8.945 -3.075 19.265 1.00 . A A . 7 PRO CG 1 1 2 1349 1 1 7 PRO HA H -7.553 -5.280 17.373 1.00 . A A . 7 PRO HA 1 1 2 1350 1 1 7 PRO HB2 H -8.935 -2.754 17.115 1.00 . A A . 7 PRO HB2 1 1 2 1351 1 1 7 PRO HB3 H -9.616 -4.299 17.603 1.00 . A A . 7 PRO HB3 1 1 2 1352 1 1 7 PRO HD2 H -7.120 -2.599 20.356 1.00 . A A . 7 PRO HD2 1 1 2 1353 1 1 7 PRO HD3 H -7.867 -4.131 20.836 1.00 . A A . 7 PRO HD3 1 1 2 1354 1 1 7 PRO HG2 H -9.072 -1.992 19.282 1.00 . A A . 7 PRO HG2 1 1 2 1355 1 1 7 PRO HG3 H -9.813 -3.516 19.754 1.00 . A A . 7 PRO HG3 1 1 2 1356 1 1 7 PRO N N -6.857 -4.175 19.003 1.00 . A A . 7 PRO N 1 1 2 1357 1 1 7 PRO O O -5.994 -4.090 15.757 1.00 . A A . 7 PRO O 1 1 2 1358 1 1 8 CYS C C -4.596 -0.745 16.844 1.00 . A A . 8 CYS C 1 1 2 1359 1 1 8 CYS CA C -5.749 -1.320 15.991 1.00 . A A . 8 CYS CA 1 1 2 1360 1 1 8 CYS CB C -6.540 -0.172 15.373 1.00 . A A . 8 CYS CB 1 1 2 1361 1 1 8 CYS H H -7.401 -1.720 17.276 1.00 . A A . 8 CYS H 1 1 2 1362 1 1 8 CYS HA H -5.320 -1.953 15.215 1.00 . A A . 8 CYS HA 1 1 2 1363 1 1 8 CYS HB2 H -7.587 -0.465 15.275 1.00 . A A . 8 CYS HB2 1 1 2 1364 1 1 8 CYS HB3 H -6.497 0.693 16.038 1.00 . A A . 8 CYS HB3 1 1 2 1365 1 1 8 CYS N N -6.674 -2.154 16.747 1.00 . A A . 8 CYS N 1 1 2 1366 1 1 8 CYS O O -3.652 -0.176 16.310 1.00 . A A . 8 CYS O 1 1 2 1367 1 1 8 CYS SG S -5.916 0.320 13.750 1.00 . A A . 8 CYS SG 1 1 2 1368 1 1 9 PHE C C -2.508 0.055 18.586 1.00 . A A . 9 PHE C 1 1 2 1369 1 1 9 PHE CA C -3.920 -0.139 19.098 1.00 . A A . 9 PHE CA 1 1 2 1370 1 1 9 PHE CB C -3.904 -0.824 20.461 1.00 . A A . 9 PHE CB 1 1 2 1371 1 1 9 PHE CD1 C -4.066 1.117 22.105 1.00 . A A . 9 PHE CD1 1 1 2 1372 1 1 9 PHE CD2 C -1.931 -0.148 21.925 1.00 . A A . 9 PHE CD2 1 1 2 1373 1 1 9 PHE CE1 C -3.482 1.963 23.112 1.00 . A A . 9 PHE CE1 1 1 2 1374 1 1 9 PHE CE2 C -1.344 0.696 22.931 1.00 . A A . 9 PHE CE2 1 1 2 1375 1 1 9 PHE CG C -3.295 0.058 21.509 1.00 . A A . 9 PHE CG 1 1 2 1376 1 1 9 PHE CZ C -2.120 1.752 23.525 1.00 . A A . 9 PHE CZ 1 1 2 1377 1 1 9 PHE H H -5.469 -1.486 18.528 1.00 . A A . 9 PHE H 1 1 2 1378 1 1 9 PHE HA H -4.380 0.816 19.176 1.00 . A A . 9 PHE HA 1 1 2 1379 1 1 9 PHE HB2 H -4.927 -1.090 20.743 1.00 . A A . 9 PHE HB2 1 1 2 1380 1 1 9 PHE HB3 H -3.318 -1.740 20.405 1.00 . A A . 9 PHE HB3 1 1 2 1381 1 1 9 PHE HD1 H -5.086 1.276 21.791 1.00 . A A . 9 PHE HD1 1 1 2 1382 1 1 9 PHE HD2 H -1.344 -0.939 21.479 1.00 . A A . 9 PHE HD2 1 1 2 1383 1 1 9 PHE HE1 H -4.066 2.756 23.557 1.00 . A A . 9 PHE HE1 1 1 2 1384 1 1 9 PHE HE2 H -0.321 0.537 23.241 1.00 . A A . 9 PHE HE2 1 1 2 1385 1 1 9 PHE HZ H -1.681 2.387 24.280 1.00 . A A . 9 PHE HZ 1 1 2 1386 1 1 9 PHE N N -4.725 -0.918 18.176 1.00 . A A . 9 PHE N 1 1 2 1387 1 1 9 PHE O O -2.047 1.129 18.217 1.00 . A A . 9 PHE O 1 1 2 1388 1 1 10 ARG C C -0.071 -1.427 16.918 1.00 . A A . 10 ARG C 1 1 2 1389 1 1 10 ARG CA C -0.464 -1.230 18.400 1.00 . A A . 10 ARG CA 1 1 2 1390 1 1 10 ARG CB C 0.086 -2.329 19.277 1.00 . A A . 10 ARG CB 1 1 2 1391 1 1 10 ARG CD C 1.904 -0.511 19.934 1.00 . A A . 10 ARG CD 1 1 2 1392 1 1 10 ARG CG C 1.178 -1.832 20.228 1.00 . A A . 10 ARG CG 1 1 2 1393 1 1 10 ARG CZ C 3.619 -0.623 18.266 1.00 . A A . 10 ARG CZ 1 1 2 1394 1 1 10 ARG H H -2.570 -1.830 18.806 1.00 . A A . 10 ARG H 1 1 2 1395 1 1 10 ARG HA H -0.051 -0.317 18.783 1.00 . A A . 10 ARG HA 1 1 2 1396 1 1 10 ARG HB2 H -0.732 -2.733 19.882 1.00 . A A . 10 ARG HB2 1 1 2 1397 1 1 10 ARG HB3 H 0.456 -3.146 18.648 1.00 . A A . 10 ARG HB3 1 1 2 1398 1 1 10 ARG HD2 H 1.267 0.355 20.114 1.00 . A A . 10 ARG HD2 1 1 2 1399 1 1 10 ARG HD3 H 2.809 -0.411 20.533 1.00 . A A . 10 ARG HD3 1 1 2 1400 1 1 10 ARG HE H 1.646 -0.319 17.813 1.00 . A A . 10 ARG HE 1 1 2 1401 1 1 10 ARG HG2 H 0.800 -1.837 21.249 1.00 . A A . 10 ARG HG2 1 1 2 1402 1 1 10 ARG HG3 H 1.934 -2.576 20.143 1.00 . A A . 10 ARG HG3 1 1 2 1403 1 1 10 ARG HH11 H 4.650 -0.072 19.919 1.00 . A A . 10 ARG HH11 1 1 2 1404 1 1 10 ARG HH12 H 5.104 0.740 18.458 1.00 . A A . 10 ARG HH12 1 1 2 1405 1 1 10 ARG HH21 H 3.411 -1.639 16.527 1.00 . A A . 10 ARG HH21 1 1 2 1406 1 1 10 ARG HH22 H 4.870 -1.961 17.403 1.00 . A A . 10 ARG HH22 1 1 2 1407 1 1 10 ARG N N -1.899 -1.119 18.616 1.00 . A A . 10 ARG N 1 1 2 1408 1 1 10 ARG NE N 2.313 -0.463 18.544 1.00 . A A . 10 ARG NE 1 1 2 1409 1 1 10 ARG NH1 N 4.533 0.073 18.937 1.00 . A A . 10 ARG NH1 1 1 2 1410 1 1 10 ARG NH2 N 3.998 -1.478 17.320 1.00 . A A . 10 ARG NH2 1 1 2 1411 1 1 10 ARG O O 1.079 -1.695 16.594 1.00 . A A . 10 ARG O 1 1 2 1412 1 1 11 ALA C C 0.278 -1.579 14.053 1.00 . A A . 11 ALA C 1 1 2 1413 1 1 11 ALA CA C -1.029 -1.941 14.767 1.00 . A A . 11 ALA CA 1 1 2 1414 1 1 11 ALA CB C -2.237 -1.510 13.934 1.00 . A A . 11 ALA CB 1 1 2 1415 1 1 11 ALA H H -1.946 -0.970 16.480 1.00 . A A . 11 ALA H 1 1 2 1416 1 1 11 ALA HA H -1.079 -3.012 14.963 1.00 . A A . 11 ALA HA 1 1 2 1417 1 1 11 ALA HB1 H -3.126 -1.423 14.560 1.00 . A A . 11 ALA HB1 1 1 2 1418 1 1 11 ALA HB2 H -2.062 -0.543 13.465 1.00 . A A . 11 ALA HB2 1 1 2 1419 1 1 11 ALA HB3 H -2.452 -2.236 13.150 1.00 . A A . 11 ALA HB3 1 1 2 1420 1 1 11 ALA N N -1.093 -1.277 16.055 1.00 . A A . 11 ALA N 1 1 2 1421 1 1 11 ALA O O 0.544 -0.421 13.754 1.00 . A A . 11 ALA O 1 1 2 1422 1 1 12 ASN C C 2.266 -2.270 11.667 1.00 . A A . 12 ASN C 1 1 2 1423 1 1 12 ASN CA C 2.370 -2.371 13.197 1.00 . A A . 12 ASN CA 1 1 2 1424 1 1 12 ASN CB C 3.357 -3.476 13.579 1.00 . A A . 12 ASN CB 1 1 2 1425 1 1 12 ASN CG C 3.633 -3.438 15.083 1.00 . A A . 12 ASN CG 1 1 2 1426 1 1 12 ASN H H 0.782 -3.568 14.021 1.00 . A A . 12 ASN H 1 1 2 1427 1 1 12 ASN HA H 2.685 -1.404 13.585 1.00 . A A . 12 ASN HA 1 1 2 1428 1 1 12 ASN HB2 H 2.955 -4.454 13.317 1.00 . A A . 12 ASN HB2 1 1 2 1429 1 1 12 ASN HB3 H 4.298 -3.350 13.044 1.00 . A A . 12 ASN HB3 1 1 2 1430 1 1 12 ASN HD21 H 1.694 -3.309 15.687 1.00 . A A . 12 ASN HD21 1 1 2 1431 1 1 12 ASN HD22 H 2.660 -4.525 16.501 1.00 . A A . 12 ASN HD22 1 1 2 1432 1 1 12 ASN N N 1.072 -2.637 13.800 1.00 . A A . 12 ASN N 1 1 2 1433 1 1 12 ASN ND2 N 2.566 -3.789 15.824 1.00 . A A . 12 ASN ND2 1 1 2 1434 1 1 12 ASN O O 3.133 -2.719 10.927 1.00 . A A . 12 ASN O 1 1 2 1435 1 1 12 ASN OD1 O 4.727 -3.119 15.532 1.00 . A A . 12 ASN OD1 1 1 2 1436 1 1 13 CYS C C 2.497 -0.205 9.797 1.00 . A A . 13 CYS C 1 1 2 1437 1 1 13 CYS CA C 1.109 -0.760 10.116 1.00 . A A . 13 CYS CA 1 1 2 1438 1 1 13 CYS CB C 0.077 0.334 10.384 1.00 . A A . 13 CYS CB 1 1 2 1439 1 1 13 CYS H H 0.299 -1.797 11.754 1.00 . A A . 13 CYS H 1 1 2 1440 1 1 13 CYS HA H 0.781 -1.378 9.279 1.00 . A A . 13 CYS HA 1 1 2 1441 1 1 13 CYS HB2 H 0.468 1.128 11.027 1.00 . A A . 13 CYS HB2 1 1 2 1442 1 1 13 CYS HB3 H -0.218 0.777 9.436 1.00 . A A . 13 CYS HB3 1 1 2 1443 1 1 13 CYS N N 1.146 -1.647 11.258 1.00 . A A . 13 CYS N 1 1 2 1444 1 1 13 CYS O O 3.066 0.618 10.503 1.00 . A A . 13 CYS O 1 1 2 1445 1 1 13 CYS SG S -1.394 -0.384 11.152 1.00 . A A . 13 CYS SG 1 1 2 1446 1 1 14 GLU C C 3.709 1.371 7.691 1.00 . A A . 14 GLU C 1 1 2 1447 1 1 14 GLU CA C 4.060 -0.098 7.957 1.00 . A A . 14 GLU CA 1 1 2 1448 1 1 14 GLU CB C 4.385 -0.842 6.658 1.00 . A A . 14 GLU CB 1 1 2 1449 1 1 14 GLU CD C 3.976 0.494 4.557 1.00 . A A . 14 GLU CD 1 1 2 1450 1 1 14 GLU CG C 5.013 0.074 5.604 1.00 . A A . 14 GLU CG 1 1 2 1451 1 1 14 GLU H H 2.583 -1.637 8.418 1.00 . A A . 14 GLU H 1 1 2 1452 1 1 14 GLU HA H 4.921 -0.134 8.621 1.00 . A A . 14 GLU HA 1 1 2 1453 1 1 14 GLU HB2 H 5.091 -1.638 6.896 1.00 . A A . 14 GLU HB2 1 1 2 1454 1 1 14 GLU HB3 H 3.499 -1.330 6.249 1.00 . A A . 14 GLU HB3 1 1 2 1455 1 1 14 GLU HG2 H 5.427 0.969 6.068 1.00 . A A . 14 GLU HG2 1 1 2 1456 1 1 14 GLU HG3 H 5.831 -0.438 5.097 1.00 . A A . 14 GLU HG3 1 1 2 1457 1 1 14 GLU N N 2.983 -0.758 8.676 1.00 . A A . 14 GLU N 1 1 2 1458 1 1 14 GLU O O 4.414 2.283 8.106 1.00 . A A . 14 GLU O 1 1 2 1459 1 1 14 GLU OE1 O 2.812 0.123 4.694 1.00 . A A . 14 GLU OE1 1 1 2 1460 1 1 14 GLU OE2 O 4.348 1.190 3.614 1.00 . A A . 14 GLU OE2 1 1 2 1461 1 1 15 TYR C C 1.071 2.594 8.571 1.00 . A A . 15 TYR C 1 1 2 1462 1 1 15 TYR CA C 1.793 2.734 7.226 1.00 . A A . 15 TYR CA 1 1 2 1463 1 1 15 TYR CB C 0.824 2.977 6.065 1.00 . A A . 15 TYR CB 1 1 2 1464 1 1 15 TYR CD1 C 1.466 5.388 5.538 1.00 . A A . 15 TYR CD1 1 1 2 1465 1 1 15 TYR CD2 C -0.867 4.878 6.238 1.00 . A A . 15 TYR CD2 1 1 2 1466 1 1 15 TYR CE1 C 1.130 6.782 5.428 1.00 . A A . 15 TYR CE1 1 1 2 1467 1 1 15 TYR CE2 C -1.206 6.272 6.131 1.00 . A A . 15 TYR CE2 1 1 2 1468 1 1 15 TYR CG C 0.470 4.430 5.945 1.00 . A A . 15 TYR CG 1 1 2 1469 1 1 15 TYR CZ C -0.207 7.224 5.726 1.00 . A A . 15 TYR CZ 1 1 2 1470 1 1 15 TYR H H 2.292 0.864 6.299 1.00 . A A . 15 TYR H 1 1 2 1471 1 1 15 TYR HA H 2.487 3.566 7.304 1.00 . A A . 15 TYR HA 1 1 2 1472 1 1 15 TYR HB2 H 1.264 2.651 5.133 1.00 . A A . 15 TYR HB2 1 1 2 1473 1 1 15 TYR HB3 H -0.086 2.398 6.231 1.00 . A A . 15 TYR HB3 1 1 2 1474 1 1 15 TYR HD1 H 2.469 5.057 5.313 1.00 . A A . 15 TYR HD1 1 1 2 1475 1 1 15 TYR HD2 H -1.619 4.163 6.536 1.00 . A A . 15 TYR HD2 1 1 2 1476 1 1 15 TYR HE1 H 1.880 7.496 5.121 1.00 . A A . 15 TYR HE1 1 1 2 1477 1 1 15 TYR HE2 H -2.210 6.603 6.355 1.00 . A A . 15 TYR HE2 1 1 2 1478 1 1 15 TYR HH H 0.220 9.044 5.301 1.00 . A A . 15 TYR HH 1 1 2 1479 1 1 15 TYR N N 2.581 1.540 6.977 1.00 . A A . 15 TYR N 1 1 2 1480 1 1 15 TYR O O 1.651 2.202 9.574 1.00 . A A . 15 TYR O 1 1 2 1481 1 1 15 TYR OH O -0.530 8.562 5.623 1.00 . A A . 15 TYR OH 1 1 2 1482 1 1 16 GLN C C -2.125 2.355 10.001 1.00 . A A . 16 GLN C 1 1 2 1483 1 1 16 GLN CA C -0.889 3.238 9.776 1.00 . A A . 16 GLN CA 1 1 2 1484 1 1 16 GLN CB C -1.274 4.714 9.772 1.00 . A A . 16 GLN CB 1 1 2 1485 1 1 16 GLN CD C -1.056 6.873 11.034 1.00 . A A . 16 GLN CD 1 1 2 1486 1 1 16 GLN CG C -0.721 5.380 11.029 1.00 . A A . 16 GLN CG 1 1 2 1487 1 1 16 GLN H H -0.546 3.320 7.653 1.00 . A A . 16 GLN H 1 1 2 1488 1 1 16 GLN HA H -0.169 3.035 10.569 1.00 . A A . 16 GLN HA 1 1 2 1489 1 1 16 GLN HB2 H -0.884 5.186 8.875 1.00 . A A . 16 GLN HB2 1 1 2 1490 1 1 16 GLN HB3 H -2.357 4.827 9.705 1.00 . A A . 16 GLN HB3 1 1 2 1491 1 1 16 GLN HE21 H 0.334 7.709 9.805 1.00 . A A . 16 GLN HE21 1 1 2 1492 1 1 16 GLN HE22 H -1.321 7.770 9.227 1.00 . A A . 16 GLN HE22 1 1 2 1493 1 1 16 GLN HG2 H -1.140 4.904 11.916 1.00 . A A . 16 GLN HG2 1 1 2 1494 1 1 16 GLN HG3 H 0.361 5.246 11.073 1.00 . A A . 16 GLN HG3 1 1 2 1495 1 1 16 GLN N N -0.222 2.954 8.527 1.00 . A A . 16 GLN N 1 1 2 1496 1 1 16 GLN NE2 N -0.644 7.508 9.922 1.00 . A A . 16 GLN NE2 1 1 2 1497 1 1 16 GLN O O -2.309 1.293 9.422 1.00 . A A . 16 GLN O 1 1 2 1498 1 1 16 GLN OE1 O -1.641 7.402 11.972 1.00 . A A . 16 GLN OE1 1 1 2 1499 1 1 17 CYS C C -5.322 2.702 11.404 1.00 . A A . 17 CYS C 1 1 2 1500 1 1 17 CYS CA C -3.919 2.110 11.608 1.00 . A A . 17 CYS CA 1 1 2 1501 1 1 17 CYS CB C -3.588 2.098 13.102 1.00 . A A . 17 CYS CB 1 1 2 1502 1 1 17 CYS H H -2.493 3.759 11.236 1.00 . A A . 17 CYS H 1 1 2 1503 1 1 17 CYS HA H -3.827 1.094 11.213 1.00 . A A . 17 CYS HA 1 1 2 1504 1 1 17 CYS HB2 H -3.013 1.204 13.341 1.00 . A A . 17 CYS HB2 1 1 2 1505 1 1 17 CYS HB3 H -2.961 2.953 13.352 1.00 . A A . 17 CYS HB3 1 1 2 1506 1 1 17 CYS N N -2.932 2.917 10.914 1.00 . A A . 17 CYS N 1 1 2 1507 1 1 17 CYS O O -5.503 3.909 11.292 1.00 . A A . 17 CYS O 1 1 2 1508 1 1 17 CYS SG S -5.062 2.128 14.149 1.00 . A A . 17 CYS SG 1 1 2 1509 1 1 18 GLN C C -8.286 1.789 12.769 1.00 . A A . 18 GLN C 1 1 2 1510 1 1 18 GLN CA C -7.684 2.172 11.404 1.00 . A A . 18 GLN CA 1 1 2 1511 1 1 18 GLN CB C -8.364 1.542 10.199 1.00 . A A . 18 GLN CB 1 1 2 1512 1 1 18 GLN CD C -9.709 3.537 9.405 1.00 . A A . 18 GLN CD 1 1 2 1513 1 1 18 GLN CG C -9.762 2.091 9.924 1.00 . A A . 18 GLN CG 1 1 2 1514 1 1 18 GLN H H -6.056 0.860 11.029 1.00 . A A . 18 GLN H 1 1 2 1515 1 1 18 GLN HA H -7.696 3.251 11.284 1.00 . A A . 18 GLN HA 1 1 2 1516 1 1 18 GLN HB2 H -7.725 1.715 9.333 1.00 . A A . 18 GLN HB2 1 1 2 1517 1 1 18 GLN HB3 H -8.404 0.470 10.326 1.00 . A A . 18 GLN HB3 1 1 2 1518 1 1 18 GLN HE21 H -8.197 3.330 8.049 1.00 . A A . 18 GLN HE21 1 1 2 1519 1 1 18 GLN HE22 H -8.022 4.660 9.176 1.00 . A A . 18 GLN HE22 1 1 2 1520 1 1 18 GLN HG2 H -10.265 1.458 9.192 1.00 . A A . 18 GLN HG2 1 1 2 1521 1 1 18 GLN HG3 H -10.357 2.069 10.835 1.00 . A A . 18 GLN HG3 1 1 2 1522 1 1 18 GLN N N -6.291 1.770 11.366 1.00 . A A . 18 GLN N 1 1 2 1523 1 1 18 GLN NE2 N -8.540 3.873 8.823 1.00 . A A . 18 GLN NE2 1 1 2 1524 1 1 18 GLN O O -7.735 2.146 13.803 1.00 . A A . 18 GLN O 1 1 2 1525 1 1 18 GLN OE1 O -10.665 4.293 9.527 1.00 . A A . 18 GLN OE1 1 1 2 1526 1 1 19 PRO C C -10.533 -0.318 11.004 1.00 . A A . 19 PRO C 1 1 2 1527 1 1 19 PRO CA C -9.569 -0.276 12.201 1.00 . A A . 19 PRO CA 1 1 2 1528 1 1 19 PRO CB C -10.244 -1.060 13.325 1.00 . A A . 19 PRO CB 1 1 2 1529 1 1 19 PRO CD C -10.483 1.355 13.723 1.00 . A A . 19 PRO CD 1 1 2 1530 1 1 19 PRO CG C -10.957 -0.021 14.200 1.00 . A A . 19 PRO CG 1 1 2 1531 1 1 19 PRO HA H -8.597 -0.683 11.932 1.00 . A A . 19 PRO HA 1 1 2 1532 1 1 19 PRO HB2 H -10.949 -1.789 12.926 1.00 . A A . 19 PRO HB2 1 1 2 1533 1 1 19 PRO HB3 H -9.505 -1.594 13.921 1.00 . A A . 19 PRO HB3 1 1 2 1534 1 1 19 PRO HD2 H -11.287 1.911 13.240 1.00 . A A . 19 PRO HD2 1 1 2 1535 1 1 19 PRO HD3 H -10.086 1.951 14.545 1.00 . A A . 19 PRO HD3 1 1 2 1536 1 1 19 PRO HG2 H -12.037 -0.119 14.099 1.00 . A A . 19 PRO HG2 1 1 2 1537 1 1 19 PRO HG3 H -10.697 -0.175 15.247 1.00 . A A . 19 PRO HG3 1 1 2 1538 1 1 19 PRO N N -9.432 1.063 12.764 1.00 . A A . 19 PRO N 1 1 2 1539 1 1 19 PRO O O -11.584 0.312 11.018 1.00 . A A . 19 PRO O 1 1 2 1540 1 1 20 LEU C C -11.728 -2.764 10.652 1.00 . A A . 20 LEU C 1 1 2 1541 1 1 20 LEU CA C -10.943 -2.210 9.492 1.00 . A A . 20 LEU CA 1 1 2 1542 1 1 20 LEU CB C -10.226 -3.321 8.732 1.00 . A A . 20 LEU CB 1 1 2 1543 1 1 20 LEU CD1 C -10.083 -2.228 6.468 1.00 . A A . 20 LEU CD1 1 1 2 1544 1 1 20 LEU CD2 C -10.563 -4.696 6.630 1.00 . A A . 20 LEU CD2 1 1 2 1545 1 1 20 LEU CG C -10.742 -3.332 7.296 1.00 . A A . 20 LEU CG 1 1 2 1546 1 1 20 LEU H H -9.692 -0.683 9.211 1.00 . A A . 20 LEU H 1 1 2 1547 1 1 20 LEU HA H -11.597 -1.723 8.767 1.00 . A A . 20 LEU HA 1 1 2 1548 1 1 20 LEU HB2 H -9.149 -3.213 8.757 1.00 . A A . 20 LEU HB2 1 1 2 1549 1 1 20 LEU HB3 H -10.451 -4.276 9.206 1.00 . A A . 20 LEU HB3 1 1 2 1550 1 1 20 LEU HD11 H -10.751 -1.881 5.680 1.00 . A A . 20 LEU HD11 1 1 2 1551 1 1 20 LEU HD12 H -9.829 -1.373 7.095 1.00 . A A . 20 LEU HD12 1 1 2 1552 1 1 20 LEU HD13 H -9.166 -2.587 6.000 1.00 . A A . 20 LEU HD13 1 1 2 1553 1 1 20 LEU HD21 H -10.707 -4.621 5.552 1.00 . A A . 20 LEU HD21 1 1 2 1554 1 1 20 LEU HD22 H -9.562 -5.090 6.806 1.00 . A A . 20 LEU HD22 1 1 2 1555 1 1 20 LEU HD23 H -11.287 -5.414 7.014 1.00 . A A . 20 LEU HD23 1 1 2 1556 1 1 20 LEU HG H -11.810 -3.115 7.364 1.00 . A A . 20 LEU HG 1 1 2 1557 1 1 20 LEU N N -10.131 -1.108 9.972 1.00 . A A . 20 LEU N 1 1 2 1558 1 1 20 LEU O O -11.216 -3.436 11.526 1.00 . A A . 20 LEU O 1 1 2 1559 1 1 21 ASN C C -14.493 -3.234 12.292 1.00 . A A . 21 ASN C 1 1 2 1560 1 1 21 ASN CA C -13.670 -2.016 11.851 1.00 . A A . 21 ASN CA 1 1 2 1561 1 1 21 ASN CB C -14.574 -0.790 11.700 1.00 . A A . 21 ASN CB 1 1 2 1562 1 1 21 ASN CG C -15.673 -1.017 10.658 1.00 . A A . 21 ASN CG 1 1 2 1563 1 1 21 ASN H H -12.691 -1.577 9.882 1.00 . A A . 21 ASN H 1 1 2 1564 1 1 21 ASN HA H -12.916 -1.814 12.610 1.00 . A A . 21 ASN HA 1 1 2 1565 1 1 21 ASN HB2 H -15.047 -0.539 12.652 1.00 . A A . 21 ASN HB2 1 1 2 1566 1 1 21 ASN HB3 H -13.973 0.059 11.371 1.00 . A A . 21 ASN HB3 1 1 2 1567 1 1 21 ASN HD21 H -15.256 0.853 9.984 1.00 . A A . 21 ASN HD21 1 1 2 1568 1 1 21 ASN N N -12.944 -2.230 10.604 1.00 . A A . 21 ASN N 1 1 2 1569 1 1 21 ASN ND2 N -15.822 0.041 9.842 1.00 . A A . 21 ASN ND2 1 1 2 1570 1 1 21 ASN O O -14.737 -3.439 13.475 1.00 . A A . 21 ASN O 1 1 2 1571 1 1 21 ASN OD1 O -16.328 -2.050 10.610 1.00 . A A . 21 ASN OD1 1 1 2 1572 1 1 22 GLN C C -14.769 -6.287 12.278 1.00 . A A . 22 GLN C 1 1 2 1573 1 1 22 GLN CA C -15.666 -5.214 11.634 1.00 . A A . 22 GLN CA 1 1 2 1574 1 1 22 GLN CB C -16.332 -5.774 10.376 1.00 . A A . 22 GLN CB 1 1 2 1575 1 1 22 GLN CD C -18.739 -6.380 10.701 1.00 . A A . 22 GLN CD 1 1 2 1576 1 1 22 GLN CG C -17.303 -6.909 10.697 1.00 . A A . 22 GLN CG 1 1 2 1577 1 1 22 GLN H H -14.717 -3.764 10.340 1.00 . A A . 22 GLN H 1 1 2 1578 1 1 22 GLN HA H -16.416 -4.896 12.358 1.00 . A A . 22 GLN HA 1 1 2 1579 1 1 22 GLN HB2 H -16.864 -4.975 9.859 1.00 . A A . 22 GLN HB2 1 1 2 1580 1 1 22 GLN HB3 H -15.567 -6.132 9.687 1.00 . A A . 22 GLN HB3 1 1 2 1581 1 1 22 GLN HE21 H -19.466 -6.920 12.523 1.00 . A A . 22 GLN HE21 1 1 2 1582 1 1 22 GLN HE22 H -20.220 -7.703 11.146 1.00 . A A . 22 GLN HE22 1 1 2 1583 1 1 22 GLN HG2 H -17.221 -7.705 9.957 1.00 . A A . 22 GLN HG2 1 1 2 1584 1 1 22 GLN HG3 H -17.081 -7.340 11.674 1.00 . A A . 22 GLN HG3 1 1 2 1585 1 1 22 GLN N N -14.905 -4.025 11.287 1.00 . A A . 22 GLN N 1 1 2 1586 1 1 22 GLN NE2 N -19.548 -7.062 11.532 1.00 . A A . 22 GLN NE2 1 1 2 1587 1 1 22 GLN O O -14.920 -7.477 12.028 1.00 . A A . 22 GLN O 1 1 2 1588 1 1 22 GLN OE1 O -19.081 -5.431 10.007 1.00 . A A . 22 GLN OE1 1 1 2 1589 1 1 23 THR C C -12.000 -6.749 11.793 1.00 . A A . 23 THR C 1 1 2 1590 1 1 23 THR CA C -12.529 -5.537 12.547 1.00 . A A . 23 THR CA 1 1 2 1591 1 1 23 THR CB C -11.526 -5.046 13.609 1.00 . A A . 23 THR CB 1 1 2 1592 1 1 23 THR CG2 C -12.162 -4.028 14.556 1.00 . A A . 23 THR CG2 1 1 2 1593 1 1 23 THR H H -14.069 -5.427 14.015 1.00 . A A . 23 THR H 1 1 2 1594 1 1 23 THR HA H -12.750 -4.797 11.795 1.00 . A A . 23 THR HA 1 1 2 1595 1 1 23 THR HB H -10.630 -4.598 13.157 1.00 . A A . 23 THR HB 1 1 2 1596 1 1 23 THR HG1 H -11.277 -5.956 15.268 1.00 . A A . 23 THR HG1 1 1 2 1597 1 1 23 THR HG21 H -12.907 -4.504 15.195 1.00 . A A . 23 THR HG21 1 1 2 1598 1 1 23 THR HG22 H -11.409 -3.573 15.200 1.00 . A A . 23 THR HG22 1 1 2 1599 1 1 23 THR HG23 H -12.653 -3.232 13.998 1.00 . A A . 23 THR HG23 1 1 2 1600 1 1 23 THR N N -13.834 -5.796 13.116 1.00 . A A . 23 THR N 1 1 2 1601 1 1 23 THR O O -12.103 -7.894 12.216 1.00 . A A . 23 THR O 1 1 2 1602 1 1 23 THR OG1 O -11.088 -6.151 14.359 1.00 . A A . 23 THR OG1 1 1 2 1603 1 1 24 SER C C -8.952 -6.267 11.055 1.00 . A A . 24 SER C 1 1 2 1604 1 1 24 SER CA C -10.118 -6.952 10.318 1.00 . A A . 24 SER CA 1 1 2 1605 1 1 24 SER CB C -9.875 -6.834 8.822 1.00 . A A . 24 SER CB 1 1 2 1606 1 1 24 SER H H -11.772 -5.571 10.149 1.00 . A A . 24 SER H 1 1 2 1607 1 1 24 SER HA H -10.165 -7.973 10.658 1.00 . A A . 24 SER HA 1 1 2 1608 1 1 24 SER HB2 H -10.808 -6.888 8.262 1.00 . A A . 24 SER HB2 1 1 2 1609 1 1 24 SER HB3 H -9.409 -5.870 8.631 1.00 . A A . 24 SER HB3 1 1 2 1610 1 1 24 SER HG H -9.008 -8.522 9.027 1.00 . A A . 24 SER HG 1 1 2 1611 1 1 24 SER N N -11.424 -6.380 10.636 1.00 . A A . 24 SER N 1 1 2 1612 1 1 24 SER O O -7.911 -6.851 11.333 1.00 . A A . 24 SER O 1 1 2 1613 1 1 24 SER OG O -9.015 -7.846 8.362 1.00 . A A . 24 SER OG 1 1 2 1614 1 1 25 TYR C C -7.200 -4.181 10.195 1.00 . A A . 25 TYR C 1 1 2 1615 1 1 25 TYR CA C -8.362 -3.850 11.140 1.00 . A A . 25 TYR CA 1 1 2 1616 1 1 25 TYR CB C -7.838 -3.290 12.458 1.00 . A A . 25 TYR CB 1 1 2 1617 1 1 25 TYR CD1 C -7.106 -5.430 13.642 1.00 . A A . 25 TYR CD1 1 1 2 1618 1 1 25 TYR CD2 C -5.395 -3.712 13.081 1.00 . A A . 25 TYR CD2 1 1 2 1619 1 1 25 TYR CE1 C -6.079 -6.277 14.190 1.00 . A A . 25 TYR CE1 1 1 2 1620 1 1 25 TYR CE2 C -4.365 -4.557 13.628 1.00 . A A . 25 TYR CE2 1 1 2 1621 1 1 25 TYR CG C -6.768 -4.150 13.076 1.00 . A A . 25 TYR CG 1 1 2 1622 1 1 25 TYR CZ C -4.708 -5.842 14.177 1.00 . A A . 25 TYR CZ 1 1 2 1623 1 1 25 TYR H H -10.222 -4.919 11.426 1.00 . A A . 25 TYR H 1 1 2 1624 1 1 25 TYR HA H -9.031 -3.093 10.724 1.00 . A A . 25 TYR HA 1 1 2 1625 1 1 25 TYR HB2 H -7.474 -2.273 12.282 1.00 . A A . 25 TYR HB2 1 1 2 1626 1 1 25 TYR HB3 H -8.671 -3.214 13.146 1.00 . A A . 25 TYR HB3 1 1 2 1627 1 1 25 TYR HD1 H -8.135 -5.756 13.655 1.00 . A A . 25 TYR HD1 1 1 2 1628 1 1 25 TYR HD2 H -5.137 -2.746 12.673 1.00 . A A . 25 TYR HD2 1 1 2 1629 1 1 25 TYR HE1 H -6.338 -7.237 14.610 1.00 . A A . 25 TYR HE1 1 1 2 1630 1 1 25 TYR HE2 H -3.337 -4.226 13.626 1.00 . A A . 25 TYR HE2 1 1 2 1631 1 1 25 TYR HH H -4.065 -7.532 14.812 1.00 . A A . 25 TYR HH 1 1 2 1632 1 1 25 TYR N N -9.232 -4.992 11.336 1.00 . A A . 25 TYR N 1 1 2 1633 1 1 25 TYR O O -6.902 -5.327 9.883 1.00 . A A . 25 TYR O 1 1 2 1634 1 1 25 TYR OH O -3.721 -6.657 14.693 1.00 . A A . 25 TYR OH 1 1 2 1635 1 1 26 LEU C C -4.437 -3.054 8.585 1.00 . A A . 26 LEU C 1 1 2 1636 1 1 26 LEU CA C -5.967 -3.176 8.459 1.00 . A A . 26 LEU CA 1 1 2 1637 1 1 26 LEU CB C -6.690 -2.071 7.704 1.00 . A A . 26 LEU CB 1 1 2 1638 1 1 26 LEU CD1 C -7.196 0.363 7.507 1.00 . A A . 26 LEU CD1 1 1 2 1639 1 1 26 LEU CD2 C -5.864 -0.469 9.537 1.00 . A A . 26 LEU CD2 1 1 2 1640 1 1 26 LEU CG C -6.225 -0.675 8.066 1.00 . A A . 26 LEU CG 1 1 2 1641 1 1 26 LEU H H -6.757 -2.138 10.021 1.00 . A A . 26 LEU H 1 1 2 1642 1 1 26 LEU HA H -6.224 -4.142 8.022 1.00 . A A . 26 LEU HA 1 1 2 1643 1 1 26 LEU HB2 H -6.622 -2.233 6.626 1.00 . A A . 26 LEU HB2 1 1 2 1644 1 1 26 LEU HB3 H -7.745 -2.101 7.995 1.00 . A A . 26 LEU HB3 1 1 2 1645 1 1 26 LEU HD11 H -7.367 0.191 6.445 1.00 . A A . 26 LEU HD11 1 1 2 1646 1 1 26 LEU HD12 H -8.163 0.306 8.008 1.00 . A A . 26 LEU HD12 1 1 2 1647 1 1 26 LEU HD13 H -6.797 1.372 7.615 1.00 . A A . 26 LEU HD13 1 1 2 1648 1 1 26 LEU HD21 H -5.373 0.496 9.633 1.00 . A A . 26 LEU HD21 1 1 2 1649 1 1 26 LEU HD22 H -6.726 -0.518 10.194 1.00 . A A . 26 LEU HD22 1 1 2 1650 1 1 26 LEU HD23 H -5.151 -1.202 9.905 1.00 . A A . 26 LEU HD23 1 1 2 1651 1 1 26 LEU HG H -5.303 -0.539 7.559 1.00 . A A . 26 LEU HG 1 1 2 1652 1 1 26 LEU N N -6.554 -3.089 9.766 1.00 . A A . 26 LEU N 1 1 2 1653 1 1 26 LEU O O -3.839 -3.556 9.529 1.00 . A A . 26 LEU O 1 1 2 1654 1 1 27 CYS C C -3.072 -0.222 6.748 1.00 . A A . 27 CYS C 1 1 2 1655 1 1 27 CYS CA C -3.099 -1.168 7.943 1.00 . A A . 27 CYS CA 1 1 2 1656 1 1 27 CYS CB C -1.683 -1.503 8.375 1.00 . A A . 27 CYS CB 1 1 2 1657 1 1 27 CYS H H -4.000 -2.640 6.645 1.00 . A A . 27 CYS H 1 1 2 1658 1 1 27 CYS HA H -3.620 -0.678 8.767 1.00 . A A . 27 CYS HA 1 1 2 1659 1 1 27 CYS HB2 H -1.295 -2.258 7.697 1.00 . A A . 27 CYS HB2 1 1 2 1660 1 1 27 CYS HB3 H -1.057 -0.610 8.290 1.00 . A A . 27 CYS HB3 1 1 2 1661 1 1 27 CYS N N -3.844 -2.371 7.594 1.00 . A A . 27 CYS N 1 1 2 1662 1 1 27 CYS O O -2.736 -0.581 5.626 1.00 . A A . 27 CYS O 1 1 2 1663 1 1 27 CYS SG S -1.611 -2.108 10.080 1.00 . A A . 27 CYS SG 1 1 2 1664 1 1 28 VAL C C -2.779 2.002 5.012 1.00 . A A . 28 VAL C 1 1 2 1665 1 1 28 VAL CA C -3.883 1.928 6.055 1.00 . A A . 28 VAL CA 1 1 2 1666 1 1 28 VAL CB C -4.186 3.335 6.584 1.00 . A A . 28 VAL CB 1 1 2 1667 1 1 28 VAL CG1 C -5.661 3.678 6.376 1.00 . A A . 28 VAL CG1 1 1 2 1668 1 1 28 VAL CG2 C -3.805 3.532 8.048 1.00 . A A . 28 VAL CG2 1 1 2 1669 1 1 28 VAL H H -3.398 1.243 8.065 1.00 . A A . 28 VAL H 1 1 2 1670 1 1 28 VAL HA H -4.770 1.484 5.604 1.00 . A A . 28 VAL HA 1 1 2 1671 1 1 28 VAL HB H -3.573 4.031 6.008 1.00 . A A . 28 VAL HB 1 1 2 1672 1 1 28 VAL HG11 H -6.037 3.235 5.454 1.00 . A A . 28 VAL HG11 1 1 2 1673 1 1 28 VAL HG12 H -6.264 3.297 7.200 1.00 . A A . 28 VAL HG12 1 1 2 1674 1 1 28 VAL HG13 H -5.807 4.757 6.323 1.00 . A A . 28 VAL HG13 1 1 2 1675 1 1 28 VAL HG21 H -4.085 2.673 8.657 1.00 . A A . 28 VAL HG21 1 1 2 1676 1 1 28 VAL HG22 H -2.731 3.692 8.121 1.00 . A A . 28 VAL HG22 1 1 2 1677 1 1 28 VAL HG23 H -4.306 4.408 8.461 1.00 . A A . 28 VAL HG23 1 1 2 1678 1 1 28 VAL N N -3.456 1.013 7.097 1.00 . A A . 28 VAL N 1 1 2 1679 1 1 28 VAL O O -1.696 1.461 5.190 1.00 . A A . 28 VAL O 1 1 2 1680 1 1 29 CYS C C -2.249 4.246 2.251 1.00 . A A . 29 CYS C 1 1 2 1681 1 1 29 CYS CA C -2.024 2.946 3.014 1.00 . A A . 29 CYS CA 1 1 2 1682 1 1 29 CYS CB C -1.932 1.769 2.047 1.00 . A A . 29 CYS CB 1 1 2 1683 1 1 29 CYS H H -3.952 2.312 3.485 1.00 . A A . 29 CYS H 1 1 2 1684 1 1 29 CYS HA H -1.099 2.927 3.593 1.00 . A A . 29 CYS HA 1 1 2 1685 1 1 29 CYS HB2 H -2.917 1.571 1.630 1.00 . A A . 29 CYS HB2 1 1 2 1686 1 1 29 CYS HB3 H -1.265 1.986 1.211 1.00 . A A . 29 CYS HB3 1 1 2 1687 1 1 29 CYS N N -3.129 2.671 3.901 1.00 . A A . 29 CYS N 1 1 2 1688 1 1 29 CYS O O -3.127 5.052 2.536 1.00 . A A . 29 CYS O 1 1 2 1689 1 1 29 CYS SG S -1.332 0.298 2.921 1.00 . A A . 29 CYS SG 1 1 2 1690 1 1 30 ALA C C -2.248 6.176 -0.191 1.00 . A A . 30 ALA C 1 1 2 1691 1 1 30 ALA CA C -1.109 5.678 0.709 1.00 . A A . 30 ALA CA 1 1 2 1692 1 1 30 ALA CB C 0.159 5.626 -0.132 1.00 . A A . 30 ALA CB 1 1 2 1693 1 1 30 ALA H H -0.671 3.641 1.403 1.00 . A A . 30 ALA H 1 1 2 1694 1 1 30 ALA HA H -0.943 6.345 1.554 1.00 . A A . 30 ALA HA 1 1 2 1695 1 1 30 ALA HB1 H 0.650 4.661 -0.022 1.00 . A A . 30 ALA HB1 1 1 2 1696 1 1 30 ALA HB2 H -0.080 5.777 -1.185 1.00 . A A . 30 ALA HB2 1 1 2 1697 1 1 30 ALA HB3 H 0.853 6.407 0.177 1.00 . A A . 30 ALA HB3 1 1 2 1698 1 1 30 ALA N N -1.353 4.354 1.265 1.00 . A A . 30 ALA N 1 1 2 1699 1 1 30 ALA O O -2.045 6.995 -1.079 1.00 . A A . 30 ALA O 1 1 2 1700 1 1 31 GLU C C -3.730 4.755 -2.178 1.00 . A A . 31 GLU C 1 1 2 1701 1 1 31 GLU CA C -3.941 4.529 -0.677 1.00 . A A . 31 GLU CA 1 1 2 1702 1 1 31 GLU CB C -5.420 4.370 -0.351 1.00 . A A . 31 GLU CB 1 1 2 1703 1 1 31 GLU CD C -7.377 2.806 -0.422 1.00 . A A . 31 GLU CD 1 1 2 1704 1 1 31 GLU CG C -5.850 2.908 -0.402 1.00 . A A . 31 GLU CG 1 1 2 1705 1 1 31 GLU H H -3.885 5.864 0.960 1.00 . A A . 31 GLU H 1 1 2 1706 1 1 31 GLU HA H -3.385 3.650 -0.354 1.00 . A A . 31 GLU HA 1 1 2 1707 1 1 31 GLU HB2 H -5.618 4.771 0.643 1.00 . A A . 31 GLU HB2 1 1 2 1708 1 1 31 GLU HB3 H -6.000 4.972 -1.045 1.00 . A A . 31 GLU HB3 1 1 2 1709 1 1 31 GLU HG2 H -5.444 2.427 -1.290 1.00 . A A . 31 GLU HG2 1 1 2 1710 1 1 31 GLU HG3 H -5.468 2.379 0.471 1.00 . A A . 31 GLU HG3 1 1 2 1711 1 1 31 GLU N N -3.444 5.644 0.096 1.00 . A A . 31 GLU N 1 1 2 1712 1 1 31 GLU O O -3.311 5.815 -2.626 1.00 . A A . 31 GLU O 1 1 2 1713 1 1 31 GLU OE1 O -7.975 3.160 -1.437 1.00 . A A . 31 GLU OE1 1 1 2 1714 1 1 31 GLU OE2 O -7.949 2.373 0.577 1.00 . A A . 31 GLU OE2 1 1 2 1715 1 1 32 GLY C C -2.001 2.597 -3.802 1.00 . A A . 32 GLY C 1 1 2 1716 1 1 32 GLY CA C -3.287 3.381 -4.116 1.00 . A A . 32 GLY CA 1 1 2 1717 1 1 32 GLY H H -4.816 3.087 -2.643 1.00 . A A . 32 GLY H 1 1 2 1718 1 1 32 GLY HA2 H -3.930 2.791 -4.773 1.00 . A A . 32 GLY HA2 1 1 2 1719 1 1 32 GLY HA3 H -3.044 4.334 -4.590 1.00 . A A . 32 GLY HA3 1 1 2 1720 1 1 32 GLY N N -4.056 3.677 -2.917 1.00 . A A . 32 GLY N 1 1 2 1721 1 1 32 GLY O O -0.993 2.725 -4.485 1.00 . A A . 32 GLY O 1 1 2 1722 1 1 33 PHE C C -1.389 0.144 -1.140 1.00 . A A . 33 PHE C 1 1 2 1723 1 1 33 PHE CA C -0.938 1.276 -2.061 1.00 . A A . 33 PHE CA 1 1 2 1724 1 1 33 PHE CB C -0.301 2.399 -1.238 1.00 . A A . 33 PHE CB 1 1 2 1725 1 1 33 PHE CD1 C 0.692 4.076 -2.886 1.00 . A A . 33 PHE CD1 1 1 2 1726 1 1 33 PHE CD2 C 2.218 2.580 -1.615 1.00 . A A . 33 PHE CD2 1 1 2 1727 1 1 33 PHE CE1 C 1.826 4.696 -3.519 1.00 . A A . 33 PHE CE1 1 1 2 1728 1 1 33 PHE CE2 C 3.355 3.209 -2.233 1.00 . A A . 33 PHE CE2 1 1 2 1729 1 1 33 PHE CG C 0.882 3.019 -1.927 1.00 . A A . 33 PHE CG 1 1 2 1730 1 1 33 PHE CZ C 3.158 4.270 -3.183 1.00 . A A . 33 PHE CZ 1 1 2 1731 1 1 33 PHE H H -3.008 1.498 -2.394 1.00 . A A . 33 PHE H 1 1 2 1732 1 1 33 PHE HA H -0.248 0.888 -2.810 1.00 . A A . 33 PHE HA 1 1 2 1733 1 1 33 PHE HB2 H -1.041 3.180 -1.044 1.00 . A A . 33 PHE HB2 1 1 2 1734 1 1 33 PHE HB3 H 0.040 1.997 -0.282 1.00 . A A . 33 PHE HB3 1 1 2 1735 1 1 33 PHE HD1 H -0.307 4.406 -3.130 1.00 . A A . 33 PHE HD1 1 1 2 1736 1 1 33 PHE HD2 H 2.376 1.762 -0.930 1.00 . A A . 33 PHE HD2 1 1 2 1737 1 1 33 PHE HE1 H 1.677 5.469 -4.256 1.00 . A A . 33 PHE HE1 1 1 2 1738 1 1 33 PHE HE2 H 4.354 2.884 -1.984 1.00 . A A . 33 PHE HE2 1 1 2 1739 1 1 33 PHE HZ H 4.010 4.748 -3.643 1.00 . A A . 33 PHE HZ 1 1 2 1740 1 1 33 PHE N N -2.113 1.771 -2.745 1.00 . A A . 33 PHE N 1 1 2 1741 1 1 33 PHE O O -1.947 0.366 -0.073 1.00 . A A . 33 PHE O 1 1 2 1742 1 1 34 ALA C C -0.648 -3.294 -0.757 1.00 . A A . 34 ALA C 1 1 2 1743 1 1 34 ALA CA C -1.721 -2.221 -0.971 1.00 . A A . 34 ALA CA 1 1 2 1744 1 1 34 ALA CB C -2.876 -2.734 -1.835 1.00 . A A . 34 ALA CB 1 1 2 1745 1 1 34 ALA H H -0.492 -1.199 -2.398 1.00 . A A . 34 ALA H 1 1 2 1746 1 1 34 ALA HA H -2.081 -1.871 -0.004 1.00 . A A . 34 ALA HA 1 1 2 1747 1 1 34 ALA HB1 H -3.808 -2.761 -1.271 1.00 . A A . 34 ALA HB1 1 1 2 1748 1 1 34 ALA HB2 H -3.046 -2.079 -2.689 1.00 . A A . 34 ALA HB2 1 1 2 1749 1 1 34 ALA HB3 H -2.673 -3.737 -2.210 1.00 . A A . 34 ALA HB3 1 1 2 1750 1 1 34 ALA N N -1.111 -1.079 -1.622 1.00 . A A . 34 ALA N 1 1 2 1751 1 1 34 ALA O O 0.509 -3.123 -1.123 1.00 . A A . 34 ALA O 1 1 2 1752 1 1 35 PRO C C 0.228 -5.883 -1.671 1.00 . A A . 35 PRO C 1 1 2 1753 1 1 35 PRO CA C -0.407 -5.689 -0.294 1.00 . A A . 35 PRO CA 1 1 2 1754 1 1 35 PRO CB C -1.492 -6.726 -0.004 1.00 . A A . 35 PRO CB 1 1 2 1755 1 1 35 PRO CD C -2.312 -4.492 0.635 1.00 . A A . 35 PRO CD 1 1 2 1756 1 1 35 PRO CG C -2.579 -5.993 0.798 1.00 . A A . 35 PRO CG 1 1 2 1757 1 1 35 PRO HA H 0.382 -5.752 0.456 1.00 . A A . 35 PRO HA 1 1 2 1758 1 1 35 PRO HB2 H -1.904 -7.115 -0.934 1.00 . A A . 35 PRO HB2 1 1 2 1759 1 1 35 PRO HB3 H -1.097 -7.569 0.555 1.00 . A A . 35 PRO HB3 1 1 2 1760 1 1 35 PRO HD2 H -3.133 -4.001 0.120 1.00 . A A . 35 PRO HD2 1 1 2 1761 1 1 35 PRO HD3 H -2.167 -4.007 1.600 1.00 . A A . 35 PRO HD3 1 1 2 1762 1 1 35 PRO HG2 H -3.572 -6.254 0.436 1.00 . A A . 35 PRO HG2 1 1 2 1763 1 1 35 PRO HG3 H -2.525 -6.276 1.850 1.00 . A A . 35 PRO HG3 1 1 2 1764 1 1 35 PRO N N -1.090 -4.417 -0.149 1.00 . A A . 35 PRO N 1 1 2 1765 1 1 35 PRO O O -0.363 -6.433 -2.593 1.00 . A A . 35 PRO O 1 1 2 1766 1 1 36 ILE C C 2.372 -7.621 -1.228 1.00 . A A . 36 ILE C 1 1 2 1767 1 1 36 ILE CA C 2.610 -6.279 -1.962 1.00 . A A . 36 ILE CA 1 1 2 1768 1 1 36 ILE CB C 3.859 -5.539 -1.477 1.00 . A A . 36 ILE CB 1 1 2 1769 1 1 36 ILE CD1 C 5.903 -6.482 -0.327 1.00 . A A . 36 ILE CD1 1 1 2 1770 1 1 36 ILE CG1 C 5.151 -6.338 -1.638 1.00 . A A . 36 ILE CG1 1 1 2 1771 1 1 36 ILE CG2 C 3.641 -5.073 -0.047 1.00 . A A . 36 ILE CG2 1 1 2 1772 1 1 36 ILE H H 1.610 -4.393 -1.651 1.00 . A A . 36 ILE H 1 1 2 1773 1 1 36 ILE HA H 2.697 -6.407 -3.034 1.00 . A A . 36 ILE HA 1 1 2 1774 1 1 36 ILE HB H 3.965 -4.647 -2.092 1.00 . A A . 36 ILE HB 1 1 2 1775 1 1 36 ILE HD11 H 5.274 -6.983 0.411 1.00 . A A . 36 ILE HD11 1 1 2 1776 1 1 36 ILE HD12 H 6.803 -7.063 -0.500 1.00 . A A . 36 ILE HD12 1 1 2 1777 1 1 36 ILE HD13 H 6.182 -5.506 0.067 1.00 . A A . 36 ILE HD13 1 1 2 1778 1 1 36 ILE HG12 H 4.954 -7.335 -2.013 1.00 . A A . 36 ILE HG12 1 1 2 1779 1 1 36 ILE HG13 H 5.790 -5.851 -2.375 1.00 . A A . 36 ILE HG13 1 1 2 1780 1 1 36 ILE HG21 H 4.490 -4.524 0.357 1.00 . A A . 36 ILE HG21 1 1 2 1781 1 1 36 ILE HG22 H 2.779 -4.409 -0.012 1.00 . A A . 36 ILE HG22 1 1 2 1782 1 1 36 ILE HG23 H 3.463 -5.935 0.602 1.00 . A A . 36 ILE HG23 1 1 2 1783 1 1 36 ILE N N 1.479 -5.385 -1.729 1.00 . A A . 36 ILE N 1 1 2 1784 1 1 36 ILE O O 1.607 -7.679 -0.272 1.00 . A A . 36 ILE O 1 1 2 1785 1 1 37 PRO C C 3.510 -9.566 0.653 1.00 . A A . 37 PRO C 1 1 2 1786 1 1 37 PRO CA C 3.425 -9.820 -0.854 1.00 . A A . 37 PRO CA 1 1 2 1787 1 1 37 PRO CB C 4.759 -10.274 -1.446 1.00 . A A . 37 PRO CB 1 1 2 1788 1 1 37 PRO CD C 3.536 -8.863 -3.068 1.00 . A A . 37 PRO CD 1 1 2 1789 1 1 37 PRO CG C 4.717 -9.837 -2.923 1.00 . A A . 37 PRO CG 1 1 2 1790 1 1 37 PRO HA H 2.691 -10.612 -1.001 1.00 . A A . 37 PRO HA 1 1 2 1791 1 1 37 PRO HB2 H 5.583 -9.778 -0.933 1.00 . A A . 37 PRO HB2 1 1 2 1792 1 1 37 PRO HB3 H 4.910 -11.348 -1.330 1.00 . A A . 37 PRO HB3 1 1 2 1793 1 1 37 PRO HD2 H 3.845 -7.925 -3.524 1.00 . A A . 37 PRO HD2 1 1 2 1794 1 1 37 PRO HD3 H 2.749 -9.295 -3.687 1.00 . A A . 37 PRO HD3 1 1 2 1795 1 1 37 PRO HG2 H 5.650 -9.351 -3.206 1.00 . A A . 37 PRO HG2 1 1 2 1796 1 1 37 PRO HG3 H 4.583 -10.701 -3.574 1.00 . A A . 37 PRO HG3 1 1 2 1797 1 1 37 PRO N N 3.049 -8.700 -1.703 1.00 . A A . 37 PRO N 1 1 2 1798 1 1 37 PRO O O 3.656 -8.447 1.126 1.00 . A A . 37 PRO O 1 1 2 1799 1 1 38 HIS C C 3.004 -9.864 3.659 1.00 . A A . 38 HIS C 1 1 2 1800 1 1 38 HIS CA C 3.708 -10.872 2.753 1.00 . A A . 38 HIS CA 1 1 2 1801 1 1 38 HIS CB C 5.216 -11.026 2.991 1.00 . A A . 38 HIS CB 1 1 2 1802 1 1 38 HIS CD2 C 7.301 -10.368 1.711 1.00 . A A . 38 HIS CD2 1 1 2 1803 1 1 38 HIS CE1 C 7.088 -8.159 1.593 1.00 . A A . 38 HIS CE1 1 1 2 1804 1 1 38 HIS CG C 6.128 -10.063 2.285 1.00 . A A . 38 HIS CG 1 1 2 1805 1 1 38 HIS H H 2.995 -11.509 0.862 1.00 . A A . 38 HIS H 1 1 2 1806 1 1 38 HIS HA H 3.275 -11.808 3.046 1.00 . A A . 38 HIS HA 1 1 2 1807 1 1 38 HIS HB2 H 5.399 -10.938 4.067 1.00 . A A . 38 HIS HB2 1 1 2 1808 1 1 38 HIS HB3 H 5.502 -12.040 2.693 1.00 . A A . 38 HIS HB3 1 1 2 1809 1 1 38 HIS HD1 H 5.131 -8.109 2.408 1.00 . A A . 38 HIS HD1 1 1 2 1810 1 1 38 HIS HD2 H 7.684 -11.361 1.616 1.00 . A A . 38 HIS HD2 1 1 2 1811 1 1 38 HIS HE1 H 7.299 -7.102 1.454 1.00 . A A . 38 HIS HE1 1 1 2 1812 1 1 38 HIS N N 3.366 -10.716 1.346 1.00 . A A . 38 HIS N 1 1 2 1813 1 1 38 HIS ND1 N 5.953 -8.613 2.145 1.00 . A A . 38 HIS ND1 1 1 2 1814 1 1 38 HIS NE2 N 7.953 -9.130 1.258 1.00 . A A . 38 HIS NE2 1 1 2 1815 1 1 38 HIS O O 1.793 -9.870 3.836 1.00 . A A . 38 HIS O 1 1 2 1816 1 1 39 GLU C C 2.733 -7.911 6.196 1.00 . A A . 39 GLU C 1 1 2 1817 1 1 39 GLU CA C 3.920 -8.720 5.631 1.00 . A A . 39 GLU CA 1 1 2 1818 1 1 39 GLU CB C 5.116 -7.805 5.908 1.00 . A A . 39 GLU CB 1 1 2 1819 1 1 39 GLU CD C 7.027 -6.986 4.513 1.00 . A A . 39 GLU CD 1 1 2 1820 1 1 39 GLU CG C 6.411 -8.206 5.201 1.00 . A A . 39 GLU CG 1 1 2 1821 1 1 39 GLU H H 4.643 -8.934 3.573 1.00 . A A . 39 GLU H 1 1 2 1822 1 1 39 GLU HA H 4.016 -9.667 6.156 1.00 . A A . 39 GLU HA 1 1 2 1823 1 1 39 GLU HB2 H 4.831 -6.813 5.550 1.00 . A A . 39 GLU HB2 1 1 2 1824 1 1 39 GLU HB3 H 5.271 -7.735 6.988 1.00 . A A . 39 GLU HB3 1 1 2 1825 1 1 39 GLU HG2 H 7.144 -8.633 5.878 1.00 . A A . 39 GLU HG2 1 1 2 1826 1 1 39 GLU HG3 H 6.213 -8.967 4.464 1.00 . A A . 39 GLU HG3 1 1 2 1827 1 1 39 GLU N N 3.871 -9.009 4.199 1.00 . A A . 39 GLU N 1 1 2 1828 1 1 39 GLU O O 2.959 -6.854 6.756 1.00 . A A . 39 GLU O 1 1 2 1829 1 1 39 GLU OE1 O 6.422 -6.473 3.573 1.00 . A A . 39 GLU OE1 1 1 2 1830 1 1 39 GLU OE2 O 8.105 -6.562 4.925 1.00 . A A . 39 GLU OE2 1 1 2 1831 1 1 40 PRO C C 0.103 -6.288 6.577 1.00 . A A . 40 PRO C 1 1 2 1832 1 1 40 PRO CA C 0.299 -7.620 5.784 1.00 . A A . 40 PRO CA 1 1 2 1833 1 1 40 PRO CB C -0.888 -8.545 6.083 1.00 . A A . 40 PRO CB 1 1 2 1834 1 1 40 PRO CD C 1.194 -9.790 6.530 1.00 . A A . 40 PRO CD 1 1 2 1835 1 1 40 PRO CG C -0.328 -9.919 6.477 1.00 . A A . 40 PRO CG 1 1 2 1836 1 1 40 PRO HA H 0.299 -7.407 4.716 1.00 . A A . 40 PRO HA 1 1 2 1837 1 1 40 PRO HB2 H -1.496 -8.146 6.894 1.00 . A A . 40 PRO HB2 1 1 2 1838 1 1 40 PRO HB3 H -1.537 -8.633 5.212 1.00 . A A . 40 PRO HB3 1 1 2 1839 1 1 40 PRO HD2 H 1.561 -9.943 7.545 1.00 . A A . 40 PRO HD2 1 1 2 1840 1 1 40 PRO HD3 H 1.686 -10.513 5.881 1.00 . A A . 40 PRO HD3 1 1 2 1841 1 1 40 PRO HG2 H -0.719 -10.228 7.447 1.00 . A A . 40 PRO HG2 1 1 2 1842 1 1 40 PRO HG3 H -0.622 -10.676 5.749 1.00 . A A . 40 PRO HG3 1 1 2 1843 1 1 40 PRO N N 1.487 -8.429 6.106 1.00 . A A . 40 PRO N 1 1 2 1844 1 1 40 PRO O O -0.826 -6.154 7.365 1.00 . A A . 40 PRO O 1 1 2 1845 1 1 41 HIS C C 0.709 -3.350 4.847 1.00 . A A . 41 HIS C 1 1 2 1846 1 1 41 HIS CA C 0.774 -3.881 6.293 1.00 . A A . 41 HIS CA 1 1 2 1847 1 1 41 HIS CB C 1.870 -3.144 7.087 1.00 . A A . 41 HIS CB 1 1 2 1848 1 1 41 HIS CD2 C 3.827 -4.572 7.644 1.00 . A A . 41 HIS CD2 1 1 2 1849 1 1 41 HIS CE1 C 5.169 -4.462 5.888 1.00 . A A . 41 HIS CE1 1 1 2 1850 1 1 41 HIS CG C 3.257 -3.695 6.831 1.00 . A A . 41 HIS CG 1 1 2 1851 1 1 41 HIS H H 1.964 -5.574 6.102 1.00 . A A . 41 HIS H 1 1 2 1852 1 1 41 HIS HA H -0.182 -3.688 6.747 1.00 . A A . 41 HIS HA 1 1 2 1853 1 1 41 HIS HB2 H 1.809 -2.083 6.846 1.00 . A A . 41 HIS HB2 1 1 2 1854 1 1 41 HIS HB3 H 1.653 -3.241 8.154 1.00 . A A . 41 HIS HB3 1 1 2 1855 1 1 41 HIS HD1 H 4.168 -2.792 5.048 1.00 . A A . 41 HIS HD1 1 1 2 1856 1 1 41 HIS HD2 H 3.326 -4.856 8.520 1.00 . A A . 41 HIS HD2 1 1 2 1857 1 1 41 HIS HE1 H 5.531 -5.027 5.034 1.00 . A A . 41 HIS HE1 1 1 2 1858 1 1 41 HIS N N 1.020 -5.324 6.324 1.00 . A A . 41 HIS N 1 1 2 1859 1 1 41 HIS ND1 N 4.228 -3.507 5.744 1.00 . A A . 41 HIS ND1 1 1 2 1860 1 1 41 HIS NE2 N 5.111 -5.033 7.104 1.00 . A A . 41 HIS NE2 1 1 2 1861 1 1 41 HIS O O -0.332 -3.307 4.203 1.00 . A A . 41 HIS O 1 1 2 1862 1 1 42 ARG C C 2.981 -2.446 2.229 1.00 . A A . 42 ARG C 1 1 2 1863 1 1 42 ARG CA C 2.596 -3.491 3.239 1.00 . A A . 42 ARG CA 1 1 2 1864 1 1 42 ARG CB C 1.726 -4.539 2.622 1.00 . A A . 42 ARG CB 1 1 2 1865 1 1 42 ARG CD C 1.795 -6.960 2.919 1.00 . A A . 42 ARG CD 1 1 2 1866 1 1 42 ARG CG C 1.589 -5.640 3.626 1.00 . A A . 42 ARG CG 1 1 2 1867 1 1 42 ARG CZ C 0.240 -8.642 2.215 1.00 . A A . 42 ARG CZ 1 1 2 1868 1 1 42 ARG H H 2.439 -2.706 5.221 1.00 . A A . 42 ARG H 1 1 2 1869 1 1 42 ARG HA H 3.511 -3.943 3.568 1.00 . A A . 42 ARG HA 1 1 2 1870 1 1 42 ARG HB2 H 0.759 -4.143 2.311 1.00 . A A . 42 ARG HB2 1 1 2 1871 1 1 42 ARG HB3 H 2.230 -4.951 1.778 1.00 . A A . 42 ARG HB3 1 1 2 1872 1 1 42 ARG HD2 H 2.619 -6.909 2.210 1.00 . A A . 42 ARG HD2 1 1 2 1873 1 1 42 ARG HD3 H 1.986 -7.725 3.644 1.00 . A A . 42 ARG HD3 1 1 2 1874 1 1 42 ARG HE H 0.044 -6.666 1.716 1.00 . A A . 42 ARG HE 1 1 2 1875 1 1 42 ARG HG2 H 2.329 -5.472 4.429 1.00 . A A . 42 ARG HG2 1 1 2 1876 1 1 42 ARG HG3 H 0.587 -5.586 4.033 1.00 . A A . 42 ARG HG3 1 1 2 1877 1 1 42 ARG HH11 H 1.678 -9.253 0.928 1.00 . A A . 42 ARG HH11 1 1 2 1878 1 1 42 ARG HH12 H 0.469 -10.435 1.305 1.00 . A A . 42 ARG HH12 1 1 2 1879 1 1 42 ARG HH21 H -0.928 -8.540 3.865 1.00 . A A . 42 ARG HH21 1 1 2 1880 1 1 42 ARG HH22 H -1.254 -9.872 2.807 1.00 . A A . 42 ARG HH22 1 1 2 1881 1 1 42 ARG N N 1.922 -2.955 4.416 1.00 . A A . 42 ARG N 1 1 2 1882 1 1 42 ARG NE N 0.600 -7.346 2.195 1.00 . A A . 42 ARG NE 1 1 2 1883 1 1 42 ARG NH1 N 0.845 -9.515 1.417 1.00 . A A . 42 ARG NH1 1 1 2 1884 1 1 42 ARG NH2 N -0.727 -9.052 3.030 1.00 . A A . 42 ARG NH2 1 1 2 1885 1 1 42 ARG O O 4.102 -2.321 1.751 1.00 . A A . 42 ARG O 1 1 2 1886 1 1 43 CYS C C 3.117 -0.529 0.208 1.00 . A A . 43 CYS C 1 1 2 1887 1 1 43 CYS CA C 1.768 -0.892 0.813 1.00 . A A . 43 CYS CA 1 1 2 1888 1 1 43 CYS CB C 1.020 0.362 1.198 1.00 . A A . 43 CYS CB 1 1 2 1889 1 1 43 CYS H H 1.300 -1.832 2.762 1.00 . A A . 43 CYS H 1 1 2 1890 1 1 43 CYS HA H 1.218 -1.479 0.078 1.00 . A A . 43 CYS HA 1 1 2 1891 1 1 43 CYS HB2 H 1.532 1.231 0.783 1.00 . A A . 43 CYS HB2 1 1 2 1892 1 1 43 CYS HB3 H 0.048 0.259 0.749 1.00 . A A . 43 CYS HB3 1 1 2 1893 1 1 43 CYS N N 1.909 -1.723 1.981 1.00 . A A . 43 CYS N 1 1 2 1894 1 1 43 CYS O O 3.919 0.198 0.781 1.00 . A A . 43 CYS O 1 1 2 1895 1 1 43 CYS SG S 0.690 0.583 2.957 1.00 . A A . 43 CYS SG 1 1 2 1896 1 1 44 GLN C C 4.466 -1.010 -3.129 1.00 . A A . 44 GLN C 1 1 2 1897 1 1 44 GLN CA C 4.581 -0.877 -1.610 1.00 . A A . 44 GLN CA 1 1 2 1898 1 1 44 GLN CB C 5.579 -1.901 -1.074 1.00 . A A . 44 GLN CB 1 1 2 1899 1 1 44 GLN CD C 7.575 -2.333 0.369 1.00 . A A . 44 GLN CD 1 1 2 1900 1 1 44 GLN CG C 6.637 -1.256 -0.178 1.00 . A A . 44 GLN CG 1 1 2 1901 1 1 44 GLN H H 2.580 -1.635 -1.435 1.00 . A A . 44 GLN H 1 1 2 1902 1 1 44 GLN HA H 4.844 0.145 -1.333 1.00 . A A . 44 GLN HA 1 1 2 1903 1 1 44 GLN HB2 H 5.045 -2.671 -0.516 1.00 . A A . 44 GLN HB2 1 1 2 1904 1 1 44 GLN HB3 H 6.060 -2.405 -1.912 1.00 . A A . 44 GLN HB3 1 1 2 1905 1 1 44 GLN HE21 H 7.852 -2.948 -1.550 1.00 . A A . 44 GLN HE21 1 1 2 1906 1 1 44 GLN HE22 H 8.546 -3.985 -0.318 1.00 . A A . 44 GLN HE22 1 1 2 1907 1 1 44 GLN HG2 H 7.222 -0.527 -0.738 1.00 . A A . 44 GLN HG2 1 1 2 1908 1 1 44 GLN HG3 H 6.168 -0.736 0.657 1.00 . A A . 44 GLN HG3 1 1 2 1909 1 1 44 GLN N N 3.297 -1.096 -0.994 1.00 . A A . 44 GLN N 1 1 2 1910 1 1 44 GLN NE2 N 8.032 -3.164 -0.585 1.00 . A A . 44 GLN NE2 1 1 2 1911 1 1 44 GLN O O 4.756 -2.048 -3.711 1.00 . A A . 44 GLN O 1 1 2 1912 1 1 44 GLN OE1 O 7.857 -2.402 1.559 1.00 . A A . 44 GLN OE1 1 1 2 1913 1 1 45 MET C C 2.036 -1.072 -4.516 1.00 . A A . 45 MET C 1 1 2 1914 1 1 45 MET CA C 2.627 0.263 -4.048 1.00 . A A . 45 MET CA 1 1 2 1915 1 1 45 MET CB C 2.454 1.338 -5.125 1.00 . A A . 45 MET CB 1 1 2 1916 1 1 45 MET CE C 3.232 -0.384 -8.460 1.00 . A A . 45 MET CE 1 1 2 1917 1 1 45 MET CG C 3.472 1.196 -6.255 1.00 . A A . 45 MET CG 1 1 2 1918 1 1 45 MET H H 4.678 0.878 -3.811 1.00 . A A . 45 MET H 1 1 2 1919 1 1 45 MET HA H 2.129 0.566 -3.128 1.00 . A A . 45 MET HA 1 1 2 1920 1 1 45 MET HB2 H 1.444 1.298 -5.534 1.00 . A A . 45 MET HB2 1 1 2 1921 1 1 45 MET HB3 H 2.557 2.325 -4.675 1.00 . A A . 45 MET HB3 1 1 2 1922 1 1 45 MET HE1 H 2.203 -0.707 -8.599 1.00 . A A . 45 MET HE1 1 1 2 1923 1 1 45 MET HE2 H 3.313 0.649 -8.797 1.00 . A A . 45 MET HE2 1 1 2 1924 1 1 45 MET HE3 H 3.878 -1.009 -9.076 1.00 . A A . 45 MET HE3 1 1 2 1925 1 1 45 MET HG2 H 3.138 1.762 -7.125 1.00 . A A . 45 MET HG2 1 1 2 1926 1 1 45 MET HG3 H 4.433 1.607 -5.943 1.00 . A A . 45 MET HG3 1 1 2 1927 1 1 45 MET N N 4.036 0.117 -3.721 1.00 . A A . 45 MET N 1 1 2 1928 1 1 45 MET O O 2.741 -2.013 -4.857 1.00 . A A . 45 MET O 1 1 2 1929 1 1 45 MET SD S 3.701 -0.526 -6.728 1.00 . A A . 45 MET SD 1 1 2 1930 1 1 46 PHE C C -0.063 -1.560 -6.765 1.00 . A A . 46 PHE C 1 1 2 1931 1 1 46 PHE CA C 0.033 -2.080 -5.329 1.00 . A A . 46 PHE CA 1 1 2 1932 1 1 46 PHE CB C -1.361 -2.348 -4.765 1.00 . A A . 46 PHE CB 1 1 2 1933 1 1 46 PHE CD1 C -0.971 -4.867 -4.862 1.00 . A A . 46 PHE CD1 1 1 2 1934 1 1 46 PHE CD2 C -3.171 -3.949 -5.576 1.00 . A A . 46 PHE CD2 1 1 2 1935 1 1 46 PHE CE1 C -1.437 -6.201 -5.135 1.00 . A A . 46 PHE CE1 1 1 2 1936 1 1 46 PHE CE2 C -3.640 -5.282 -5.850 1.00 . A A . 46 PHE CE2 1 1 2 1937 1 1 46 PHE CG C -1.837 -3.736 -5.076 1.00 . A A . 46 PHE CG 1 1 2 1938 1 1 46 PHE CZ C -2.773 -6.407 -5.628 1.00 . A A . 46 PHE CZ 1 1 2 1939 1 1 46 PHE H H 0.161 -0.447 -3.946 1.00 . A A . 46 PHE H 1 1 2 1940 1 1 46 PHE HA H 0.654 -2.976 -5.291 1.00 . A A . 46 PHE HA 1 1 2 1941 1 1 46 PHE HB2 H -1.336 -2.223 -3.684 1.00 . A A . 46 PHE HB2 1 1 2 1942 1 1 46 PHE HB3 H -2.076 -1.628 -5.161 1.00 . A A . 46 PHE HB3 1 1 2 1943 1 1 46 PHE HD1 H 0.033 -4.710 -4.496 1.00 . A A . 46 PHE HD1 1 1 2 1944 1 1 46 PHE HD2 H -3.823 -3.104 -5.745 1.00 . A A . 46 PHE HD2 1 1 2 1945 1 1 46 PHE HE1 H -0.786 -7.046 -4.969 1.00 . A A . 46 PHE HE1 1 1 2 1946 1 1 46 PHE HE2 H -4.643 -5.438 -6.220 1.00 . A A . 46 PHE HE2 1 1 2 1947 1 1 46 PHE HZ H -3.125 -7.408 -5.829 1.00 . A A . 46 PHE HZ 1 1 2 1948 1 1 46 PHE N N 0.692 -1.086 -4.504 1.00 . A A . 46 PHE N 1 1 2 1949 1 1 46 PHE O O -0.775 -0.608 -7.057 1.00 . A A . 46 PHE O 1 1 2 1950 1 1 47 CYS C C 0.344 -4.086 -9.208 1.30 . A A . 47 CYS C 1 1 2 1951 1 1 47 CYS CA C 0.110 -2.603 -8.917 0.80 . A A . 47 CYS CA 1 1 2 1952 1 1 47 CYS CB C 0.655 -1.736 -10.053 0.60 . A A . 47 CYS CB 1 1 2 1953 1 1 47 CYS H H 1.639 -2.501 -7.411 1.00 . A A . 47 CYS H 1 1 2 1954 1 1 47 CYS HA H -0.954 -2.419 -8.812 1.10 . A A . 47 CYS HA 1 1 2 1955 1 1 47 CYS HB2 H 0.001 -1.852 -10.915 0.90 . A A . 47 CYS HB2 1 1 2 1956 1 1 47 CYS HB3 H 0.605 -0.684 -9.775 0.90 . A A . 47 CYS HB3 1 1 2 1957 1 1 47 CYS N N 0.698 -2.248 -7.638 0.60 . A A . 47 CYS N 1 1 2 1958 1 1 47 CYS O O 1.335 -4.678 -8.799 1.90 . A A . 47 CYS O 1 1 2 1959 1 1 47 CYS SG S 2.348 -2.137 -10.556 1.30 . A A . 47 CYS SG 1 1 2 1960 1 1 48 ASN C C -2.054 -6.574 -9.391 1.90 . A A . 48 ASN C 1 1 2 1961 1 1 48 ASN CA C -1.853 -5.056 -9.264 2.30 . A A . 48 ASN CA 1 1 2 1962 1 1 48 ASN CB C -3.047 -4.318 -9.871 3.00 . A A . 48 ASN CB 1 1 2 1963 1 1 48 ASN CG C -4.148 -4.141 -8.824 3.70 . A A . 48 ASN CG 1 1 2 1964 1 1 48 ASN H H -0.542 -4.739 -10.933 2.00 . A A . 48 ASN H 1 1 2 1965 1 1 48 ASN HA H -1.725 -4.796 -8.213 2.70 . A A . 48 ASN HA 1 1 2 1966 1 1 48 ASN HB2 H -2.746 -3.336 -10.235 3.30 . A A . 48 ASN HB2 1 1 2 1967 1 1 48 ASN HB3 H -3.451 -4.874 -10.717 3.20 . A A . 48 ASN HB3 1 1 2 1968 1 1 48 ASN HD21 H -3.612 -2.200 -8.458 1.00 . A A . 48 ASN HD21 1 1 2 1969 1 1 48 ASN N N -0.639 -4.637 -9.943 1.70 . A A . 48 ASN N 1 1 2 1970 1 1 48 ASN ND2 N -4.367 -2.853 -8.503 4.10 . A A . 48 ASN ND2 1 1 2 1971 1 1 48 ASN O O -3.169 -7.061 -9.538 2.30 . A A . 48 ASN O 1 1 2 1972 1 1 48 ASN OD1 O -4.749 -5.097 -8.349 4.40 . A A . 48 ASN OD1 1 1 2 1973 1 1 49 GLN C C -0.619 -6.941 -11.751 1.80 . A A . 49 GLN C 1 1 2 1974 1 1 49 GLN CA C -0.306 -7.822 -10.538 2.00 . A A . 49 GLN CA 1 1 2 1975 1 1 49 GLN CB C -0.822 -9.236 -10.803 2.20 . A A . 49 GLN CB 1 1 2 1976 1 1 49 GLN CD C 0.935 -11.001 -10.528 3.40 . A A . 49 GLN CD 1 1 2 1977 1 1 49 GLN CG C 0.217 -10.091 -11.528 2.70 . A A . 49 GLN CG 1 1 2 1978 1 1 49 GLN H H -0.472 -7.444 -8.439 2.50 . A A . 49 GLN H 1 1 2 1979 1 1 49 GLN HA H 0.771 -7.827 -10.369 2.50 . A A . 49 GLN HA 1 1 2 1980 1 1 49 GLN HB2 H -1.100 -9.709 -9.863 2.60 . A A . 49 GLN HB2 1 1 2 1981 1 1 49 GLN HB3 H -1.728 -9.180 -11.408 2.10 . A A . 49 GLN HB3 1 1 2 1982 1 1 49 GLN HE21 H 2.583 -11.148 -11.712 4.10 . A A . 49 GLN HE21 1 1 2 1983 1 1 49 GLN HE22 H 2.892 -11.128 -9.985 4.50 . A A . 49 GLN HE22 1 1 2 1984 1 1 49 GLN HG2 H -0.258 -10.707 -12.291 2.70 . A A . 49 GLN HG2 1 1 2 1985 1 1 49 GLN HG3 H 0.954 -9.459 -12.025 2.80 . A A . 49 GLN HG3 1 1 2 1986 1 1 49 GLN N N -0.908 -7.286 -9.325 2.00 . A A . 49 GLN N 1 1 2 1987 1 1 49 GLN NE2 N 2.255 -11.101 -10.763 4.00 . A A . 49 GLN NE2 1 1 2 1988 1 1 49 GLN O O -1.676 -7.043 -12.362 2.20 . A A . 49 GLN O 1 1 2 1989 1 1 49 GLN OE1 O 0.336 -11.565 -9.621 3.70 . A A . 49 GLN OE1 1 1 2 1990 1 1 50 THR C C -0.459 -5.676 -14.306 1.50 . A A . 50 THR C 1 1 2 1991 1 1 50 THR CA C 0.767 -5.968 -13.438 1.80 . A A . 50 THR CA 1 1 2 1992 1 1 50 THR CB C 1.435 -7.266 -13.895 1.90 . A A . 50 THR CB 1 1 2 1993 1 1 50 THR CG2 C 0.410 -8.292 -14.378 2.30 . A A . 50 THR CG2 1 1 2 1994 1 1 50 THR H H 0.819 -5.542 -11.338 2.00 . A A . 50 THR H 1 1 2 1995 1 1 50 THR HA H 1.459 -5.128 -13.495 2.10 . A A . 50 THR HA 1 1 2 1996 1 1 50 THR HB H 2.012 -7.687 -13.072 2.20 . A A . 50 THR HB 1 1 2 1997 1 1 50 THR HG1 H 2.248 -7.679 -15.571 2.50 . A A . 50 THR HG1 1 1 2 1998 1 1 50 THR HG21 H 0.331 -8.281 -15.465 2.40 . A A . 50 THR HG21 1 1 2 1999 1 1 50 THR HG22 H -0.576 -8.078 -13.965 2.60 . A A . 50 THR HG22 1 1 2 2000 1 1 50 THR HG23 H 0.693 -9.298 -14.071 2.80 . A A . 50 THR HG23 1 1 2 2001 1 1 50 THR N N 0.370 -6.082 -12.050 1.70 . A A . 50 THR N 1 1 2 2002 1 1 50 THR O O -1.511 -5.262 -13.835 2.20 . A A . 50 THR O 1 1 2 2003 1 1 50 THR OG1 O 2.340 -6.985 -14.933 2.20 . A A . 50 THR OG1 1 1 2 2004 1 1 51 ALA C C -0.412 -3.506 -16.094 0.60 . A A . 51 ALA C 1 1 2 2005 1 1 51 ALA CA C 0.305 -4.813 -16.403 0.60 . A A . 51 ALA CA 1 1 2 2006 1 1 51 ALA CB C 0.134 -5.104 -17.884 0.70 . A A . 51 ALA CB 1 1 2 2007 1 1 51 ALA H H -0.231 -6.851 -15.939 0.90 . A A . 51 ALA H 1 1 2 2008 1 1 51 ALA HA H 1.354 -4.718 -16.129 0.70 . A A . 51 ALA HA 1 1 2 2009 1 1 51 ALA HB1 H 0.222 -4.179 -18.455 1.20 . A A . 51 ALA HB1 1 1 2 2010 1 1 51 ALA HB2 H -0.852 -5.525 -18.073 1.00 . A A . 51 ALA HB2 1 1 2 2011 1 1 51 ALA HB3 H 0.893 -5.802 -18.231 1.30 . A A . 51 ALA HB3 1 1 2 2012 1 1 51 ALA N N -0.231 -5.907 -15.609 0.80 . A A . 51 ALA N 1 1 2 2013 1 1 51 ALA O O -1.210 -2.996 -16.872 1.10 . A A . 51 ALA O 1 1 2 2014 1 1 52 CYS C C 2.243 -2.469 -15.500 0.80 . A A . 52 CYS C 1 1 2 2015 1 1 52 CYS CA C 0.963 -2.000 -14.813 0.80 . A A . 52 CYS CA 1 1 2 2016 1 1 52 CYS CB C 1.192 -1.646 -13.343 0.90 . A A . 52 CYS CB 1 1 2 2017 1 1 52 CYS H H -0.480 -3.390 -14.090 0.90 . A A . 52 CYS H 1 1 2 2018 1 1 52 CYS HA H 0.571 -1.162 -15.373 0.80 . A A . 52 CYS HA 1 1 2 2019 1 1 52 CYS HB2 H 1.682 -0.677 -13.262 1.00 . A A . 52 CYS HB2 1 1 2 2020 1 1 52 CYS HB3 H 0.225 -1.540 -12.857 1.10 . A A . 52 CYS HB3 1 1 2 2021 1 1 52 CYS N N -0.061 -3.010 -14.904 0.70 . A A . 52 CYS N 1 1 2 2022 1 1 52 CYS O O 2.975 -3.325 -15.018 1.20 . A A . 52 CYS O 1 1 2 2023 1 1 52 CYS SG S 2.151 -2.895 -12.445 1.00 . A A . 52 CYS SG 1 1 2 2024 1 1 53 PRO C C 2.967 0.480 -16.013 0.80 . A A . 53 PRO C 1 1 2 2025 1 1 53 PRO CA C 3.400 -0.741 -16.817 0.70 . A A . 53 PRO CA 1 1 2 2026 1 1 53 PRO CB C 3.362 -0.365 -18.296 0.90 . A A . 53 PRO CB 1 1 2 2027 1 1 53 PRO CD C 1.701 -2.136 -17.874 0.80 . A A . 53 PRO CD 1 1 2 2028 1 1 53 PRO CG C 2.170 -1.109 -18.906 0.90 . A A . 53 PRO CG 1 1 2 2029 1 1 53 PRO HA H 4.395 -1.057 -16.506 0.80 . A A . 53 PRO HA 1 1 2 2030 1 1 53 PRO HB2 H 3.244 0.713 -18.411 1.00 . A A . 53 PRO HB2 1 1 2 2031 1 1 53 PRO HB3 H 4.289 -0.651 -18.793 1.10 . A A . 53 PRO HB3 1 1 2 2032 1 1 53 PRO HD2 H 0.633 -2.042 -17.679 0.80 . A A . 53 PRO HD2 1 1 2 2033 1 1 53 PRO HD3 H 1.912 -3.154 -18.201 0.90 . A A . 53 PRO HD3 1 1 2 2034 1 1 53 PRO HG2 H 1.368 -0.402 -19.118 0.90 . A A . 53 PRO HG2 1 1 2 2035 1 1 53 PRO HG3 H 2.457 -1.594 -19.837 1.00 . A A . 53 PRO HG3 1 1 2 2036 1 1 53 PRO N N 2.455 -1.834 -16.672 0.60 . A A . 53 PRO N 1 1 2 2037 1 1 53 PRO O O 1.921 0.510 -15.378 1.60 . A A . 53 PRO O 1 1 2 2038 1 1 54 ALA C C 2.151 3.128 -16.633 0.90 . A A . 54 ALA C 1 1 2 2039 1 1 54 ALA CA C 3.367 2.806 -15.767 0.80 . A A . 54 ALA CA 1 1 2 2040 1 1 54 ALA CB C 4.454 3.858 -15.975 0.80 . A A . 54 ALA CB 1 1 2 2041 1 1 54 ALA H H 4.826 1.237 -16.017 1.40 . A A . 54 ALA H 1 1 2 2042 1 1 54 ALA HA H 3.096 2.788 -14.714 0.70 . A A . 54 ALA HA 1 1 2 2043 1 1 54 ALA HB1 H 4.591 4.444 -15.065 1.20 . A A . 54 ALA HB1 1 1 2 2044 1 1 54 ALA HB2 H 4.181 4.548 -16.774 1.40 . A A . 54 ALA HB2 1 1 2 2045 1 1 54 ALA HB3 H 5.406 3.394 -16.223 1.30 . A A . 54 ALA HB3 1 1 2 2046 1 1 54 ALA N N 3.857 1.478 -16.081 0.80 . A A . 54 ALA N 1 1 2 2047 1 1 54 ALA O O 1.735 2.354 -17.486 1.50 . A A . 54 ALA O 1 1 2 2048 1 1 55 ASP C C 1.443 6.726 -16.859 1.10 . A A . 55 ASP C 1 1 2 2049 1 1 55 ASP CA C 1.439 5.292 -17.412 1.20 . A A . 55 ASP CA 1 1 2 2050 1 1 55 ASP CB C 0.097 5.005 -18.077 1.40 . A A . 55 ASP CB 1 1 2 2051 1 1 55 ASP CG C 0.085 5.536 -19.511 2.10 . A A . 55 ASP CG 1 1 2 2052 1 1 55 ASP H H 1.271 4.527 -15.434 1.40 . A A . 55 ASP H 1 1 2 2053 1 1 55 ASP HA H 2.270 5.158 -18.104 1.30 . A A . 55 ASP HA 1 1 2 2054 1 1 55 ASP HB2 H -0.087 3.931 -18.081 1.80 . A A . 55 ASP HB2 1 1 2 2055 1 1 55 ASP HB3 H -0.707 5.473 -17.510 1.50 . A A . 55 ASP HB3 1 1 2 2056 1 1 55 ASP N N 1.618 4.327 -16.347 1.00 . A A . 55 ASP N 1 1 2 2057 1 1 55 ASP O O 0.719 7.592 -17.335 1.50 . A A . 55 ASP O 1 1 2 2058 1 1 55 ASP OD1 O 0.524 4.818 -20.408 2.80 . A A . 55 ASP OD1 1 1 2 2059 1 1 55 ASP OD2 O -0.365 6.663 -19.716 2.60 . A A . 55 ASP OD2 1 1 2 2060 1 1 56 CYS C C 1.905 9.328 -15.819 0.80 . A A . 56 CYS C 1 1 2 2061 1 1 56 CYS CA C 2.171 8.072 -14.988 0.80 . A A . 56 CYS CA 1 1 2 2062 1 1 56 CYS CB C 3.479 8.181 -14.212 0.90 . A A . 56 CYS CB 1 1 2 2063 1 1 56 CYS H H 2.940 6.264 -15.449 1.10 . A A . 56 CYS H 1 1 2 2064 1 1 56 CYS HA H 1.345 7.877 -14.303 0.70 . A A . 56 CYS HA 1 1 2 2065 1 1 56 CYS HB2 H 4.073 8.993 -14.628 0.90 . A A . 56 CYS HB2 1 1 2 2066 1 1 56 CYS HB3 H 3.213 8.403 -13.187 1.00 . A A . 56 CYS HB3 1 1 2 2067 1 1 56 CYS N N 2.293 6.920 -15.833 0.90 . A A . 56 CYS N 1 1 2 2068 1 1 56 CYS O O 2.167 9.382 -17.015 1.10 . A A . 56 CYS O 1 1 2 2069 1 1 56 CYS SG S 4.507 6.686 -14.180 1.30 . A A . 56 CYS SG 1 1 2 2070 1 1 57 ASP C C 2.784 12.212 -15.718 0.90 . A A . 57 ASP C 1 1 2 2071 1 1 57 ASP CA C 1.355 11.653 -15.691 1.00 . A A . 57 ASP CA 1 1 2 2072 1 1 57 ASP CB C 0.452 12.574 -14.870 1.10 . A A . 57 ASP CB 1 1 2 2073 1 1 57 ASP CG C 0.254 13.898 -15.611 1.60 . A A . 57 ASP CG 1 1 2 2074 1 1 57 ASP H H 0.998 10.167 -14.185 1.10 . A A . 57 ASP H 1 1 2 2075 1 1 57 ASP HA H 0.963 11.519 -16.698 1.20 . A A . 57 ASP HA 1 1 2 2076 1 1 57 ASP HB2 H -0.521 12.113 -14.702 1.20 . A A . 57 ASP HB2 1 1 2 2077 1 1 57 ASP HB3 H 0.894 12.777 -13.895 1.10 . A A . 57 ASP HB3 1 1 2 2078 1 1 57 ASP N N 1.370 10.330 -15.099 0.80 . A A . 57 ASP N 1 1 2 2079 1 1 57 ASP O O 3.512 12.140 -14.735 1.00 . A A . 57 ASP O 1 1 2 2080 1 1 57 ASP OD1 O -0.499 13.919 -16.583 2.20 . A A . 57 ASP OD1 1 1 2 2081 1 1 57 ASP OD2 O 0.856 14.892 -15.207 2.00 . A A . 57 ASP OD2 1 1 2 2082 1 1 58 PRO C C 4.599 14.640 -16.138 1.20 . A A . 58 PRO C 1 1 2 2083 1 1 58 PRO CA C 4.450 13.420 -17.051 1.20 . A A . 58 PRO CA 1 1 2 2084 1 1 58 PRO CB C 4.515 13.849 -18.520 1.40 . A A . 58 PRO CB 1 1 2 2085 1 1 58 PRO CD C 2.335 12.778 -18.091 1.30 . A A . 58 PRO CD 1 1 2 2086 1 1 58 PRO CG C 3.174 13.473 -19.166 1.50 . A A . 58 PRO CG 1 1 2 2087 1 1 58 PRO HA H 5.241 12.707 -16.822 1.30 . A A . 58 PRO HA 1 1 2 2088 1 1 58 PRO HB2 H 4.691 14.922 -18.600 1.50 . A A . 58 PRO HB2 1 1 2 2089 1 1 58 PRO HB3 H 5.337 13.343 -19.027 1.70 . A A . 58 PRO HB3 1 1 2 2090 1 1 58 PRO HD2 H 1.404 13.314 -17.906 1.30 . A A . 58 PRO HD2 1 1 2 2091 1 1 58 PRO HD3 H 2.095 11.754 -18.377 1.40 . A A . 58 PRO HD3 1 1 2 2092 1 1 58 PRO HG2 H 2.664 14.364 -19.532 1.50 . A A . 58 PRO HG2 1 1 2 2093 1 1 58 PRO HG3 H 3.331 12.810 -20.017 1.70 . A A . 58 PRO HG3 1 1 2 2094 1 1 58 PRO N N 3.156 12.778 -16.891 1.00 . A A . 58 PRO N 1 1 2 2095 1 1 58 PRO O O 5.555 14.770 -15.385 1.50 . A A . 58 PRO O 1 1 2 2096 1 1 59 ASN C C 4.241 17.107 -14.551 1.30 . A A . 59 ASN C 1 1 2 2097 1 1 59 ASN CA C 3.835 16.916 -16.001 1.30 . A A . 59 ASN CA 1 1 2 2098 1 1 59 ASN CB C 2.545 17.687 -16.308 1.50 . A A . 59 ASN CB 1 1 2 2099 1 1 59 ASN CG C 2.806 18.912 -17.191 1.90 . A A . 59 ASN CG 1 1 2 2100 1 1 59 ASN H H 2.669 15.281 -16.565 1.10 . A A . 59 ASN H 1 1 2 2101 1 1 59 ASN HA H 4.659 17.188 -16.628 1.50 . A A . 59 ASN HA 1 1 2 2102 1 1 59 ASN HB2 H 1.836 17.033 -16.824 1.70 . A A . 59 ASN HB2 1 1 2 2103 1 1 59 ASN HB3 H 2.087 18.021 -15.375 1.70 . A A . 59 ASN HB3 1 1 2 2104 1 1 59 ASN HD21 H 4.712 18.791 -16.632 2.10 . A A . 59 ASN HD21 1 1 2 2105 1 1 59 ASN HD22 H 4.249 20.375 -17.257 2.50 . A A . 59 ASN HD22 1 1 2 2106 1 1 59 ASN N N 3.588 15.520 -16.262 1.10 . A A . 59 ASN N 1 1 2 2107 1 1 59 ASN ND2 N 4.034 19.424 -17.016 2.00 . A A . 59 ASN ND2 1 1 2 2108 1 1 59 ASN O O 5.320 17.558 -14.188 1.70 . A A . 59 ASN O 1 1 2 2109 1 1 59 ASN OD1 O 1.961 19.348 -17.962 2.70 . A A . 59 ASN OD1 1 1 2 2110 1 1 60 THR C C 3.415 16.095 -11.360 0.90 . A A . 60 THR C 1 1 2 2111 1 1 60 THR CA C 3.091 17.173 -12.418 1.20 . A A . 60 THR CA 1 1 2 2112 1 1 60 THR CB C 1.698 17.756 -12.230 1.40 . A A . 60 THR CB 1 1 2 2113 1 1 60 THR CG2 C 0.764 16.718 -11.646 1.40 . A A . 60 THR CG2 1 1 2 2114 1 1 60 THR H H 2.557 16.268 -14.374 1.00 . A A . 60 THR H 1 1 2 2115 1 1 60 THR HA H 3.785 17.987 -12.294 1.40 . A A . 60 THR HA 1 1 2 2116 1 1 60 THR HB H 1.311 18.107 -13.186 1.90 . A A . 60 THR HB 1 1 2 2117 1 1 60 THR HG1 H 1.632 19.636 -11.910 2.30 . A A . 60 THR HG1 1 1 2 2118 1 1 60 THR HG21 H 0.902 15.775 -12.172 1.90 . A A . 60 THR HG21 1 1 2 2119 1 1 60 THR HG22 H -0.269 17.043 -11.740 1.80 . A A . 60 THR HG22 1 1 2 2120 1 1 60 THR HG23 H 1.009 16.565 -10.595 1.70 . A A . 60 THR HG23 1 1 2 2121 1 1 60 THR N N 3.236 16.699 -13.786 1.10 . A A . 60 THR N 1 1 2 2122 1 1 60 THR O O 3.127 16.267 -10.182 1.10 . A A . 60 THR O 1 1 2 2123 1 1 60 THR OG1 O 1.763 18.867 -11.371 2.10 . A A . 60 THR OG1 1 1 2 2124 1 1 61 GLN C C 3.459 13.582 -9.924 0.90 . A A . 61 GLN C 1 1 2 2125 1 1 61 GLN CA C 3.565 13.679 -11.448 0.80 . A A . 61 GLN CA 1 1 2 2126 1 1 61 GLN CB C 4.540 12.624 -11.971 1.00 . A A . 61 GLN CB 1 1 2 2127 1 1 61 GLN CD C 7.034 12.577 -12.208 1.90 . A A . 61 GLN CD 1 1 2 2128 1 1 61 GLN CG C 5.871 12.660 -11.219 1.40 . A A . 61 GLN CG 1 1 2 2129 1 1 61 GLN H H 4.704 15.118 -12.570 1.20 . A A . 61 GLN H 1 1 2 2130 1 1 61 GLN HA H 2.576 13.556 -11.889 0.70 . A A . 61 GLN HA 1 1 2 2131 1 1 61 GLN HB2 H 4.092 11.635 -11.878 1.60 . A A . 61 GLN HB2 1 1 2 2132 1 1 61 GLN HB3 H 4.717 12.786 -13.034 1.60 . A A . 61 GLN HB3 1 1 2 2133 1 1 61 GLN HE21 H 6.666 10.608 -12.562 2.60 . A A . 61 GLN HE21 1 1 2 2134 1 1 61 GLN HE22 H 8.349 11.093 -12.665 2.80 . A A . 61 GLN HE22 1 1 2 2135 1 1 61 GLN HG2 H 5.964 13.581 -10.643 1.80 . A A . 61 GLN HG2 1 1 2 2136 1 1 61 GLN HG3 H 5.939 11.825 -10.521 1.90 . A A . 61 GLN HG3 1 1 2 2137 1 1 61 GLN N N 4.032 14.997 -11.840 0.90 . A A . 61 GLN N 1 1 2 2138 1 1 61 GLN NE2 N 7.381 11.312 -12.505 2.40 . A A . 61 GLN NE2 1 1 2 2139 1 1 61 GLN O O 4.380 13.154 -9.239 1.50 . A A . 61 GLN O 1 1 2 2140 1 1 61 GLN OE1 O 7.571 13.581 -12.662 2.40 . A A . 61 GLN OE1 1 1 2 2141 1 1 62 ALA C C 1.384 11.825 -8.555 0.90 . A A . 62 ALA C 1 1 2 2142 1 1 62 ALA CA C 1.696 13.311 -8.302 1.00 . A A . 62 ALA CA 1 1 2 2143 1 1 62 ALA CB C 0.404 14.025 -7.903 1.30 . A A . 62 ALA CB 1 1 2 2144 1 1 62 ALA H H 2.050 14.970 -9.587 1.50 . A A . 62 ALA H 1 1 2 2145 1 1 62 ALA HA H 2.426 13.403 -7.502 1.20 . A A . 62 ALA HA 1 1 2 2146 1 1 62 ALA HB1 H 0.595 14.780 -7.140 1.70 . A A . 62 ALA HB1 1 1 2 2147 1 1 62 ALA HB2 H -0.324 13.318 -7.504 1.60 . A A . 62 ALA HB2 1 1 2 2148 1 1 62 ALA HB3 H -0.045 14.522 -8.763 1.70 . A A . 62 ALA HB3 1 1 2 2149 1 1 62 ALA N N 2.274 14.007 -9.444 1.00 . A A . 62 ALA N 1 1 2 2150 1 1 62 ALA O O 0.703 11.183 -7.764 1.80 . A A . 62 ALA O 1 1 2 2151 1 1 63 SER C C 1.927 9.188 -10.996 0.60 . A A . 63 SER C 1 1 2 2152 1 1 63 SER CA C 1.103 10.357 -10.425 0.50 . A A . 63 SER CA 1 1 2 2153 1 1 63 SER CB C 0.387 11.079 -11.566 0.60 . A A . 63 SER CB 1 1 2 2154 1 1 63 SER H H 2.809 11.634 -9.970 1.20 . A A . 63 SER H 1 1 2 2155 1 1 63 SER HA H 0.392 9.953 -9.707 0.50 . A A . 63 SER HA 1 1 2 2156 1 1 63 SER HB2 H 0.572 12.152 -11.522 1.20 . A A . 63 SER HB2 1 1 2 2157 1 1 63 SER HB3 H 0.738 10.716 -12.532 0.90 . A A . 63 SER HB3 1 1 2 2158 1 1 63 SER HG H -1.145 9.947 -11.653 1.60 . A A . 63 SER HG 1 1 2 2159 1 1 63 SER N N 1.908 11.313 -9.681 0.60 . A A . 63 SER N 1 1 2 2160 1 1 63 SER O O 1.487 8.501 -11.909 1.60 . A A . 63 SER O 1 1 2 2161 1 1 63 SER OG O -1.001 10.871 -11.498 1.30 . A A . 63 SER OG 1 1 2 2162 1 1 64 CYS C C 4.424 7.115 -9.582 0.50 . A A . 64 CYS C 1 1 2 2163 1 1 64 CYS CA C 3.927 7.859 -10.824 0.50 . A A . 64 CYS CA 1 1 2 2164 1 1 64 CYS CB C 5.118 8.328 -11.669 0.50 . A A . 64 CYS CB 1 1 2 2165 1 1 64 CYS H H 3.399 9.588 -9.654 1.40 . A A . 64 CYS H 1 1 2 2166 1 1 64 CYS HA H 3.268 7.209 -11.400 0.60 . A A . 64 CYS HA 1 1 2 2167 1 1 64 CYS HB2 H 4.829 9.151 -12.321 0.70 . A A . 64 CYS HB2 1 1 2 2168 1 1 64 CYS HB3 H 5.894 8.720 -11.012 0.70 . A A . 64 CYS HB3 1 1 2 2169 1 1 64 CYS N N 3.122 8.992 -10.408 0.60 . A A . 64 CYS N 1 1 2 2170 1 1 64 CYS O O 5.616 7.023 -9.317 1.10 . A A . 64 CYS O 1 1 2 2171 1 1 64 CYS SG S 5.855 7.018 -12.680 1.30 . A A . 64 CYS SG 1 1 2 2172 1 1 65 GLU C C 4.400 6.076 -6.566 1.00 . A A . 65 GLU C 1 1 2 2173 1 1 65 GLU CA C 3.401 6.895 -7.414 1.10 . A A . 65 GLU CA 1 1 2 2174 1 1 65 GLU CB C 1.989 6.651 -6.898 1.30 . A A . 65 GLU CB 1 1 2 2175 1 1 65 GLU CD C 0.405 8.548 -6.465 1.90 . A A . 65 GLU CD 1 1 2 2176 1 1 65 GLU CG C 1.572 7.730 -5.906 1.50 . A A . 65 GLU CG 1 1 2 2177 1 1 65 GLU H H 2.733 6.005 -9.257 1.60 . A A . 65 GLU H 1 1 2 2178 1 1 65 GLU HA H 3.688 7.939 -7.341 1.30 . A A . 65 GLU HA 1 1 2 2179 1 1 65 GLU HB2 H 1.308 6.622 -7.746 1.50 . A A . 65 GLU HB2 1 1 2 2180 1 1 65 GLU HB3 H 1.936 5.674 -6.419 1.30 . A A . 65 GLU HB3 1 1 2 2181 1 1 65 GLU HG2 H 1.273 7.279 -4.962 1.70 . A A . 65 GLU HG2 1 1 2 2182 1 1 65 GLU HG3 H 2.416 8.390 -5.708 1.70 . A A . 65 GLU HG3 1 1 2 2183 1 1 65 GLU N N 3.427 6.594 -8.842 1.00 . A A . 65 GLU N 1 1 2 2184 1 1 65 GLU O O 4.407 6.136 -5.342 1.10 . A A . 65 GLU O 1 1 2 2185 1 1 65 GLU OE1 O 0.367 8.766 -7.675 2.40 . A A . 65 GLU OE1 1 1 2 2186 1 1 65 GLU OE2 O -0.451 8.958 -5.683 1.90 . A A . 65 GLU OE2 1 1 2 2187 1 1 66 CYS C C 7.045 3.890 -6.537 0.90 . A A . 66 CYS C 1 1 2 2188 1 1 66 CYS CA C 5.560 3.989 -6.897 1.00 . A A . 66 CYS CA 1 1 2 2189 1 1 66 CYS CB C 5.232 3.150 -8.124 1.20 . A A . 66 CYS CB 1 1 2 2190 1 1 66 CYS H H 5.116 5.377 -8.284 1.10 . A A . 66 CYS H 1 1 2 2191 1 1 66 CYS HA H 4.936 3.738 -6.039 1.10 . A A . 66 CYS HA 1 1 2 2192 1 1 66 CYS HB2 H 6.106 3.043 -8.766 1.20 . A A . 66 CYS HB2 1 1 2 2193 1 1 66 CYS HB3 H 4.969 2.176 -7.774 1.50 . A A . 66 CYS HB3 1 1 2 2194 1 1 66 CYS N N 5.228 5.321 -7.300 1.00 . A A . 66 CYS N 1 1 2 2195 1 1 66 CYS O O 7.774 4.875 -6.517 1.10 . A A . 66 CYS O 1 1 2 2196 1 1 66 CYS SG S 3.808 3.743 -9.083 1.70 . A A . 66 CYS SG 1 1 2 2197 1 1 67 PRO C C 8.710 3.135 -4.188 0.90 . A A . 67 PRO C 1 1 2 2198 1 1 67 PRO CA C 7.722 2.192 -4.890 0.90 . A A . 67 PRO CA 1 1 2 2199 1 1 67 PRO CB C 8.272 0.764 -5.032 0.90 . A A . 67 PRO CB 1 1 2 2200 1 1 67 PRO CD C 7.704 1.632 -7.272 0.80 . A A . 67 PRO CD 1 1 2 2201 1 1 67 PRO CG C 8.184 0.389 -6.518 0.80 . A A . 67 PRO CG 1 1 2 2202 1 1 67 PRO HA H 6.791 2.183 -4.324 1.10 . A A . 67 PRO HA 1 1 2 2203 1 1 67 PRO HB2 H 9.314 0.691 -4.712 0.80 . A A . 67 PRO HB2 1 1 2 2204 1 1 67 PRO HB3 H 7.673 0.072 -4.434 1.00 . A A . 67 PRO HB3 1 1 2 2205 1 1 67 PRO HD2 H 8.458 1.999 -7.966 0.70 . A A . 67 PRO HD2 1 1 2 2206 1 1 67 PRO HD3 H 6.797 1.420 -7.834 0.90 . A A . 67 PRO HD3 1 1 2 2207 1 1 67 PRO HG2 H 9.157 0.063 -6.884 0.80 . A A . 67 PRO HG2 1 1 2 2208 1 1 67 PRO HG3 H 7.488 -0.437 -6.661 1.00 . A A . 67 PRO HG3 1 1 2 2209 1 1 67 PRO N N 7.449 2.633 -6.248 0.80 . A A . 67 PRO N 1 1 2 2210 1 1 67 PRO O O 8.768 4.324 -4.476 1.30 . A A . 67 PRO O 1 1 2 2211 1 1 68 GLU C C 11.043 4.426 -3.324 1.10 . A A . 68 GLU C 1 1 2 2212 1 1 68 GLU CA C 10.487 3.256 -2.516 1.20 . A A . 68 GLU CA 1 1 2 2213 1 1 68 GLU CB C 11.637 2.331 -2.092 1.50 . A A . 68 GLU CB 1 1 2 2214 1 1 68 GLU CD C 12.573 0.010 -2.022 2.80 . A A . 68 GLU CD 1 1 2 2215 1 1 68 GLU CG C 11.298 0.840 -2.184 2.10 . A A . 68 GLU CG 1 1 2 2216 1 1 68 GLU H H 9.296 1.556 -3.061 1.60 . A A . 68 GLU H 1 1 2 2217 1 1 68 GLU HA H 9.987 3.664 -1.662 1.30 . A A . 68 GLU HA 1 1 2 2218 1 1 68 GLU HB2 H 12.510 2.539 -2.711 1.90 . A A . 68 GLU HB2 1 1 2 2219 1 1 68 GLU HB3 H 11.927 2.569 -1.069 1.90 . A A . 68 GLU HB3 1 1 2 2220 1 1 68 GLU HG2 H 10.589 0.557 -1.407 2.40 . A A . 68 GLU HG2 1 1 2 2221 1 1 68 GLU HG3 H 10.847 0.606 -3.149 2.50 . A A . 68 GLU HG3 1 1 2 2222 1 1 68 GLU N N 9.460 2.523 -3.249 1.20 . A A . 68 GLU N 1 1 2 2223 1 1 68 GLU O O 11.192 5.555 -2.873 1.20 . A A . 68 GLU O 1 1 2 2224 1 1 68 GLU OE1 O 13.602 0.578 -1.660 3.40 . A A . 68 GLU OE1 1 1 2 2225 1 1 68 GLU OE2 O 12.522 -1.196 -2.260 3.30 . A A . 68 GLU OE2 1 1 2 2226 1 1 69 GLY C C 10.529 4.679 -6.759 1.20 . A A . 69 GLY C 1 1 2 2227 1 1 69 GLY CA C 11.533 4.954 -5.639 1.50 . A A . 69 GLY CA 1 1 2 2228 1 1 69 GLY H H 11.131 3.037 -4.607 1.40 . A A . 69 GLY H 1 1 2 2229 1 1 69 GLY HA2 H 11.396 5.958 -5.236 1.70 . A A . 69 GLY HA2 1 1 2 2230 1 1 69 GLY HA3 H 12.555 4.823 -5.997 1.80 . A A . 69 GLY HA3 1 1 2 2231 1 1 69 GLY N N 11.326 4.014 -4.556 1.20 . A A . 69 GLY N 1 1 2 2232 1 1 69 GLY O O 9.867 5.574 -7.271 1.40 . A A . 69 GLY O 1 1 2 2233 1 1 70 TYR C C 12.436 3.682 -8.558 0.80 . A A . 70 TYR C 1 1 2 2234 1 1 70 TYR CA C 11.659 2.736 -7.630 0.80 . A A . 70 TYR CA 1 1 2 2235 1 1 70 TYR CB C 11.264 1.472 -8.395 0.60 . A A . 70 TYR CB 1 1 2 2236 1 1 70 TYR CD1 C 12.411 -0.100 -6.751 1.50 . A A . 70 TYR CD1 1 1 2 2237 1 1 70 TYR CD2 C 12.910 -0.313 -9.180 1.30 . A A . 70 TYR CD2 1 1 2 2238 1 1 70 TYR CE1 C 13.312 -1.185 -6.469 1.70 . A A . 70 TYR CE1 1 1 2 2239 1 1 70 TYR CE2 C 13.812 -1.399 -8.901 1.40 . A A . 70 TYR CE2 1 1 2 2240 1 1 70 TYR CG C 12.205 0.341 -8.107 0.70 . A A . 70 TYR CG 1 1 2 2241 1 1 70 TYR CZ C 14.013 -1.834 -7.545 1.10 . A A . 70 TYR CZ 1 1 2 2242 1 1 70 TYR H H 9.653 2.842 -6.865 1.00 . A A . 70 TYR H 1 1 2 2243 1 1 70 TYR HA H 12.278 2.482 -6.769 0.90 . A A . 70 TYR HA 1 1 2 2244 1 1 70 TYR HB2 H 10.257 1.167 -8.120 0.60 . A A . 70 TYR HB2 1 1 2 2245 1 1 70 TYR HB3 H 11.255 1.667 -9.467 0.60 . A A . 70 TYR HB3 1 1 2 2246 1 1 70 TYR HD1 H 11.885 0.387 -5.943 2.30 . A A . 70 TYR HD1 1 1 2 2247 1 1 70 TYR HD2 H 12.759 0.013 -10.199 2.10 . A A . 70 TYR HD2 1 1 2 2248 1 1 70 TYR HE1 H 13.462 -1.511 -5.450 2.50 . A A . 70 TYR HE1 1 1 2 2249 1 1 70 TYR HE2 H 14.338 -1.886 -9.709 2.10 . A A . 70 TYR HE2 1 1 2 2250 1 1 70 TYR HH H 14.411 -3.699 -7.343 1.50 . A A . 70 TYR HH 1 1 2 2251 1 1 70 TYR N N 10.467 3.378 -7.099 0.90 . A A . 70 TYR N 1 1 2 2252 1 1 70 TYR O O 12.055 4.820 -8.801 1.10 . A A . 70 TYR O 1 1 2 2253 1 1 70 TYR OH O 14.877 -2.876 -7.275 1.30 . A A . 70 TYR OH 1 1 2 2254 1 1 71 ILE C C 13.713 2.743 -11.479 0.90 . A A . 71 ILE C 1 1 2 2255 1 1 71 ILE CA C 14.088 3.653 -10.301 1.00 . A A . 71 ILE CA 1 1 2 2256 1 1 71 ILE CB C 15.608 3.781 -10.199 1.20 . A A . 71 ILE CB 1 1 2 2257 1 1 71 ILE CD1 C 15.440 5.819 -8.699 1.80 . A A . 71 ILE CD1 1 1 2 2258 1 1 71 ILE CG1 C 16.014 4.411 -8.866 1.40 . A A . 71 ILE CG1 1 1 2 2259 1 1 71 ILE CG2 C 16.165 4.588 -11.372 1.80 . A A . 71 ILE CG2 1 1 2 2260 1 1 71 ILE H H 14.005 2.364 -8.586 1.10 . A A . 71 ILE H 1 1 2 2261 1 1 71 ILE HA H 13.631 4.632 -10.441 1.20 . A A . 71 ILE HA 1 1 2 2262 1 1 71 ILE HB H 16.037 2.780 -10.244 1.70 . A A . 71 ILE HB 1 1 2 2263 1 1 71 ILE HD11 H 14.656 6.010 -9.431 2.20 . A A . 71 ILE HD11 1 1 2 2264 1 1 71 ILE HD12 H 16.216 6.573 -8.833 2.30 . A A . 71 ILE HD12 1 1 2 2265 1 1 71 ILE HD13 H 15.012 5.948 -7.705 2.10 . A A . 71 ILE HD13 1 1 2 2266 1 1 71 ILE HG12 H 15.676 3.779 -8.045 1.60 . A A . 71 ILE HG12 1 1 2 2267 1 1 71 ILE HG13 H 17.101 4.452 -8.799 1.70 . A A . 71 ILE HG13 1 1 2 2268 1 1 71 ILE HG21 H 17.246 4.702 -11.287 2.30 . A A . 71 ILE HG21 1 1 2 2269 1 1 71 ILE HG22 H 15.724 5.584 -11.403 2.20 . A A . 71 ILE HG22 1 1 2 2270 1 1 71 ILE HG23 H 15.951 4.096 -12.321 2.20 . A A . 71 ILE HG23 1 1 2 2271 1 1 71 ILE N N 13.554 3.122 -9.058 0.90 . A A . 71 ILE N 1 1 2 2272 1 1 71 ILE O O 14.510 2.488 -12.374 0.90 . A A . 71 ILE O 1 1 2 2273 1 1 72 LEU C C 11.954 3.313 -13.579 0.80 . A A . 72 LEU C 1 1 2 2274 1 1 72 LEU CA C 11.407 2.893 -12.212 0.80 . A A . 72 LEU CA 1 1 2 2275 1 1 72 LEU CB C 10.873 4.101 -11.448 0.80 . A A . 72 LEU CB 1 1 2 2276 1 1 72 LEU CD1 C 8.876 5.593 -11.737 0.70 . A A . 72 LEU CD1 1 1 2 2277 1 1 72 LEU CD2 C 11.142 6.314 -12.527 0.60 . A A . 72 LEU CD2 1 1 2 2278 1 1 72 LEU CG C 10.203 5.134 -12.343 0.70 . A A . 72 LEU CG 1 1 2 2279 1 1 72 LEU H H 12.208 1.580 -10.742 0.90 . A A . 72 LEU H 1 1 2 2280 1 1 72 LEU HA H 10.631 2.140 -12.346 0.80 . A A . 72 LEU HA 1 1 2 2281 1 1 72 LEU HB2 H 10.159 3.797 -10.692 1.00 . A A . 72 LEU HB2 1 1 2 2282 1 1 72 LEU HB3 H 11.703 4.553 -10.912 1.00 . A A . 72 LEU HB3 1 1 2 2283 1 1 72 LEU HD11 H 9.044 6.342 -10.963 1.40 . A A . 72 LEU HD11 1 1 2 2284 1 1 72 LEU HD12 H 8.345 4.756 -11.283 1.20 . A A . 72 LEU HD12 1 1 2 2285 1 1 72 LEU HD13 H 8.232 6.034 -12.496 1.20 . A A . 72 LEU HD13 1 1 2 2286 1 1 72 LEU HD21 H 10.576 7.233 -12.672 1.10 . A A . 72 LEU HD21 1 1 2 2287 1 1 72 LEU HD22 H 11.790 6.153 -13.387 1.10 . A A . 72 LEU HD22 1 1 2 2288 1 1 72 LEU HD23 H 11.766 6.429 -11.640 1.20 . A A . 72 LEU HD23 1 1 2 2289 1 1 72 LEU HG H 10.005 4.686 -13.317 0.70 . A A . 72 LEU HG 1 1 2 2290 1 1 72 LEU N N 12.451 2.274 -11.416 0.80 . A A . 72 LEU N 1 1 2 2291 1 1 72 LEU O O 13.002 3.938 -13.693 0.90 . A A . 72 LEU O 1 1 2 2292 1 1 73 ASP C C 10.848 1.995 -16.825 1.20 . A A . 73 ASP C 1 1 2 2293 1 1 73 ASP CA C 11.719 1.990 -15.562 1.00 . A A . 73 ASP CA 1 1 2 2294 1 1 73 ASP CB C 11.815 0.600 -14.929 1.50 . A A . 73 ASP CB 1 1 2 2295 1 1 73 ASP CG C 13.001 -0.156 -15.532 2.00 . A A . 73 ASP CG 1 1 2 2296 1 1 73 ASP H H 10.235 3.265 -14.687 0.80 . A A . 73 ASP H 1 1 2 2297 1 1 73 ASP HA H 12.709 2.365 -15.818 1.20 . A A . 73 ASP HA 1 1 2 2298 1 1 73 ASP HB2 H 11.953 0.675 -13.850 1.90 . A A . 73 ASP HB2 1 1 2 2299 1 1 73 ASP HB3 H 10.903 0.031 -15.109 1.90 . A A . 73 ASP HB3 1 1 2 2300 1 1 73 ASP N N 11.170 2.924 -14.599 0.90 . A A . 73 ASP N 1 1 2 2301 1 1 73 ASP O O 10.372 3.037 -17.260 1.70 . A A . 73 ASP O 1 1 2 2302 1 1 73 ASP OD1 O 13.665 0.398 -16.407 2.30 . A A . 73 ASP OD1 1 1 2 2303 1 1 73 ASP OD2 O 13.246 -1.289 -15.121 2.80 . A A . 73 ASP OD2 1 1 2 2304 1 1 74 ASP C C 8.737 1.627 -18.626 1.40 . A A . 74 ASP C 1 1 2 2305 1 1 74 ASP CA C 9.390 0.411 -17.944 1.80 . A A . 74 ASP CA 1 1 2 2306 1 1 74 ASP CB C 8.507 -0.165 -16.836 2.60 . A A . 74 ASP CB 1 1 2 2307 1 1 74 ASP CG C 9.036 -1.520 -16.362 3.20 . A A . 74 ASP CG 1 1 2 2308 1 1 74 ASP H H 11.413 0.101 -17.316 1.40 . A A . 74 ASP H 1 1 2 2309 1 1 74 ASP HA H 9.585 -0.347 -18.701 2.30 . A A . 74 ASP HA 1 1 2 2310 1 1 74 ASP HB2 H 8.473 0.521 -15.990 3.00 . A A . 74 ASP HB2 1 1 2 2311 1 1 74 ASP HB3 H 7.488 -0.298 -17.198 3.10 . A A . 74 ASP HB3 1 1 2 2312 1 1 74 ASP N N 10.680 0.777 -17.382 1.30 . A A . 74 ASP N 1 1 2 2313 1 1 74 ASP O O 9.400 2.418 -19.285 1.80 . A A . 74 ASP O 1 1 2 2314 1 1 74 ASP OD1 O 10.251 -1.710 -16.352 3.70 . A A . 74 ASP OD1 1 1 2 2315 1 1 74 ASP OD2 O 8.222 -2.372 -16.007 3.60 . A A . 74 ASP OD2 1 1 2 2316 1 1 75 GLY C C 7.234 4.106 -17.604 1.10 . A A . 75 GLY C 1 1 2 2317 1 1 75 GLY CA C 6.773 3.023 -18.598 1.10 . A A . 75 GLY CA 1 1 2 2318 1 1 75 GLY H H 6.887 0.907 -18.177 1.30 . A A . 75 GLY H 1 1 2 2319 1 1 75 GLY HA2 H 7.054 3.346 -19.588 1.50 . A A . 75 GLY HA2 1 1 2 2320 1 1 75 GLY HA3 H 5.697 2.874 -18.531 1.30 . A A . 75 GLY HA3 1 1 2 2321 1 1 75 GLY N N 7.409 1.722 -18.428 1.00 . A A . 75 GLY N 1 1 2 2322 1 1 75 GLY O O 7.034 5.294 -17.821 1.40 . A A . 75 GLY O 1 1 2 2323 1 1 76 PHE C C 7.663 3.584 -14.063 0.80 . A A . 76 PHE C 1 1 2 2324 1 1 76 PHE CA C 8.161 4.340 -15.312 0.90 . A A . 76 PHE CA 1 1 2 2325 1 1 76 PHE CB C 7.529 5.736 -15.321 1.00 . A A . 76 PHE CB 1 1 2 2326 1 1 76 PHE CD1 C 9.368 6.342 -16.995 1.80 . A A . 76 PHE CD1 1 1 2 2327 1 1 76 PHE CD2 C 8.236 8.149 -15.713 2.00 . A A . 76 PHE CD2 1 1 2 2328 1 1 76 PHE CE1 C 10.172 7.324 -17.673 2.50 . A A . 76 PHE CE1 1 1 2 2329 1 1 76 PHE CE2 C 9.040 9.134 -16.388 2.70 . A A . 76 PHE CE2 1 1 2 2330 1 1 76 PHE CG C 8.392 6.750 -16.017 1.20 . A A . 76 PHE CG 1 1 2 2331 1 1 76 PHE CZ C 10.006 8.721 -17.370 2.80 . A A . 76 PHE CZ 1 1 2 2332 1 1 76 PHE H H 8.094 2.640 -16.700 1.00 . A A . 76 PHE H 1 1 2 2333 1 1 76 PHE HA H 9.248 4.413 -15.266 0.80 . A A . 76 PHE HA 1 1 2 2334 1 1 76 PHE HB2 H 6.540 5.715 -15.777 1.60 . A A . 76 PHE HB2 1 1 2 2335 1 1 76 PHE HB3 H 7.380 6.069 -14.295 1.30 . A A . 76 PHE HB3 1 1 2 2336 1 1 76 PHE HD1 H 9.498 5.294 -17.222 2.30 . A A . 76 PHE HD1 1 1 2 2337 1 1 76 PHE HD2 H 7.511 8.459 -14.976 2.50 . A A . 76 PHE HD2 1 1 2 2338 1 1 76 PHE HE1 H 10.896 7.016 -18.413 3.20 . A A . 76 PHE HE1 1 1 2 2339 1 1 76 PHE HE2 H 8.913 10.182 -16.158 3.50 . A A . 76 PHE HE2 1 1 2 2340 1 1 76 PHE HZ H 10.604 9.461 -17.881 3.50 . A A . 76 PHE HZ 1 1 2 2341 1 1 76 PHE N N 7.861 3.597 -16.534 0.90 . A A . 76 PHE N 1 1 2 2342 1 1 76 PHE O O 7.275 4.186 -13.069 0.80 . A A . 76 PHE O 1 1 2 2343 1 1 77 ILE C C 5.687 1.891 -12.776 0.70 . A A . 77 ILE C 1 1 2 2344 1 1 77 ILE CA C 6.417 1.557 -14.077 0.80 . A A . 77 ILE CA 1 1 2 2345 1 1 77 ILE CB C 6.592 0.062 -14.326 0.90 . A A . 77 ILE CB 1 1 2 2346 1 1 77 ILE CD1 C 5.666 -2.253 -13.870 1.20 . A A . 77 ILE CD1 1 1 2 2347 1 1 77 ILE CG1 C 5.386 -0.750 -13.878 1.10 . A A . 77 ILE CG1 1 1 2 2348 1 1 77 ILE CG2 C 7.871 -0.446 -13.687 0.90 . A A . 77 ILE CG2 1 1 2 2349 1 1 77 ILE H H 8.447 1.826 -14.684 0.80 . A A . 77 ILE H 1 1 2 2350 1 1 77 ILE HA H 5.815 1.918 -14.891 0.80 . A A . 77 ILE HA 1 1 2 2351 1 1 77 ILE HB H 6.667 -0.076 -15.401 0.90 . A A . 77 ILE HB 1 1 2 2352 1 1 77 ILE HD11 H 4.756 -2.815 -13.658 1.50 . A A . 77 ILE HD11 1 1 2 2353 1 1 77 ILE HD12 H 6.404 -2.505 -13.108 1.60 . A A . 77 ILE HD12 1 1 2 2354 1 1 77 ILE HD13 H 6.049 -2.583 -14.836 1.70 . A A . 77 ILE HD13 1 1 2 2355 1 1 77 ILE HG12 H 5.099 -0.420 -12.888 1.30 . A A . 77 ILE HG12 1 1 2 2356 1 1 77 ILE HG13 H 4.543 -0.546 -14.534 1.10 . A A . 77 ILE HG13 1 1 2 2357 1 1 77 ILE HG21 H 8.010 -1.500 -13.923 1.10 . A A . 77 ILE HG21 1 1 2 2358 1 1 77 ILE HG22 H 7.820 -0.323 -12.606 1.40 . A A . 77 ILE HG22 1 1 2 2359 1 1 77 ILE HG23 H 8.728 0.114 -14.059 1.40 . A A . 77 ILE HG23 1 1 2 2360 1 1 77 ILE N N 7.693 2.241 -14.177 0.80 . A A . 77 ILE N 1 1 2 2361 1 1 77 ILE O O 6.272 2.195 -11.744 0.80 . A A . 77 ILE O 1 1 2 2362 1 1 78 CYS C C 2.040 1.830 -12.130 0.70 . A A . 78 CYS C 1 1 2 2363 1 1 78 CYS CA C 3.467 2.367 -11.941 0.50 . A A . 78 CYS CA 1 1 2 2364 1 1 78 CYS CB C 3.518 3.889 -12.036 0.40 . A A . 78 CYS CB 1 1 2 2365 1 1 78 CYS H H 4.017 1.253 -13.702 0.50 . A A . 78 CYS H 1 1 2 2366 1 1 78 CYS HA H 3.843 2.033 -10.974 0.60 . A A . 78 CYS HA 1 1 2 2367 1 1 78 CYS HB2 H 3.880 4.194 -13.018 0.70 . A A . 78 CYS HB2 1 1 2 2368 1 1 78 CYS HB3 H 2.520 4.311 -11.915 0.70 . A A . 78 CYS HB3 1 1 2 2369 1 1 78 CYS N N 4.354 1.798 -12.934 0.50 . A A . 78 CYS N 1 1 2 2370 1 1 78 CYS O O 1.584 0.958 -11.401 1.70 . A A . 78 CYS O 1 1 2 2371 1 1 78 CYS SG S 4.610 4.566 -10.766 1.00 . A A . 78 CYS SG 1 1 2 2372 1 1 79 THR C C -0.371 2.105 -14.838 0.90 . A A . 79 THR C 1 1 2 2373 1 1 79 THR CA C -0.024 2.049 -13.344 0.70 . A A . 79 THR CA 1 1 2 2374 1 1 79 THR CB C -0.901 3.016 -12.542 0.90 . A A . 79 THR CB 1 1 2 2375 1 1 79 THR CG2 C -2.244 3.297 -13.218 1.60 . A A . 79 THR CG2 1 1 2 2376 1 1 79 THR H H 1.826 3.049 -13.761 1.30 . A A . 79 THR H 1 1 2 2377 1 1 79 THR HA H -0.139 1.027 -12.984 0.80 . A A . 79 THR HA 1 1 2 2378 1 1 79 THR HB H -0.366 3.956 -12.403 0.70 . A A . 79 THR HB 1 1 2 2379 1 1 79 THR HG1 H -0.557 1.730 -11.174 2.00 . A A . 79 THR HG1 1 1 2 2380 1 1 79 THR HG21 H -2.957 3.708 -12.505 2.00 . A A . 79 THR HG21 1 1 2 2381 1 1 79 THR HG22 H -2.671 2.384 -13.631 2.20 . A A . 79 THR HG22 1 1 2 2382 1 1 79 THR HG23 H -2.128 4.011 -14.034 2.10 . A A . 79 THR HG23 1 1 2 2383 1 1 79 THR N N 1.372 2.401 -13.150 0.70 . A A . 79 THR N 1 1 2 2384 1 1 79 THR O O -0.438 3.170 -15.439 1.50 . A A . 79 THR O 1 1 2 2385 1 1 79 THR OG1 O -1.131 2.480 -11.263 1.70 . A A . 79 THR OG1 1 1 2 2386 1 1 80 ASP C C -2.940 1.431 -15.817 1.10 . A A . 80 ASP C 1 1 2 2387 1 1 80 ASP CA C -1.920 0.346 -15.456 1.20 . A A . 80 ASP CA 1 1 2 2388 1 1 80 ASP CB C -2.257 -0.290 -14.108 1.70 . A A . 80 ASP CB 1 1 2 2389 1 1 80 ASP CG C -3.091 -1.554 -14.319 2.40 . A A . 80 ASP CG 1 1 2 2390 1 1 80 ASP H H 0.169 0.303 -15.692 0.80 . A A . 80 ASP H 1 1 2 2391 1 1 80 ASP HA H -1.894 -0.402 -16.250 1.50 . A A . 80 ASP HA 1 1 2 2392 1 1 80 ASP HB2 H -1.336 -0.550 -13.581 2.10 . A A . 80 ASP HB2 1 1 2 2393 1 1 80 ASP HB3 H -2.826 0.405 -13.487 1.80 . A A . 80 ASP HB3 1 1 2 2394 1 1 80 ASP N N -0.581 0.893 -15.391 0.80 . A A . 80 ASP N 1 1 2 2395 1 1 80 ASP O O -2.628 2.608 -15.943 1.90 . A A . 80 ASP O 1 1 2 2396 1 1 80 ASP OD1 O -2.620 -2.463 -14.999 2.90 . A A . 80 ASP OD1 1 1 2 2397 1 1 80 ASP OD2 O -4.204 -1.615 -13.798 2.90 . A A . 80 ASP OD2 1 1 2 2398 1 1 81 ILE C C -4.345 2.099 -18.142 1.60 . A A . 81 ILE C 1 1 2 2399 1 1 81 ILE CA C -4.723 0.857 -17.327 1.30 . A A . 81 ILE CA 1 1 2 2400 1 1 81 ILE CB C -6.244 0.719 -17.260 1.70 . A A . 81 ILE CB 1 1 2 2401 1 1 81 ILE CD1 C -7.877 -1.186 -16.895 3.00 . A A . 81 ILE CD1 1 1 2 2402 1 1 81 ILE CG1 C -6.640 -0.459 -16.368 2.50 . A A . 81 ILE CG1 1 1 2 2403 1 1 81 ILE CG2 C -6.834 0.566 -18.662 1.90 . A A . 81 ILE CG2 1 1 2 2404 1 1 81 ILE H H -4.658 0.510 -15.215 1.50 . A A . 81 ILE H 1 1 2 2405 1 1 81 ILE HA H -4.285 -0.033 -17.779 1.50 . A A . 81 ILE HA 1 1 2 2406 1 1 81 ILE HB H -6.648 1.630 -16.818 2.20 . A A . 81 ILE HB 1 1 2 2407 1 1 81 ILE HD11 H -8.075 -2.088 -16.317 3.20 . A A . 81 ILE HD11 1 1 2 2408 1 1 81 ILE HD12 H -7.741 -1.476 -17.937 3.40 . A A . 81 ILE HD12 1 1 2 2409 1 1 81 ILE HD13 H -8.757 -0.546 -16.836 3.30 . A A . 81 ILE HD13 1 1 2 2410 1 1 81 ILE HG12 H -5.807 -1.159 -16.299 2.70 . A A . 81 ILE HG12 1 1 2 2411 1 1 81 ILE HG13 H -6.829 -0.102 -15.355 3.00 . A A . 81 ILE HG13 1 1 2 2412 1 1 81 ILE HG21 H -6.581 1.423 -19.286 2.20 . A A . 81 ILE HG21 1 1 2 2413 1 1 81 ILE HG22 H -7.920 0.489 -18.621 2.30 . A A . 81 ILE HG22 1 1 2 2414 1 1 81 ILE HG23 H -6.450 -0.330 -19.149 2.30 . A A . 81 ILE HG23 1 1 2 2415 1 1 81 ILE N N -4.182 0.941 -15.982 1.00 . A A . 81 ILE N 1 1 2 2416 1 1 81 ILE O O -4.151 3.186 -17.612 2.40 . A A . 81 ILE O 1 1 2 2417 1 1 82 ASP C C -5.466 3.886 -20.061 2.70 . A A . 82 ASP C 1 1 2 2418 1 1 82 ASP CA C -4.271 2.982 -20.372 2.60 . A A . 82 ASP CA 1 1 2 2419 1 1 82 ASP CB C -4.352 2.477 -21.813 3.50 . A A . 82 ASP CB 1 1 2 2420 1 1 82 ASP CG C -4.108 3.636 -22.783 3.90 . A A . 82 ASP CG 1 1 2 2421 1 1 82 ASP H H -4.187 0.916 -19.803 2.10 . A A . 82 ASP H 1 1 2 2422 1 1 82 ASP HA H -3.347 3.532 -20.200 3.00 . A A . 82 ASP HA 1 1 2 2423 1 1 82 ASP HB2 H -3.605 1.704 -21.991 3.90 . A A . 82 ASP HB2 1 1 2 2424 1 1 82 ASP HB3 H -5.332 2.046 -22.016 3.90 . A A . 82 ASP HB3 1 1 2 2425 1 1 82 ASP N N -4.257 1.853 -19.461 1.90 . A A . 82 ASP N 1 1 2 2426 1 1 82 ASP O O -6.324 3.568 -19.246 3.30 . A A . 82 ASP O 1 1 2 2427 1 1 82 ASP OD1 O -3.397 4.570 -22.414 4.20 . A A . 82 ASP OD1 1 1 2 2428 1 1 82 ASP OD2 O -4.632 3.591 -23.894 4.50 . A A . 82 ASP OD2 1 1 2 2429 1 1 83 GLU C C -6.778 6.453 -22.240 1.00 . A A . 83 GLU C 1 1 2 2430 1 1 83 GLU CA C -6.692 5.784 -20.867 1.00 . A A . 83 GLU CA 1 1 2 2431 1 1 83 GLU CB C -6.743 6.839 -19.761 1.00 . A A . 83 GLU CB 1 1 2 2432 1 1 83 GLU CD C -7.226 7.312 -17.350 1.00 . A A . 83 GLU CD 1 1 2 2433 1 1 83 GLU CG C -6.966 6.214 -18.383 1.00 . A A . 83 GLU CG 1 1 2 2434 1 1 83 GLU H H -4.622 5.352 -21.213 1.00 . A A . 83 GLU H 1 1 2 2435 1 1 83 GLU HA H -7.504 5.065 -20.763 1.00 . A A . 83 GLU HA 1 1 2 2436 1 1 83 GLU HB2 H -5.814 7.408 -19.757 1.00 . A A . 83 GLU HB2 1 1 2 2437 1 1 83 GLU HB3 H -7.542 7.550 -19.972 1.00 . A A . 83 GLU HB3 1 1 2 2438 1 1 83 GLU HG2 H -7.820 5.536 -18.402 1.00 . A A . 83 GLU HG2 1 1 2 2439 1 1 83 GLU HG3 H -6.093 5.638 -18.077 1.00 . A A . 83 GLU HG3 1 1 2 2440 1 1 83 GLU N N -5.457 5.030 -20.767 1.00 . A A . 83 GLU N 1 1 2 2441 1 1 83 GLU O O -7.764 7.141 -22.497 1.00 . A A . 83 GLU O 1 1 2 2442 1 1 83 GLU OXT O -5.856 6.279 -23.036 1.00 . A A . 83 GLU OXT 1 1 2 2443 1 1 83 GLU OE1 O -8.358 7.785 -17.268 1.00 . A A . 83 GLU OE1 1 1 2 2444 1 1 83 GLU OE2 O -6.292 7.681 -16.639 1.00 . A A . 83 GLU OE2 1 1 2 2445 2 2 1 NAG C1 C -16.826 0.005 8.794 1.00 . B A . 121 NAG C1 1 1 2 2446 2 2 1 NAG C2 C -16.158 -0.229 7.441 1.00 . B A . 121 NAG C2 1 1 2 2447 2 2 1 NAG C3 C -17.068 -1.027 6.510 1.00 . B A . 121 NAG C3 1 1 2 2448 2 2 1 NAG C4 C -18.544 -0.733 6.783 1.00 . B A . 121 NAG C4 1 1 2 2449 2 2 1 NAG C5 C -18.918 -0.908 8.258 1.00 . B A . 121 NAG C5 1 1 2 2450 2 2 1 NAG C6 C -19.782 -2.150 8.477 1.00 . B A . 121 NAG C6 1 1 2 2451 2 2 1 NAG C7 C -14.578 1.298 6.474 1.00 . B A . 121 NAG C7 1 1 2 2452 2 2 1 NAG C8 C -13.644 1.474 7.673 1.00 . B A . 121 NAG C8 1 1 2 2453 2 2 1 NAG H1 H -17.332 0.970 8.817 1.00 . B A . 121 NAG H1 1 1 2 2454 2 2 1 NAG H2 H -15.204 -0.741 7.571 1.00 . B A . 121 NAG H2 1 1 2 2455 2 2 1 NAG H3 H -16.833 -0.782 5.474 1.00 . B A . 121 NAG H3 1 1 2 2456 2 2 1 NAG H4 H -19.161 -1.394 6.175 1.00 . B A . 121 NAG H4 1 1 2 2457 2 2 1 NAG H5 H -19.470 -0.029 8.591 1.00 . B A . 121 NAG H5 1 1 2 2458 2 2 1 NAG H61 H -19.208 -2.944 8.955 1.00 . B A . 121 NAG H61 1 1 2 2459 2 2 1 NAG H62 H -20.160 -2.533 7.529 1.00 . B A . 121 NAG H62 1 1 2 2460 2 2 1 NAG H81 H -13.435 2.532 7.830 1.00 . B A . 121 NAG H81 1 1 2 2461 2 2 1 NAG H82 H -14.110 1.069 8.571 1.00 . B A . 121 NAG H82 1 1 2 2462 2 2 1 NAG H83 H -12.705 0.950 7.494 1.00 . B A . 121 NAG H83 1 1 2 2463 2 2 1 NAG HN2 H -16.567 1.731 6.678 1.00 . B A . 121 NAG HN2 1 1 2 2464 2 2 1 NAG HO3 H -17.343 -2.682 7.419 1.00 . B A . 121 NAG HO3 1 1 2 2465 2 2 1 NAG HO4 H -18.002 1.019 6.257 1.00 . B A . 121 NAG HO4 1 1 2 2466 2 2 1 NAG HO6 H -20.715 -0.997 9.675 1.00 . B A . 121 NAG HO6 1 1 2 2467 2 2 1 NAG N2 N -15.851 1.050 6.831 1.00 . B A . 121 NAG N2 1 1 2 2468 2 2 1 NAG O3 O -16.824 -2.401 6.677 1.00 . B A . 121 NAG O3 1 1 2 2469 2 2 1 NAG O4 O -18.834 0.583 6.385 1.00 . B A . 121 NAG O4 1 1 2 2470 2 2 1 NAG O5 O -17.754 -1.022 9.042 1.00 . B A . 121 NAG O5 1 1 2 2471 2 2 1 NAG O6 O -20.882 -1.850 9.298 1.00 . B A . 121 NAG O6 1 1 2 2472 2 2 1 NAG O7 O -14.173 1.380 5.321 1.00 . B A . 121 NAG O7 1 1 2 2473 3 2 1 NAG C1 C -5.730 -2.441 -8.224 1.00 . C A . 148 NAG C1 1 1 2 2474 3 2 1 NAG C2 C -5.731 -1.079 -7.537 1.00 . C A . 148 NAG C2 1 1 2 2475 3 2 1 NAG C3 C -6.962 -0.256 -7.919 1.00 . C A . 148 NAG C3 1 1 2 2476 3 2 1 NAG C4 C -8.171 -1.137 -8.242 1.00 . C A . 148 NAG C4 1 1 2 2477 3 2 1 NAG C5 C -7.845 -2.285 -9.205 1.00 . C A . 148 NAG C5 1 1 2 2478 3 2 1 NAG C6 C -8.550 -2.109 -10.550 1.00 . C A . 148 NAG C6 1 1 2 2479 3 2 1 NAG C7 C -5.216 -0.265 -5.343 1.00 . C A . 148 NAG C7 1 1 2 2480 3 2 1 NAG C8 C -4.488 -0.762 -4.092 1.00 . C A . 148 NAG C8 1 1 2 2481 3 2 1 NAG H1 H -6.163 -3.208 -7.582 1.00 . C A . 148 NAG H1 1 1 2 2482 3 2 1 NAG H2 H -4.821 -0.532 -7.783 1.00 . C A . 148 NAG H2 1 1 2 2483 3 2 1 NAG H3 H -7.215 0.412 -7.095 1.00 . C A . 148 NAG H3 1 1 2 2484 3 2 1 NAG H4 H -8.954 -0.518 -8.680 1.00 . C A . 148 NAG H4 1 1 2 2485 3 2 1 NAG H5 H -8.169 -3.224 -8.756 1.00 . C A . 148 NAG H5 1 1 2 2486 3 2 1 NAG H61 H -7.853 -1.762 -11.313 1.00 . C A . 148 NAG H61 1 1 2 2487 3 2 1 NAG H62 H -9.358 -1.381 -10.475 1.00 . C A . 148 NAG H62 1 1 2 2488 3 2 1 NAG H81 H -3.476 -0.358 -4.065 1.00 . C A . 148 NAG H81 1 1 2 2489 3 2 1 NAG H82 H -5.022 -0.439 -3.199 1.00 . C A . 148 NAG H82 1 1 2 2490 3 2 1 NAG H83 H -4.435 -1.850 -4.101 1.00 . C A . 148 NAG H83 1 1 2 2491 3 2 1 NAG HN2 H -6.041 -2.109 -5.682 1.00 . C A . 148 NAG HN2 1 1 2 2492 3 2 1 NAG HO3 H -6.928 1.434 -8.801 1.00 . C A . 148 NAG HO3 1 1 2 2493 3 2 1 NAG HO4 H -9.621 -1.495 -7.056 1.00 . C A . 148 NAG HO4 1 1 2 2494 3 2 1 NAG HO6 H -8.660 -4.013 -10.497 1.00 . C A . 148 NAG HO6 1 1 2 2495 3 2 1 NAG N2 N -5.705 -1.264 -6.099 1.00 . C A . 148 NAG N2 1 1 2 2496 3 2 1 NAG O3 O -6.661 0.553 -9.027 1.00 . C A . 148 NAG O3 1 1 2 2497 3 2 1 NAG O4 O -8.689 -1.668 -7.049 1.00 . C A . 148 NAG O4 1 1 2 2498 3 2 1 NAG O5 O -6.457 -2.355 -9.424 1.00 . C A . 148 NAG O5 1 1 2 2499 3 2 1 NAG O6 O -9.100 -3.328 -10.982 1.00 . C A . 148 NAG O6 1 1 2 2500 3 2 1 NAG O7 O -5.322 0.928 -5.599 1.00 . C A . 148 NAG O7 1 1 3 2501 1 1 1 HIS C C -0.406 -10.114 26.040 1.00 . A A . 1 HIS C 1 1 3 2502 1 1 1 HIS CA C 0.788 -10.807 26.699 1.00 . A A . 1 HIS CA 1 1 3 2503 1 1 1 HIS CB C 1.623 -11.500 25.622 1.00 . A A . 1 HIS CB 1 1 3 2504 1 1 1 HIS CD2 C 3.568 -9.861 25.495 1.00 . A A . 1 HIS CD2 1 1 3 2505 1 1 1 HIS CE1 C 5.290 -11.229 25.916 1.00 . A A . 1 HIS CE1 1 1 3 2506 1 1 1 HIS CG C 3.068 -11.095 25.681 1.00 . A A . 1 HIS CG 1 1 3 2507 1 1 1 HIS H1 H 0.396 -11.290 28.657 1.00 . A A . 1 HIS H1 1 1 3 2508 1 1 1 HIS H2 H -0.630 -12.039 27.530 1.00 . A A . 1 HIS H2 1 1 3 2509 1 1 1 HIS H3 H 0.968 -12.582 27.715 1.00 . A A . 1 HIS H3 1 1 3 2510 1 1 1 HIS HA H 1.388 -10.046 27.198 1.00 . A A . 1 HIS HA 1 1 3 2511 1 1 1 HIS HB2 H 1.548 -12.581 25.739 1.00 . A A . 1 HIS HB2 1 1 3 2512 1 1 1 HIS HB3 H 1.223 -11.262 24.637 1.00 . A A . 1 HIS HB3 1 1 3 2513 1 1 1 HIS HD2 H 2.998 -8.978 25.274 1.00 . A A . 1 HIS HD2 1 1 3 2514 1 1 1 HIS HE1 H 6.293 -11.606 26.096 1.00 . A A . 1 HIS HE1 1 1 3 2515 1 1 1 HIS HE2 H 5.656 -9.171 25.552 1.00 . A A . 1 HIS HE2 1 1 3 2516 1 1 1 HIS N N 0.349 -11.747 27.724 1.00 . A A . 1 HIS N 1 1 3 2517 1 1 1 HIS ND1 N 4.193 -12.006 25.959 1.00 . A A . 1 HIS ND1 1 1 3 2518 1 1 1 HIS NE2 N 5.026 -9.942 25.647 1.00 . A A . 1 HIS NE2 1 1 3 2519 1 1 1 HIS O O -1.157 -10.708 25.275 1.00 . A A . 1 HIS O 1 1 3 2520 1 1 2 MET C C -0.689 -7.634 24.268 1.00 . A A . 2 MET C 1 1 3 2521 1 1 2 MET CA C -1.382 -7.971 25.589 1.00 . A A . 2 MET CA 1 1 3 2522 1 1 2 MET CB C -1.705 -6.690 26.359 1.00 . A A . 2 MET CB 1 1 3 2523 1 1 2 MET CE C 0.239 -4.378 28.904 1.00 . A A . 2 MET CE 1 1 3 2524 1 1 2 MET CG C -0.439 -5.954 26.798 1.00 . A A . 2 MET CG 1 1 3 2525 1 1 2 MET H H -0.043 -8.460 27.189 1.00 . A A . 2 MET H 1 1 3 2526 1 1 2 MET HA H -2.285 -8.545 25.382 1.00 . A A . 2 MET HA 1 1 3 2527 1 1 2 MET HB2 H -2.312 -6.032 25.736 1.00 . A A . 2 MET HB2 1 1 3 2528 1 1 2 MET HB3 H -2.308 -6.933 27.234 1.00 . A A . 2 MET HB3 1 1 3 2529 1 1 2 MET HE1 H -0.190 -5.028 29.667 1.00 . A A . 2 MET HE1 1 1 3 2530 1 1 2 MET HE2 H 0.357 -3.378 29.322 1.00 . A A . 2 MET HE2 1 1 3 2531 1 1 2 MET HE3 H 1.223 -4.761 28.631 1.00 . A A . 2 MET HE3 1 1 3 2532 1 1 2 MET HG2 H 0.084 -6.530 27.561 1.00 . A A . 2 MET HG2 1 1 3 2533 1 1 2 MET HG3 H 0.243 -5.841 25.955 1.00 . A A . 2 MET HG3 1 1 3 2534 1 1 2 MET N N -0.525 -8.821 26.391 1.00 . A A . 2 MET N 1 1 3 2535 1 1 2 MET O O 0.454 -7.194 24.228 1.00 . A A . 2 MET O 1 1 3 2536 1 1 2 MET SD S -0.830 -4.326 27.457 1.00 . A A . 2 MET SD 1 1 3 2537 1 1 3 GLU C C -3.543 -7.663 21.943 1.00 . A A . 3 GLU C 1 1 3 2538 1 1 3 GLU CA C -2.632 -7.032 23.005 1.00 . A A . 3 GLU CA 1 1 3 2539 1 1 3 GLU CB C -2.186 -5.624 22.600 1.00 . A A . 3 GLU CB 1 1 3 2540 1 1 3 GLU CD C -1.811 -3.563 24.001 1.00 . A A . 3 GLU CD 1 1 3 2541 1 1 3 GLU CG C -2.850 -4.554 23.470 1.00 . A A . 3 GLU CG 1 1 3 2542 1 1 3 GLU H H -1.252 -8.611 22.560 1.00 . A A . 3 GLU H 1 1 3 2543 1 1 3 GLU HA H -3.149 -7.012 23.964 1.00 . A A . 3 GLU HA 1 1 3 2544 1 1 3 GLU HB2 H -1.101 -5.550 22.702 1.00 . A A . 3 GLU HB2 1 1 3 2545 1 1 3 GLU HB3 H -2.428 -5.446 21.549 1.00 . A A . 3 GLU HB3 1 1 3 2546 1 1 3 GLU HG2 H -3.602 -4.009 22.901 1.00 . A A . 3 GLU HG2 1 1 3 2547 1 1 3 GLU HG3 H -3.352 -5.015 24.321 1.00 . A A . 3 GLU HG3 1 1 3 2548 1 1 3 GLU N N -1.465 -7.870 23.196 1.00 . A A . 3 GLU N 1 1 3 2549 1 1 3 GLU O O -3.091 -8.337 21.025 1.00 . A A . 3 GLU O 1 1 3 2550 1 1 3 GLU OE1 O -0.742 -3.452 23.405 1.00 . A A . 3 GLU OE1 1 1 3 2551 1 1 3 GLU OE2 O -2.084 -2.910 25.007 1.00 . A A . 3 GLU OE2 1 1 3 2552 1 1 4 PRO C C -5.853 -7.212 19.837 1.00 . A A . 4 PRO C 1 1 3 2553 1 1 4 PRO CA C -5.894 -7.881 21.218 1.00 . A A . 4 PRO CA 1 1 3 2554 1 1 4 PRO CB C -7.216 -7.496 21.879 1.00 . A A . 4 PRO CB 1 1 3 2555 1 1 4 PRO CD C -5.357 -6.646 23.260 1.00 . A A . 4 PRO CD 1 1 3 2556 1 1 4 PRO CG C -6.868 -6.573 23.051 1.00 . A A . 4 PRO CG 1 1 3 2557 1 1 4 PRO HA H -5.818 -8.962 21.100 1.00 . A A . 4 PRO HA 1 1 3 2558 1 1 4 PRO HB2 H -7.865 -6.985 21.168 1.00 . A A . 4 PRO HB2 1 1 3 2559 1 1 4 PRO HB3 H -7.744 -8.382 22.231 1.00 . A A . 4 PRO HB3 1 1 3 2560 1 1 4 PRO HD2 H -4.912 -5.652 23.264 1.00 . A A . 4 PRO HD2 1 1 3 2561 1 1 4 PRO HD3 H -5.117 -7.149 24.196 1.00 . A A . 4 PRO HD3 1 1 3 2562 1 1 4 PRO HG2 H -7.154 -5.551 22.812 1.00 . A A . 4 PRO HG2 1 1 3 2563 1 1 4 PRO HG3 H -7.391 -6.885 23.952 1.00 . A A . 4 PRO HG3 1 1 3 2564 1 1 4 PRO N N -4.859 -7.411 22.133 1.00 . A A . 4 PRO N 1 1 3 2565 1 1 4 PRO O O -6.860 -7.101 19.149 1.00 . A A . 4 PRO O 1 1 3 2566 1 1 5 VAL C C -5.652 -4.761 18.500 1.00 . A A . 5 VAL C 1 1 3 2567 1 1 5 VAL CA C -4.369 -5.487 18.905 1.00 . A A . 5 VAL CA 1 1 3 2568 1 1 5 VAL CB C -3.490 -5.635 17.676 1.00 . A A . 5 VAL CB 1 1 3 2569 1 1 5 VAL CG1 C -3.222 -4.274 17.035 1.00 . A A . 5 VAL CG1 1 1 3 2570 1 1 5 VAL CG2 C -2.185 -6.365 17.992 1.00 . A A . 5 VAL CG2 1 1 3 2571 1 1 5 VAL H H -3.857 -7.354 19.789 1.00 . A A . 5 VAL H 1 1 3 2572 1 1 5 VAL HA H -3.857 -4.905 19.670 1.00 . A A . 5 VAL HA 1 1 3 2573 1 1 5 VAL HB H -4.065 -6.233 16.980 1.00 . A A . 5 VAL HB 1 1 3 2574 1 1 5 VAL HG11 H -3.322 -3.474 17.767 1.00 . A A . 5 VAL HG11 1 1 3 2575 1 1 5 VAL HG12 H -2.214 -4.232 16.625 1.00 . A A . 5 VAL HG12 1 1 3 2576 1 1 5 VAL HG13 H -3.930 -4.081 16.229 1.00 . A A . 5 VAL HG13 1 1 3 2577 1 1 5 VAL HG21 H -1.902 -6.228 19.036 1.00 . A A . 5 VAL HG21 1 1 3 2578 1 1 5 VAL HG22 H -2.281 -7.435 17.807 1.00 . A A . 5 VAL HG22 1 1 3 2579 1 1 5 VAL HG23 H -1.372 -5.991 17.369 1.00 . A A . 5 VAL HG23 1 1 3 2580 1 1 5 VAL N N -4.623 -6.794 19.489 1.00 . A A . 5 VAL N 1 1 3 2581 1 1 5 VAL O O -6.510 -5.264 17.786 1.00 . A A . 5 VAL O 1 1 3 2582 1 1 6 ASP C C -7.404 -2.601 17.535 1.00 . A A . 6 ASP C 1 1 3 2583 1 1 6 ASP CA C -6.889 -2.738 18.971 1.00 . A A . 6 ASP CA 1 1 3 2584 1 1 6 ASP CB C -6.586 -1.373 19.587 1.00 . A A . 6 ASP CB 1 1 3 2585 1 1 6 ASP CG C -6.594 -1.494 21.112 1.00 . A A . 6 ASP CG 1 1 3 2586 1 1 6 ASP H H -4.954 -3.326 19.680 1.00 . A A . 6 ASP H 1 1 3 2587 1 1 6 ASP HA H -7.616 -3.245 19.598 1.00 . A A . 6 ASP HA 1 1 3 2588 1 1 6 ASP HB2 H -5.601 -1.040 19.270 1.00 . A A . 6 ASP HB2 1 1 3 2589 1 1 6 ASP HB3 H -7.308 -0.613 19.292 1.00 . A A . 6 ASP HB3 1 1 3 2590 1 1 6 ASP N N -5.674 -3.525 19.019 1.00 . A A . 6 ASP N 1 1 3 2591 1 1 6 ASP O O -7.021 -3.325 16.624 1.00 . A A . 6 ASP O 1 1 3 2592 1 1 6 ASP OD1 O -5.899 -2.363 21.635 1.00 . A A . 6 ASP OD1 1 1 3 2593 1 1 6 ASP OD2 O -7.296 -0.718 21.758 1.00 . A A . 6 ASP OD2 1 1 3 2594 1 1 7 PRO C C -6.645 0.173 17.067 1.00 . A A . 7 PRO C 1 1 3 2595 1 1 7 PRO CA C -8.009 -0.380 16.678 1.00 . A A . 7 PRO CA 1 1 3 2596 1 1 7 PRO CB C -9.115 0.599 17.052 1.00 . A A . 7 PRO CB 1 1 3 2597 1 1 7 PRO CD C -9.571 -1.599 18.097 1.00 . A A . 7 PRO CD 1 1 3 2598 1 1 7 PRO CG C -10.079 -0.165 17.962 1.00 . A A . 7 PRO CG 1 1 3 2599 1 1 7 PRO HA H -8.015 -0.591 15.610 1.00 . A A . 7 PRO HA 1 1 3 2600 1 1 7 PRO HB2 H -8.701 1.464 17.571 1.00 . A A . 7 PRO HB2 1 1 3 2601 1 1 7 PRO HB3 H -9.629 0.961 16.162 1.00 . A A . 7 PRO HB3 1 1 3 2602 1 1 7 PRO HD2 H -9.426 -1.875 19.142 1.00 . A A . 7 PRO HD2 1 1 3 2603 1 1 7 PRO HD3 H -10.256 -2.312 17.638 1.00 . A A . 7 PRO HD3 1 1 3 2604 1 1 7 PRO HG2 H -10.102 0.309 18.941 1.00 . A A . 7 PRO HG2 1 1 3 2605 1 1 7 PRO HG3 H -11.075 -0.161 17.529 1.00 . A A . 7 PRO HG3 1 1 3 2606 1 1 7 PRO N N -8.302 -1.605 17.400 1.00 . A A . 7 PRO N 1 1 3 2607 1 1 7 PRO O O -6.489 1.208 17.704 1.00 . A A . 7 PRO O 1 1 3 2608 1 1 8 CYS C C -3.478 0.437 17.189 1.00 . A A . 8 CYS C 1 1 3 2609 1 1 8 CYS CA C -4.405 -0.144 16.107 1.00 . A A . 8 CYS CA 1 1 3 2610 1 1 8 CYS CB C -4.708 0.917 15.076 1.00 . A A . 8 CYS CB 1 1 3 2611 1 1 8 CYS H H -6.098 -1.488 16.288 1.00 . A A . 8 CYS H 1 1 3 2612 1 1 8 CYS HA H -3.908 -0.995 15.641 1.00 . A A . 8 CYS HA 1 1 3 2613 1 1 8 CYS HB2 H -4.972 0.380 14.175 1.00 . A A . 8 CYS HB2 1 1 3 2614 1 1 8 CYS HB3 H -5.591 1.473 15.388 1.00 . A A . 8 CYS HB3 1 1 3 2615 1 1 8 CYS N N -5.692 -0.637 16.590 1.00 . A A . 8 CYS N 1 1 3 2616 1 1 8 CYS O O -2.342 0.814 16.928 1.00 . A A . 8 CYS O 1 1 3 2617 1 1 8 CYS SG S -3.334 2.058 14.765 1.00 . A A . 8 CYS SG 1 1 3 2618 1 1 9 PHE C C -1.847 0.046 19.450 1.00 . A A . 9 PHE C 1 1 3 2619 1 1 9 PHE CA C -3.224 0.697 19.581 1.00 . A A . 9 PHE CA 1 1 3 2620 1 1 9 PHE CB C -3.952 0.180 20.816 1.00 . A A . 9 PHE CB 1 1 3 2621 1 1 9 PHE CD1 C -2.022 -0.292 22.413 1.00 . A A . 9 PHE CD1 1 1 3 2622 1 1 9 PHE CD2 C -3.598 1.564 22.930 1.00 . A A . 9 PHE CD2 1 1 3 2623 1 1 9 PHE CE1 C -1.282 0.001 23.612 1.00 . A A . 9 PHE CE1 1 1 3 2624 1 1 9 PHE CE2 C -2.861 1.859 24.130 1.00 . A A . 9 PHE CE2 1 1 3 2625 1 1 9 PHE CG C -3.183 0.488 22.067 1.00 . A A . 9 PHE CG 1 1 3 2626 1 1 9 PHE CZ C -1.702 1.077 24.470 1.00 . A A . 9 PHE CZ 1 1 3 2627 1 1 9 PHE H H -5.042 0.461 18.334 1.00 . A A . 9 PHE H 1 1 3 2628 1 1 9 PHE HA H -3.082 1.751 19.644 1.00 . A A . 9 PHE HA 1 1 3 2629 1 1 9 PHE HB2 H -4.943 0.637 20.887 1.00 . A A . 9 PHE HB2 1 1 3 2630 1 1 9 PHE HB3 H -4.067 -0.899 20.729 1.00 . A A . 9 PHE HB3 1 1 3 2631 1 1 9 PHE HD1 H -1.705 -1.099 21.770 1.00 . A A . 9 PHE HD1 1 1 3 2632 1 1 9 PHE HD2 H -4.467 2.153 22.675 1.00 . A A . 9 PHE HD2 1 1 3 2633 1 1 9 PHE HE1 H -0.413 -0.587 23.868 1.00 . A A . 9 PHE HE1 1 1 3 2634 1 1 9 PHE HE2 H -3.176 2.666 24.774 1.00 . A A . 9 PHE HE2 1 1 3 2635 1 1 9 PHE HZ H -1.148 1.297 25.370 1.00 . A A . 9 PHE HZ 1 1 3 2636 1 1 9 PHE N N -4.044 0.501 18.396 1.00 . A A . 9 PHE N 1 1 3 2637 1 1 9 PHE O O -0.808 0.598 19.791 1.00 . A A . 9 PHE O 1 1 3 2638 1 1 10 ARG C C -0.267 -2.191 17.365 1.00 . A A . 10 ARG C 1 1 3 2639 1 1 10 ARG CA C -0.814 -2.063 18.805 1.00 . A A . 10 ARG CA 1 1 3 2640 1 1 10 ARG CB C -1.214 -3.443 19.309 1.00 . A A . 10 ARG CB 1 1 3 2641 1 1 10 ARG CD C 0.201 -5.467 19.828 1.00 . A A . 10 ARG CD 1 1 3 2642 1 1 10 ARG CG C -0.143 -4.032 20.221 1.00 . A A . 10 ARG CG 1 1 3 2643 1 1 10 ARG CZ C 2.330 -6.178 19.001 1.00 . A A . 10 ARG CZ 1 1 3 2644 1 1 10 ARG H H -2.891 -1.284 18.580 1.00 . A A . 10 ARG H 1 1 3 2645 1 1 10 ARG HA H -0.039 -1.633 19.432 1.00 . A A . 10 ARG HA 1 1 3 2646 1 1 10 ARG HB2 H -2.161 -3.358 19.848 1.00 . A A . 10 ARG HB2 1 1 3 2647 1 1 10 ARG HB3 H -1.365 -4.111 18.456 1.00 . A A . 10 ARG HB3 1 1 3 2648 1 1 10 ARG HD2 H -0.352 -6.195 20.421 1.00 . A A . 10 ARG HD2 1 1 3 2649 1 1 10 ARG HD3 H 0.002 -5.646 18.771 1.00 . A A . 10 ARG HD3 1 1 3 2650 1 1 10 ARG HE H 2.037 -5.572 20.936 1.00 . A A . 10 ARG HE 1 1 3 2651 1 1 10 ARG HG2 H 0.753 -3.413 20.180 1.00 . A A . 10 ARG HG2 1 1 3 2652 1 1 10 ARG HG3 H -0.492 -3.998 21.250 1.00 . A A . 10 ARG HG3 1 1 3 2653 1 1 10 ARG HH11 H 2.736 -8.153 19.188 1.00 . A A . 10 ARG HH11 1 1 3 2654 1 1 10 ARG HH12 H 1.721 -7.726 17.851 1.00 . A A . 10 ARG HH12 1 1 3 2655 1 1 10 ARG HH21 H 2.699 -4.603 17.786 1.00 . A A . 10 ARG HH21 1 1 3 2656 1 1 10 ARG HH22 H 4.102 -5.458 18.336 1.00 . A A . 10 ARG HH22 1 1 3 2657 1 1 10 ARG N N -1.961 -1.169 18.922 1.00 . A A . 10 ARG N 1 1 3 2658 1 1 10 ARG NE N 1.612 -5.724 20.043 1.00 . A A . 10 ARG NE 1 1 3 2659 1 1 10 ARG NH1 N 2.257 -7.458 18.652 1.00 . A A . 10 ARG NH1 1 1 3 2660 1 1 10 ARG NH2 N 3.108 -5.344 18.318 1.00 . A A . 10 ARG NH2 1 1 3 2661 1 1 10 ARG O O 0.543 -3.060 17.067 1.00 . A A . 10 ARG O 1 1 3 2662 1 1 11 ALA C C 1.017 -1.681 14.875 1.00 . A A . 11 ALA C 1 1 3 2663 1 1 11 ALA CA C -0.469 -1.383 15.090 1.00 . A A . 11 ALA CA 1 1 3 2664 1 1 11 ALA CB C -0.855 -0.075 14.399 1.00 . A A . 11 ALA CB 1 1 3 2665 1 1 11 ALA H H -1.472 -0.702 16.900 1.00 . A A . 11 ALA H 1 1 3 2666 1 1 11 ALA HA H -1.077 -2.201 14.707 1.00 . A A . 11 ALA HA 1 1 3 2667 1 1 11 ALA HB1 H -0.624 0.781 15.031 1.00 . A A . 11 ALA HB1 1 1 3 2668 1 1 11 ALA HB2 H -0.318 0.040 13.458 1.00 . A A . 11 ALA HB2 1 1 3 2669 1 1 11 ALA HB3 H -1.922 -0.056 14.180 1.00 . A A . 11 ALA HB3 1 1 3 2670 1 1 11 ALA N N -0.760 -1.282 16.508 1.00 . A A . 11 ALA N 1 1 3 2671 1 1 11 ALA O O 1.830 -1.608 15.787 1.00 . A A . 11 ALA O 1 1 3 2672 1 1 12 ASN C C 2.388 -1.619 11.448 1.00 . A A . 12 ASN C 1 1 3 2673 1 1 12 ASN CA C 2.385 -1.300 12.943 1.00 . A A . 12 ASN CA 1 1 3 2674 1 1 12 ASN CB C 3.731 -1.671 13.570 1.00 . A A . 12 ASN CB 1 1 3 2675 1 1 12 ASN CG C 3.816 -3.181 13.811 1.00 . A A . 12 ASN CG 1 1 3 2676 1 1 12 ASN H H 0.804 -2.740 13.134 1.00 . A A . 12 ASN H 1 1 3 2677 1 1 12 ASN HA H 2.167 -0.241 13.074 1.00 . A A . 12 ASN HA 1 1 3 2678 1 1 12 ASN HB2 H 4.551 -1.373 12.916 1.00 . A A . 12 ASN HB2 1 1 3 2679 1 1 12 ASN HB3 H 3.864 -1.154 14.521 1.00 . A A . 12 ASN HB3 1 1 3 2680 1 1 12 ASN HD21 H 4.901 -3.852 12.226 1.00 . A A . 12 ASN HD21 1 1 3 2681 1 1 12 ASN HD22 H 3.250 -4.436 12.313 1.00 . A A . 12 ASN HD22 1 1 3 2682 1 1 12 ASN N N 1.309 -2.017 13.604 1.00 . A A . 12 ASN N 1 1 3 2683 1 1 12 ASN ND2 N 4.006 -3.886 12.682 1.00 . A A . 12 ASN ND2 1 1 3 2684 1 1 12 ASN O O 3.314 -2.214 10.910 1.00 . A A . 12 ASN O 1 1 3 2685 1 1 12 ASN OD1 O 3.716 -3.663 14.933 1.00 . A A . 12 ASN OD1 1 1 3 2686 1 1 13 CYS C C 2.679 0.563 9.748 1.00 . A A . 13 CYS C 1 1 3 2687 1 1 13 CYS CA C 1.316 -0.131 9.806 1.00 . A A . 13 CYS CA 1 1 3 2688 1 1 13 CYS CB C 0.201 0.875 10.085 1.00 . A A . 13 CYS CB 1 1 3 2689 1 1 13 CYS H H 0.399 -1.581 11.030 1.00 . A A . 13 CYS H 1 1 3 2690 1 1 13 CYS HA H 1.130 -0.638 8.857 1.00 . A A . 13 CYS HA 1 1 3 2691 1 1 13 CYS HB2 H 0.408 1.436 10.997 1.00 . A A . 13 CYS HB2 1 1 3 2692 1 1 13 CYS HB3 H 0.132 1.578 9.254 1.00 . A A . 13 CYS HB3 1 1 3 2693 1 1 13 CYS N N 1.283 -1.174 10.820 1.00 . A A . 13 CYS N 1 1 3 2694 1 1 13 CYS O O 3.075 1.319 10.627 1.00 . A A . 13 CYS O 1 1 3 2695 1 1 13 CYS SG S -1.387 0.039 10.271 1.00 . A A . 13 CYS SG 1 1 3 2696 1 1 14 GLU C C 4.002 2.537 8.217 1.00 . A A . 14 GLU C 1 1 3 2697 1 1 14 GLU CA C 4.444 1.070 8.200 1.00 . A A . 14 GLU CA 1 1 3 2698 1 1 14 GLU CB C 4.885 0.659 6.799 1.00 . A A . 14 GLU CB 1 1 3 2699 1 1 14 GLU CD C 6.470 1.903 5.315 1.00 . A A . 14 GLU CD 1 1 3 2700 1 1 14 GLU CG C 6.353 0.996 6.542 1.00 . A A . 14 GLU CG 1 1 3 2701 1 1 14 GLU H H 3.096 -0.630 8.185 1.00 . A A . 14 GLU H 1 1 3 2702 1 1 14 GLU HA H 5.258 0.933 8.907 1.00 . A A . 14 GLU HA 1 1 3 2703 1 1 14 GLU HB2 H 4.723 -0.411 6.662 1.00 . A A . 14 GLU HB2 1 1 3 2704 1 1 14 GLU HB3 H 4.257 1.166 6.071 1.00 . A A . 14 GLU HB3 1 1 3 2705 1 1 14 GLU HG2 H 6.786 1.507 7.402 1.00 . A A . 14 GLU HG2 1 1 3 2706 1 1 14 GLU HG3 H 6.931 0.089 6.368 1.00 . A A . 14 GLU HG3 1 1 3 2707 1 1 14 GLU N N 3.359 0.217 8.647 1.00 . A A . 14 GLU N 1 1 3 2708 1 1 14 GLU O O 4.540 3.361 8.947 1.00 . A A . 14 GLU O 1 1 3 2709 1 1 14 GLU OE1 O 6.001 3.038 5.378 1.00 . A A . 14 GLU OE1 1 1 3 2710 1 1 14 GLU OE2 O 7.029 1.464 4.312 1.00 . A A . 14 GLU OE2 1 1 3 2711 1 1 15 TYR C C 1.304 3.641 8.906 1.00 . A A . 15 TYR C 1 1 3 2712 1 1 15 TYR CA C 2.151 3.950 7.667 1.00 . A A . 15 TYR CA 1 1 3 2713 1 1 15 TYR CB C 1.297 4.309 6.438 1.00 . A A . 15 TYR CB 1 1 3 2714 1 1 15 TYR CD1 C 2.044 6.749 6.581 1.00 . A A . 15 TYR CD1 1 1 3 2715 1 1 15 TYR CD2 C -0.331 6.239 6.048 1.00 . A A . 15 TYR CD2 1 1 3 2716 1 1 15 TYR CE1 C 1.766 8.156 6.481 1.00 . A A . 15 TYR CE1 1 1 3 2717 1 1 15 TYR CE2 C -0.613 7.646 5.948 1.00 . A A . 15 TYR CE2 1 1 3 2718 1 1 15 TYR CG C 0.999 5.780 6.361 1.00 . A A . 15 TYR CG 1 1 3 2719 1 1 15 TYR CZ C 0.436 8.605 6.167 1.00 . A A . 15 TYR CZ 1 1 3 2720 1 1 15 TYR H H 2.820 2.229 6.570 1.00 . A A . 15 TYR H 1 1 3 2721 1 1 15 TYR HA H 2.830 4.762 7.917 1.00 . A A . 15 TYR HA 1 1 3 2722 1 1 15 TYR HB2 H 1.834 4.033 5.540 1.00 . A A . 15 TYR HB2 1 1 3 2723 1 1 15 TYR HB3 H 0.357 3.745 6.445 1.00 . A A . 15 TYR HB3 1 1 3 2724 1 1 15 TYR HD1 H 3.042 6.416 6.827 1.00 . A A . 15 TYR HD1 1 1 3 2725 1 1 15 TYR HD2 H -1.124 5.527 5.883 1.00 . A A . 15 TYR HD2 1 1 3 2726 1 1 15 TYR HE1 H 2.556 8.877 6.639 1.00 . A A . 15 TYR HE1 1 1 3 2727 1 1 15 TYR HE2 H -1.611 7.981 5.705 1.00 . A A . 15 TYR HE2 1 1 3 2728 1 1 15 TYR HH H -0.206 10.147 5.227 1.00 . A A . 15 TYR HH 1 1 3 2729 1 1 15 TYR N N 2.991 2.804 7.370 1.00 . A A . 15 TYR N 1 1 3 2730 1 1 15 TYR O O 1.778 3.091 9.891 1.00 . A A . 15 TYR O 1 1 3 2731 1 1 15 TYR OH O 0.166 9.955 6.077 1.00 . A A . 15 TYR OH 1 1 3 2732 1 1 16 GLN C C -1.982 2.876 9.611 1.00 . A A . 16 GLN C 1 1 3 2733 1 1 16 GLN CA C -0.851 3.856 9.929 1.00 . A A . 16 GLN CA 1 1 3 2734 1 1 16 GLN CB C -1.405 5.202 10.405 1.00 . A A . 16 GLN CB 1 1 3 2735 1 1 16 GLN CD C -1.808 6.695 12.376 1.00 . A A . 16 GLN CD 1 1 3 2736 1 1 16 GLN CG C -1.445 5.278 11.931 1.00 . A A . 16 GLN CG 1 1 3 2737 1 1 16 GLN H H -0.190 4.490 7.921 1.00 . A A . 16 GLN H 1 1 3 2738 1 1 16 GLN HA H -0.251 3.405 10.711 1.00 . A A . 16 GLN HA 1 1 3 2739 1 1 16 GLN HB2 H -0.791 6.005 10.023 1.00 . A A . 16 GLN HB2 1 1 3 2740 1 1 16 GLN HB3 H -2.417 5.326 10.003 1.00 . A A . 16 GLN HB3 1 1 3 2741 1 1 16 GLN HE21 H -3.454 6.657 11.180 1.00 . A A . 16 GLN HE21 1 1 3 2742 1 1 16 GLN HE22 H -2.811 8.250 11.529 1.00 . A A . 16 GLN HE22 1 1 3 2743 1 1 16 GLN HG2 H -2.179 4.579 12.332 1.00 . A A . 16 GLN HG2 1 1 3 2744 1 1 16 GLN HG3 H -0.474 5.012 12.350 1.00 . A A . 16 GLN HG3 1 1 3 2745 1 1 16 GLN N N 0.030 4.041 8.790 1.00 . A A . 16 GLN N 1 1 3 2746 1 1 16 GLN NE2 N -2.778 7.250 11.628 1.00 . A A . 16 GLN NE2 1 1 3 2747 1 1 16 GLN O O -1.902 2.033 8.726 1.00 . A A . 16 GLN O 1 1 3 2748 1 1 16 GLN OE1 O -1.251 7.238 13.322 1.00 . A A . 16 GLN OE1 1 1 3 2749 1 1 17 CYS C C -5.342 2.625 9.795 1.00 . A A . 17 CYS C 1 1 3 2750 1 1 17 CYS CA C -4.097 2.098 10.512 1.00 . A A . 17 CYS CA 1 1 3 2751 1 1 17 CYS CB C -4.426 1.802 11.976 1.00 . A A . 17 CYS CB 1 1 3 2752 1 1 17 CYS H H -2.869 3.845 11.054 1.00 . A A . 17 CYS H 1 1 3 2753 1 1 17 CYS HA H -3.724 1.190 10.037 1.00 . A A . 17 CYS HA 1 1 3 2754 1 1 17 CYS HB2 H -5.497 1.635 12.082 1.00 . A A . 17 CYS HB2 1 1 3 2755 1 1 17 CYS HB3 H -3.936 0.876 12.278 1.00 . A A . 17 CYS HB3 1 1 3 2756 1 1 17 CYS N N -3.032 3.078 10.426 1.00 . A A . 17 CYS N 1 1 3 2757 1 1 17 CYS O O -5.717 3.785 9.918 1.00 . A A . 17 CYS O 1 1 3 2758 1 1 17 CYS SG S -3.933 3.111 13.122 1.00 . A A . 17 CYS SG 1 1 3 2759 1 1 18 GLN C C -7.029 0.367 10.744 1.00 . A A . 18 GLN C 1 1 3 2760 1 1 18 GLN CA C -7.237 1.199 9.479 1.00 . A A . 18 GLN CA 1 1 3 2761 1 1 18 GLN CB C -7.824 0.349 8.360 1.00 . A A . 18 GLN CB 1 1 3 2762 1 1 18 GLN CD C -9.301 2.197 7.518 1.00 . A A . 18 GLN CD 1 1 3 2763 1 1 18 GLN CG C -9.262 0.752 8.030 1.00 . A A . 18 GLN CG 1 1 3 2764 1 1 18 GLN H H -5.510 1.273 8.249 1.00 . A A . 18 GLN H 1 1 3 2765 1 1 18 GLN HA H -7.858 2.068 9.698 1.00 . A A . 18 GLN HA 1 1 3 2766 1 1 18 GLN HB2 H -7.210 0.467 7.463 1.00 . A A . 18 GLN HB2 1 1 3 2767 1 1 18 GLN HB3 H -7.776 -0.700 8.653 1.00 . A A . 18 GLN HB3 1 1 3 2768 1 1 18 GLN HE21 H -7.606 1.824 6.448 1.00 . A A . 18 GLN HE21 1 1 3 2769 1 1 18 GLN HE22 H -8.013 3.516 6.643 1.00 . A A . 18 GLN HE22 1 1 3 2770 1 1 18 GLN HG2 H -9.677 0.095 7.267 1.00 . A A . 18 GLN HG2 1 1 3 2771 1 1 18 GLN HG3 H -9.894 0.672 8.915 1.00 . A A . 18 GLN HG3 1 1 3 2772 1 1 18 GLN N N -5.950 1.693 9.043 1.00 . A A . 18 GLN N 1 1 3 2773 1 1 18 GLN NE2 N -8.211 2.544 6.805 1.00 . A A . 18 GLN NE2 1 1 3 2774 1 1 18 GLN O O -5.985 -0.240 10.937 1.00 . A A . 18 GLN O 1 1 3 2775 1 1 18 GLN OE1 O -10.248 2.938 7.751 1.00 . A A . 18 GLN OE1 1 1 3 2776 1 1 19 PRO C C -9.885 -1.091 10.792 1.00 . A A . 19 PRO C 1 1 3 2777 1 1 19 PRO CA C -8.951 -0.695 11.933 1.00 . A A . 19 PRO CA 1 1 3 2778 1 1 19 PRO CB C -9.772 -0.231 13.131 1.00 . A A . 19 PRO CB 1 1 3 2779 1 1 19 PRO CD C -8.268 1.591 12.446 1.00 . A A . 19 PRO CD 1 1 3 2780 1 1 19 PRO CG C -9.161 1.097 13.577 1.00 . A A . 19 PRO CG 1 1 3 2781 1 1 19 PRO HA H -8.378 -1.562 12.242 1.00 . A A . 19 PRO HA 1 1 3 2782 1 1 19 PRO HB2 H -10.818 -0.101 12.853 1.00 . A A . 19 PRO HB2 1 1 3 2783 1 1 19 PRO HB3 H -9.730 -0.965 13.936 1.00 . A A . 19 PRO HB3 1 1 3 2784 1 1 19 PRO HD2 H -8.750 2.380 11.868 1.00 . A A . 19 PRO HD2 1 1 3 2785 1 1 19 PRO HD3 H -7.316 1.961 12.823 1.00 . A A . 19 PRO HD3 1 1 3 2786 1 1 19 PRO HG2 H -9.939 1.819 13.800 1.00 . A A . 19 PRO HG2 1 1 3 2787 1 1 19 PRO HG3 H -8.550 0.934 14.461 1.00 . A A . 19 PRO HG3 1 1 3 2788 1 1 19 PRO N N -8.061 0.423 11.617 1.00 . A A . 19 PRO N 1 1 3 2789 1 1 19 PRO O O -10.975 -0.558 10.629 1.00 . A A . 19 PRO O 1 1 3 2790 1 1 20 LEU C C -10.238 -3.674 8.461 1.00 . A A . 20 LEU C 1 1 3 2791 1 1 20 LEU CA C -9.977 -3.372 9.936 1.00 . A A . 20 LEU CA 1 1 3 2792 1 1 20 LEU CB C -11.251 -3.480 10.783 1.00 . A A . 20 LEU CB 1 1 3 2793 1 1 20 LEU CD1 C -12.548 -5.503 11.512 1.00 . A A . 20 LEU CD1 1 1 3 2794 1 1 20 LEU CD2 C -13.451 -4.030 9.685 1.00 . A A . 20 LEU CD2 1 1 3 2795 1 1 20 LEU CG C -12.189 -4.600 10.331 1.00 . A A . 20 LEU CG 1 1 3 2796 1 1 20 LEU H H -8.565 -1.844 9.457 1.00 . A A . 20 LEU H 1 1 3 2797 1 1 20 LEU HA H -9.268 -4.048 10.362 1.00 . A A . 20 LEU HA 1 1 3 2798 1 1 20 LEU HB2 H -10.962 -3.690 11.813 1.00 . A A . 20 LEU HB2 1 1 3 2799 1 1 20 LEU HB3 H -11.796 -2.542 10.785 1.00 . A A . 20 LEU HB3 1 1 3 2800 1 1 20 LEU HD11 H -11.713 -6.153 11.775 1.00 . A A . 20 LEU HD11 1 1 3 2801 1 1 20 LEU HD12 H -12.800 -4.909 12.390 1.00 . A A . 20 LEU HD12 1 1 3 2802 1 1 20 LEU HD13 H -13.406 -6.134 11.277 1.00 . A A . 20 LEU HD13 1 1 3 2803 1 1 20 LEU HD21 H -13.256 -3.055 9.241 1.00 . A A . 20 LEU HD21 1 1 3 2804 1 1 20 LEU HD22 H -13.819 -4.691 8.900 1.00 . A A . 20 LEU HD22 1 1 3 2805 1 1 20 LEU HD23 H -14.246 -3.912 10.422 1.00 . A A . 20 LEU HD23 1 1 3 2806 1 1 20 LEU HG H -11.672 -5.203 9.588 1.00 . A A . 20 LEU HG 1 1 3 2807 1 1 20 LEU N N -9.367 -2.055 10.016 1.00 . A A . 20 LEU N 1 1 3 2808 1 1 20 LEU O O -9.631 -4.495 7.787 1.00 . A A . 20 LEU O 1 1 3 2809 1 1 21 ASN C C -11.508 -3.992 5.915 1.00 . A A . 21 ASN C 1 1 3 2810 1 1 21 ASN CA C -12.021 -2.930 6.883 1.00 . A A . 21 ASN CA 1 1 3 2811 1 1 21 ASN CB C -12.065 -1.564 6.195 1.00 . A A . 21 ASN CB 1 1 3 2812 1 1 21 ASN CG C -13.387 -0.868 6.532 1.00 . A A . 21 ASN CG 1 1 3 2813 1 1 21 ASN H H -11.313 -2.245 8.860 1.00 . A A . 21 ASN H 1 1 3 2814 1 1 21 ASN HA H -13.017 -3.216 7.220 1.00 . A A . 21 ASN HA 1 1 3 2815 1 1 21 ASN HB2 H -11.239 -0.936 6.539 1.00 . A A . 21 ASN HB2 1 1 3 2816 1 1 21 ASN HB3 H -11.995 -1.680 5.111 1.00 . A A . 21 ASN HB3 1 1 3 2817 1 1 21 ASN HD21 H -12.458 0.932 6.232 1.00 . A A . 21 ASN HD21 1 1 3 2818 1 1 21 ASN N N -11.201 -2.847 8.079 1.00 . A A . 21 ASN N 1 1 3 2819 1 1 21 ASN ND2 N -13.327 0.470 6.407 1.00 . A A . 21 ASN ND2 1 1 3 2820 1 1 21 ASN O O -10.423 -3.897 5.355 1.00 . A A . 21 ASN O 1 1 3 2821 1 1 21 ASN OD1 O -14.379 -1.498 6.877 1.00 . A A . 21 ASN OD1 1 1 3 2822 1 1 22 GLN C C -11.050 -7.015 5.529 1.00 . A A . 22 GLN C 1 1 3 2823 1 1 22 GLN CA C -12.055 -6.081 4.853 1.00 . A A . 22 GLN CA 1 1 3 2824 1 1 22 GLN CB C -11.471 -5.518 3.557 1.00 . A A . 22 GLN CB 1 1 3 2825 1 1 22 GLN CD C -12.779 -5.162 1.452 1.00 . A A . 22 GLN CD 1 1 3 2826 1 1 22 GLN CG C -12.066 -6.198 2.323 1.00 . A A . 22 GLN CG 1 1 3 2827 1 1 22 GLN H H -13.260 -4.992 6.247 1.00 . A A . 22 GLN H 1 1 3 2828 1 1 22 GLN HA H -12.980 -6.624 4.663 1.00 . A A . 22 GLN HA 1 1 3 2829 1 1 22 GLN HB2 H -11.658 -4.446 3.509 1.00 . A A . 22 GLN HB2 1 1 3 2830 1 1 22 GLN HB3 H -10.388 -5.646 3.558 1.00 . A A . 22 GLN HB3 1 1 3 2831 1 1 22 GLN HE21 H -13.715 -6.715 0.528 1.00 . A A . 22 GLN HE21 1 1 3 2832 1 1 22 GLN HE22 H -14.113 -5.120 -0.084 1.00 . A A . 22 GLN HE22 1 1 3 2833 1 1 22 GLN HG2 H -11.284 -6.678 1.735 1.00 . A A . 22 GLN HG2 1 1 3 2834 1 1 22 GLN HG3 H -12.781 -6.966 2.617 1.00 . A A . 22 GLN HG3 1 1 3 2835 1 1 22 GLN N N -12.390 -4.996 5.754 1.00 . A A . 22 GLN N 1 1 3 2836 1 1 22 GLN NE2 N -13.610 -5.716 0.551 1.00 . A A . 22 GLN NE2 1 1 3 2837 1 1 22 GLN O O -11.183 -8.232 5.511 1.00 . A A . 22 GLN O 1 1 3 2838 1 1 22 GLN OE1 O -12.589 -3.960 1.590 1.00 . A A . 22 GLN OE1 1 1 3 2839 1 1 23 THR C C -9.015 -7.690 7.946 1.00 . A A . 23 THR C 1 1 3 2840 1 1 23 THR CA C -8.875 -7.115 6.540 1.00 . A A . 23 THR CA 1 1 3 2841 1 1 23 THR CB C -7.612 -6.262 6.420 1.00 . A A . 23 THR CB 1 1 3 2842 1 1 23 THR CG2 C -6.355 -7.119 6.264 1.00 . A A . 23 THR CG2 1 1 3 2843 1 1 23 THR H H -10.063 -5.363 6.234 1.00 . A A . 23 THR H 1 1 3 2844 1 1 23 THR HA H -8.871 -7.955 5.881 1.00 . A A . 23 THR HA 1 1 3 2845 1 1 23 THR HB H -7.514 -5.634 7.306 1.00 . A A . 23 THR HB 1 1 3 2846 1 1 23 THR HG1 H -8.628 -5.470 5.014 1.00 . A A . 23 THR HG1 1 1 3 2847 1 1 23 THR HG21 H -5.475 -6.589 6.630 1.00 . A A . 23 THR HG21 1 1 3 2848 1 1 23 THR HG22 H -6.445 -8.049 6.826 1.00 . A A . 23 THR HG22 1 1 3 2849 1 1 23 THR HG23 H -6.183 -7.373 5.218 1.00 . A A . 23 THR HG23 1 1 3 2850 1 1 23 THR N N -10.039 -6.355 6.123 1.00 . A A . 23 THR N 1 1 3 2851 1 1 23 THR O O -8.616 -8.808 8.249 1.00 . A A . 23 THR O 1 1 3 2852 1 1 23 THR OG1 O -7.732 -5.404 5.314 1.00 . A A . 23 THR OG1 1 1 3 2853 1 1 24 SER C C -7.722 -6.491 10.225 1.00 . A A . 24 SER C 1 1 3 2854 1 1 24 SER CA C -9.225 -6.745 10.134 1.00 . A A . 24 SER CA 1 1 3 2855 1 1 24 SER CB C -9.727 -7.967 10.867 1.00 . A A . 24 SER CB 1 1 3 2856 1 1 24 SER H H -10.134 -6.121 8.299 1.00 . A A . 24 SER H 1 1 3 2857 1 1 24 SER HA H -9.770 -5.904 10.544 1.00 . A A . 24 SER HA 1 1 3 2858 1 1 24 SER HB2 H -9.706 -7.797 11.940 1.00 . A A . 24 SER HB2 1 1 3 2859 1 1 24 SER HB3 H -10.764 -8.094 10.565 1.00 . A A . 24 SER HB3 1 1 3 2860 1 1 24 SER HG H -9.090 -9.713 11.295 1.00 . A A . 24 SER HG 1 1 3 2861 1 1 24 SER N N -9.612 -6.826 8.760 1.00 . A A . 24 SER N 1 1 3 2862 1 1 24 SER O O -6.883 -7.189 9.667 1.00 . A A . 24 SER O 1 1 3 2863 1 1 24 SER OG O -8.996 -9.126 10.557 1.00 . A A . 24 SER OG 1 1 3 2864 1 1 25 TYR C C -5.541 -4.506 9.786 1.00 . A A . 25 TYR C 1 1 3 2865 1 1 25 TYR CA C -6.871 -4.202 10.470 1.00 . A A . 25 TYR CA 1 1 3 2866 1 1 25 TYR CB C -6.730 -3.228 11.666 1.00 . A A . 25 TYR CB 1 1 3 2867 1 1 25 TYR CD1 C -5.258 -4.727 13.121 1.00 . A A . 25 TYR CD1 1 1 3 2868 1 1 25 TYR CD2 C -4.488 -2.422 12.587 1.00 . A A . 25 TYR CD2 1 1 3 2869 1 1 25 TYR CE1 C -4.023 -4.980 13.816 1.00 . A A . 25 TYR CE1 1 1 3 2870 1 1 25 TYR CE2 C -3.253 -2.671 13.281 1.00 . A A . 25 TYR CE2 1 1 3 2871 1 1 25 TYR CG C -5.485 -3.456 12.483 1.00 . A A . 25 TYR CG 1 1 3 2872 1 1 25 TYR CZ C -3.014 -3.957 13.881 1.00 . A A . 25 TYR CZ 1 1 3 2873 1 1 25 TYR H H -8.083 -5.366 11.784 1.00 . A A . 25 TYR H 1 1 3 2874 1 1 25 TYR HA H -7.509 -3.783 9.672 1.00 . A A . 25 TYR HA 1 1 3 2875 1 1 25 TYR HB2 H -6.755 -2.180 11.358 1.00 . A A . 25 TYR HB2 1 1 3 2876 1 1 25 TYR HB3 H -7.586 -3.384 12.323 1.00 . A A . 25 TYR HB3 1 1 3 2877 1 1 25 TYR HD1 H -6.017 -5.493 13.078 1.00 . A A . 25 TYR HD1 1 1 3 2878 1 1 25 TYR HD2 H -4.670 -1.454 12.145 1.00 . A A . 25 TYR HD2 1 1 3 2879 1 1 25 TYR HE1 H -3.855 -5.937 14.290 1.00 . A A . 25 TYR HE1 1 1 3 2880 1 1 25 TYR HE2 H -2.507 -1.893 13.350 1.00 . A A . 25 TYR HE2 1 1 3 2881 1 1 25 TYR HH H -1.542 -3.454 15.002 1.00 . A A . 25 TYR HH 1 1 3 2882 1 1 25 TYR N N -7.488 -5.417 10.987 1.00 . A A . 25 TYR N 1 1 3 2883 1 1 25 TYR O O -4.924 -5.554 9.936 1.00 . A A . 25 TYR O 1 1 3 2884 1 1 25 TYR OH O -1.813 -4.216 14.509 1.00 . A A . 25 TYR OH 1 1 3 2885 1 1 26 LEU C C -3.213 -3.195 7.614 1.00 . A A . 26 LEU C 1 1 3 2886 1 1 26 LEU CA C -4.618 -3.769 7.730 1.00 . A A . 26 LEU CA 1 1 3 2887 1 1 26 LEU CB C -5.599 -3.353 6.643 1.00 . A A . 26 LEU CB 1 1 3 2888 1 1 26 LEU CD1 C -5.577 -1.112 5.596 1.00 . A A . 26 LEU CD1 1 1 3 2889 1 1 26 LEU CD2 C -7.648 -1.989 6.691 1.00 . A A . 26 LEU CD2 1 1 3 2890 1 1 26 LEU CG C -6.123 -1.934 6.750 1.00 . A A . 26 LEU CG 1 1 3 2891 1 1 26 LEU H H -5.687 -2.617 9.187 1.00 . A A . 26 LEU H 1 1 3 2892 1 1 26 LEU HA H -4.561 -4.839 7.625 1.00 . A A . 26 LEU HA 1 1 3 2893 1 1 26 LEU HB2 H -5.168 -3.529 5.655 1.00 . A A . 26 LEU HB2 1 1 3 2894 1 1 26 LEU HB3 H -6.470 -3.995 6.755 1.00 . A A . 26 LEU HB3 1 1 3 2895 1 1 26 LEU HD11 H -5.184 -0.163 5.953 1.00 . A A . 26 LEU HD11 1 1 3 2896 1 1 26 LEU HD12 H -4.777 -1.658 5.096 1.00 . A A . 26 LEU HD12 1 1 3 2897 1 1 26 LEU HD13 H -6.365 -0.925 4.868 1.00 . A A . 26 LEU HD13 1 1 3 2898 1 1 26 LEU HD21 H -8.081 -1.017 6.473 1.00 . A A . 26 LEU HD21 1 1 3 2899 1 1 26 LEU HD22 H -7.951 -2.679 5.903 1.00 . A A . 26 LEU HD22 1 1 3 2900 1 1 26 LEU HD23 H -8.052 -2.373 7.628 1.00 . A A . 26 LEU HD23 1 1 3 2901 1 1 26 LEU HG H -5.807 -1.495 7.697 1.00 . A A . 26 LEU HG 1 1 3 2902 1 1 26 LEU N N -5.182 -3.466 9.024 1.00 . A A . 26 LEU N 1 1 3 2903 1 1 26 LEU O O -2.268 -3.663 8.234 1.00 . A A . 26 LEU O 1 1 3 2904 1 1 27 CYS C C -2.508 0.022 5.912 1.00 . A A . 27 CYS C 1 1 3 2905 1 1 27 CYS CA C -2.501 -0.937 7.113 1.00 . A A . 27 CYS CA 1 1 3 2906 1 1 27 CYS CB C -1.083 -1.261 7.557 1.00 . A A . 27 CYS CB 1 1 3 2907 1 1 27 CYS H H -3.590 -2.386 5.880 1.00 . A A . 27 CYS H 1 1 3 2908 1 1 27 CYS HA H -3.056 -0.502 7.942 1.00 . A A . 27 CYS HA 1 1 3 2909 1 1 27 CYS HB2 H -0.735 -2.111 6.969 1.00 . A A . 27 CYS HB2 1 1 3 2910 1 1 27 CYS HB3 H -0.427 -0.408 7.369 1.00 . A A . 27 CYS HB3 1 1 3 2911 1 1 27 CYS N N -3.157 -2.179 6.751 1.00 . A A . 27 CYS N 1 1 3 2912 1 1 27 CYS O O -2.623 -0.389 4.764 1.00 . A A . 27 CYS O 1 1 3 2913 1 1 27 CYS SG S -0.998 -1.711 9.311 1.00 . A A . 27 CYS SG 1 1 3 2914 1 1 28 VAL C C -2.832 2.447 4.066 1.00 . A A . 28 VAL C 1 1 3 2915 1 1 28 VAL CA C -3.175 2.322 5.550 1.00 . A A . 28 VAL CA 1 1 3 2916 1 1 28 VAL CB C -2.967 3.687 6.200 1.00 . A A . 28 VAL CB 1 1 3 2917 1 1 28 VAL CG1 C -3.420 4.830 5.288 1.00 . A A . 28 VAL CG1 1 1 3 2918 1 1 28 VAL CG2 C -3.660 3.797 7.555 1.00 . A A . 28 VAL CG2 1 1 3 2919 1 1 28 VAL H H -1.751 1.589 6.983 1.00 . A A . 28 VAL H 1 1 3 2920 1 1 28 VAL HA H -4.180 1.950 5.596 1.00 . A A . 28 VAL HA 1 1 3 2921 1 1 28 VAL HB H -1.890 3.758 6.346 1.00 . A A . 28 VAL HB 1 1 3 2922 1 1 28 VAL HG11 H -4.447 4.676 4.955 1.00 . A A . 28 VAL HG11 1 1 3 2923 1 1 28 VAL HG12 H -3.377 5.786 5.811 1.00 . A A . 28 VAL HG12 1 1 3 2924 1 1 28 VAL HG13 H -2.787 4.897 4.404 1.00 . A A . 28 VAL HG13 1 1 3 2925 1 1 28 VAL HG21 H -3.099 4.454 8.221 1.00 . A A . 28 VAL HG21 1 1 3 2926 1 1 28 VAL HG22 H -4.657 4.220 7.452 1.00 . A A . 28 VAL HG22 1 1 3 2927 1 1 28 VAL HG23 H -3.762 2.816 8.012 1.00 . A A . 28 VAL HG23 1 1 3 2928 1 1 28 VAL N N -2.380 1.319 6.255 1.00 . A A . 28 VAL N 1 1 3 2929 1 1 28 VAL O O -3.680 2.667 3.210 1.00 . A A . 28 VAL O 1 1 3 2930 1 1 29 CYS C C -1.279 3.956 2.073 1.00 . A A . 29 CYS C 1 1 3 2931 1 1 29 CYS CA C -0.633 3.204 3.229 1.00 . A A . 29 CYS CA 1 1 3 2932 1 1 29 CYS CB C 0.602 2.469 2.693 1.00 . A A . 29 CYS CB 1 1 3 2933 1 1 29 CYS H H -1.216 1.481 4.373 1.00 . A A . 29 CYS H 1 1 3 2934 1 1 29 CYS HA H -0.388 3.946 3.989 1.00 . A A . 29 CYS HA 1 1 3 2935 1 1 29 CYS HB2 H 0.296 1.458 2.455 1.00 . A A . 29 CYS HB2 1 1 3 2936 1 1 29 CYS HB3 H 0.939 2.915 1.754 1.00 . A A . 29 CYS HB3 1 1 3 2937 1 1 29 CYS N N -1.530 2.266 3.862 1.00 . A A . 29 CYS N 1 1 3 2938 1 1 29 CYS O O -2.399 3.754 1.622 1.00 . A A . 29 CYS O 1 1 3 2939 1 1 29 CYS SG S 2.023 2.365 3.808 1.00 . A A . 29 CYS SG 1 1 3 2940 1 1 30 ALA C C -1.508 5.931 -0.202 1.00 . A A . 30 ALA C 1 1 3 2941 1 1 30 ALA CA C -0.742 6.126 1.108 1.00 . A A . 30 ALA CA 1 1 3 2942 1 1 30 ALA CB C 0.531 6.926 0.827 1.00 . A A . 30 ALA CB 1 1 3 2943 1 1 30 ALA H H 0.448 4.574 2.175 1.00 . A A . 30 ALA H 1 1 3 2944 1 1 30 ALA HA H -1.339 6.642 1.860 1.00 . A A . 30 ALA HA 1 1 3 2945 1 1 30 ALA HB1 H 1.290 6.298 0.360 1.00 . A A . 30 ALA HB1 1 1 3 2946 1 1 30 ALA HB2 H 0.325 7.761 0.158 1.00 . A A . 30 ALA HB2 1 1 3 2947 1 1 30 ALA HB3 H 0.948 7.329 1.750 1.00 . A A . 30 ALA HB3 1 1 3 2948 1 1 30 ALA N N -0.372 4.839 1.664 1.00 . A A . 30 ALA N 1 1 3 2949 1 1 30 ALA O O -0.923 5.850 -1.274 1.00 . A A . 30 ALA O 1 1 3 2950 1 1 31 GLU C C -3.091 4.961 -2.312 1.00 . A A . 31 GLU C 1 1 3 2951 1 1 31 GLU CA C -3.612 4.968 -0.875 1.00 . A A . 31 GLU CA 1 1 3 2952 1 1 31 GLU CB C -5.065 5.419 -0.851 1.00 . A A . 31 GLU CB 1 1 3 2953 1 1 31 GLU CD C -7.322 4.724 -1.673 1.00 . A A . 31 GLU CD 1 1 3 2954 1 1 31 GLU CG C -6.025 4.247 -1.017 1.00 . A A . 31 GLU CG 1 1 3 2955 1 1 31 GLU H H -3.316 6.314 0.714 1.00 . A A . 31 GLU H 1 1 3 2956 1 1 31 GLU HA H -3.525 3.975 -0.439 1.00 . A A . 31 GLU HA 1 1 3 2957 1 1 31 GLU HB2 H -5.268 5.916 0.093 1.00 . A A . 31 GLU HB2 1 1 3 2958 1 1 31 GLU HB3 H -5.222 6.158 -1.633 1.00 . A A . 31 GLU HB3 1 1 3 2959 1 1 31 GLU HG2 H -5.571 3.472 -1.634 1.00 . A A . 31 GLU HG2 1 1 3 2960 1 1 31 GLU HG3 H -6.254 3.812 -0.045 1.00 . A A . 31 GLU HG3 1 1 3 2961 1 1 31 GLU N N -2.842 5.862 -0.039 1.00 . A A . 31 GLU N 1 1 3 2962 1 1 31 GLU O O -2.618 5.955 -2.849 1.00 . A A . 31 GLU O 1 1 3 2963 1 1 31 GLU OE1 O -8.103 5.400 -1.005 1.00 . A A . 31 GLU OE1 1 1 3 2964 1 1 31 GLU OE2 O -7.536 4.415 -2.844 1.00 . A A . 31 GLU OE2 1 1 3 2965 1 1 32 GLY C C -0.832 3.301 -3.269 1.00 . A A . 32 GLY C 1 1 3 2966 1 1 32 GLY CA C -2.253 3.301 -3.854 1.00 . A A . 32 GLY CA 1 1 3 2967 1 1 32 GLY H H -4.023 3.196 -2.621 1.00 . A A . 32 GLY H 1 1 3 2968 1 1 32 GLY HA2 H -2.535 2.288 -4.144 1.00 . A A . 32 GLY HA2 1 1 3 2969 1 1 32 GLY HA3 H -2.308 3.969 -4.716 1.00 . A A . 32 GLY HA3 1 1 3 2970 1 1 32 GLY N N -3.239 3.758 -2.889 1.00 . A A . 32 GLY N 1 1 3 2971 1 1 32 GLY O O 0.145 3.568 -3.958 1.00 . A A . 32 GLY O 1 1 3 2972 1 1 33 PHE C C -0.116 1.389 -0.305 1.00 . A A . 33 PHE C 1 1 3 2973 1 1 33 PHE CA C 0.379 2.344 -1.393 1.00 . A A . 33 PHE CA 1 1 3 2974 1 1 33 PHE CB C 1.303 3.408 -0.790 1.00 . A A . 33 PHE CB 1 1 3 2975 1 1 33 PHE CD1 C 1.864 5.121 -2.596 1.00 . A A . 33 PHE CD1 1 1 3 2976 1 1 33 PHE CD2 C 3.540 3.378 -2.012 1.00 . A A . 33 PHE CD2 1 1 3 2977 1 1 33 PHE CE1 C 2.765 5.662 -3.578 1.00 . A A . 33 PHE CE1 1 1 3 2978 1 1 33 PHE CE2 C 4.446 3.919 -2.991 1.00 . A A . 33 PHE CE2 1 1 3 2979 1 1 33 PHE CG C 2.245 3.975 -1.811 1.00 . A A . 33 PHE CG 1 1 3 2980 1 1 33 PHE CZ C 4.058 5.062 -3.773 1.00 . A A . 33 PHE CZ 1 1 3 2981 1 1 33 PHE H H -1.597 3.057 -1.384 1.00 . A A . 33 PHE H 1 1 3 2982 1 1 33 PHE HA H 0.870 1.788 -2.190 1.00 . A A . 33 PHE HA 1 1 3 2983 1 1 33 PHE HB2 H 0.705 4.223 -0.373 1.00 . A A . 33 PHE HB2 1 1 3 2984 1 1 33 PHE HB3 H 1.900 2.969 0.013 1.00 . A A . 33 PHE HB3 1 1 3 2985 1 1 33 PHE HD1 H 0.895 5.574 -2.446 1.00 . A A . 33 PHE HD1 1 1 3 2986 1 1 33 PHE HD2 H 3.832 2.518 -1.427 1.00 . A A . 33 PHE HD2 1 1 3 2987 1 1 33 PHE HE1 H 2.470 6.513 -4.175 1.00 . A A . 33 PHE HE1 1 1 3 2988 1 1 33 PHE HE2 H 5.412 3.460 -3.147 1.00 . A A . 33 PHE HE2 1 1 3 2989 1 1 33 PHE HZ H 4.739 5.471 -4.505 1.00 . A A . 33 PHE HZ 1 1 3 2990 1 1 33 PHE N N -0.790 2.974 -1.964 1.00 . A A . 33 PHE N 1 1 3 2991 1 1 33 PHE O O -0.795 1.789 0.633 1.00 . A A . 33 PHE O 1 1 3 2992 1 1 34 ALA C C -0.094 -2.296 -0.400 1.00 . A A . 34 ALA C 1 1 3 2993 1 1 34 ALA CA C -0.661 -0.926 -0.041 1.00 . A A . 34 ALA CA 1 1 3 2994 1 1 34 ALA CB C -2.040 -0.738 -0.675 1.00 . A A . 34 ALA CB 1 1 3 2995 1 1 34 ALA H H 1.115 -0.120 -0.938 1.00 . A A . 34 ALA H 1 1 3 2996 1 1 34 ALA HA H -0.719 -0.842 1.042 1.00 . A A . 34 ALA HA 1 1 3 2997 1 1 34 ALA HB1 H -2.790 -0.530 0.087 1.00 . A A . 34 ALA HB1 1 1 3 2998 1 1 34 ALA HB2 H -2.035 0.094 -1.380 1.00 . A A . 34 ALA HB2 1 1 3 2999 1 1 34 ALA HB3 H -2.348 -1.636 -1.210 1.00 . A A . 34 ALA HB3 1 1 3 3000 1 1 34 ALA N N 0.246 0.110 -0.500 1.00 . A A . 34 ALA N 1 1 3 3001 1 1 34 ALA O O 0.536 -2.488 -1.433 1.00 . A A . 34 ALA O 1 1 3 3002 1 1 35 PRO C C 1.098 -4.935 -0.497 1.00 . A A . 35 PRO C 1 1 3 3003 1 1 35 PRO CA C 0.569 -4.324 0.800 1.00 . A A . 35 PRO CA 1 1 3 3004 1 1 35 PRO CB C -0.232 -5.347 1.610 1.00 . A A . 35 PRO CB 1 1 3 3005 1 1 35 PRO CD C -1.634 -3.353 1.211 1.00 . A A . 35 PRO CD 1 1 3 3006 1 1 35 PRO CG C -1.602 -4.719 1.905 1.00 . A A . 35 PRO CG 1 1 3 3007 1 1 35 PRO HA H 1.409 -3.944 1.381 1.00 . A A . 35 PRO HA 1 1 3 3008 1 1 35 PRO HB2 H -0.351 -6.272 1.046 1.00 . A A . 35 PRO HB2 1 1 3 3009 1 1 35 PRO HB3 H 0.285 -5.592 2.537 1.00 . A A . 35 PRO HB3 1 1 3 3010 1 1 35 PRO HD2 H -2.452 -3.291 0.492 1.00 . A A . 35 PRO HD2 1 1 3 3011 1 1 35 PRO HD3 H -1.741 -2.544 1.932 1.00 . A A . 35 PRO HD3 1 1 3 3012 1 1 35 PRO HG2 H -2.404 -5.357 1.532 1.00 . A A . 35 PRO HG2 1 1 3 3013 1 1 35 PRO HG3 H -1.746 -4.605 2.979 1.00 . A A . 35 PRO HG3 1 1 3 3014 1 1 35 PRO N N -0.359 -3.245 0.523 1.00 . A A . 35 PRO N 1 1 3 3015 1 1 35 PRO O O 0.501 -5.826 -1.089 1.00 . A A . 35 PRO O 1 1 3 3016 1 1 36 ILE C C 3.222 -6.667 -0.966 1.00 . A A . 36 ILE C 1 1 3 3017 1 1 36 ILE CA C 3.329 -5.211 -1.453 1.00 . A A . 36 ILE CA 1 1 3 3018 1 1 36 ILE CB C 4.678 -4.620 -1.040 1.00 . A A . 36 ILE CB 1 1 3 3019 1 1 36 ILE CD1 C 6.463 -6.100 -0.059 1.00 . A A . 36 ILE CD1 1 1 3 3020 1 1 36 ILE CG1 C 5.836 -5.573 -1.336 1.00 . A A . 36 ILE CG1 1 1 3 3021 1 1 36 ILE CG2 C 4.640 -4.191 0.427 1.00 . A A . 36 ILE CG2 1 1 3 3022 1 1 36 ILE H H 2.393 -3.397 -0.776 1.00 . A A . 36 ILE H 1 1 3 3023 1 1 36 ILE HA H 3.208 -5.168 -2.531 1.00 . A A . 36 ILE HA 1 1 3 3024 1 1 36 ILE HB H 4.864 -3.731 -1.631 1.00 . A A . 36 ILE HB 1 1 3 3025 1 1 36 ILE HD11 H 7.070 -6.978 -0.273 1.00 . A A . 36 ILE HD11 1 1 3 3026 1 1 36 ILE HD12 H 7.086 -5.330 0.394 1.00 . A A . 36 ILE HD12 1 1 3 3027 1 1 36 ILE HD13 H 5.677 -6.372 0.645 1.00 . A A . 36 ILE HD13 1 1 3 3028 1 1 36 ILE HG12 H 5.499 -6.418 -1.929 1.00 . A A . 36 ILE HG12 1 1 3 3029 1 1 36 ILE HG13 H 6.591 -5.056 -1.928 1.00 . A A . 36 ILE HG13 1 1 3 3030 1 1 36 ILE HG21 H 4.255 -4.997 1.050 1.00 . A A . 36 ILE HG21 1 1 3 3031 1 1 36 ILE HG22 H 5.637 -3.934 0.786 1.00 . A A . 36 ILE HG22 1 1 3 3032 1 1 36 ILE HG23 H 3.995 -3.322 0.560 1.00 . A A . 36 ILE HG23 1 1 3 3033 1 1 36 ILE N N 2.265 -4.385 -0.889 1.00 . A A . 36 ILE N 1 1 3 3034 1 1 36 ILE O O 2.946 -6.927 0.199 1.00 . A A . 36 ILE O 1 1 3 3035 1 1 37 PRO C C 4.321 -9.252 -0.239 1.00 . A A . 37 PRO C 1 1 3 3036 1 1 37 PRO CA C 3.612 -9.009 -1.570 1.00 . A A . 37 PRO CA 1 1 3 3037 1 1 37 PRO CB C 4.419 -9.590 -2.729 1.00 . A A . 37 PRO CB 1 1 3 3038 1 1 37 PRO CD C 3.641 -7.330 -3.332 1.00 . A A . 37 PRO CD 1 1 3 3039 1 1 37 PRO CG C 4.251 -8.614 -3.905 1.00 . A A . 37 PRO CG 1 1 3 3040 1 1 37 PRO HA H 2.630 -9.478 -1.528 1.00 . A A . 37 PRO HA 1 1 3 3041 1 1 37 PRO HB2 H 5.470 -9.661 -2.448 1.00 . A A . 37 PRO HB2 1 1 3 3042 1 1 37 PRO HB3 H 4.076 -10.592 -2.981 1.00 . A A . 37 PRO HB3 1 1 3 3043 1 1 37 PRO HD2 H 4.309 -6.486 -3.499 1.00 . A A . 37 PRO HD2 1 1 3 3044 1 1 37 PRO HD3 H 2.680 -7.107 -3.796 1.00 . A A . 37 PRO HD3 1 1 3 3045 1 1 37 PRO HG2 H 5.213 -8.406 -4.374 1.00 . A A . 37 PRO HG2 1 1 3 3046 1 1 37 PRO HG3 H 3.598 -9.041 -4.666 1.00 . A A . 37 PRO HG3 1 1 3 3047 1 1 37 PRO N N 3.454 -7.607 -1.913 1.00 . A A . 37 PRO N 1 1 3 3048 1 1 37 PRO O O 4.825 -8.344 0.410 1.00 . A A . 37 PRO O 1 1 3 3049 1 1 38 HIS C C 3.196 -9.907 2.230 1.00 . A A . 38 HIS C 1 1 3 3050 1 1 38 HIS CA C 3.991 -10.971 1.467 1.00 . A A . 38 HIS CA 1 1 3 3051 1 1 38 HIS CB C 5.234 -11.496 2.209 1.00 . A A . 38 HIS CB 1 1 3 3052 1 1 38 HIS CD2 C 6.976 -9.952 1.101 1.00 . A A . 38 HIS CD2 1 1 3 3053 1 1 38 HIS CE1 C 8.293 -9.528 2.849 1.00 . A A . 38 HIS CE1 1 1 3 3054 1 1 38 HIS CG C 6.456 -10.618 2.148 1.00 . A A . 38 HIS CG 1 1 3 3055 1 1 38 HIS H H 4.530 -11.248 -0.576 1.00 . A A . 38 HIS H 1 1 3 3056 1 1 38 HIS HA H 3.315 -11.798 1.376 1.00 . A A . 38 HIS HA 1 1 3 3057 1 1 38 HIS HB2 H 4.963 -11.623 3.263 1.00 . A A . 38 HIS HB2 1 1 3 3058 1 1 38 HIS HB3 H 5.494 -12.480 1.808 1.00 . A A . 38 HIS HB3 1 1 3 3059 1 1 38 HIS HD1 H 7.194 -10.714 4.218 1.00 . A A . 38 HIS HD1 1 1 3 3060 1 1 38 HIS HD2 H 6.588 -9.944 0.102 1.00 . A A . 38 HIS HD2 1 1 3 3061 1 1 38 HIS HE1 H 9.089 -9.143 3.482 1.00 . A A . 38 HIS HE1 1 1 3 3062 1 1 38 HIS N N 4.314 -10.555 0.111 1.00 . A A . 38 HIS N 1 1 3 3063 1 1 38 HIS ND1 N 7.328 -10.343 3.298 1.00 . A A . 38 HIS ND1 1 1 3 3064 1 1 38 HIS NE2 N 8.179 -9.228 1.546 1.00 . A A . 38 HIS NE2 1 1 3 3065 1 1 38 HIS O O 2.007 -9.685 2.029 1.00 . A A . 38 HIS O 1 1 3 3066 1 1 39 GLU C C 2.131 -8.117 4.195 1.00 . A A . 39 GLU C 1 1 3 3067 1 1 39 GLU CA C 3.466 -8.842 4.386 1.00 . A A . 39 GLU CA 1 1 3 3068 1 1 39 GLU CB C 4.499 -7.907 5.002 1.00 . A A . 39 GLU CB 1 1 3 3069 1 1 39 GLU CD C 6.893 -7.659 5.699 1.00 . A A . 39 GLU CD 1 1 3 3070 1 1 39 GLU CG C 5.919 -8.430 4.806 1.00 . A A . 39 GLU CG 1 1 3 3071 1 1 39 GLU H H 4.930 -9.463 2.903 1.00 . A A . 39 GLU H 1 1 3 3072 1 1 39 GLU HA H 3.343 -9.737 4.989 1.00 . A A . 39 GLU HA 1 1 3 3073 1 1 39 GLU HB2 H 4.407 -6.940 4.507 1.00 . A A . 39 GLU HB2 1 1 3 3074 1 1 39 GLU HB3 H 4.305 -7.777 6.068 1.00 . A A . 39 GLU HB3 1 1 3 3075 1 1 39 GLU HG2 H 5.975 -9.492 5.048 1.00 . A A . 39 GLU HG2 1 1 3 3076 1 1 39 GLU HG3 H 6.214 -8.307 3.765 1.00 . A A . 39 GLU HG3 1 1 3 3077 1 1 39 GLU N N 3.974 -9.289 3.110 1.00 . A A . 39 GLU N 1 1 3 3078 1 1 39 GLU O O 2.032 -7.136 3.468 1.00 . A A . 39 GLU O 1 1 3 3079 1 1 39 GLU OE1 O 6.935 -7.936 6.897 1.00 . A A . 39 GLU OE1 1 1 3 3080 1 1 39 GLU OE2 O 7.599 -6.791 5.186 1.00 . A A . 39 GLU OE2 1 1 3 3081 1 1 40 PRO C C 0.230 -6.832 6.321 1.00 . A A . 40 PRO C 1 1 3 3082 1 1 40 PRO CA C -0.075 -7.881 5.248 1.00 . A A . 40 PRO CA 1 1 3 3083 1 1 40 PRO CB C -1.078 -8.901 5.793 1.00 . A A . 40 PRO CB 1 1 3 3084 1 1 40 PRO CD C 1.035 -10.059 5.260 1.00 . A A . 40 PRO CD 1 1 3 3085 1 1 40 PRO CG C -0.391 -10.273 5.774 1.00 . A A . 40 PRO CG 1 1 3 3086 1 1 40 PRO HA H -0.469 -7.383 4.362 1.00 . A A . 40 PRO HA 1 1 3 3087 1 1 40 PRO HB2 H -1.376 -8.637 6.808 1.00 . A A . 40 PRO HB2 1 1 3 3088 1 1 40 PRO HB3 H -1.979 -8.916 5.179 1.00 . A A . 40 PRO HB3 1 1 3 3089 1 1 40 PRO HD2 H 1.757 -10.279 6.045 1.00 . A A . 40 PRO HD2 1 1 3 3090 1 1 40 PRO HD3 H 1.249 -10.687 4.395 1.00 . A A . 40 PRO HD3 1 1 3 3091 1 1 40 PRO HG2 H -0.374 -10.707 6.774 1.00 . A A . 40 PRO HG2 1 1 3 3092 1 1 40 PRO HG3 H -0.932 -10.963 5.126 1.00 . A A . 40 PRO HG3 1 1 3 3093 1 1 40 PRO N N 1.103 -8.654 4.890 1.00 . A A . 40 PRO N 1 1 3 3094 1 1 40 PRO O O -0.181 -6.946 7.469 1.00 . A A . 40 PRO O 1 1 3 3095 1 1 41 HIS C C 0.785 -3.429 5.087 1.00 . A A . 41 HIS C 1 1 3 3096 1 1 41 HIS CA C 0.558 -4.454 6.205 1.00 . A A . 41 HIS CA 1 1 3 3097 1 1 41 HIS CB C 1.255 -3.983 7.484 1.00 . A A . 41 HIS CB 1 1 3 3098 1 1 41 HIS CD2 C 3.743 -3.415 7.668 1.00 . A A . 41 HIS CD2 1 1 3 3099 1 1 41 HIS CE1 C 4.657 -5.422 7.321 1.00 . A A . 41 HIS CE1 1 1 3 3100 1 1 41 HIS CG C 2.729 -4.279 7.483 1.00 . A A . 41 HIS CG 1 1 3 3101 1 1 41 HIS H H 1.832 -5.991 5.380 1.00 . A A . 41 HIS H 1 1 3 3102 1 1 41 HIS HA H -0.513 -4.524 6.314 1.00 . A A . 41 HIS HA 1 1 3 3103 1 1 41 HIS HB2 H 1.113 -2.904 7.577 1.00 . A A . 41 HIS HB2 1 1 3 3104 1 1 41 HIS HB3 H 0.792 -4.458 8.353 1.00 . A A . 41 HIS HB3 1 1 3 3105 1 1 41 HIS HD1 H 2.813 -6.444 7.103 1.00 . A A . 41 HIS HD1 1 1 3 3106 1 1 41 HIS HD2 H 3.639 -2.361 7.845 1.00 . A A . 41 HIS HD2 1 1 3 3107 1 1 41 HIS HE1 H 5.372 -6.203 7.074 1.00 . A A . 41 HIS HE1 1 1 3 3108 1 1 41 HIS N N 0.978 -5.811 5.867 1.00 . A A . 41 HIS N 1 1 3 3109 1 1 41 HIS ND1 N 3.329 -5.603 7.266 1.00 . A A . 41 HIS ND1 1 1 3 3110 1 1 41 HIS NE2 N 5.015 -4.152 7.580 1.00 . A A . 41 HIS NE2 1 1 3 3111 1 1 41 HIS O O 0.139 -2.391 5.020 1.00 . A A . 41 HIS O 1 1 3 3112 1 1 42 ARG C C 2.102 -1.886 2.754 1.00 . A A . 42 ARG C 1 1 3 3113 1 1 42 ARG CA C 2.699 -2.789 3.821 1.00 . A A . 42 ARG CA 1 1 3 3114 1 1 42 ARG CB C 3.985 -3.411 3.287 1.00 . A A . 42 ARG CB 1 1 3 3115 1 1 42 ARG CD C 6.014 -4.640 4.203 1.00 . A A . 42 ARG CD 1 1 3 3116 1 1 42 ARG CG C 5.054 -3.464 4.375 1.00 . A A . 42 ARG CG 1 1 3 3117 1 1 42 ARG CZ C 8.158 -3.692 3.688 1.00 . A A . 42 ARG CZ 1 1 3 3118 1 1 42 ARG H H 1.737 -4.774 4.071 1.00 . A A . 42 ARG H 1 1 3 3119 1 1 42 ARG HA H 2.905 -2.193 4.711 1.00 . A A . 42 ARG HA 1 1 3 3120 1 1 42 ARG HB2 H 3.774 -4.397 2.885 1.00 . A A . 42 ARG HB2 1 1 3 3121 1 1 42 ARG HB3 H 4.360 -2.821 2.452 1.00 . A A . 42 ARG HB3 1 1 3 3122 1 1 42 ARG HD2 H 5.730 -5.487 4.827 1.00 . A A . 42 ARG HD2 1 1 3 3123 1 1 42 ARG HD3 H 6.077 -4.966 3.165 1.00 . A A . 42 ARG HD3 1 1 3 3124 1 1 42 ARG HE H 7.666 -4.395 5.545 1.00 . A A . 42 ARG HE 1 1 3 3125 1 1 42 ARG HG2 H 5.622 -2.530 4.359 1.00 . A A . 42 ARG HG2 1 1 3 3126 1 1 42 ARG HG3 H 4.552 -3.532 5.343 1.00 . A A . 42 ARG HG3 1 1 3 3127 1 1 42 ARG HH11 H 6.955 -2.101 3.340 1.00 . A A . 42 ARG HH11 1 1 3 3128 1 1 42 ARG HH12 H 8.509 -2.033 2.578 1.00 . A A . 42 ARG HH12 1 1 3 3129 1 1 42 ARG HH21 H 9.572 -5.135 3.808 1.00 . A A . 42 ARG HH21 1 1 3 3130 1 1 42 ARG HH22 H 9.799 -3.979 2.536 1.00 . A A . 42 ARG HH22 1 1 3 3131 1 1 42 ARG N N 1.735 -3.791 4.226 1.00 . A A . 42 ARG N 1 1 3 3132 1 1 42 ARG NE N 7.351 -4.250 4.607 1.00 . A A . 42 ARG NE 1 1 3 3133 1 1 42 ARG NH1 N 7.849 -2.511 3.158 1.00 . A A . 42 ARG NH1 1 1 3 3134 1 1 42 ARG NH2 N 9.268 -4.320 3.312 1.00 . A A . 42 ARG NH2 1 1 3 3135 1 1 42 ARG O O 0.975 -2.043 2.303 1.00 . A A . 42 ARG O 1 1 3 3136 1 1 43 CYS C C 4.313 -0.866 0.389 1.00 . A A . 43 CYS C 1 1 3 3137 1 1 43 CYS CA C 3.008 -0.438 1.058 1.00 . A A . 43 CYS CA 1 1 3 3138 1 1 43 CYS CB C 2.890 1.078 1.116 1.00 . A A . 43 CYS CB 1 1 3 3139 1 1 43 CYS H H 3.365 -0.375 3.144 1.00 . A A . 43 CYS H 1 1 3 3140 1 1 43 CYS HA H 2.144 -0.854 0.540 1.00 . A A . 43 CYS HA 1 1 3 3141 1 1 43 CYS HB2 H 3.344 1.529 0.234 1.00 . A A . 43 CYS HB2 1 1 3 3142 1 1 43 CYS HB3 H 1.831 1.295 1.088 1.00 . A A . 43 CYS HB3 1 1 3 3143 1 1 43 CYS N N 2.959 -0.916 2.416 1.00 . A A . 43 CYS N 1 1 3 3144 1 1 43 CYS O O 5.298 -1.195 1.038 1.00 . A A . 43 CYS O 1 1 3 3145 1 1 43 CYS SG S 3.602 1.826 2.610 1.00 . A A . 43 CYS SG 1 1 3 3146 1 1 44 GLN C C 5.159 -1.023 -3.188 1.00 . A A . 44 GLN C 1 1 3 3147 1 1 44 GLN CA C 5.469 -0.758 -1.718 1.00 . A A . 44 GLN CA 1 1 3 3148 1 1 44 GLN CB C 6.480 -1.783 -1.208 1.00 . A A . 44 GLN CB 1 1 3 3149 1 1 44 GLN CD C 8.713 -2.169 -0.142 1.00 . A A . 44 GLN CD 1 1 3 3150 1 1 44 GLN CG C 7.648 -1.123 -0.475 1.00 . A A . 44 GLN CG 1 1 3 3151 1 1 44 GLN H H 3.353 -0.834 -1.413 1.00 . A A . 44 GLN H 1 1 3 3152 1 1 44 GLN HA H 5.846 0.258 -1.604 1.00 . A A . 44 GLN HA 1 1 3 3153 1 1 44 GLN HB2 H 5.985 -2.492 -0.546 1.00 . A A . 44 GLN HB2 1 1 3 3154 1 1 44 GLN HB3 H 6.857 -2.357 -2.055 1.00 . A A . 44 GLN HB3 1 1 3 3155 1 1 44 GLN HE21 H 7.604 -3.867 -0.012 1.00 . A A . 44 GLN HE21 1 1 3 3156 1 1 44 GLN HE22 H 8.453 -3.409 1.453 1.00 . A A . 44 GLN HE22 1 1 3 3157 1 1 44 GLN HG2 H 8.098 -0.345 -1.092 1.00 . A A . 44 GLN HG2 1 1 3 3158 1 1 44 GLN HG3 H 7.308 -0.657 0.450 1.00 . A A . 44 GLN HG3 1 1 3 3159 1 1 44 GLN N N 4.241 -0.834 -0.953 1.00 . A A . 44 GLN N 1 1 3 3160 1 1 44 GLN NE2 N 8.212 -3.245 0.491 1.00 . A A . 44 GLN NE2 1 1 3 3161 1 1 44 GLN O O 5.299 -2.130 -3.694 1.00 . A A . 44 GLN O 1 1 3 3162 1 1 44 GLN OE1 O 9.891 -2.012 -0.439 1.00 . A A . 44 GLN OE1 1 1 3 3163 1 1 45 MET C C 2.421 -0.771 -3.705 1.00 . A A . 45 MET C 1 1 3 3164 1 1 45 MET CA C 3.330 0.465 -3.711 1.00 . A A . 45 MET CA 1 1 3 3165 1 1 45 MET CB C 2.964 1.389 -4.873 1.00 . A A . 45 MET CB 1 1 3 3166 1 1 45 MET CE C 2.644 -0.568 -8.219 1.00 . A A . 45 MET CE 1 1 3 3167 1 1 45 MET CG C 3.608 0.946 -6.187 1.00 . A A . 45 MET CG 1 1 3 3168 1 1 45 MET H H 5.396 0.673 -4.269 1.00 . A A . 45 MET H 1 1 3 3169 1 1 45 MET HA H 3.236 0.987 -2.760 1.00 . A A . 45 MET HA 1 1 3 3170 1 1 45 MET HB2 H 1.881 1.421 -4.990 1.00 . A A . 45 MET HB2 1 1 3 3171 1 1 45 MET HB3 H 3.281 2.406 -4.645 1.00 . A A . 45 MET HB3 1 1 3 3172 1 1 45 MET HE1 H 3.479 -0.476 -8.912 1.00 . A A . 45 MET HE1 1 1 3 3173 1 1 45 MET HE2 H 2.044 -1.428 -8.512 1.00 . A A . 45 MET HE2 1 1 3 3174 1 1 45 MET HE3 H 2.031 0.332 -8.289 1.00 . A A . 45 MET HE3 1 1 3 3175 1 1 45 MET HG2 H 3.238 1.558 -7.010 1.00 . A A . 45 MET HG2 1 1 3 3176 1 1 45 MET HG3 H 4.688 1.083 -6.143 1.00 . A A . 45 MET HG3 1 1 3 3177 1 1 45 MET N N 4.726 0.076 -3.830 1.00 . A A . 45 MET N 1 1 3 3178 1 1 45 MET O O 2.864 -1.894 -3.914 1.00 . A A . 45 MET O 1 1 3 3179 1 1 45 MET SD S 3.249 -0.781 -6.538 1.00 . A A . 45 MET SD 1 1 3 3180 1 1 46 PHE C C 0.481 -0.903 -5.761 1.00 . A A . 46 PHE C 1 1 3 3181 1 1 46 PHE CA C 0.151 -1.168 -4.285 1.00 . A A . 46 PHE CA 1 1 3 3182 1 1 46 PHE CB C -1.250 -0.663 -3.907 1.00 . A A . 46 PHE CB 1 1 3 3183 1 1 46 PHE CD1 C -2.842 -2.348 -4.980 1.00 . A A . 46 PHE CD1 1 1 3 3184 1 1 46 PHE CD2 C -2.809 -0.006 -5.818 1.00 . A A . 46 PHE CD2 1 1 3 3185 1 1 46 PHE CE1 C -3.868 -2.677 -5.934 1.00 . A A . 46 PHE CE1 1 1 3 3186 1 1 46 PHE CE2 C -3.834 -0.331 -6.775 1.00 . A A . 46 PHE CE2 1 1 3 3187 1 1 46 PHE CG C -2.310 -1.011 -4.914 1.00 . A A . 46 PHE CG 1 1 3 3188 1 1 46 PHE CZ C -4.363 -1.667 -6.832 1.00 . A A . 46 PHE CZ 1 1 3 3189 1 1 46 PHE H H 0.814 0.079 -2.699 1.00 . A A . 46 PHE H 1 1 3 3190 1 1 46 PHE HA H 0.283 -2.226 -4.054 1.00 . A A . 46 PHE HA 1 1 3 3191 1 1 46 PHE HB2 H -1.539 -1.081 -2.943 1.00 . A A . 46 PHE HB2 1 1 3 3192 1 1 46 PHE HB3 H -1.229 0.420 -3.786 1.00 . A A . 46 PHE HB3 1 1 3 3193 1 1 46 PHE HD1 H -2.469 -3.105 -4.310 1.00 . A A . 46 PHE HD1 1 1 3 3194 1 1 46 PHE HD2 H -2.412 0.998 -5.776 1.00 . A A . 46 PHE HD2 1 1 3 3195 1 1 46 PHE HE1 H -4.268 -3.680 -5.975 1.00 . A A . 46 PHE HE1 1 1 3 3196 1 1 46 PHE HE2 H -4.205 0.427 -7.448 1.00 . A A . 46 PHE HE2 1 1 3 3197 1 1 46 PHE HZ H -5.131 -1.913 -7.550 1.00 . A A . 46 PHE HZ 1 1 3 3198 1 1 46 PHE N N 1.127 -0.492 -3.460 1.00 . A A . 46 PHE N 1 1 3 3199 1 1 46 PHE O O 0.552 0.234 -6.212 1.00 . A A . 46 PHE O 1 1 3 3200 1 1 47 CYS C C 0.045 -3.752 -8.074 1.30 . A A . 47 CYS C 1 1 3 3201 1 1 47 CYS CA C -0.297 -2.378 -7.493 0.80 . A A . 47 CYS CA 1 1 3 3202 1 1 47 CYS CB C -0.294 -1.323 -8.599 0.60 . A A . 47 CYS CB 1 1 3 3203 1 1 47 CYS H H 1.465 -2.615 -6.297 1.00 . A A . 47 CYS H 1 1 3 3204 1 1 47 CYS HA H -1.266 -2.421 -6.997 1.10 . A A . 47 CYS HA 1 1 3 3205 1 1 47 CYS HB2 H 0.186 -0.414 -8.238 0.90 . A A . 47 CYS HB2 1 1 3 3206 1 1 47 CYS HB3 H 0.300 -1.678 -9.441 0.90 . A A . 47 CYS HB3 1 1 3 3207 1 1 47 CYS N N 0.673 -2.030 -6.471 0.60 . A A . 47 CYS N 1 1 3 3208 1 1 47 CYS O O 1.155 -4.007 -8.524 1.90 . A A . 47 CYS O 1 1 3 3209 1 1 47 CYS SG S -1.945 -0.898 -9.202 1.30 . A A . 47 CYS SG 1 1 3 3210 1 1 48 ASN C C -2.729 -5.563 -9.450 1.90 . A A . 48 ASN C 1 1 3 3211 1 1 48 ASN CA C -1.225 -5.459 -9.186 2.30 . A A . 48 ASN CA 1 1 3 3212 1 1 48 ASN CB C -0.613 -6.858 -9.007 3.00 . A A . 48 ASN CB 1 1 3 3213 1 1 48 ASN CG C -0.500 -7.282 -7.536 3.70 . A A . 48 ASN CG 1 1 3 3214 1 1 48 ASN H H -1.574 -4.672 -7.222 2.00 . A A . 48 ASN H 1 1 3 3215 1 1 48 ASN HA H -0.760 -4.949 -10.029 2.70 . A A . 48 ASN HA 1 1 3 3216 1 1 48 ASN HB2 H -1.217 -7.598 -9.532 3.30 . A A . 48 ASN HB2 1 1 3 3217 1 1 48 ASN HB3 H 0.383 -6.887 -9.449 3.20 . A A . 48 ASN HB3 1 1 3 3218 1 1 48 ASN HD21 H -2.540 -7.177 -7.381 1.00 . A A . 48 ASN HD21 1 1 3 3219 1 1 48 ASN N N -0.987 -4.613 -8.029 1.70 . A A . 48 ASN N 1 1 3 3220 1 1 48 ASN ND2 N -1.678 -7.291 -6.887 4.10 . A A . 48 ASN ND2 1 1 3 3221 1 1 48 ASN O O -3.367 -6.574 -9.182 2.30 . A A . 48 ASN O 1 1 3 3222 1 1 48 ASN OD1 O 0.578 -7.577 -7.033 4.40 . A A . 48 ASN OD1 1 1 3 3223 1 1 49 GLN C C -4.483 -3.177 -11.670 1.80 . A A . 49 GLN C 1 1 3 3224 1 1 49 GLN CA C -4.106 -4.576 -11.152 2.00 . A A . 49 GLN CA 1 1 3 3225 1 1 49 GLN CB C -5.334 -5.408 -10.771 2.20 . A A . 49 GLN CB 1 1 3 3226 1 1 49 GLN CD C -6.738 -5.983 -8.782 3.40 . A A . 49 GLN CD 1 1 3 3227 1 1 49 GLN CG C -6.041 -4.849 -9.536 2.70 . A A . 49 GLN CG 1 1 3 3228 1 1 49 GLN H H -3.033 -3.546 -9.609 2.50 . A A . 49 GLN H 1 1 3 3229 1 1 49 GLN HA H -3.517 -5.088 -11.912 2.50 . A A . 49 GLN HA 1 1 3 3230 1 1 49 GLN HB2 H -6.030 -5.435 -11.609 2.60 . A A . 49 GLN HB2 1 1 3 3231 1 1 49 GLN HB3 H -5.034 -6.440 -10.585 2.10 . A A . 49 GLN HB3 1 1 3 3232 1 1 49 GLN HE21 H -6.080 -5.162 -7.041 4.50 . A A . 49 GLN HE21 1 1 3 3233 1 1 49 GLN HE22 H -6.604 -6.833 -6.938 4.10 . A A . 49 GLN HE22 1 1 3 3234 1 1 49 GLN HG2 H -5.326 -4.367 -8.870 2.70 . A A . 49 GLN HG2 1 1 3 3235 1 1 49 GLN HG3 H -6.785 -4.104 -9.822 2.80 . A A . 49 GLN HG3 1 1 3 3236 1 1 49 GLN N N -3.242 -4.444 -9.994 2.00 . A A . 49 GLN N 1 1 3 3237 1 1 49 GLN NE2 N -6.448 -5.994 -7.469 4.00 . A A . 49 GLN NE2 1 1 3 3238 1 1 49 GLN O O -3.641 -2.296 -11.788 2.20 . A A . 49 GLN O 1 1 3 3239 1 1 49 GLN OE1 O -7.476 -6.779 -9.347 3.70 . A A . 49 GLN OE1 1 1 3 3240 1 1 50 THR C C -6.419 -1.006 -13.193 1.50 . A A . 50 THR C 1 1 3 3241 1 1 50 THR CA C -6.133 -2.508 -13.282 1.80 . A A . 50 THR CA 1 1 3 3242 1 1 50 THR CB C -7.357 -3.247 -13.824 1.90 . A A . 50 THR CB 1 1 3 3243 1 1 50 THR CG2 C -6.964 -4.369 -14.785 2.30 . A A . 50 THR CG2 1 1 3 3244 1 1 50 THR H H -6.496 -3.264 -11.308 2.00 . A A . 50 THR H 1 1 3 3245 1 1 50 THR HA H -5.264 -2.672 -13.918 2.10 . A A . 50 THR HA 1 1 3 3246 1 1 50 THR HB H -8.008 -2.540 -14.338 2.20 . A A . 50 THR HB 1 1 3 3247 1 1 50 THR HG1 H -8.811 -3.191 -12.591 2.50 . A A . 50 THR HG1 1 1 3 3248 1 1 50 THR HG21 H -6.774 -3.975 -15.784 2.40 . A A . 50 THR HG21 1 1 3 3249 1 1 50 THR HG22 H -7.757 -5.112 -14.861 2.60 . A A . 50 THR HG22 1 1 3 3250 1 1 50 THR HG23 H -6.060 -4.874 -14.445 2.80 . A A . 50 THR HG23 1 1 3 3251 1 1 50 THR N N -5.787 -3.026 -11.972 1.70 . A A . 50 THR N 1 1 3 3252 1 1 50 THR O O -5.976 -0.214 -14.015 2.20 . A A . 50 THR O 1 1 3 3253 1 1 50 THR OG1 O -8.090 -3.785 -12.753 2.20 . A A . 50 THR OG1 1 1 3 3254 1 1 51 ALA C C -5.664 1.168 -11.603 0.60 . A A . 51 ALA C 1 1 3 3255 1 1 51 ALA CA C -6.599 0.082 -11.047 0.60 . A A . 51 ALA CA 1 1 3 3256 1 1 51 ALA CB C -5.872 -0.876 -10.101 0.70 . A A . 51 ALA CB 1 1 3 3257 1 1 51 ALA H H -8.120 -1.033 -12.061 0.90 . A A . 51 ALA H 1 1 3 3258 1 1 51 ALA HA H -7.427 0.575 -10.538 0.70 . A A . 51 ALA HA 1 1 3 3259 1 1 51 ALA HB1 H -6.418 -1.815 -10.002 1.20 . A A . 51 ALA HB1 1 1 3 3260 1 1 51 ALA HB2 H -5.770 -0.437 -9.108 1.00 . A A . 51 ALA HB2 1 1 3 3261 1 1 51 ALA HB3 H -4.872 -1.103 -10.470 1.30 . A A . 51 ALA HB3 1 1 3 3262 1 1 51 ALA N N -7.189 -0.675 -12.138 0.80 . A A . 51 ALA N 1 1 3 3263 1 1 51 ALA O O -5.937 1.785 -12.626 1.10 . A A . 51 ALA O 1 1 3 3264 1 1 52 CYS C C -3.209 1.523 -12.901 0.80 . A A . 52 CYS C 1 1 3 3265 1 1 52 CYS CA C -3.413 2.030 -11.471 0.80 . A A . 52 CYS CA 1 1 3 3266 1 1 52 CYS CB C -2.155 1.746 -10.650 0.90 . A A . 52 CYS CB 1 1 3 3267 1 1 52 CYS H H -4.523 1.051 -9.916 0.90 . A A . 52 CYS H 1 1 3 3268 1 1 52 CYS HA H -3.646 3.094 -11.490 0.80 . A A . 52 CYS HA 1 1 3 3269 1 1 52 CYS HB2 H -1.378 2.465 -10.909 1.10 . A A . 52 CYS HB2 1 1 3 3270 1 1 52 CYS HB3 H -2.356 1.869 -9.584 1.00 . A A . 52 CYS HB3 1 1 3 3271 1 1 52 CYS N N -4.553 1.362 -10.866 0.70 . A A . 52 CYS N 1 1 3 3272 1 1 52 CYS O O -3.181 0.328 -13.167 1.20 . A A . 52 CYS O 1 1 3 3273 1 1 52 CYS SG S -1.522 0.077 -10.943 1.00 . A A . 52 CYS SG 1 1 3 3274 1 1 53 PRO C C -0.817 3.255 -14.403 0.80 . A A . 53 PRO C 1 1 3 3275 1 1 53 PRO CA C -2.055 2.491 -14.847 0.70 . A A . 53 PRO CA 1 1 3 3276 1 1 53 PRO CB C -2.651 3.321 -15.967 0.90 . A A . 53 PRO CB 1 1 3 3277 1 1 53 PRO CD C -3.973 3.637 -13.922 0.80 . A A . 53 PRO CD 1 1 3 3278 1 1 53 PRO CG C -3.534 4.317 -15.224 0.90 . A A . 53 PRO CG 1 1 3 3279 1 1 53 PRO HA H -1.810 1.472 -15.149 0.80 . A A . 53 PRO HA 1 1 3 3280 1 1 53 PRO HB2 H -1.876 3.830 -16.541 1.00 . A A . 53 PRO HB2 1 1 3 3281 1 1 53 PRO HB3 H -3.236 2.704 -16.649 1.10 . A A . 53 PRO HB3 1 1 3 3282 1 1 53 PRO HD2 H -3.861 4.299 -13.064 0.80 . A A . 53 PRO HD2 1 1 3 3283 1 1 53 PRO HD3 H -5.005 3.290 -13.975 0.90 . A A . 53 PRO HD3 1 1 3 3284 1 1 53 PRO HG2 H -2.921 5.187 -14.990 0.90 . A A . 53 PRO HG2 1 1 3 3285 1 1 53 PRO HG3 H -4.376 4.604 -15.841 1.00 . A A . 53 PRO HG3 1 1 3 3286 1 1 53 PRO N N -3.068 2.511 -13.810 0.60 . A A . 53 PRO N 1 1 3 3287 1 1 53 PRO O O -0.873 4.275 -13.726 1.60 . A A . 53 PRO O 1 1 3 3288 1 1 54 ALA C C 0.697 4.646 -16.301 0.90 . A A . 54 ALA C 1 1 3 3289 1 1 54 ALA CA C 1.129 3.228 -15.900 0.80 . A A . 54 ALA CA 1 1 3 3290 1 1 54 ALA CB C 1.078 2.298 -17.114 0.80 . A A . 54 ALA CB 1 1 3 3291 1 1 54 ALA H H 0.378 1.728 -14.531 1.40 . A A . 54 ALA H 1 1 3 3292 1 1 54 ALA HA H 2.142 3.273 -15.499 0.70 . A A . 54 ALA HA 1 1 3 3293 1 1 54 ALA HB1 H 2.079 2.101 -17.499 1.20 . A A . 54 ALA HB1 1 1 3 3294 1 1 54 ALA HB2 H 0.486 2.735 -17.918 1.40 . A A . 54 ALA HB2 1 1 3 3295 1 1 54 ALA HB3 H 0.631 1.340 -16.850 1.30 . A A . 54 ALA HB3 1 1 3 3296 1 1 54 ALA N N 0.296 2.667 -14.843 0.80 . A A . 54 ALA N 1 1 3 3297 1 1 54 ALA O O 0.043 5.369 -15.559 1.50 . A A . 54 ALA O 1 1 3 3298 1 1 55 ASP C C 1.312 7.315 -16.878 1.10 . A A . 55 ASP C 1 1 3 3299 1 1 55 ASP CA C 0.971 6.342 -18.006 1.20 . A A . 55 ASP CA 1 1 3 3300 1 1 55 ASP CB C -0.450 6.486 -18.540 1.40 . A A . 55 ASP CB 1 1 3 3301 1 1 55 ASP CG C -0.912 7.945 -18.545 2.10 . A A . 55 ASP CG 1 1 3 3302 1 1 55 ASP H H 1.502 4.310 -18.156 1.40 . A A . 55 ASP H 1 1 3 3303 1 1 55 ASP HA H 1.697 6.465 -18.810 1.30 . A A . 55 ASP HA 1 1 3 3304 1 1 55 ASP HB2 H -0.497 6.093 -19.556 1.80 . A A . 55 ASP HB2 1 1 3 3305 1 1 55 ASP HB3 H -1.119 5.880 -17.931 1.50 . A A . 55 ASP HB3 1 1 3 3306 1 1 55 ASP N N 1.128 4.986 -17.530 1.00 . A A . 55 ASP N 1 1 3 3307 1 1 55 ASP O O 0.513 8.129 -16.431 1.50 . A A . 55 ASP O 1 1 3 3308 1 1 55 ASP OD1 O -0.264 8.764 -19.195 2.60 . A A . 55 ASP OD1 1 1 3 3309 1 1 55 ASP OD2 O -1.915 8.245 -17.901 2.80 . A A . 55 ASP OD2 1 1 3 3310 1 1 56 CYS C C 2.998 9.545 -16.749 0.80 . A A . 56 CYS C 1 1 3 3311 1 1 56 CYS CA C 3.411 8.244 -16.064 0.80 . A A . 56 CYS CA 1 1 3 3312 1 1 56 CYS CB C 4.833 7.856 -16.439 0.90 . A A . 56 CYS CB 1 1 3 3313 1 1 56 CYS H H 3.083 6.282 -16.444 1.10 . A A . 56 CYS H 1 1 3 3314 1 1 56 CYS HA H 3.313 8.341 -14.984 0.70 . A A . 56 CYS HA 1 1 3 3315 1 1 56 CYS HB2 H 5.102 8.278 -17.412 1.00 . A A . 56 CYS HB2 1 1 3 3316 1 1 56 CYS HB3 H 5.469 8.282 -15.680 0.90 . A A . 56 CYS HB3 1 1 3 3317 1 1 56 CYS N N 2.577 7.143 -16.454 0.90 . A A . 56 CYS N 1 1 3 3318 1 1 56 CYS O O 2.363 9.564 -17.796 1.10 . A A . 56 CYS O 1 1 3 3319 1 1 56 CYS SG S 5.141 6.067 -16.439 1.30 . A A . 56 CYS SG 1 1 3 3320 1 1 57 ASP C C 2.808 12.857 -15.313 0.90 . A A . 57 ASP C 1 1 3 3321 1 1 57 ASP CA C 2.430 11.378 -15.317 1.00 . A A . 57 ASP CA 1 1 3 3322 1 1 57 ASP CB C 2.372 10.859 -13.883 1.10 . A A . 57 ASP CB 1 1 3 3323 1 1 57 ASP CG C 1.008 11.182 -13.269 1.60 . A A . 57 ASP CG 1 1 3 3324 1 1 57 ASP H H 4.388 10.834 -15.987 1.10 . A A . 57 ASP H 1 1 3 3325 1 1 57 ASP HA H 1.476 11.245 -15.829 1.20 . A A . 57 ASP HA 1 1 3 3326 1 1 57 ASP HB2 H 2.528 9.781 -13.861 1.10 . A A . 57 ASP HB2 1 1 3 3327 1 1 57 ASP HB3 H 3.155 11.320 -13.281 1.20 . A A . 57 ASP HB3 1 1 3 3328 1 1 57 ASP N N 3.414 10.625 -16.066 0.80 . A A . 57 ASP N 1 1 3 3329 1 1 57 ASP O O 3.899 13.249 -14.920 1.00 . A A . 57 ASP O 1 1 3 3330 1 1 57 ASP OD1 O -0.006 10.861 -13.888 2.20 . A A . 57 ASP OD1 1 1 3 3331 1 1 57 ASP OD2 O 0.974 11.751 -12.179 2.00 . A A . 57 ASP OD2 1 1 3 3332 1 1 58 PRO C C 3.177 15.196 -17.175 1.20 . A A . 58 PRO C 1 1 3 3333 1 1 58 PRO CA C 1.917 14.330 -17.062 1.20 . A A . 58 PRO CA 1 1 3 3334 1 1 58 PRO CB C 0.658 15.196 -17.150 1.40 . A A . 58 PRO CB 1 1 3 3335 1 1 58 PRO CD C 0.613 13.929 -15.031 1.30 . A A . 58 PRO CD 1 1 3 3336 1 1 58 PRO CG C -0.168 14.934 -15.882 1.50 . A A . 58 PRO CG 1 1 3 3337 1 1 58 PRO HA H 1.928 13.589 -17.861 1.30 . A A . 58 PRO HA 1 1 3 3338 1 1 58 PRO HB2 H 0.923 16.251 -17.224 1.50 . A A . 58 PRO HB2 1 1 3 3339 1 1 58 PRO HB3 H 0.082 14.938 -18.039 1.70 . A A . 58 PRO HB3 1 1 3 3340 1 1 58 PRO HD2 H 0.865 14.344 -14.054 1.30 . A A . 58 PRO HD2 1 1 3 3341 1 1 58 PRO HD3 H 0.048 13.008 -14.883 1.40 . A A . 58 PRO HD3 1 1 3 3342 1 1 58 PRO HG2 H -0.327 15.860 -15.329 1.50 . A A . 58 PRO HG2 1 1 3 3343 1 1 58 PRO HG3 H -1.148 14.533 -16.141 1.70 . A A . 58 PRO HG3 1 1 3 3344 1 1 58 PRO N N 1.826 13.654 -15.780 1.00 . A A . 58 PRO N 1 1 3 3345 1 1 58 PRO O O 3.780 15.318 -18.234 1.50 . A A . 58 PRO O 1 1 3 3346 1 1 59 ASN C C 6.006 15.905 -15.799 1.30 . A A . 59 ASN C 1 1 3 3347 1 1 59 ASN CA C 4.693 16.658 -16.020 1.30 . A A . 59 ASN CA 1 1 3 3348 1 1 59 ASN CB C 4.519 17.757 -14.971 1.50 . A A . 59 ASN CB 1 1 3 3349 1 1 59 ASN CG C 5.837 18.512 -14.786 1.90 . A A . 59 ASN CG 1 1 3 3350 1 1 59 ASN H H 3.028 15.600 -15.171 1.10 . A A . 59 ASN H 1 1 3 3351 1 1 59 ASN HA H 4.730 17.045 -17.020 1.50 . A A . 59 ASN HA 1 1 3 3352 1 1 59 ASN HB2 H 3.745 18.464 -15.279 1.70 . A A . 59 ASN HB2 1 1 3 3353 1 1 59 ASN HB3 H 4.235 17.314 -14.013 1.70 . A A . 59 ASN HB3 1 1 3 3354 1 1 59 ASN HD21 H 6.508 16.928 -13.701 2.10 . A A . 59 ASN HD21 1 1 3 3355 1 1 59 ASN HD22 H 7.469 18.390 -13.573 2.50 . A A . 59 ASN HD22 1 1 3 3356 1 1 59 ASN N N 3.534 15.780 -16.015 1.10 . A A . 59 ASN N 1 1 3 3357 1 1 59 ASN ND2 N 6.682 17.888 -13.944 2.00 . A A . 59 ASN ND2 1 1 3 3358 1 1 59 ASN O O 7.043 16.192 -16.385 1.70 . A A . 59 ASN O 1 1 3 3359 1 1 59 ASN OD1 O 6.065 19.569 -15.362 2.70 . A A . 59 ASN OD1 1 1 3 3360 1 1 60 THR C C 7.733 13.249 -14.775 0.90 . A A . 60 THR C 1 1 3 3361 1 1 60 THR CA C 7.005 14.453 -14.143 1.20 . A A . 60 THR CA 1 1 3 3362 1 1 60 THR CB C 6.572 14.113 -12.717 1.40 . A A . 60 THR CB 1 1 3 3363 1 1 60 THR CG2 C 5.633 15.170 -12.134 1.40 . A A . 60 THR CG2 1 1 3 3364 1 1 60 THR H H 4.892 14.698 -14.827 1.00 . A A . 60 THR H 1 1 3 3365 1 1 60 THR HA H 7.695 15.286 -14.171 1.40 . A A . 60 THR HA 1 1 3 3366 1 1 60 THR HB H 7.453 14.017 -12.081 1.90 . A A . 60 THR HB 1 1 3 3367 1 1 60 THR HG1 H 5.551 12.754 -11.853 2.30 . A A . 60 THR HG1 1 1 3 3368 1 1 60 THR HG21 H 4.725 15.255 -12.731 1.90 . A A . 60 THR HG21 1 1 3 3369 1 1 60 THR HG22 H 6.113 16.148 -12.108 1.80 . A A . 60 THR HG22 1 1 3 3370 1 1 60 THR HG23 H 5.347 14.909 -11.116 1.70 . A A . 60 THR HG23 1 1 3 3371 1 1 60 THR N N 5.859 14.926 -14.910 1.10 . A A . 60 THR N 1 1 3 3372 1 1 60 THR O O 8.818 12.871 -14.350 1.10 . A A . 60 THR O 1 1 3 3373 1 1 60 THR OG1 O 5.925 12.866 -12.717 2.10 . A A . 60 THR OG1 1 1 3 3374 1 1 61 GLN C C 7.929 10.485 -15.090 0.90 . A A . 61 GLN C 1 1 3 3375 1 1 61 GLN CA C 7.324 11.317 -16.232 0.80 . A A . 61 GLN CA 1 1 3 3376 1 1 61 GLN CB C 8.205 11.330 -17.485 1.00 . A A . 61 GLN CB 1 1 3 3377 1 1 61 GLN CD C 7.320 11.874 -19.771 1.90 . A A . 61 GLN CD 1 1 3 3378 1 1 61 GLN CG C 7.459 10.783 -18.704 1.40 . A A . 61 GLN CG 1 1 3 3379 1 1 61 GLN H H 6.466 13.328 -16.270 1.20 . A A . 61 GLN H 1 1 3 3380 1 1 61 GLN HA H 6.352 10.892 -16.472 0.70 . A A . 61 GLN HA 1 1 3 3381 1 1 61 GLN HB2 H 8.513 12.356 -17.684 1.60 . A A . 61 GLN HB2 1 1 3 3382 1 1 61 GLN HB3 H 9.122 10.760 -17.334 1.60 . A A . 61 GLN HB3 1 1 3 3383 1 1 61 GLN HE21 H 9.052 11.569 -20.799 2.80 . A A . 61 GLN HE21 1 1 3 3384 1 1 61 GLN HE22 H 7.585 11.508 -21.757 2.60 . A A . 61 GLN HE22 1 1 3 3385 1 1 61 GLN HG2 H 7.996 9.936 -19.131 1.80 . A A . 61 GLN HG2 1 1 3 3386 1 1 61 GLN HG3 H 6.464 10.440 -18.420 1.90 . A A . 61 GLN HG3 1 1 3 3387 1 1 61 GLN N N 7.083 12.692 -15.810 0.90 . A A . 61 GLN N 1 1 3 3388 1 1 61 GLN NE2 N 8.051 11.629 -20.874 2.40 . A A . 61 GLN NE2 1 1 3 3389 1 1 61 GLN O O 7.825 10.823 -13.918 1.50 . A A . 61 GLN O 1 1 3 3390 1 1 61 GLN OE1 O 6.605 12.854 -19.605 2.40 . A A . 61 GLN OE1 1 1 3 3391 1 1 62 ALA C C 7.550 8.012 -13.792 0.90 . A A . 62 ALA C 1 1 3 3392 1 1 62 ALA CA C 8.837 8.342 -14.545 1.00 . A A . 62 ALA CA 1 1 3 3393 1 1 62 ALA CB C 9.998 8.779 -13.642 1.30 . A A . 62 ALA CB 1 1 3 3394 1 1 62 ALA H H 9.000 9.395 -16.404 1.50 . A A . 62 ALA H 1 1 3 3395 1 1 62 ALA HA H 9.106 7.449 -15.083 1.20 . A A . 62 ALA HA 1 1 3 3396 1 1 62 ALA HB1 H 10.956 8.656 -14.148 1.70 . A A . 62 ALA HB1 1 1 3 3397 1 1 62 ALA HB2 H 10.021 8.188 -12.727 1.60 . A A . 62 ALA HB2 1 1 3 3398 1 1 62 ALA HB3 H 9.896 9.826 -13.360 1.70 . A A . 62 ALA HB3 1 1 3 3399 1 1 62 ALA N N 8.561 9.380 -15.512 1.00 . A A . 62 ALA N 1 1 3 3400 1 1 62 ALA O O 6.696 7.260 -14.245 1.80 . A A . 62 ALA O 1 1 3 3401 1 1 63 SER C C 5.455 7.457 -12.012 0.60 . A A . 63 SER C 1 1 3 3402 1 1 63 SER CA C 6.299 8.718 -11.815 0.50 . A A . 63 SER CA 1 1 3 3403 1 1 63 SER CB C 5.492 9.957 -12.204 0.60 . A A . 63 SER CB 1 1 3 3404 1 1 63 SER H H 8.408 9.030 -12.434 1.20 . A A . 63 SER H 1 1 3 3405 1 1 63 SER HA H 6.622 8.778 -10.775 0.50 . A A . 63 SER HA 1 1 3 3406 1 1 63 SER HB2 H 5.869 10.398 -13.126 1.20 . A A . 63 SER HB2 1 1 3 3407 1 1 63 SER HB3 H 4.443 9.707 -12.359 0.90 . A A . 63 SER HB3 1 1 3 3408 1 1 63 SER HG H 4.775 11.441 -11.245 1.60 . A A . 63 SER HG 1 1 3 3409 1 1 63 SER N N 7.508 8.641 -12.618 0.60 . A A . 63 SER N 1 1 3 3410 1 1 63 SER O O 4.245 7.507 -12.200 1.60 . A A . 63 SER O 1 1 3 3411 1 1 63 SER OG O 5.571 10.928 -11.191 1.30 . A A . 63 SER OG 1 1 3 3412 1 1 64 CYS C C 6.163 3.966 -11.396 0.50 . A A . 64 CYS C 1 1 3 3413 1 1 64 CYS CA C 5.519 5.071 -12.236 0.50 . A A . 64 CYS CA 1 1 3 3414 1 1 64 CYS CB C 5.614 4.746 -13.731 0.50 . A A . 64 CYS CB 1 1 3 3415 1 1 64 CYS H H 7.167 6.367 -11.771 1.40 . A A . 64 CYS H 1 1 3 3416 1 1 64 CYS HA H 4.480 5.198 -11.932 0.60 . A A . 64 CYS HA 1 1 3 3417 1 1 64 CYS HB2 H 6.560 5.110 -14.132 0.70 . A A . 64 CYS HB2 1 1 3 3418 1 1 64 CYS HB3 H 5.609 3.664 -13.872 0.70 . A A . 64 CYS HB3 1 1 3 3419 1 1 64 CYS N N 6.185 6.329 -11.957 0.60 . A A . 64 CYS N 1 1 3 3420 1 1 64 CYS O O 6.987 3.192 -11.866 1.10 . A A . 64 CYS O 1 1 3 3421 1 1 64 CYS SG S 4.255 5.457 -14.700 1.30 . A A . 64 CYS SG 1 1 3 3422 1 1 65 GLU C C 7.469 3.153 -8.466 1.00 . A A . 65 GLU C 1 1 3 3423 1 1 65 GLU CA C 6.654 4.320 -9.056 1.10 . A A . 65 GLU CA 1 1 3 3424 1 1 65 GLU CB C 5.857 4.973 -7.936 1.30 . A A . 65 GLU CB 1 1 3 3425 1 1 65 GLU CD C 7.165 7.112 -7.871 1.90 . A A . 65 GLU CD 1 1 3 3426 1 1 65 GLU CG C 6.718 5.887 -7.070 1.50 . A A . 65 GLU CG 1 1 3 3427 1 1 65 GLU H H 4.782 3.702 -9.909 1.60 . A A . 65 GLU H 1 1 3 3428 1 1 65 GLU HA H 7.358 4.989 -9.528 1.30 . A A . 65 GLU HA 1 1 3 3429 1 1 65 GLU HB2 H 5.027 5.520 -8.378 1.50 . A A . 65 GLU HB2 1 1 3 3430 1 1 65 GLU HB3 H 5.415 4.197 -7.310 1.30 . A A . 65 GLU HB3 1 1 3 3431 1 1 65 GLU HG2 H 6.157 6.215 -6.196 1.70 . A A . 65 GLU HG2 1 1 3 3432 1 1 65 GLU HG3 H 7.599 5.348 -6.719 1.70 . A A . 65 GLU HG3 1 1 3 3433 1 1 65 GLU N N 5.726 3.953 -10.123 1.00 . A A . 65 GLU N 1 1 3 3434 1 1 65 GLU O O 8.365 3.335 -7.651 1.10 . A A . 65 GLU O 1 1 3 3435 1 1 65 GLU OE1 O 6.339 7.992 -8.106 2.40 . A A . 65 GLU OE1 1 1 3 3436 1 1 65 GLU OE2 O 8.333 7.170 -8.251 1.90 . A A . 65 GLU OE2 1 1 3 3437 1 1 66 CYS C C 8.507 0.255 -7.923 0.90 . A A . 66 CYS C 1 1 3 3438 1 1 66 CYS CA C 7.087 0.768 -8.154 1.00 . A A . 66 CYS CA 1 1 3 3439 1 1 66 CYS CB C 6.268 -0.250 -8.939 1.20 . A A . 66 CYS CB 1 1 3 3440 1 1 66 CYS H H 6.474 1.974 -9.717 1.10 . A A . 66 CYS H 1 1 3 3441 1 1 66 CYS HA H 6.619 1.016 -7.201 1.10 . A A . 66 CYS HA 1 1 3 3442 1 1 66 CYS HB2 H 6.936 -1.014 -9.331 1.20 . A A . 66 CYS HB2 1 1 3 3443 1 1 66 CYS HB3 H 5.580 -0.700 -8.245 1.50 . A A . 66 CYS HB3 1 1 3 3444 1 1 66 CYS N N 7.092 1.965 -8.939 1.00 . A A . 66 CYS N 1 1 3 3445 1 1 66 CYS O O 9.444 0.562 -8.649 1.10 . A A . 66 CYS O 1 1 3 3446 1 1 66 CYS SG S 5.265 0.399 -10.304 1.70 . A A . 66 CYS SG 1 1 3 3447 1 1 67 PRO C C 10.872 -0.315 -5.942 0.90 . A A . 67 PRO C 1 1 3 3448 1 1 67 PRO CA C 9.373 -0.229 -5.673 0.90 . A A . 67 PRO CA 1 1 3 3449 1 1 67 PRO CB C 8.909 -1.219 -4.595 0.90 . A A . 67 PRO CB 1 1 3 3450 1 1 67 PRO CD C 7.821 -1.786 -6.738 0.80 . A A . 67 PRO CD 1 1 3 3451 1 1 67 PRO CG C 8.073 -2.290 -5.312 0.80 . A A . 67 PRO CG 1 1 3 3452 1 1 67 PRO HA H 9.162 0.775 -5.353 1.10 . A A . 67 PRO HA 1 1 3 3453 1 1 67 PRO HB2 H 9.751 -1.663 -4.055 1.00 . A A . 67 PRO HB2 1 1 3 3454 1 1 67 PRO HB3 H 8.280 -0.694 -3.870 0.80 . A A . 67 PRO HB3 1 1 3 3455 1 1 67 PRO HD2 H 8.150 -2.505 -7.489 0.70 . A A . 67 PRO HD2 1 1 3 3456 1 1 67 PRO HD3 H 6.764 -1.577 -6.904 0.90 . A A . 67 PRO HD3 1 1 3 3457 1 1 67 PRO HG2 H 8.606 -3.241 -5.330 0.80 . A A . 67 PRO HG2 1 1 3 3458 1 1 67 PRO HG3 H 7.130 -2.451 -4.790 1.00 . A A . 67 PRO HG3 1 1 3 3459 1 1 67 PRO N N 8.590 -0.558 -6.850 0.80 . A A . 67 PRO N 1 1 3 3460 1 1 67 PRO O O 11.565 0.666 -6.183 1.30 . A A . 67 PRO O 1 1 3 3461 1 1 68 GLU C C 13.711 -1.494 -6.482 1.10 . A A . 68 GLU C 1 1 3 3462 1 1 68 GLU CA C 12.652 -1.805 -5.408 1.20 . A A . 68 GLU CA 1 1 3 3463 1 1 68 GLU CB C 12.792 -3.262 -4.968 1.50 . A A . 68 GLU CB 1 1 3 3464 1 1 68 GLU CD C 13.215 -4.842 -3.071 2.80 . A A . 68 GLU CD 1 1 3 3465 1 1 68 GLU CG C 12.993 -3.378 -3.457 2.10 . A A . 68 GLU CG 1 1 3 3466 1 1 68 GLU H H 10.486 -2.108 -5.584 1.60 . A A . 68 GLU H 1 1 3 3467 1 1 68 GLU HA H 12.789 -1.155 -4.547 1.30 . A A . 68 GLU HA 1 1 3 3468 1 1 68 GLU HB2 H 11.902 -3.819 -5.261 1.90 . A A . 68 GLU HB2 1 1 3 3469 1 1 68 GLU HB3 H 13.632 -3.723 -5.486 1.90 . A A . 68 GLU HB3 1 1 3 3470 1 1 68 GLU HG2 H 13.855 -2.793 -3.137 2.40 . A A . 68 GLU HG2 1 1 3 3471 1 1 68 GLU HG3 H 12.120 -3.000 -2.924 2.50 . A A . 68 GLU HG3 1 1 3 3472 1 1 68 GLU N N 11.285 -1.581 -5.855 1.20 . A A . 68 GLU N 1 1 3 3473 1 1 68 GLU O O 14.866 -1.883 -6.353 1.20 . A A . 68 GLU O 1 1 3 3474 1 1 68 GLU OE1 O 12.679 -5.716 -3.751 3.40 . A A . 68 GLU OE1 1 1 3 3475 1 1 68 GLU OE2 O 13.921 -5.091 -2.095 3.30 . A A . 68 GLU OE2 1 1 3 3476 1 1 69 GLY C C 12.708 -1.390 -9.850 1.20 . A A . 69 GLY C 1 1 3 3477 1 1 69 GLY CA C 13.821 -1.101 -8.837 1.50 . A A . 69 GLY CA 1 1 3 3478 1 1 69 GLY H H 12.587 -0.070 -7.393 1.40 . A A . 69 GLY H 1 1 3 3479 1 1 69 GLY HA2 H 14.444 -0.266 -9.157 1.80 . A A . 69 GLY HA2 1 1 3 3480 1 1 69 GLY HA3 H 14.440 -1.993 -8.711 1.70 . A A . 69 GLY HA3 1 1 3 3481 1 1 69 GLY N N 13.271 -0.783 -7.534 1.20 . A A . 69 GLY N 1 1 3 3482 1 1 69 GLY O O 12.768 -2.368 -10.584 1.40 . A A . 69 GLY O 1 1 3 3483 1 1 70 TYR C C 12.219 0.495 -12.142 0.80 . A A . 70 TYR C 1 1 3 3484 1 1 70 TYR CA C 11.512 0.617 -10.771 0.80 . A A . 70 TYR CA 1 1 3 3485 1 1 70 TYR CB C 11.913 1.932 -10.095 0.60 . A A . 70 TYR CB 1 1 3 3486 1 1 70 TYR CD1 C 14.405 1.879 -10.660 1.50 . A A . 70 TYR CD1 1 1 3 3487 1 1 70 TYR CD2 C 13.696 1.990 -8.278 1.30 . A A . 70 TYR CD2 1 1 3 3488 1 1 70 TYR CE1 C 15.783 1.849 -10.251 1.70 . A A . 70 TYR CE1 1 1 3 3489 1 1 70 TYR CE2 C 15.074 1.962 -7.865 1.40 . A A . 70 TYR CE2 1 1 3 3490 1 1 70 TYR CG C 13.353 1.939 -9.676 0.70 . A A . 70 TYR CG 1 1 3 3491 1 1 70 TYR CZ C 16.118 1.889 -8.852 1.10 . A A . 70 TYR CZ 1 1 3 3492 1 1 70 TYR H H 10.947 -0.656 -9.180 1.00 . A A . 70 TYR H 1 1 3 3493 1 1 70 TYR HA H 10.440 0.642 -10.968 0.90 . A A . 70 TYR HA 1 1 3 3494 1 1 70 TYR HB2 H 11.740 2.768 -10.773 0.60 . A A . 70 TYR HB2 1 1 3 3495 1 1 70 TYR HB3 H 11.292 2.103 -9.216 0.60 . A A . 70 TYR HB3 1 1 3 3496 1 1 70 TYR HD1 H 14.166 1.864 -11.712 2.30 . A A . 70 TYR HD1 1 1 3 3497 1 1 70 TYR HD2 H 12.914 2.049 -7.535 2.10 . A A . 70 TYR HD2 1 1 3 3498 1 1 70 TYR HE1 H 16.565 1.791 -10.994 2.50 . A A . 70 TYR HE1 1 1 3 3499 1 1 70 TYR HE2 H 15.324 1.992 -6.815 2.10 . A A . 70 TYR HE2 1 1 3 3500 1 1 70 TYR HH H 17.896 2.606 -8.813 1.50 . A A . 70 TYR HH 1 1 3 3501 1 1 70 TYR N N 11.683 -0.507 -9.842 0.90 . A A . 70 TYR N 1 1 3 3502 1 1 70 TYR O O 12.377 1.488 -12.843 1.10 . A A . 70 TYR O 1 1 3 3503 1 1 70 TYR OH O 17.439 1.855 -8.457 1.30 . A A . 70 TYR OH 1 1 3 3504 1 1 71 ILE C C 10.702 -1.924 -13.414 0.90 . A A . 71 ILE C 1 1 3 3505 1 1 71 ILE CA C 12.075 -1.322 -13.718 1.00 . A A . 71 ILE CA 1 1 3 3506 1 1 71 ILE CB C 13.046 -2.386 -14.233 1.20 . A A . 71 ILE CB 1 1 3 3507 1 1 71 ILE CD1 C 15.479 -2.582 -14.910 1.80 . A A . 71 ILE CD1 1 1 3 3508 1 1 71 ILE CG1 C 14.209 -1.735 -14.981 1.40 . A A . 71 ILE CG1 1 1 3 3509 1 1 71 ILE CG2 C 12.339 -3.409 -15.123 1.80 . A A . 71 ILE CG2 1 1 3 3510 1 1 71 ILE H H 13.272 -1.242 -11.952 1.10 . A A . 71 ILE H 1 1 3 3511 1 1 71 ILE HA H 11.964 -0.509 -14.436 1.20 . A A . 71 ILE HA 1 1 3 3512 1 1 71 ILE HB H 13.455 -2.909 -13.368 1.70 . A A . 71 ILE HB 1 1 3 3513 1 1 71 ILE HD11 H 15.255 -3.634 -15.089 2.20 . A A . 71 ILE HD11 1 1 3 3514 1 1 71 ILE HD12 H 15.949 -2.499 -13.930 2.30 . A A . 71 ILE HD12 1 1 3 3515 1 1 71 ILE HD13 H 16.204 -2.261 -15.659 2.10 . A A . 71 ILE HD13 1 1 3 3516 1 1 71 ILE HG12 H 13.931 -1.581 -16.024 1.60 . A A . 71 ILE HG12 1 1 3 3517 1 1 71 ILE HG13 H 14.405 -0.748 -14.562 1.70 . A A . 71 ILE HG13 1 1 3 3518 1 1 71 ILE HG21 H 13.008 -3.771 -15.904 2.30 . A A . 71 ILE HG21 1 1 3 3519 1 1 71 ILE HG22 H 11.464 -2.971 -15.603 2.20 . A A . 71 ILE HG22 1 1 3 3520 1 1 71 ILE HG23 H 12.008 -4.269 -14.539 2.20 . A A . 71 ILE HG23 1 1 3 3521 1 1 71 ILE N N 12.613 -0.737 -12.508 0.90 . A A . 71 ILE N 1 1 3 3522 1 1 71 ILE O O 10.489 -3.129 -13.454 0.90 . A A . 71 ILE O 1 1 3 3523 1 1 72 LEU C C 8.360 -1.733 -14.933 0.80 . A A . 72 LEU C 1 1 3 3524 1 1 72 LEU CA C 8.879 -0.532 -14.135 0.80 . A A . 72 LEU CA 1 1 3 3525 1 1 72 LEU CB C 9.614 0.432 -15.075 0.80 . A A . 72 LEU CB 1 1 3 3526 1 1 72 LEU CD1 C 7.325 1.461 -15.192 0.60 . A A . 72 LEU CD1 1 1 3 3527 1 1 72 LEU CD2 C 9.355 2.857 -15.719 0.70 . A A . 72 LEU CD2 1 1 3 3528 1 1 72 LEU CG C 8.730 1.463 -15.774 0.70 . A A . 72 LEU CG 1 1 3 3529 1 1 72 LEU H H 9.839 -0.506 -12.226 0.90 . A A . 72 LEU H 1 1 3 3530 1 1 72 LEU HA H 8.049 -0.076 -13.598 0.80 . A A . 72 LEU HA 1 1 3 3531 1 1 72 LEU HB2 H 10.413 0.938 -14.536 1.00 . A A . 72 LEU HB2 1 1 3 3532 1 1 72 LEU HB3 H 10.081 -0.155 -15.857 1.00 . A A . 72 LEU HB3 1 1 3 3533 1 1 72 LEU HD11 H 6.688 2.181 -15.701 1.10 . A A . 72 LEU HD11 1 1 3 3534 1 1 72 LEU HD12 H 7.359 1.709 -14.132 1.10 . A A . 72 LEU HD12 1 1 3 3535 1 1 72 LEU HD13 H 6.881 0.472 -15.295 1.20 . A A . 72 LEU HD13 1 1 3 3536 1 1 72 LEU HD21 H 10.169 2.893 -14.996 1.40 . A A . 72 LEU HD21 1 1 3 3537 1 1 72 LEU HD22 H 8.616 3.605 -15.434 1.20 . A A . 72 LEU HD22 1 1 3 3538 1 1 72 LEU HD23 H 9.758 3.139 -16.692 1.20 . A A . 72 LEU HD23 1 1 3 3539 1 1 72 LEU HG H 8.657 1.174 -16.823 0.70 . A A . 72 LEU HG 1 1 3 3540 1 1 72 LEU N N 9.792 -0.984 -13.103 0.80 . A A . 72 LEU N 1 1 3 3541 1 1 72 LEU O O 9.118 -2.484 -15.535 0.90 . A A . 72 LEU O 1 1 3 3542 1 1 73 ASP C C 4.977 -3.134 -14.601 1.20 . A A . 73 ASP C 1 1 3 3543 1 1 73 ASP CA C 6.459 -3.019 -14.241 1.00 . A A . 73 ASP CA 1 1 3 3544 1 1 73 ASP CB C 6.627 -2.893 -12.726 1.50 . A A . 73 ASP CB 1 1 3 3545 1 1 73 ASP CG C 7.342 -4.130 -12.179 2.00 . A A . 73 ASP CG 1 1 3 3546 1 1 73 ASP H H 6.431 -1.167 -15.314 0.80 . A A . 73 ASP H 1 1 3 3547 1 1 73 ASP HA H 6.996 -3.885 -14.627 1.20 . A A . 73 ASP HA 1 1 3 3548 1 1 73 ASP HB2 H 7.210 -2.006 -12.474 1.90 . A A . 73 ASP HB2 1 1 3 3549 1 1 73 ASP HB3 H 5.657 -2.801 -12.238 1.90 . A A . 73 ASP HB3 1 1 3 3550 1 1 73 ASP N N 7.022 -1.856 -14.894 0.90 . A A . 73 ASP N 1 1 3 3551 1 1 73 ASP O O 4.308 -2.153 -14.898 1.70 . A A . 73 ASP O 1 1 3 3552 1 1 73 ASP OD1 O 6.720 -5.190 -12.123 2.30 . A A . 73 ASP OD1 1 1 3 3553 1 1 73 ASP OD2 O 8.512 -4.020 -11.816 2.80 . A A . 73 ASP OD2 1 1 3 3554 1 1 74 ASP C C 3.172 -4.013 -16.554 1.40 . A A . 74 ASP C 1 1 3 3555 1 1 74 ASP CA C 3.977 -5.024 -15.736 1.80 . A A . 74 ASP CA 1 1 3 3556 1 1 74 ASP CB C 3.079 -6.196 -15.339 2.60 . A A . 74 ASP CB 1 1 3 3557 1 1 74 ASP CG C 3.432 -7.426 -16.179 3.20 . A A . 74 ASP CG 1 1 3 3558 1 1 74 ASP H H 4.666 -4.929 -13.711 1.40 . A A . 74 ASP H 1 1 3 3559 1 1 74 ASP HA H 4.831 -5.377 -16.315 2.30 . A A . 74 ASP HA 1 1 3 3560 1 1 74 ASP HB2 H 3.205 -6.440 -14.284 3.00 . A A . 74 ASP HB2 1 1 3 3561 1 1 74 ASP HB3 H 2.030 -5.948 -15.500 3.10 . A A . 74 ASP HB3 1 1 3 3562 1 1 74 ASP N N 4.520 -4.398 -14.543 1.30 . A A . 74 ASP N 1 1 3 3563 1 1 74 ASP O O 1.948 -4.033 -16.590 1.80 . A A . 74 ASP O 1 1 3 3564 1 1 74 ASP OD1 O 4.322 -8.175 -15.780 3.60 . A A . 74 ASP OD1 1 1 3 3565 1 1 74 ASP OD2 O 2.813 -7.621 -17.223 3.70 . A A . 74 ASP OD2 1 1 3 3566 1 1 75 GLY C C 4.122 -1.072 -18.510 1.10 . A A . 75 GLY C 1 1 3 3567 1 1 75 GLY CA C 3.387 -2.388 -18.314 1.10 . A A . 75 GLY CA 1 1 3 3568 1 1 75 GLY H H 4.881 -2.953 -16.883 1.30 . A A . 75 GLY H 1 1 3 3569 1 1 75 GLY HA2 H 3.509 -2.989 -19.189 1.50 . A A . 75 GLY HA2 1 1 3 3570 1 1 75 GLY HA3 H 2.329 -2.218 -18.107 1.30 . A A . 75 GLY HA3 1 1 3 3571 1 1 75 GLY N N 3.951 -3.132 -17.202 1.00 . A A . 75 GLY N 1 1 3 3572 1 1 75 GLY O O 4.643 -0.723 -19.563 1.40 . A A . 75 GLY O 1 1 3 3573 1 1 76 PHE C C 4.337 1.537 -15.856 0.80 . A A . 76 PHE C 1 1 3 3574 1 1 76 PHE CA C 4.791 0.854 -17.162 0.90 . A A . 76 PHE CA 1 1 3 3575 1 1 76 PHE CB C 4.530 1.792 -18.344 1.00 . A A . 76 PHE CB 1 1 3 3576 1 1 76 PHE CD1 C 6.651 3.200 -18.156 2.00 . A A . 76 PHE CD1 1 1 3 3577 1 1 76 PHE CD2 C 6.184 1.982 -20.275 1.80 . A A . 76 PHE CD2 1 1 3 3578 1 1 76 PHE CE1 C 7.876 3.708 -18.716 2.70 . A A . 76 PHE CE1 1 1 3 3579 1 1 76 PHE CE2 C 7.401 2.499 -20.843 2.50 . A A . 76 PHE CE2 1 1 3 3580 1 1 76 PHE CG C 5.804 2.329 -18.930 1.20 . A A . 76 PHE CG 1 1 3 3581 1 1 76 PHE CZ C 8.248 3.361 -20.061 2.80 . A A . 76 PHE CZ 1 1 3 3582 1 1 76 PHE H H 3.660 -0.973 -16.655 1.00 . A A . 76 PHE H 1 1 3 3583 1 1 76 PHE HA H 5.850 0.604 -17.085 0.80 . A A . 76 PHE HA 1 1 3 3584 1 1 76 PHE HB2 H 3.968 1.278 -19.123 1.60 . A A . 76 PHE HB2 1 1 3 3585 1 1 76 PHE HB3 H 3.921 2.636 -18.021 1.30 . A A . 76 PHE HB3 1 1 3 3586 1 1 76 PHE HD1 H 6.359 3.494 -17.159 2.50 . A A . 76 PHE HD1 1 1 3 3587 1 1 76 PHE HD2 H 5.550 1.337 -20.863 2.30 . A A . 76 PHE HD2 1 1 3 3588 1 1 76 PHE HE1 H 8.520 4.343 -18.125 3.50 . A A . 76 PHE HE1 1 1 3 3589 1 1 76 PHE HE2 H 7.674 2.249 -21.857 3.20 . A A . 76 PHE HE2 1 1 3 3590 1 1 76 PHE HZ H 9.162 3.750 -20.487 3.50 . A A . 76 PHE HZ 1 1 3 3591 1 1 76 PHE N N 4.096 -0.410 -17.362 0.90 . A A . 76 PHE N 1 1 3 3592 1 1 76 PHE O O 4.359 2.755 -15.738 0.80 . A A . 76 PHE O 1 1 3 3593 1 1 77 ILE C C 2.634 2.137 -13.449 0.70 . A A . 77 ILE C 1 1 3 3594 1 1 77 ILE CA C 2.615 0.880 -14.330 0.80 . A A . 77 ILE CA 1 1 3 3595 1 1 77 ILE CB C 2.247 -0.410 -13.606 0.90 . A A . 77 ILE CB 1 1 3 3596 1 1 77 ILE CD1 C 0.374 -1.954 -12.891 1.20 . A A . 77 ILE CD1 1 1 3 3597 1 1 77 ILE CG1 C 0.753 -0.534 -13.313 1.10 . A A . 77 ILE CG1 1 1 3 3598 1 1 77 ILE CG2 C 3.128 -0.626 -12.387 0.90 . A A . 77 ILE CG2 1 1 3 3599 1 1 77 ILE H H 4.262 -0.261 -15.013 0.80 . A A . 77 ILE H 1 1 3 3600 1 1 77 ILE HA H 1.905 0.964 -15.147 0.80 . A A . 77 ILE HA 1 1 3 3601 1 1 77 ILE HB H 2.467 -1.217 -14.299 0.90 . A A . 77 ILE HB 1 1 3 3602 1 1 77 ILE HD11 H -0.600 -2.234 -13.294 1.50 . A A . 77 ILE HD11 1 1 3 3603 1 1 77 ILE HD12 H 0.326 -2.036 -11.806 1.60 . A A . 77 ILE HD12 1 1 3 3604 1 1 77 ILE HD13 H 1.109 -2.674 -13.251 1.70 . A A . 77 ILE HD13 1 1 3 3605 1 1 77 ILE HG12 H 0.466 0.161 -12.534 1.30 . A A . 77 ILE HG12 1 1 3 3606 1 1 77 ILE HG13 H 0.184 -0.253 -14.200 1.10 . A A . 77 ILE HG13 1 1 3 3607 1 1 77 ILE HG21 H 3.788 0.230 -12.249 1.10 . A A . 77 ILE HG21 1 1 3 3608 1 1 77 ILE HG22 H 3.750 -1.510 -12.533 1.40 . A A . 77 ILE HG22 1 1 3 3609 1 1 77 ILE HG23 H 2.526 -0.764 -11.491 1.40 . A A . 77 ILE HG23 1 1 3 3610 1 1 77 ILE N N 3.930 0.674 -14.901 0.80 . A A . 77 ILE N 1 1 3 3611 1 1 77 ILE O O 3.463 3.023 -13.618 0.80 . A A . 77 ILE O 1 1 3 3612 1 1 78 CYS C C 0.922 2.931 -10.338 0.70 . A A . 78 CYS C 1 1 3 3613 1 1 78 CYS CA C 1.975 2.121 -11.098 0.50 . A A . 78 CYS CA 1 1 3 3614 1 1 78 CYS CB C 3.367 2.674 -10.766 0.40 . A A . 78 CYS CB 1 1 3 3615 1 1 78 CYS H H 0.719 2.104 -12.825 0.50 . A A . 78 CYS H 1 1 3 3616 1 1 78 CYS HA H 1.897 1.074 -10.805 0.60 . A A . 78 CYS HA 1 1 3 3617 1 1 78 CYS HB2 H 4.060 2.596 -11.601 0.70 . A A . 78 CYS HB2 1 1 3 3618 1 1 78 CYS HB3 H 3.291 3.734 -10.522 0.70 . A A . 78 CYS HB3 1 1 3 3619 1 1 78 CYS N N 1.668 2.167 -12.519 0.50 . A A . 78 CYS N 1 1 3 3620 1 1 78 CYS O O 0.225 2.431 -9.463 1.70 . A A . 78 CYS O 1 1 3 3621 1 1 78 CYS SG S 4.116 1.805 -9.371 1.00 . A A . 78 CYS SG 1 1 3 3622 1 1 79 THR C C -1.205 5.482 -10.552 0.90 . A A . 79 THR C 1 1 3 3623 1 1 79 THR CA C 0.153 5.173 -9.918 0.70 . A A . 79 THR CA 1 1 3 3624 1 1 79 THR CB C 0.978 6.456 -9.789 0.90 . A A . 79 THR CB 1 1 3 3625 1 1 79 THR CG2 C 0.896 7.049 -8.382 1.60 . A A . 79 THR CG2 1 1 3 3626 1 1 79 THR H H 1.317 4.499 -11.586 1.30 . A A . 79 THR H 1 1 3 3627 1 1 79 THR HA H 0.003 4.701 -8.947 0.80 . A A . 79 THR HA 1 1 3 3628 1 1 79 THR HB H 0.620 7.189 -10.513 0.70 . A A . 79 THR HB 1 1 3 3629 1 1 79 THR HG1 H 2.742 5.923 -9.295 2.00 . A A . 79 THR HG1 1 1 3 3630 1 1 79 THR HG21 H 0.541 6.308 -7.667 2.00 . A A . 79 THR HG21 1 1 3 3631 1 1 79 THR HG22 H 0.213 7.897 -8.357 2.20 . A A . 79 THR HG22 1 1 3 3632 1 1 79 THR HG23 H 1.875 7.396 -8.051 2.10 . A A . 79 THR HG23 1 1 3 3633 1 1 79 THR N N 0.866 4.214 -10.740 0.70 . A A . 79 THR N 1 1 3 3634 1 1 79 THR O O -1.347 6.375 -11.378 1.50 . A A . 79 THR O 1 1 3 3635 1 1 79 THR OG1 O 2.321 6.187 -10.102 1.70 . A A . 79 THR OG1 1 1 3 3636 1 1 80 ASP C C -3.073 6.430 -8.643 1.10 . A A . 80 ASP C 1 1 3 3637 1 1 80 ASP CA C -3.409 5.282 -9.609 1.20 . A A . 80 ASP CA 1 1 3 3638 1 1 80 ASP CB C -4.253 4.205 -8.932 1.70 . A A . 80 ASP CB 1 1 3 3639 1 1 80 ASP CG C -5.688 4.699 -8.732 2.40 . A A . 80 ASP CG 1 1 3 3640 1 1 80 ASP H H -2.081 3.684 -10.118 0.80 . A A . 80 ASP H 1 1 3 3641 1 1 80 ASP HA H -3.932 5.679 -10.475 1.50 . A A . 80 ASP HA 1 1 3 3642 1 1 80 ASP HB2 H -4.275 3.300 -9.541 1.80 . A A . 80 ASP HB2 1 1 3 3643 1 1 80 ASP HB3 H -3.819 3.957 -7.965 2.10 . A A . 80 ASP HB3 1 1 3 3644 1 1 80 ASP N N -2.187 4.679 -10.105 0.80 . A A . 80 ASP N 1 1 3 3645 1 1 80 ASP O O -2.081 7.131 -8.799 1.90 . A A . 80 ASP O 1 1 3 3646 1 1 80 ASP OD1 O -6.423 4.778 -9.715 2.90 . A A . 80 ASP OD1 1 1 3 3647 1 1 80 ASP OD2 O -6.053 4.999 -7.596 2.90 . A A . 80 ASP OD2 1 1 3 3648 1 1 81 ILE C C -5.272 8.120 -9.026 1.60 . A A . 81 ILE C 1 1 3 3649 1 1 81 ILE CA C -4.814 7.752 -7.611 1.30 . A A . 81 ILE CA 1 1 3 3650 1 1 81 ILE CB C -4.066 8.923 -6.972 1.70 . A A . 81 ILE CB 1 1 3 3651 1 1 81 ILE CD1 C -4.146 7.883 -4.666 3.00 . A A . 81 ILE CD1 1 1 3 3652 1 1 81 ILE CG1 C -3.251 8.456 -5.766 2.50 . A A . 81 ILE CG1 1 1 3 3653 1 1 81 ILE CG2 C -5.037 10.034 -6.570 1.90 . A A . 81 ILE CG2 1 1 3 3654 1 1 81 ILE H H -3.969 5.928 -6.879 1.50 . A A . 81 ILE H 1 1 3 3655 1 1 81 ILE HA H -5.688 7.477 -7.021 1.50 . A A . 81 ILE HA 1 1 3 3656 1 1 81 ILE HB H -3.375 9.329 -7.711 2.20 . A A . 81 ILE HB 1 1 3 3657 1 1 81 ILE HD11 H -4.115 8.508 -3.774 3.20 . A A . 81 ILE HD11 1 1 3 3658 1 1 81 ILE HD12 H -3.825 6.879 -4.387 3.40 . A A . 81 ILE HD12 1 1 3 3659 1 1 81 ILE HD13 H -5.182 7.824 -5.001 3.30 . A A . 81 ILE HD13 1 1 3 3660 1 1 81 ILE HG12 H -2.532 7.700 -6.082 2.70 . A A . 81 ILE HG12 1 1 3 3661 1 1 81 ILE HG13 H -2.672 9.291 -5.370 3.00 . A A . 81 ILE HG13 1 1 3 3662 1 1 81 ILE HG21 H -5.364 9.908 -5.538 2.20 . A A . 81 ILE HG21 1 1 3 3663 1 1 81 ILE HG22 H -5.923 10.028 -7.206 2.30 . A A . 81 ILE HG22 1 1 3 3664 1 1 81 ILE HG23 H -4.566 11.013 -6.656 2.30 . A A . 81 ILE HG23 1 1 3 3665 1 1 81 ILE N N -3.961 6.576 -7.641 1.00 . A A . 81 ILE N 1 1 3 3666 1 1 81 ILE O O -4.513 8.081 -9.987 2.40 . A A . 81 ILE O 1 1 3 3667 1 1 82 ASP C C -6.813 7.948 -11.442 2.70 . A A . 82 ASP C 1 1 3 3668 1 1 82 ASP CA C -7.100 8.966 -10.334 2.60 . A A . 82 ASP CA 1 1 3 3669 1 1 82 ASP CB C -6.470 10.321 -10.661 3.50 . A A . 82 ASP CB 1 1 3 3670 1 1 82 ASP CG C -7.486 11.220 -11.371 3.90 . A A . 82 ASP CG 1 1 3 3671 1 1 82 ASP H H -7.148 8.414 -8.264 2.10 . A A . 82 ASP H 1 1 3 3672 1 1 82 ASP HA H -8.177 9.056 -10.198 3.00 . A A . 82 ASP HA 1 1 3 3673 1 1 82 ASP HB2 H -6.134 10.817 -9.751 3.90 . A A . 82 ASP HB2 1 1 3 3674 1 1 82 ASP HB3 H -5.602 10.192 -11.308 3.90 . A A . 82 ASP HB3 1 1 3 3675 1 1 82 ASP N N -6.568 8.477 -9.076 1.90 . A A . 82 ASP N 1 1 3 3676 1 1 82 ASP O O -6.682 6.754 -11.202 3.30 . A A . 82 ASP O 1 1 3 3677 1 1 82 ASP OD1 O -8.634 10.805 -11.521 4.50 . A A . 82 ASP OD1 1 1 3 3678 1 1 82 ASP OD2 O -7.116 12.324 -11.765 4.20 . A A . 82 ASP OD2 1 1 3 3679 1 1 83 GLU C C -8.310 7.178 -13.958 1.00 . A A . 83 GLU C 1 1 3 3680 1 1 83 GLU CA C -7.925 8.578 -13.475 1.00 . A A . 83 GLU CA 1 1 3 3681 1 1 83 GLU CB C -7.682 9.504 -14.667 1.00 . A A . 83 GLU CB 1 1 3 3682 1 1 83 GLU CD C -8.413 9.208 -17.043 1.00 . A A . 83 GLU CD 1 1 3 3683 1 1 83 GLU CG C -8.876 9.536 -15.622 1.00 . A A . 83 GLU CG 1 1 3 3684 1 1 83 GLU H H -5.853 8.859 -13.002 1.00 . A A . 83 GLU H 1 1 3 3685 1 1 83 GLU HA H -8.712 8.967 -12.828 1.00 . A A . 83 GLU HA 1 1 3 3686 1 1 83 GLU HB2 H -7.475 10.513 -14.311 1.00 . A A . 83 GLU HB2 1 1 3 3687 1 1 83 GLU HB3 H -6.793 9.178 -15.207 1.00 . A A . 83 GLU HB3 1 1 3 3688 1 1 83 GLU HG2 H -9.630 8.810 -15.319 1.00 . A A . 83 GLU HG2 1 1 3 3689 1 1 83 GLU HG3 H -9.342 10.521 -15.621 1.00 . A A . 83 GLU HG3 1 1 3 3690 1 1 83 GLU N N -6.725 8.503 -12.665 1.00 . A A . 83 GLU N 1 1 3 3691 1 1 83 GLU O O -8.888 6.425 -13.176 1.00 . A A . 83 GLU O 1 1 3 3692 1 1 83 GLU OXT O -8.027 6.857 -15.111 1.00 . A A . 83 GLU OXT 1 1 3 3693 1 1 83 GLU OE1 O -7.337 9.663 -17.429 1.00 . A A . 83 GLU OE1 1 1 3 3694 1 1 83 GLU OE2 O -9.133 8.503 -17.748 1.00 . A A . 83 GLU OE2 1 1 3 3695 2 2 1 NAG C1 C -14.564 1.218 6.533 1.00 . B A . 121 NAG C1 1 1 3 3696 2 2 1 NAG C2 C -14.365 2.396 7.487 1.00 . B A . 121 NAG C2 1 1 3 3697 2 2 1 NAG C3 C -15.584 3.318 7.529 1.00 . B A . 121 NAG C3 1 1 3 3698 2 2 1 NAG C4 C -16.150 3.576 6.132 1.00 . B A . 121 NAG C4 1 1 3 3699 2 2 1 NAG C5 C -16.238 2.290 5.308 1.00 . B A . 121 NAG C5 1 1 3 3700 2 2 1 NAG C6 C -16.709 2.563 3.879 1.00 . B A . 121 NAG C6 1 1 3 3701 2 2 1 NAG C7 C -13.175 2.508 9.565 1.00 . B A . 121 NAG C7 1 1 3 3702 2 2 1 NAG C8 C -11.959 1.625 9.843 1.00 . B A . 121 NAG C8 1 1 3 3703 2 2 1 NAG H1 H -15.307 0.522 6.923 1.00 . B A . 121 NAG H1 1 1 3 3704 2 2 1 NAG H2 H -13.475 2.961 7.210 1.00 . B A . 121 NAG H2 1 1 3 3705 2 2 1 NAG H3 H -16.355 2.870 8.155 1.00 . B A . 121 NAG H3 1 1 3 3706 2 2 1 NAG H4 H -15.520 4.298 5.613 1.00 . B A . 121 NAG H4 1 1 3 3707 2 2 1 NAG H5 H -16.935 1.604 5.790 1.00 . B A . 121 NAG H5 1 1 3 3708 2 2 1 NAG H61 H -17.586 3.210 3.877 1.00 . B A . 121 NAG H61 1 1 3 3709 2 2 1 NAG H62 H -16.973 1.634 3.374 1.00 . B A . 121 NAG H62 1 1 3 3710 2 2 1 NAG H81 H -12.013 0.721 9.237 1.00 . B A . 121 NAG H81 1 1 3 3711 2 2 1 NAG H82 H -11.042 2.162 9.600 1.00 . B A . 121 NAG H82 1 1 3 3712 2 2 1 NAG H83 H -11.940 1.349 10.897 1.00 . B A . 121 NAG H83 1 1 3 3713 2 2 1 NAG HN2 H -14.615 1.104 9.178 1.00 . B A . 121 NAG HN2 1 1 3 3714 2 2 1 NAG HO3 H -15.216 4.395 9.060 1.00 . B A . 121 NAG HO3 1 1 3 3715 2 2 1 NAG HO4 H -17.341 5.060 6.007 1.00 . B A . 121 NAG HO4 1 1 3 3716 2 2 1 NAG HO6 H -15.422 3.950 3.635 1.00 . B A . 121 NAG HO6 1 1 3 3717 2 2 1 NAG N2 N -14.110 1.890 8.821 1.00 . B A . 121 NAG N2 1 1 3 3718 2 2 1 NAG O3 O -15.227 4.540 8.123 1.00 . B A . 121 NAG O3 1 1 3 3719 2 2 1 NAG O4 O -17.429 4.147 6.245 1.00 . B A . 121 NAG O4 1 1 3 3720 2 2 1 NAG O5 O -14.969 1.683 5.269 1.00 . B A . 121 NAG O5 1 1 3 3721 2 2 1 NAG O6 O -15.698 3.194 3.134 1.00 . B A . 121 NAG O6 1 1 3 3722 2 2 1 NAG O7 O -13.258 3.653 9.993 1.00 . B A . 121 NAG O7 1 1 3 3723 3 2 1 NAG C1 C -1.655 -7.474 -5.448 1.00 . C A . 148 NAG C1 1 1 3 3724 3 2 1 NAG C2 C -2.841 -6.749 -4.818 1.00 . C A . 148 NAG C2 1 1 3 3725 3 2 1 NAG C3 C -3.604 -7.567 -3.766 1.00 . C A . 148 NAG C3 1 1 3 3726 3 2 1 NAG C4 C -2.775 -8.622 -3.020 1.00 . C A . 148 NAG C4 1 1 3 3727 3 2 1 NAG C5 C -1.516 -9.068 -3.767 1.00 . C A . 148 NAG C5 1 1 3 3728 3 2 1 NAG C6 C -1.220 -10.550 -3.536 1.00 . C A . 148 NAG C6 1 1 3 3729 3 2 1 NAG C7 C -1.620 -5.523 -3.128 1.00 . C A . 148 NAG C7 1 1 3 3730 3 2 1 NAG C8 C -1.497 -4.154 -2.455 1.00 . C A . 148 NAG C8 1 1 3 3731 3 2 1 NAG H1 H -0.720 -7.039 -5.097 1.00 . C A . 148 NAG H1 1 1 3 3732 3 2 1 NAG H2 H -3.534 -6.452 -5.606 1.00 . C A . 148 NAG H2 1 1 3 3733 3 2 1 NAG H3 H -4.033 -6.880 -3.037 1.00 . C A . 148 NAG H3 1 1 3 3734 3 2 1 NAG H4 H -3.403 -9.498 -2.858 1.00 . C A . 148 NAG H4 1 1 3 3735 3 2 1 NAG H5 H -0.661 -8.483 -3.431 1.00 . C A . 148 NAG H5 1 1 3 3736 3 2 1 NAG H61 H -1.205 -10.784 -2.471 1.00 . C A . 148 NAG H61 1 1 3 3737 3 2 1 NAG H62 H -0.251 -10.824 -3.954 1.00 . C A . 148 NAG H62 1 1 3 3738 3 2 1 NAG H81 H -0.843 -3.504 -3.034 1.00 . C A . 148 NAG H81 1 1 3 3739 3 2 1 NAG H82 H -2.474 -3.680 -2.360 1.00 . C A . 148 NAG H82 1 1 3 3740 3 2 1 NAG H83 H -1.068 -4.280 -1.465 1.00 . C A . 148 NAG H83 1 1 3 3741 3 2 1 NAG HN2 H -2.532 -4.643 -4.728 1.00 . C A . 148 NAG HN2 1 1 3 3742 3 2 1 NAG HO3 H -4.311 -8.906 -4.923 1.00 . C A . 148 NAG HO3 1 1 3 3743 3 2 1 NAG HO4 H -2.837 -8.719 -1.117 1.00 . C A . 148 NAG HO4 1 1 3 3744 3 2 1 NAG HO6 H -2.119 -11.215 -5.081 1.00 . C A . 148 NAG HO6 1 1 3 3745 3 2 1 NAG N2 N -2.371 -5.501 -4.244 1.00 . C A . 148 NAG N2 1 1 3 3746 3 2 1 NAG O3 O -4.682 -8.211 -4.396 1.00 . C A . 148 NAG O3 1 1 3 3747 3 2 1 NAG O4 O -2.428 -8.140 -1.747 1.00 . C A . 148 NAG O4 1 1 3 3748 3 2 1 NAG O5 O -1.695 -8.844 -5.141 1.00 . C A . 148 NAG O5 1 1 3 3749 3 2 1 NAG O6 O -2.199 -11.351 -4.146 1.00 . C A . 148 NAG O6 1 1 3 3750 3 2 1 NAG O7 O -1.062 -6.512 -2.673 1.00 . C A . 148 NAG O7 1 1 4 3751 1 1 1 HIS C C -1.469 -11.836 25.352 1.00 . A A . 1 HIS C 1 1 4 3752 1 1 1 HIS CA C -2.177 -11.579 26.685 1.00 . A A . 1 HIS CA 1 1 4 3753 1 1 1 HIS CB C -1.151 -11.616 27.818 1.00 . A A . 1 HIS CB 1 1 4 3754 1 1 1 HIS CD2 C -0.352 -9.234 28.234 1.00 . A A . 1 HIS CD2 1 1 4 3755 1 1 1 HIS CE1 C -1.475 -8.744 30.108 1.00 . A A . 1 HIS CE1 1 1 4 3756 1 1 1 HIS CG C -1.085 -10.313 28.562 1.00 . A A . 1 HIS CG 1 1 4 3757 1 1 1 HIS H1 H -4.034 -12.339 26.248 1.00 . A A . 1 HIS H1 1 1 4 3758 1 1 1 HIS H2 H -2.895 -13.503 26.730 1.00 . A A . 1 HIS H2 1 1 4 3759 1 1 1 HIS H3 H -3.590 -12.467 27.882 1.00 . A A . 1 HIS H3 1 1 4 3760 1 1 1 HIS HA H -2.636 -10.591 26.639 1.00 . A A . 1 HIS HA 1 1 4 3761 1 1 1 HIS HB2 H -1.403 -12.416 28.515 1.00 . A A . 1 HIS HB2 1 1 4 3762 1 1 1 HIS HB3 H -0.165 -11.851 27.417 1.00 . A A . 1 HIS HB3 1 1 4 3763 1 1 1 HIS HD2 H 0.298 -9.150 27.384 1.00 . A A . 1 HIS HD2 1 1 4 3764 1 1 1 HIS HE1 H -1.859 -8.216 30.977 1.00 . A A . 1 HIS HE1 1 1 4 3765 1 1 1 HIS HE2 H -0.188 -7.291 29.251 1.00 . A A . 1 HIS HE2 1 1 4 3766 1 1 1 HIS N N -3.251 -12.541 26.901 1.00 . A A . 1 HIS N 1 1 4 3767 1 1 1 HIS ND1 N -1.828 -10.003 29.796 1.00 . A A . 1 HIS ND1 1 1 4 3768 1 1 1 HIS NE2 N -0.604 -8.200 29.245 1.00 . A A . 1 HIS NE2 1 1 4 3769 1 1 1 HIS O O -0.315 -12.244 25.300 1.00 . A A . 1 HIS O 1 1 4 3770 1 1 2 MET C C -1.808 -9.421 23.204 1.00 . A A . 2 MET C 1 1 4 3771 1 1 2 MET CA C -1.625 -10.932 23.139 1.00 . A A . 2 MET CA 1 1 4 3772 1 1 2 MET CB C -2.229 -11.460 21.840 1.00 . A A . 2 MET CB 1 1 4 3773 1 1 2 MET CE C -3.307 -15.362 21.484 1.00 . A A . 2 MET CE 1 1 4 3774 1 1 2 MET CG C -2.035 -12.969 21.683 1.00 . A A . 2 MET CG 1 1 4 3775 1 1 2 MET H H -3.214 -11.810 24.280 1.00 . A A . 2 MET H 1 1 4 3776 1 1 2 MET HA H -0.560 -11.151 23.176 1.00 . A A . 2 MET HA 1 1 4 3777 1 1 2 MET HB2 H -3.292 -11.220 21.804 1.00 . A A . 2 MET HB2 1 1 4 3778 1 1 2 MET HB3 H -1.759 -10.939 21.006 1.00 . A A . 2 MET HB3 1 1 4 3779 1 1 2 MET HE1 H -3.200 -15.304 22.567 1.00 . A A . 2 MET HE1 1 1 4 3780 1 1 2 MET HE2 H -2.449 -15.894 21.074 1.00 . A A . 2 MET HE2 1 1 4 3781 1 1 2 MET HE3 H -4.211 -15.924 21.252 1.00 . A A . 2 MET HE3 1 1 4 3782 1 1 2 MET HG2 H -1.106 -13.175 21.151 1.00 . A A . 2 MET HG2 1 1 4 3783 1 1 2 MET HG3 H -1.958 -13.442 22.662 1.00 . A A . 2 MET HG3 1 1 4 3784 1 1 2 MET N N -2.243 -11.569 24.285 1.00 . A A . 2 MET N 1 1 4 3785 1 1 2 MET O O -2.227 -8.846 24.202 1.00 . A A . 2 MET O 1 1 4 3786 1 1 2 MET SD S -3.405 -13.708 20.780 1.00 . A A . 2 MET SD 1 1 4 3787 1 1 3 GLU C C -0.857 -6.488 21.806 1.00 . A A . 3 GLU C 1 1 4 3788 1 1 3 GLU CA C -0.346 -7.909 22.052 1.00 . A A . 3 GLU CA 1 1 4 3789 1 1 3 GLU CB C 0.652 -8.302 20.963 1.00 . A A . 3 GLU CB 1 1 4 3790 1 1 3 GLU CD C 0.477 -9.669 18.871 1.00 . A A . 3 GLU CD 1 1 4 3791 1 1 3 GLU CG C -0.025 -8.418 19.596 1.00 . A A . 3 GLU CG 1 1 4 3792 1 1 3 GLU H H -1.827 -9.201 21.195 1.00 . A A . 3 GLU H 1 1 4 3793 1 1 3 GLU HA H 0.103 -7.981 23.040 1.00 . A A . 3 GLU HA 1 1 4 3794 1 1 3 GLU HB2 H 1.446 -7.554 20.911 1.00 . A A . 3 GLU HB2 1 1 4 3795 1 1 3 GLU HB3 H 1.113 -9.258 21.222 1.00 . A A . 3 GLU HB3 1 1 4 3796 1 1 3 GLU HG2 H -1.107 -8.485 19.708 1.00 . A A . 3 GLU HG2 1 1 4 3797 1 1 3 GLU HG3 H 0.192 -7.543 18.985 1.00 . A A . 3 GLU HG3 1 1 4 3798 1 1 3 GLU N N -1.456 -8.839 22.048 1.00 . A A . 3 GLU N 1 1 4 3799 1 1 3 GLU O O -0.892 -5.998 20.684 1.00 . A A . 3 GLU O 1 1 4 3800 1 1 3 GLU OE1 O 0.013 -10.761 19.195 1.00 . A A . 3 GLU OE1 1 1 4 3801 1 1 3 GLU OE2 O 1.325 -9.536 17.990 1.00 . A A . 3 GLU OE2 1 1 4 3802 1 1 4 PRO C C -3.000 -4.427 21.928 1.00 . A A . 4 PRO C 1 1 4 3803 1 1 4 PRO CA C -2.594 -5.326 23.097 1.00 . A A . 4 PRO CA 1 1 4 3804 1 1 4 PRO CB C -2.556 -4.524 24.400 1.00 . A A . 4 PRO CB 1 1 4 3805 1 1 4 PRO CD C -0.355 -5.586 24.040 1.00 . A A . 4 PRO CD 1 1 4 3806 1 1 4 PRO CG C -1.154 -4.702 25.001 1.00 . A A . 4 PRO CG 1 1 4 3807 1 1 4 PRO HA H -3.301 -6.149 23.183 1.00 . A A . 4 PRO HA 1 1 4 3808 1 1 4 PRO HB2 H -2.758 -3.471 24.208 1.00 . A A . 4 PRO HB2 1 1 4 3809 1 1 4 PRO HB3 H -3.316 -4.885 25.092 1.00 . A A . 4 PRO HB3 1 1 4 3810 1 1 4 PRO HD2 H 0.541 -5.079 23.681 1.00 . A A . 4 PRO HD2 1 1 4 3811 1 1 4 PRO HD3 H -0.058 -6.523 24.513 1.00 . A A . 4 PRO HD3 1 1 4 3812 1 1 4 PRO HG2 H -0.670 -3.733 25.122 1.00 . A A . 4 PRO HG2 1 1 4 3813 1 1 4 PRO HG3 H -1.219 -5.166 25.985 1.00 . A A . 4 PRO HG3 1 1 4 3814 1 1 4 PRO N N -1.252 -5.854 22.930 1.00 . A A . 4 PRO N 1 1 4 3815 1 1 4 PRO O O -2.172 -3.864 21.224 1.00 . A A . 4 PRO O 1 1 4 3816 1 1 5 VAL C C -6.019 -3.888 20.075 1.00 . A A . 5 VAL C 1 1 4 3817 1 1 5 VAL CA C -4.918 -4.839 20.546 1.00 . A A . 5 VAL CA 1 1 4 3818 1 1 5 VAL CB C -5.567 -6.189 20.800 1.00 . A A . 5 VAL CB 1 1 4 3819 1 1 5 VAL CG1 C -6.147 -6.780 19.514 1.00 . A A . 5 VAL CG1 1 1 4 3820 1 1 5 VAL CG2 C -4.600 -7.171 21.460 1.00 . A A . 5 VAL CG2 1 1 4 3821 1 1 5 VAL H H -4.899 -3.962 22.509 1.00 . A A . 5 VAL H 1 1 4 3822 1 1 5 VAL HA H -4.109 -4.906 19.821 1.00 . A A . 5 VAL HA 1 1 4 3823 1 1 5 VAL HB H -6.382 -5.968 21.485 1.00 . A A . 5 VAL HB 1 1 4 3824 1 1 5 VAL HG11 H -6.858 -7.576 19.739 1.00 . A A . 5 VAL HG11 1 1 4 3825 1 1 5 VAL HG12 H -6.667 -6.021 18.930 1.00 . A A . 5 VAL HG12 1 1 4 3826 1 1 5 VAL HG13 H -5.358 -7.200 18.891 1.00 . A A . 5 VAL HG13 1 1 4 3827 1 1 5 VAL HG21 H -4.809 -7.268 22.525 1.00 . A A . 5 VAL HG21 1 1 4 3828 1 1 5 VAL HG22 H -4.689 -8.159 21.010 1.00 . A A . 5 VAL HG22 1 1 4 3829 1 1 5 VAL HG23 H -3.568 -6.840 21.337 1.00 . A A . 5 VAL HG23 1 1 4 3830 1 1 5 VAL N N -4.333 -4.340 21.777 1.00 . A A . 5 VAL N 1 1 4 3831 1 1 5 VAL O O -7.192 -4.235 20.017 1.00 . A A . 5 VAL O 1 1 4 3832 1 1 6 ASP C C -7.103 -2.418 17.868 1.00 . A A . 6 ASP C 1 1 4 3833 1 1 6 ASP CA C -5.768 -2.032 18.500 1.00 . A A . 6 ASP CA 1 1 4 3834 1 1 6 ASP CB C -4.660 -2.383 17.512 1.00 . A A . 6 ASP CB 1 1 4 3835 1 1 6 ASP CG C -4.168 -3.821 17.691 1.00 . A A . 6 ASP CG 1 1 4 3836 1 1 6 ASP H H -5.041 -2.219 20.524 1.00 . A A . 6 ASP H 1 1 4 3837 1 1 6 ASP HA H -5.788 -0.960 18.683 1.00 . A A . 6 ASP HA 1 1 4 3838 1 1 6 ASP HB2 H -5.064 -2.290 16.516 1.00 . A A . 6 ASP HB2 1 1 4 3839 1 1 6 ASP HB3 H -3.835 -1.682 17.559 1.00 . A A . 6 ASP HB3 1 1 4 3840 1 1 6 ASP N N -5.554 -2.664 19.794 1.00 . A A . 6 ASP N 1 1 4 3841 1 1 6 ASP O O -7.514 -3.571 17.831 1.00 . A A . 6 ASP O 1 1 4 3842 1 1 6 ASP OD1 O -5.004 -4.720 17.775 1.00 . A A . 6 ASP OD1 1 1 4 3843 1 1 6 ASP OD2 O -2.957 -4.026 17.741 1.00 . A A . 6 ASP OD2 1 1 4 3844 1 1 7 PRO C C -6.322 -0.527 15.444 1.00 . A A . 7 PRO C 1 1 4 3845 1 1 7 PRO CA C -7.693 -1.039 15.916 1.00 . A A . 7 PRO CA 1 1 4 3846 1 1 7 PRO CB C -8.747 0.053 15.723 1.00 . A A . 7 PRO CB 1 1 4 3847 1 1 7 PRO CD C -8.585 -0.475 18.126 1.00 . A A . 7 PRO CD 1 1 4 3848 1 1 7 PRO CG C -9.248 0.463 17.115 1.00 . A A . 7 PRO CG 1 1 4 3849 1 1 7 PRO HA H -7.954 -1.926 15.339 1.00 . A A . 7 PRO HA 1 1 4 3850 1 1 7 PRO HB2 H -8.328 0.908 15.193 1.00 . A A . 7 PRO HB2 1 1 4 3851 1 1 7 PRO HB3 H -9.574 -0.339 15.133 1.00 . A A . 7 PRO HB3 1 1 4 3852 1 1 7 PRO HD2 H -7.977 0.077 18.843 1.00 . A A . 7 PRO HD2 1 1 4 3853 1 1 7 PRO HD3 H -9.325 -1.059 18.673 1.00 . A A . 7 PRO HD3 1 1 4 3854 1 1 7 PRO HG2 H -8.984 1.499 17.326 1.00 . A A . 7 PRO HG2 1 1 4 3855 1 1 7 PRO HG3 H -10.333 0.379 17.171 1.00 . A A . 7 PRO HG3 1 1 4 3856 1 1 7 PRO N N -7.743 -1.356 17.336 1.00 . A A . 7 PRO N 1 1 4 3857 1 1 7 PRO O O -5.579 -1.207 14.751 1.00 . A A . 7 PRO O 1 1 4 3858 1 1 8 CYS C C -3.627 1.162 16.318 1.00 . A A . 8 CYS C 1 1 4 3859 1 1 8 CYS CA C -4.806 1.308 15.343 1.00 . A A . 8 CYS CA 1 1 4 3860 1 1 8 CYS CB C -5.034 2.783 15.037 1.00 . A A . 8 CYS CB 1 1 4 3861 1 1 8 CYS H H -6.707 1.274 16.330 1.00 . A A . 8 CYS H 1 1 4 3862 1 1 8 CYS HA H -4.562 0.762 14.435 1.00 . A A . 8 CYS HA 1 1 4 3863 1 1 8 CYS HB2 H -6.058 2.921 14.686 1.00 . A A . 8 CYS HB2 1 1 4 3864 1 1 8 CYS HB3 H -4.919 3.352 15.959 1.00 . A A . 8 CYS HB3 1 1 4 3865 1 1 8 CYS N N -6.039 0.722 15.839 1.00 . A A . 8 CYS N 1 1 4 3866 1 1 8 CYS O O -2.483 1.398 15.948 1.00 . A A . 8 CYS O 1 1 4 3867 1 1 8 CYS SG S -3.879 3.444 13.808 1.00 . A A . 8 CYS SG 1 1 4 3868 1 1 9 PHE C C -1.803 -0.391 17.746 1.00 . A A . 9 PHE C 1 1 4 3869 1 1 9 PHE CA C -2.851 0.451 18.470 1.00 . A A . 9 PHE CA 1 1 4 3870 1 1 9 PHE CB C -3.409 -0.323 19.656 1.00 . A A . 9 PHE CB 1 1 4 3871 1 1 9 PHE CD1 C -2.923 1.073 21.730 1.00 . A A . 9 PHE CD1 1 1 4 3872 1 1 9 PHE CD2 C -1.545 -0.949 21.277 1.00 . A A . 9 PHE CD2 1 1 4 3873 1 1 9 PHE CE1 C -2.165 1.324 22.927 1.00 . A A . 9 PHE CE1 1 1 4 3874 1 1 9 PHE CE2 C -0.784 -0.701 22.473 1.00 . A A . 9 PHE CE2 1 1 4 3875 1 1 9 PHE CG C -2.617 -0.063 20.901 1.00 . A A . 9 PHE CG 1 1 4 3876 1 1 9 PHE CZ C -1.095 0.437 23.298 1.00 . A A . 9 PHE CZ 1 1 4 3877 1 1 9 PHE H H -4.864 0.849 17.940 1.00 . A A . 9 PHE H 1 1 4 3878 1 1 9 PHE HA H -2.431 1.395 18.814 1.00 . A A . 9 PHE HA 1 1 4 3879 1 1 9 PHE HB2 H -4.450 -0.034 19.809 1.00 . A A . 9 PHE HB2 1 1 4 3880 1 1 9 PHE HB3 H -3.380 -1.389 19.445 1.00 . A A . 9 PHE HB3 1 1 4 3881 1 1 9 PHE HD1 H -3.726 1.737 21.449 1.00 . A A . 9 PHE HD1 1 1 4 3882 1 1 9 PHE HD2 H -1.309 -1.804 20.659 1.00 . A A . 9 PHE HD2 1 1 4 3883 1 1 9 PHE HE1 H -2.399 2.178 23.546 1.00 . A A . 9 PHE HE1 1 1 4 3884 1 1 9 PHE HE2 H 0.019 -1.367 22.752 1.00 . A A . 9 PHE HE2 1 1 4 3885 1 1 9 PHE HZ H -0.524 0.624 24.195 1.00 . A A . 9 PHE HZ 1 1 4 3886 1 1 9 PHE N N -3.940 0.770 17.571 1.00 . A A . 9 PHE N 1 1 4 3887 1 1 9 PHE O O -2.041 -0.930 16.672 1.00 . A A . 9 PHE O 1 1 4 3888 1 1 10 ARG C C 0.880 -1.341 16.595 1.00 . A A . 10 ARG C 1 1 4 3889 1 1 10 ARG CA C 0.290 -1.514 18.017 1.00 . A A . 10 ARG CA 1 1 4 3890 1 1 10 ARG CB C -0.371 -2.859 18.198 1.00 . A A . 10 ARG CB 1 1 4 3891 1 1 10 ARG CD C 1.832 -3.441 19.566 1.00 . A A . 10 ARG CD 1 1 4 3892 1 1 10 ARG CG C 0.384 -3.766 19.172 1.00 . A A . 10 ARG CG 1 1 4 3893 1 1 10 ARG CZ C 3.037 -4.240 21.473 1.00 . A A . 10 ARG CZ 1 1 4 3894 1 1 10 ARG H H -0.475 0.125 19.202 1.00 . A A . 10 ARG H 1 1 4 3895 1 1 10 ARG HA H 1.066 -1.469 18.748 1.00 . A A . 10 ARG HA 1 1 4 3896 1 1 10 ARG HB2 H -1.374 -2.702 18.609 1.00 . A A . 10 ARG HB2 1 1 4 3897 1 1 10 ARG HB3 H -0.494 -3.344 17.224 1.00 . A A . 10 ARG HB3 1 1 4 3898 1 1 10 ARG HD2 H 2.467 -3.298 18.691 1.00 . A A . 10 ARG HD2 1 1 4 3899 1 1 10 ARG HD3 H 1.890 -2.556 20.199 1.00 . A A . 10 ARG HD3 1 1 4 3900 1 1 10 ARG HE H 2.313 -5.482 20.014 1.00 . A A . 10 ARG HE 1 1 4 3901 1 1 10 ARG HG2 H -0.221 -3.889 20.066 1.00 . A A . 10 ARG HG2 1 1 4 3902 1 1 10 ARG HG3 H 0.441 -4.698 18.657 1.00 . A A . 10 ARG HG3 1 1 4 3903 1 1 10 ARG HH11 H 4.836 -3.540 20.862 1.00 . A A . 10 ARG HH11 1 1 4 3904 1 1 10 ARG HH12 H 4.034 -2.578 22.058 1.00 . A A . 10 ARG HH12 1 1 4 3905 1 1 10 ARG HH21 H 1.974 -5.538 22.608 1.00 . A A . 10 ARG HH21 1 1 4 3906 1 1 10 ARG HH22 H 3.043 -4.492 23.482 1.00 . A A . 10 ARG HH22 1 1 4 3907 1 1 10 ARG N N -0.642 -0.467 18.413 1.00 . A A . 10 ARG N 1 1 4 3908 1 1 10 ARG NE N 2.397 -4.537 20.328 1.00 . A A . 10 ARG NE 1 1 4 3909 1 1 10 ARG NH1 N 4.053 -3.382 21.464 1.00 . A A . 10 ARG NH1 1 1 4 3910 1 1 10 ARG NH2 N 2.653 -4.803 22.615 1.00 . A A . 10 ARG NH2 1 1 4 3911 1 1 10 ARG O O 1.809 -2.034 16.197 1.00 . A A . 10 ARG O 1 1 4 3912 1 1 11 ALA C C 1.183 -0.759 13.649 1.00 . A A . 11 ALA C 1 1 4 3913 1 1 11 ALA CA C -0.089 -0.652 14.499 1.00 . A A . 11 ALA CA 1 1 4 3914 1 1 11 ALA CB C -0.979 0.489 13.998 1.00 . A A . 11 ALA CB 1 1 4 3915 1 1 11 ALA H H -0.256 0.207 16.486 1.00 . A A . 11 ALA H 1 1 4 3916 1 1 11 ALA HA H -0.677 -1.573 14.492 1.00 . A A . 11 ALA HA 1 1 4 3917 1 1 11 ALA HB1 H -2.031 0.258 14.170 1.00 . A A . 11 ALA HB1 1 1 4 3918 1 1 11 ALA HB2 H -0.759 1.419 14.522 1.00 . A A . 11 ALA HB2 1 1 4 3919 1 1 11 ALA HB3 H -0.846 0.658 12.930 1.00 . A A . 11 ALA HB3 1 1 4 3920 1 1 11 ALA N N 0.278 -0.377 15.878 1.00 . A A . 11 ALA N 1 1 4 3921 1 1 11 ALA O O 2.097 0.046 13.776 1.00 . A A . 11 ALA O 1 1 4 3922 1 1 12 ASN C C 1.989 -1.994 10.456 1.00 . A A . 12 ASN C 1 1 4 3923 1 1 12 ASN CA C 2.374 -1.931 11.935 1.00 . A A . 12 ASN CA 1 1 4 3924 1 1 12 ASN CB C 3.157 -3.182 12.334 1.00 . A A . 12 ASN CB 1 1 4 3925 1 1 12 ASN CG C 2.260 -4.415 12.211 1.00 . A A . 12 ASN CG 1 1 4 3926 1 1 12 ASN H H 0.432 -2.432 12.726 1.00 . A A . 12 ASN H 1 1 4 3927 1 1 12 ASN HA H 2.960 -1.026 12.075 1.00 . A A . 12 ASN HA 1 1 4 3928 1 1 12 ASN HB2 H 4.027 -3.313 11.691 1.00 . A A . 12 ASN HB2 1 1 4 3929 1 1 12 ASN HB3 H 3.511 -3.104 13.362 1.00 . A A . 12 ASN HB3 1 1 4 3930 1 1 12 ASN HD21 H 1.293 -4.557 13.995 1.00 . A A . 12 ASN HD21 1 1 4 3931 1 1 12 ASN HD22 H 2.460 -5.825 13.665 1.00 . A A . 12 ASN HD22 1 1 4 3932 1 1 12 ASN N N 1.196 -1.789 12.781 1.00 . A A . 12 ASN N 1 1 4 3933 1 1 12 ASN ND2 N 1.979 -4.984 13.397 1.00 . A A . 12 ASN ND2 1 1 4 3934 1 1 12 ASN O O 2.501 -2.791 9.679 1.00 . A A . 12 ASN O 1 1 4 3935 1 1 12 ASN OD1 O 1.856 -4.816 11.125 1.00 . A A . 12 ASN OD1 1 1 4 3936 1 1 13 CYS C C 2.638 0.114 8.727 1.00 . A A . 13 CYS C 1 1 4 3937 1 1 13 CYS CA C 1.176 -0.248 8.970 1.00 . A A . 13 CYS CA 1 1 4 3938 1 1 13 CYS CB C 0.293 0.988 9.140 1.00 . A A . 13 CYS CB 1 1 4 3939 1 1 13 CYS H H 0.223 -1.070 10.688 1.00 . A A . 13 CYS H 1 1 4 3940 1 1 13 CYS HA H 0.807 -0.842 8.132 1.00 . A A . 13 CYS HA 1 1 4 3941 1 1 13 CYS HB2 H 0.677 1.668 9.907 1.00 . A A . 13 CYS HB2 1 1 4 3942 1 1 13 CYS HB3 H 0.256 1.533 8.197 1.00 . A A . 13 CYS HB3 1 1 4 3943 1 1 13 CYS N N 1.049 -1.090 10.139 1.00 . A A . 13 CYS N 1 1 4 3944 1 1 13 CYS O O 3.247 0.926 9.413 1.00 . A A . 13 CYS O 1 1 4 3945 1 1 13 CYS SG S -1.384 0.475 9.574 1.00 . A A . 13 CYS SG 1 1 4 3946 1 1 14 GLU C C 4.166 1.530 6.873 1.00 . A A . 14 GLU C 1 1 4 3947 1 1 14 GLU CA C 4.135 -0.012 6.790 1.00 . A A . 14 GLU CA 1 1 4 3948 1 1 14 GLU CB C 3.876 -0.508 5.365 1.00 . A A . 14 GLU CB 1 1 4 3949 1 1 14 GLU CD C 6.166 -1.350 4.797 1.00 . A A . 14 GLU CD 1 1 4 3950 1 1 14 GLU CG C 5.095 -0.309 4.464 1.00 . A A . 14 GLU CG 1 1 4 3951 1 1 14 GLU H H 2.751 -1.490 7.561 1.00 . A A . 14 GLU H 1 1 4 3952 1 1 14 GLU HA H 5.094 -0.395 7.130 1.00 . A A . 14 GLU HA 1 1 4 3953 1 1 14 GLU HB2 H 3.588 -1.559 5.360 1.00 . A A . 14 GLU HB2 1 1 4 3954 1 1 14 GLU HB3 H 3.024 0.035 4.967 1.00 . A A . 14 GLU HB3 1 1 4 3955 1 1 14 GLU HG2 H 4.820 -0.409 3.414 1.00 . A A . 14 GLU HG2 1 1 4 3956 1 1 14 GLU HG3 H 5.517 0.686 4.603 1.00 . A A . 14 GLU HG3 1 1 4 3957 1 1 14 GLU N N 3.136 -0.577 7.690 1.00 . A A . 14 GLU N 1 1 4 3958 1 1 14 GLU O O 4.601 2.104 7.864 1.00 . A A . 14 GLU O 1 1 4 3959 1 1 14 GLU OE1 O 6.006 -2.504 4.402 1.00 . A A . 14 GLU OE1 1 1 4 3960 1 1 14 GLU OE2 O 7.148 -0.995 5.447 1.00 . A A . 14 GLU OE2 1 1 4 3961 1 1 15 TYR C C 1.823 3.046 7.089 1.00 . A A . 15 TYR C 1 1 4 3962 1 1 15 TYR CA C 2.787 3.289 5.921 1.00 . A A . 15 TYR CA 1 1 4 3963 1 1 15 TYR CB C 2.064 3.500 4.584 1.00 . A A . 15 TYR CB 1 1 4 3964 1 1 15 TYR CD1 C 2.524 5.963 4.126 1.00 . A A . 15 TYR CD1 1 1 4 3965 1 1 15 TYR CD2 C 0.181 5.227 4.523 1.00 . A A . 15 TYR CD2 1 1 4 3966 1 1 15 TYR CE1 C 2.070 7.317 3.942 1.00 . A A . 15 TYR CE1 1 1 4 3967 1 1 15 TYR CE2 C -0.277 6.580 4.339 1.00 . A A . 15 TYR CE2 1 1 4 3968 1 1 15 TYR CG C 1.582 4.913 4.415 1.00 . A A . 15 TYR CG 1 1 4 3969 1 1 15 TYR CZ C 0.669 7.623 4.049 1.00 . A A . 15 TYR CZ 1 1 4 3970 1 1 15 TYR H H 3.882 1.815 4.862 1.00 . A A . 15 TYR H 1 1 4 3971 1 1 15 TYR HA H 3.399 4.156 6.156 1.00 . A A . 15 TYR HA 1 1 4 3972 1 1 15 TYR HB2 H 2.751 3.286 3.772 1.00 . A A . 15 TYR HB2 1 1 4 3973 1 1 15 TYR HB3 H 1.225 2.805 4.497 1.00 . A A . 15 TYR HB3 1 1 4 3974 1 1 15 TYR HD1 H 3.576 5.733 4.044 1.00 . A A . 15 TYR HD1 1 1 4 3975 1 1 15 TYR HD2 H -0.531 4.446 4.746 1.00 . A A . 15 TYR HD2 1 1 4 3976 1 1 15 TYR HE1 H 2.780 8.099 3.720 1.00 . A A . 15 TYR HE1 1 1 4 3977 1 1 15 TYR HE2 H -1.329 6.810 4.417 1.00 . A A . 15 TYR HE2 1 1 4 3978 1 1 15 TYR HH H 0.228 9.131 2.950 1.00 . A A . 15 TYR HH 1 1 4 3979 1 1 15 TYR N N 3.683 2.157 5.779 1.00 . A A . 15 TYR N 1 1 4 3980 1 1 15 TYR O O 2.200 2.571 8.152 1.00 . A A . 15 TYR O 1 1 4 3981 1 1 15 TYR OH O 0.232 8.921 3.875 1.00 . A A . 15 TYR OH 1 1 4 3982 1 1 16 GLN C C -1.606 3.028 7.966 1.00 . A A . 16 GLN C 1 1 4 3983 1 1 16 GLN CA C -0.281 3.808 7.930 1.00 . A A . 16 GLN CA 1 1 4 3984 1 1 16 GLN CB C -0.539 5.314 7.881 1.00 . A A . 16 GLN CB 1 1 4 3985 1 1 16 GLN CD C -1.147 7.306 9.277 1.00 . A A . 16 GLN CD 1 1 4 3986 1 1 16 GLN CG C -0.624 5.868 9.302 1.00 . A A . 16 GLN CG 1 1 4 3987 1 1 16 GLN H H 0.414 3.585 5.840 1.00 . A A . 16 GLN H 1 1 4 3988 1 1 16 GLN HA H 0.272 3.564 8.836 1.00 . A A . 16 GLN HA 1 1 4 3989 1 1 16 GLN HB2 H 0.265 5.809 7.348 1.00 . A A . 16 GLN HB2 1 1 4 3990 1 1 16 GLN HB3 H -1.475 5.495 7.338 1.00 . A A . 16 GLN HB3 1 1 4 3991 1 1 16 GLN HE21 H 0.553 7.987 8.390 1.00 . A A . 16 GLN HE21 1 1 4 3992 1 1 16 GLN HE22 H -0.923 8.814 7.930 1.00 . A A . 16 GLN HE22 1 1 4 3993 1 1 16 GLN HG2 H -1.287 5.252 9.910 1.00 . A A . 16 GLN HG2 1 1 4 3994 1 1 16 GLN HG3 H 0.359 5.845 9.775 1.00 . A A . 16 GLN HG3 1 1 4 3995 1 1 16 GLN N N 0.567 3.419 6.815 1.00 . A A . 16 GLN N 1 1 4 3996 1 1 16 GLN NE2 N -0.442 8.108 8.459 1.00 . A A . 16 GLN NE2 1 1 4 3997 1 1 16 GLN O O -1.737 1.918 7.465 1.00 . A A . 16 GLN O 1 1 4 3998 1 1 16 GLN OE1 O -2.111 7.656 9.947 1.00 . A A . 16 GLN OE1 1 1 4 3999 1 1 17 CYS C C -4.952 3.332 8.785 1.00 . A A . 17 CYS C 1 1 4 4000 1 1 17 CYS CA C -3.581 3.055 9.407 1.00 . A A . 17 CYS CA 1 1 4 4001 1 1 17 CYS CB C -3.544 3.615 10.831 1.00 . A A . 17 CYS CB 1 1 4 4002 1 1 17 CYS H H -2.279 4.676 8.765 1.00 . A A . 17 CYS H 1 1 4 4003 1 1 17 CYS HA H -3.345 1.991 9.412 1.00 . A A . 17 CYS HA 1 1 4 4004 1 1 17 CYS HB2 H -2.512 3.641 11.181 1.00 . A A . 17 CYS HB2 1 1 4 4005 1 1 17 CYS HB3 H -3.894 4.647 10.825 1.00 . A A . 17 CYS HB3 1 1 4 4006 1 1 17 CYS N N -2.556 3.722 8.623 1.00 . A A . 17 CYS N 1 1 4 4007 1 1 17 CYS O O -5.296 4.468 8.481 1.00 . A A . 17 CYS O 1 1 4 4008 1 1 17 CYS SG S -4.529 2.679 12.029 1.00 . A A . 17 CYS SG 1 1 4 4009 1 1 18 GLN C C -7.104 1.375 10.422 1.00 . A A . 18 GLN C 1 1 4 4010 1 1 18 GLN CA C -7.045 2.265 9.185 1.00 . A A . 18 GLN CA 1 1 4 4011 1 1 18 GLN CB C -8.057 1.767 8.161 1.00 . A A . 18 GLN CB 1 1 4 4012 1 1 18 GLN CD C -9.335 3.718 7.249 1.00 . A A . 18 GLN CD 1 1 4 4013 1 1 18 GLN CG C -9.365 2.551 8.242 1.00 . A A . 18 GLN CG 1 1 4 4014 1 1 18 GLN H H -5.462 1.538 7.943 1.00 . A A . 18 GLN H 1 1 4 4015 1 1 18 GLN HA H -7.257 3.302 9.447 1.00 . A A . 18 GLN HA 1 1 4 4016 1 1 18 GLN HB2 H -7.631 1.857 7.160 1.00 . A A . 18 GLN HB2 1 1 4 4017 1 1 18 GLN HB3 H -8.256 0.711 8.352 1.00 . A A . 18 GLN HB3 1 1 4 4018 1 1 18 GLN HE21 H -7.538 4.323 7.985 1.00 . A A . 18 GLN HE21 1 1 4 4019 1 1 18 GLN HE22 H -7.843 4.733 6.307 1.00 . A A . 18 GLN HE22 1 1 4 4020 1 1 18 GLN HG2 H -10.208 1.897 8.021 1.00 . A A . 18 GLN HG2 1 1 4 4021 1 1 18 GLN HG3 H -9.509 2.951 9.246 1.00 . A A . 18 GLN HG3 1 1 4 4022 1 1 18 GLN N N -5.712 2.234 8.616 1.00 . A A . 18 GLN N 1 1 4 4023 1 1 18 GLN NE2 N -8.130 4.310 7.172 1.00 . A A . 18 GLN NE2 1 1 4 4024 1 1 18 GLN O O -6.319 0.452 10.595 1.00 . A A . 18 GLN O 1 1 4 4025 1 1 18 GLN OE1 O -10.325 4.059 6.612 1.00 . A A . 18 GLN OE1 1 1 4 4026 1 1 19 PRO C C -10.259 0.724 10.438 1.00 . A A . 19 PRO C 1 1 4 4027 1 1 19 PRO CA C -9.232 0.870 11.573 1.00 . A A . 19 PRO CA 1 1 4 4028 1 1 19 PRO CB C -9.926 1.539 12.761 1.00 . A A . 19 PRO CB 1 1 4 4029 1 1 19 PRO CD C -8.008 2.928 12.082 1.00 . A A . 19 PRO CD 1 1 4 4030 1 1 19 PRO CG C -9.114 2.788 13.127 1.00 . A A . 19 PRO CG 1 1 4 4031 1 1 19 PRO HA H -8.880 -0.123 11.854 1.00 . A A . 19 PRO HA 1 1 4 4032 1 1 19 PRO HB2 H -10.948 1.814 12.499 1.00 . A A . 19 PRO HB2 1 1 4 4033 1 1 19 PRO HB3 H -9.980 0.857 13.607 1.00 . A A . 19 PRO HB3 1 1 4 4034 1 1 19 PRO HD2 H -8.163 3.806 11.454 1.00 . A A . 19 PRO HD2 1 1 4 4035 1 1 19 PRO HD3 H -7.026 3.001 12.549 1.00 . A A . 19 PRO HD3 1 1 4 4036 1 1 19 PRO HG2 H -9.750 3.671 13.134 1.00 . A A . 19 PRO HG2 1 1 4 4037 1 1 19 PRO HG3 H -8.680 2.675 14.120 1.00 . A A . 19 PRO HG3 1 1 4 4038 1 1 19 PRO N N -8.087 1.722 11.277 1.00 . A A . 19 PRO N 1 1 4 4039 1 1 19 PRO O O -11.002 1.647 10.128 1.00 . A A . 19 PRO O 1 1 4 4040 1 1 20 LEU C C -12.521 -1.530 9.795 1.00 . A A . 20 LEU C 1 1 4 4041 1 1 20 LEU CA C -11.078 -1.605 10.330 1.00 . A A . 20 LEU CA 1 1 4 4042 1 1 20 LEU CB C -11.055 -1.688 11.869 1.00 . A A . 20 LEU CB 1 1 4 4043 1 1 20 LEU CD1 C -12.185 -2.888 13.764 1.00 . A A . 20 LEU CD1 1 1 4 4044 1 1 20 LEU CD2 C -13.160 -0.744 12.890 1.00 . A A . 20 LEU CD2 1 1 4 4045 1 1 20 LEU CG C -12.395 -2.018 12.525 1.00 . A A . 20 LEU CG 1 1 4 4046 1 1 20 LEU H H -9.668 -0.631 9.044 1.00 . A A . 20 LEU H 1 1 4 4047 1 1 20 LEU HA H -10.621 -2.494 9.918 1.00 . A A . 20 LEU HA 1 1 4 4048 1 1 20 LEU HB2 H -10.334 -2.445 12.174 1.00 . A A . 20 LEU HB2 1 1 4 4049 1 1 20 LEU HB3 H -10.716 -0.754 12.298 1.00 . A A . 20 LEU HB3 1 1 4 4050 1 1 20 LEU HD11 H -12.093 -2.273 14.660 1.00 . A A . 20 LEU HD11 1 1 4 4051 1 1 20 LEU HD12 H -13.024 -3.569 13.908 1.00 . A A . 20 LEU HD12 1 1 4 4052 1 1 20 LEU HD13 H -11.279 -3.487 13.670 1.00 . A A . 20 LEU HD13 1 1 4 4053 1 1 20 LEU HD21 H -13.731 -0.368 12.042 1.00 . A A . 20 LEU HD21 1 1 4 4054 1 1 20 LEU HD22 H -13.859 -0.933 13.704 1.00 . A A . 20 LEU HD22 1 1 4 4055 1 1 20 LEU HD23 H -12.475 0.041 13.211 1.00 . A A . 20 LEU HD23 1 1 4 4056 1 1 20 LEU HG H -12.990 -2.592 11.824 1.00 . A A . 20 LEU HG 1 1 4 4057 1 1 20 LEU N N -10.253 -0.487 9.842 1.00 . A A . 20 LEU N 1 1 4 4058 1 1 20 LEU O O -13.197 -2.507 9.505 1.00 . A A . 20 LEU O 1 1 4 4059 1 1 21 ASN C C -14.909 -0.406 8.232 1.00 . A A . 21 ASN C 1 1 4 4060 1 1 21 ASN CA C -14.378 -0.064 9.640 1.00 . A A . 21 ASN CA 1 1 4 4061 1 1 21 ASN CB C -14.729 1.384 9.970 1.00 . A A . 21 ASN CB 1 1 4 4062 1 1 21 ASN CG C -13.798 2.349 9.232 1.00 . A A . 21 ASN CG 1 1 4 4063 1 1 21 ASN H H -12.246 0.120 10.392 1.00 . A A . 21 ASN H 1 1 4 4064 1 1 21 ASN HA H -14.840 -0.754 10.342 1.00 . A A . 21 ASN HA 1 1 4 4065 1 1 21 ASN HB2 H -15.752 1.588 9.650 1.00 . A A . 21 ASN HB2 1 1 4 4066 1 1 21 ASN HB3 H -14.643 1.559 11.044 1.00 . A A . 21 ASN HB3 1 1 4 4067 1 1 21 ASN HD21 H -14.754 3.905 10.151 1.00 . A A . 21 ASN HD21 1 1 4 4068 1 1 21 ASN N N -12.950 -0.283 9.810 1.00 . A A . 21 ASN N 1 1 4 4069 1 1 21 ASN ND2 N -14.146 3.637 9.405 1.00 . A A . 21 ASN ND2 1 1 4 4070 1 1 21 ASN O O -16.096 -0.267 7.958 1.00 . A A . 21 ASN O 1 1 4 4071 1 1 21 ASN OD1 O -12.850 1.955 8.562 1.00 . A A . 21 ASN OD1 1 1 4 4072 1 1 22 GLN C C -13.495 -3.201 6.890 1.00 . A A . 22 GLN C 1 1 4 4073 1 1 22 GLN CA C -14.293 -1.955 6.479 1.00 . A A . 22 GLN CA 1 1 4 4074 1 1 22 GLN CB C -13.930 -1.572 5.046 1.00 . A A . 22 GLN CB 1 1 4 4075 1 1 22 GLN CD C -14.729 -1.618 2.680 1.00 . A A . 22 GLN CD 1 1 4 4076 1 1 22 GLN CG C -15.158 -1.462 4.140 1.00 . A A . 22 GLN CG 1 1 4 4077 1 1 22 GLN H H -13.098 -0.383 7.335 1.00 . A A . 22 GLN H 1 1 4 4078 1 1 22 GLN HA H -15.360 -2.151 6.584 1.00 . A A . 22 GLN HA 1 1 4 4079 1 1 22 GLN HB2 H -13.393 -0.624 5.052 1.00 . A A . 22 GLN HB2 1 1 4 4080 1 1 22 GLN HB3 H -13.243 -2.314 4.642 1.00 . A A . 22 GLN HB3 1 1 4 4081 1 1 22 GLN HE21 H -13.213 -0.262 2.699 1.00 . A A . 22 GLN HE21 1 1 4 4082 1 1 22 GLN HE22 H -14.380 -0.071 1.403 1.00 . A A . 22 GLN HE22 1 1 4 4083 1 1 22 GLN HG2 H -15.889 -2.234 4.380 1.00 . A A . 22 GLN HG2 1 1 4 4084 1 1 22 GLN HG3 H -15.644 -0.494 4.264 1.00 . A A . 22 GLN HG3 1 1 4 4085 1 1 22 GLN N N -13.984 -0.844 7.362 1.00 . A A . 22 GLN N 1 1 4 4086 1 1 22 GLN NE2 N -14.046 -0.555 2.219 1.00 . A A . 22 GLN NE2 1 1 4 4087 1 1 22 GLN O O -13.998 -4.318 6.895 1.00 . A A . 22 GLN O 1 1 4 4088 1 1 22 GLN OE1 O -14.994 -2.622 2.030 1.00 . A A . 22 GLN OE1 1 1 4 4089 1 1 23 THR C C -11.021 -4.969 8.082 1.00 . A A . 23 THR C 1 1 4 4090 1 1 23 THR CA C -11.173 -3.906 6.976 1.00 . A A . 23 THR CA 1 1 4 4091 1 1 23 THR CB C -9.834 -3.197 6.769 1.00 . A A . 23 THR CB 1 1 4 4092 1 1 23 THR CG2 C -9.172 -3.599 5.452 1.00 . A A . 23 THR CG2 1 1 4 4093 1 1 23 THR H H -12.038 -2.048 7.684 1.00 . A A . 23 THR H 1 1 4 4094 1 1 23 THR HA H -11.506 -4.420 6.090 1.00 . A A . 23 THR HA 1 1 4 4095 1 1 23 THR HB H -9.178 -3.455 7.601 1.00 . A A . 23 THR HB 1 1 4 4096 1 1 23 THR HG1 H -9.933 -1.537 7.702 1.00 . A A . 23 THR HG1 1 1 4 4097 1 1 23 THR HG21 H -8.713 -2.735 4.971 1.00 . A A . 23 THR HG21 1 1 4 4098 1 1 23 THR HG22 H -8.393 -4.343 5.621 1.00 . A A . 23 THR HG22 1 1 4 4099 1 1 23 THR HG23 H -9.901 -4.022 4.760 1.00 . A A . 23 THR HG23 1 1 4 4100 1 1 23 THR N N -12.223 -2.922 7.229 1.00 . A A . 23 THR N 1 1 4 4101 1 1 23 THR O O -10.505 -6.061 7.875 1.00 . A A . 23 THR O 1 1 4 4102 1 1 23 THR OG1 O -10.005 -1.802 6.794 1.00 . A A . 23 THR OG1 1 1 4 4103 1 1 24 SER C C -9.326 -4.759 10.322 1.00 . A A . 24 SER C 1 1 4 4104 1 1 24 SER CA C -10.841 -4.802 10.503 1.00 . A A . 24 SER CA 1 1 4 4105 1 1 24 SER CB C -11.344 -6.096 11.119 1.00 . A A . 24 SER CB 1 1 4 4106 1 1 24 SER H H -12.090 -3.759 9.147 1.00 . A A . 24 SER H 1 1 4 4107 1 1 24 SER HA H -11.139 -3.973 11.146 1.00 . A A . 24 SER HA 1 1 4 4108 1 1 24 SER HB2 H -11.101 -6.136 12.181 1.00 . A A . 24 SER HB2 1 1 4 4109 1 1 24 SER HB3 H -12.428 -6.118 11.023 1.00 . A A . 24 SER HB3 1 1 4 4110 1 1 24 SER HG H -11.398 -7.450 9.777 1.00 . A A . 24 SER HG 1 1 4 4111 1 1 24 SER N N -11.509 -4.554 9.252 1.00 . A A . 24 SER N 1 1 4 4112 1 1 24 SER O O -8.730 -5.375 9.447 1.00 . A A . 24 SER O 1 1 4 4113 1 1 24 SER OG O -10.805 -7.226 10.482 1.00 . A A . 24 SER OG 1 1 4 4114 1 1 25 TYR C C -6.843 -3.142 9.977 1.00 . A A . 25 TYR C 1 1 4 4115 1 1 25 TYR CA C -8.028 -2.785 10.865 1.00 . A A . 25 TYR CA 1 1 4 4116 1 1 25 TYR CB C -7.545 -2.054 12.123 1.00 . A A . 25 TYR CB 1 1 4 4117 1 1 25 TYR CD1 C -5.107 -2.690 12.550 1.00 . A A . 25 TYR CD1 1 1 4 4118 1 1 25 TYR CD2 C -6.898 -3.785 13.887 1.00 . A A . 25 TYR CD2 1 1 4 4119 1 1 25 TYR CE1 C -4.113 -3.461 13.248 1.00 . A A . 25 TYR CE1 1 1 4 4120 1 1 25 TYR CE2 C -5.907 -4.560 14.585 1.00 . A A . 25 TYR CE2 1 1 4 4121 1 1 25 TYR CG C -6.507 -2.853 12.861 1.00 . A A . 25 TYR CG 1 1 4 4122 1 1 25 TYR CZ C -4.513 -4.397 14.264 1.00 . A A . 25 TYR CZ 1 1 4 4123 1 1 25 TYR H H -9.251 -3.990 12.130 1.00 . A A . 25 TYR H 1 1 4 4124 1 1 25 TYR HA H -8.710 -2.161 10.280 1.00 . A A . 25 TYR HA 1 1 4 4125 1 1 25 TYR HB2 H -7.130 -1.067 11.888 1.00 . A A . 25 TYR HB2 1 1 4 4126 1 1 25 TYR HB3 H -8.401 -1.893 12.777 1.00 . A A . 25 TYR HB3 1 1 4 4127 1 1 25 TYR HD1 H -4.793 -1.980 11.799 1.00 . A A . 25 TYR HD1 1 1 4 4128 1 1 25 TYR HD2 H -7.939 -3.892 14.148 1.00 . A A . 25 TYR HD2 1 1 4 4129 1 1 25 TYR HE1 H -3.067 -3.335 13.010 1.00 . A A . 25 TYR HE1 1 1 4 4130 1 1 25 TYR HE2 H -6.207 -5.264 15.346 1.00 . A A . 25 TYR HE2 1 1 4 4131 1 1 25 TYR HH H -3.221 -5.809 14.355 1.00 . A A . 25 TYR HH 1 1 4 4132 1 1 25 TYR N N -8.782 -3.962 11.251 1.00 . A A . 25 TYR N 1 1 4 4133 1 1 25 TYR O O -6.276 -4.228 10.006 1.00 . A A . 25 TYR O 1 1 4 4134 1 1 25 TYR OH O -3.561 -5.138 14.932 1.00 . A A . 25 TYR OH 1 1 4 4135 1 1 26 LEU C C -4.613 -1.553 7.893 1.00 . A A . 26 LEU C 1 1 4 4136 1 1 26 LEU CA C -5.908 -2.370 7.923 1.00 . A A . 26 LEU CA 1 1 4 4137 1 1 26 LEU CB C -6.933 -2.037 6.828 1.00 . A A . 26 LEU CB 1 1 4 4138 1 1 26 LEU CD1 C -5.915 -1.027 4.759 1.00 . A A . 26 LEU CD1 1 1 4 4139 1 1 26 LEU CD2 C -7.993 -0.058 5.716 1.00 . A A . 26 LEU CD2 1 1 4 4140 1 1 26 LEU CG C -6.671 -0.745 6.058 1.00 . A A . 26 LEU CG 1 1 4 4141 1 1 26 LEU H H -7.149 -1.311 9.282 1.00 . A A . 26 LEU H 1 1 4 4142 1 1 26 LEU HA H -5.711 -3.442 7.887 1.00 . A A . 26 LEU HA 1 1 4 4143 1 1 26 LEU HB2 H -6.982 -2.868 6.120 1.00 . A A . 26 LEU HB2 1 1 4 4144 1 1 26 LEU HB3 H -7.919 -1.953 7.300 1.00 . A A . 26 LEU HB3 1 1 4 4145 1 1 26 LEU HD11 H -5.257 -0.199 4.501 1.00 . A A . 26 LEU HD11 1 1 4 4146 1 1 26 LEU HD12 H -5.325 -1.941 4.821 1.00 . A A . 26 LEU HD12 1 1 4 4147 1 1 26 LEU HD13 H -6.617 -1.152 3.935 1.00 . A A . 26 LEU HD13 1 1 4 4148 1 1 26 LEU HD21 H -8.671 -0.050 6.567 1.00 . A A . 26 LEU HD21 1 1 4 4149 1 1 26 LEU HD22 H -7.828 0.970 5.393 1.00 . A A . 26 LEU HD22 1 1 4 4150 1 1 26 LEU HD23 H -8.494 -0.581 4.901 1.00 . A A . 26 LEU HD23 1 1 4 4151 1 1 26 LEU HG H -6.088 -0.085 6.702 1.00 . A A . 26 LEU HG 1 1 4 4152 1 1 26 LEU N N -6.544 -2.102 9.191 1.00 . A A . 26 LEU N 1 1 4 4153 1 1 26 LEU O O -4.205 -1.003 8.909 1.00 . A A . 26 LEU O 1 1 4 4154 1 1 27 CYS C C -3.012 0.211 5.215 1.00 . A A . 27 CYS C 1 1 4 4155 1 1 27 CYS CA C -2.979 -0.442 6.594 1.00 . A A . 27 CYS CA 1 1 4 4156 1 1 27 CYS CB C -1.594 -0.962 6.938 1.00 . A A . 27 CYS CB 1 1 4 4157 1 1 27 CYS H H -4.205 -2.099 5.949 1.00 . A A . 27 CYS H 1 1 4 4158 1 1 27 CYS HA H -3.232 0.309 7.336 1.00 . A A . 27 CYS HA 1 1 4 4159 1 1 27 CYS HB2 H -1.389 -1.844 6.337 1.00 . A A . 27 CYS HB2 1 1 4 4160 1 1 27 CYS HB3 H -0.844 -0.200 6.705 1.00 . A A . 27 CYS HB3 1 1 4 4161 1 1 27 CYS N N -3.984 -1.485 6.707 1.00 . A A . 27 CYS N 1 1 4 4162 1 1 27 CYS O O -2.969 -0.427 4.171 1.00 . A A . 27 CYS O 1 1 4 4163 1 1 27 CYS SG S -1.479 -1.369 8.699 1.00 . A A . 27 CYS SG 1 1 4 4164 1 1 28 VAL C C -1.885 2.606 3.530 1.00 . A A . 28 VAL C 1 1 4 4165 1 1 28 VAL CA C -3.251 2.385 4.159 1.00 . A A . 28 VAL CA 1 1 4 4166 1 1 28 VAL CB C -3.830 3.752 4.527 1.00 . A A . 28 VAL CB 1 1 4 4167 1 1 28 VAL CG1 C -5.335 3.803 4.266 1.00 . A A . 28 VAL CG1 1 1 4 4168 1 1 28 VAL CG2 C -3.505 4.145 5.969 1.00 . A A . 28 VAL CG2 1 1 4 4169 1 1 28 VAL H H -2.988 1.915 6.248 1.00 . A A . 28 VAL H 1 1 4 4170 1 1 28 VAL HA H -3.897 1.847 3.464 1.00 . A A . 28 VAL HA 1 1 4 4171 1 1 28 VAL HB H -3.338 4.476 3.876 1.00 . A A . 28 VAL HB 1 1 4 4172 1 1 28 VAL HG11 H -5.840 4.421 5.008 1.00 . A A . 28 VAL HG11 1 1 4 4173 1 1 28 VAL HG12 H -5.546 4.220 3.281 1.00 . A A . 28 VAL HG12 1 1 4 4174 1 1 28 VAL HG13 H -5.771 2.804 4.308 1.00 . A A . 28 VAL HG13 1 1 4 4175 1 1 28 VAL HG21 H -3.836 3.374 6.663 1.00 . A A . 28 VAL HG21 1 1 4 4176 1 1 28 VAL HG22 H -2.431 4.274 6.092 1.00 . A A . 28 VAL HG22 1 1 4 4177 1 1 28 VAL HG23 H -3.991 5.082 6.241 1.00 . A A . 28 VAL HG23 1 1 4 4178 1 1 28 VAL N N -3.095 1.544 5.329 1.00 . A A . 28 VAL N 1 1 4 4179 1 1 28 VAL O O -0.850 2.397 4.148 1.00 . A A . 28 VAL O 1 1 4 4180 1 1 29 CYS C C -1.037 4.799 0.873 1.00 . A A . 29 CYS C 1 1 4 4181 1 1 29 CYS CA C -0.739 3.535 1.685 1.00 . A A . 29 CYS CA 1 1 4 4182 1 1 29 CYS CB C -0.181 2.419 0.806 1.00 . A A . 29 CYS CB 1 1 4 4183 1 1 29 CYS H H -2.537 2.510 1.646 1.00 . A A . 29 CYS H 1 1 4 4184 1 1 29 CYS HA H -0.022 3.688 2.490 1.00 . A A . 29 CYS HA 1 1 4 4185 1 1 29 CYS HB2 H -0.866 2.244 -0.024 1.00 . A A . 29 CYS HB2 1 1 4 4186 1 1 29 CYS HB3 H 0.780 2.735 0.393 1.00 . A A . 29 CYS HB3 1 1 4 4187 1 1 29 CYS N N -1.959 3.032 2.259 1.00 . A A . 29 CYS N 1 1 4 4188 1 1 29 CYS O O -1.959 5.557 1.151 1.00 . A A . 29 CYS O 1 1 4 4189 1 1 29 CYS SG S -0.012 0.868 1.739 1.00 . A A . 29 CYS SG 1 1 4 4190 1 1 30 ALA C C -1.623 5.958 -1.928 1.00 . A A . 30 ALA C 1 1 4 4191 1 1 30 ALA CA C -0.344 6.062 -1.079 1.00 . A A . 30 ALA CA 1 1 4 4192 1 1 30 ALA CB C 0.846 6.069 -2.032 1.00 . A A . 30 ALA CB 1 1 4 4193 1 1 30 ALA H H 0.697 4.530 0.073 1.00 . A A . 30 ALA H 1 1 4 4194 1 1 30 ALA HA H -0.322 6.976 -0.487 1.00 . A A . 30 ALA HA 1 1 4 4195 1 1 30 ALA HB1 H 0.602 6.619 -2.940 1.00 . A A . 30 ALA HB1 1 1 4 4196 1 1 30 ALA HB2 H 1.710 6.543 -1.566 1.00 . A A . 30 ALA HB2 1 1 4 4197 1 1 30 ALA HB3 H 1.119 5.052 -2.311 1.00 . A A . 30 ALA HB3 1 1 4 4198 1 1 30 ALA N N -0.178 4.953 -0.146 1.00 . A A . 30 ALA N 1 1 4 4199 1 1 30 ALA O O -1.698 6.482 -3.032 1.00 . A A . 30 ALA O 1 1 4 4200 1 1 31 GLU C C -2.853 3.669 -3.216 1.00 . A A . 31 GLU C 1 1 4 4201 1 1 31 GLU CA C -2.786 3.869 -1.701 1.00 . A A . 31 GLU CA 1 1 4 4202 1 1 31 GLU CB C -4.065 3.383 -1.031 1.00 . A A . 31 GLU CB 1 1 4 4203 1 1 31 GLU CD C -5.360 1.380 -0.273 1.00 . A A . 31 GLU CD 1 1 4 4204 1 1 31 GLU CG C -3.970 1.917 -0.621 1.00 . A A . 31 GLU CG 1 1 4 4205 1 1 31 GLU H H -3.002 5.580 -0.492 1.00 . A A . 31 GLU H 1 1 4 4206 1 1 31 GLU HA H -1.925 3.333 -1.307 1.00 . A A . 31 GLU HA 1 1 4 4207 1 1 31 GLU HB2 H -4.266 3.992 -0.149 1.00 . A A . 31 GLU HB2 1 1 4 4208 1 1 31 GLU HB3 H -4.900 3.541 -1.708 1.00 . A A . 31 GLU HB3 1 1 4 4209 1 1 31 GLU HG2 H -3.546 1.326 -1.431 1.00 . A A . 31 GLU HG2 1 1 4 4210 1 1 31 GLU HG3 H -3.319 1.814 0.248 1.00 . A A . 31 GLU HG3 1 1 4 4211 1 1 31 GLU N N -2.611 5.259 -1.350 1.00 . A A . 31 GLU N 1 1 4 4212 1 1 31 GLU O O -3.011 4.599 -3.998 1.00 . A A . 31 GLU O 1 1 4 4213 1 1 31 GLU OE1 O -5.850 1.681 0.814 1.00 . A A . 31 GLU OE1 1 1 4 4214 1 1 31 GLU OE2 O -5.935 0.667 -1.094 1.00 . A A . 31 GLU OE2 1 1 4 4215 1 1 32 GLY C C -1.003 1.048 -4.625 1.00 . A A . 32 GLY C 1 1 4 4216 1 1 32 GLY CA C -2.179 2.002 -4.842 1.00 . A A . 32 GLY CA 1 1 4 4217 1 1 32 GLY H H -2.870 1.664 -2.863 1.00 . A A . 32 GLY H 1 1 4 4218 1 1 32 GLY HA2 H -2.973 1.515 -5.410 1.00 . A A . 32 GLY HA2 1 1 4 4219 1 1 32 GLY HA3 H -1.854 2.915 -5.343 1.00 . A A . 32 GLY HA3 1 1 4 4220 1 1 32 GLY N N -2.721 2.372 -3.551 1.00 . A A . 32 GLY N 1 1 4 4221 1 1 32 GLY O O -0.930 -0.041 -5.178 1.00 . A A . 32 GLY O 1 1 4 4222 1 1 33 PHE C C -0.465 -0.305 -2.230 1.00 . A A . 33 PHE C 1 1 4 4223 1 1 33 PHE CA C 0.537 0.718 -2.773 1.00 . A A . 33 PHE CA 1 1 4 4224 1 1 33 PHE CB C 1.009 1.679 -1.689 1.00 . A A . 33 PHE CB 1 1 4 4225 1 1 33 PHE CD1 C 2.588 3.129 -3.076 1.00 . A A . 33 PHE CD1 1 1 4 4226 1 1 33 PHE CD2 C 3.453 1.977 -1.046 1.00 . A A . 33 PHE CD2 1 1 4 4227 1 1 33 PHE CE1 C 3.865 3.767 -3.259 1.00 . A A . 33 PHE CE1 1 1 4 4228 1 1 33 PHE CE2 C 4.730 2.615 -1.225 1.00 . A A . 33 PHE CE2 1 1 4 4229 1 1 33 PHE CG C 2.368 2.254 -1.953 1.00 . A A . 33 PHE CG 1 1 4 4230 1 1 33 PHE CZ C 4.930 3.523 -2.322 1.00 . A A . 33 PHE CZ 1 1 4 4231 1 1 33 PHE H H -0.071 2.534 -3.575 1.00 . A A . 33 PHE H 1 1 4 4232 1 1 33 PHE HA H 1.370 0.175 -3.222 1.00 . A A . 33 PHE HA 1 1 4 4233 1 1 33 PHE HB2 H 0.302 2.511 -1.612 1.00 . A A . 33 PHE HB2 1 1 4 4234 1 1 33 PHE HB3 H 1.048 1.163 -0.742 1.00 . A A . 33 PHE HB3 1 1 4 4235 1 1 33 PHE HD1 H 1.793 3.303 -3.785 1.00 . A A . 33 PHE HD1 1 1 4 4236 1 1 33 PHE HD2 H 3.307 1.282 -0.232 1.00 . A A . 33 PHE HD2 1 1 4 4237 1 1 33 PHE HE1 H 4.026 4.419 -4.105 1.00 . A A . 33 PHE HE1 1 1 4 4238 1 1 33 PHE HE2 H 5.540 2.407 -0.542 1.00 . A A . 33 PHE HE2 1 1 4 4239 1 1 33 PHE HZ H 5.880 4.022 -2.442 1.00 . A A . 33 PHE HZ 1 1 4 4240 1 1 33 PHE N N -0.106 1.554 -3.762 1.00 . A A . 33 PHE N 1 1 4 4241 1 1 33 PHE O O -1.361 0.001 -1.453 1.00 . A A . 33 PHE O 1 1 4 4242 1 1 34 ALA C C -0.124 -3.875 -2.052 1.00 . A A . 34 ALA C 1 1 4 4243 1 1 34 ALA CA C -1.029 -2.656 -2.235 1.00 . A A . 34 ALA CA 1 1 4 4244 1 1 34 ALA CB C -2.135 -2.965 -3.246 1.00 . A A . 34 ALA CB 1 1 4 4245 1 1 34 ALA H H 0.503 -1.688 -3.372 1.00 . A A . 34 ALA H 1 1 4 4246 1 1 34 ALA HA H -1.443 -2.363 -1.272 1.00 . A A . 34 ALA HA 1 1 4 4247 1 1 34 ALA HB1 H -3.105 -3.034 -2.753 1.00 . A A . 34 ALA HB1 1 1 4 4248 1 1 34 ALA HB2 H -2.196 -2.185 -4.005 1.00 . A A . 34 ALA HB2 1 1 4 4249 1 1 34 ALA HB3 H -1.945 -3.912 -3.752 1.00 . A A . 34 ALA HB3 1 1 4 4250 1 1 34 ALA N N -0.232 -1.540 -2.710 1.00 . A A . 34 ALA N 1 1 4 4251 1 1 34 ALA O O 1.018 -3.898 -2.492 1.00 . A A . 34 ALA O 1 1 4 4252 1 1 35 PRO C C 0.724 -6.773 -2.123 1.00 . A A . 35 PRO C 1 1 4 4253 1 1 35 PRO CA C 0.025 -6.072 -0.955 1.00 . A A . 35 PRO CA 1 1 4 4254 1 1 35 PRO CB C -1.019 -6.992 -0.319 1.00 . A A . 35 PRO CB 1 1 4 4255 1 1 35 PRO CD C -2.117 -4.895 -1.024 1.00 . A A . 35 PRO CD 1 1 4 4256 1 1 35 PRO CG C -2.347 -6.220 -0.291 1.00 . A A . 35 PRO CG 1 1 4 4257 1 1 35 PRO HA H 0.776 -5.785 -0.219 1.00 . A A . 35 PRO HA 1 1 4 4258 1 1 35 PRO HB2 H -1.124 -7.908 -0.899 1.00 . A A . 35 PRO HB2 1 1 4 4259 1 1 35 PRO HB3 H -0.717 -7.272 0.690 1.00 . A A . 35 PRO HB3 1 1 4 4260 1 1 35 PRO HD2 H -2.726 -4.829 -1.926 1.00 . A A . 35 PRO HD2 1 1 4 4261 1 1 35 PRO HD3 H -2.344 -4.041 -0.386 1.00 . A A . 35 PRO HD3 1 1 4 4262 1 1 35 PRO HG2 H -3.134 -6.797 -0.775 1.00 . A A . 35 PRO HG2 1 1 4 4263 1 1 35 PRO HG3 H -2.657 -6.036 0.739 1.00 . A A . 35 PRO HG3 1 1 4 4264 1 1 35 PRO N N -0.708 -4.890 -1.378 1.00 . A A . 35 PRO N 1 1 4 4265 1 1 35 PRO O O 0.197 -7.686 -2.747 1.00 . A A . 35 PRO O 1 1 4 4266 1 1 36 ILE C C 2.924 -8.347 -1.455 1.00 . A A . 36 ILE C 1 1 4 4267 1 1 36 ILE CA C 3.152 -7.093 -2.305 1.00 . A A . 36 ILE CA 1 1 4 4268 1 1 36 ILE CB C 4.280 -6.256 -1.680 1.00 . A A . 36 ILE CB 1 1 4 4269 1 1 36 ILE CD1 C 5.541 -7.234 0.261 1.00 . A A . 36 ILE CD1 1 1 4 4270 1 1 36 ILE CG1 C 5.464 -7.118 -1.244 1.00 . A A . 36 ILE CG1 1 1 4 4271 1 1 36 ILE CG2 C 3.740 -5.346 -0.561 1.00 . A A . 36 ILE CG2 1 1 4 4272 1 1 36 ILE H H 2.094 -5.279 -2.405 1.00 . A A . 36 ILE H 1 1 4 4273 1 1 36 ILE HA H 3.403 -7.347 -3.334 1.00 . A A . 36 ILE HA 1 1 4 4274 1 1 36 ILE HB H 4.671 -5.611 -2.454 1.00 . A A . 36 ILE HB 1 1 4 4275 1 1 36 ILE HD11 H 4.529 -7.307 0.656 1.00 . A A . 36 ILE HD11 1 1 4 4276 1 1 36 ILE HD12 H 6.111 -8.112 0.548 1.00 . A A . 36 ILE HD12 1 1 4 4277 1 1 36 ILE HD13 H 6.009 -6.340 0.672 1.00 . A A . 36 ILE HD13 1 1 4 4278 1 1 36 ILE HG12 H 5.389 -8.120 -1.656 1.00 . A A . 36 ILE HG12 1 1 4 4279 1 1 36 ILE HG13 H 6.391 -6.692 -1.628 1.00 . A A . 36 ILE HG13 1 1 4 4280 1 1 36 ILE HG21 H 2.775 -5.727 -0.240 1.00 . A A . 36 ILE HG21 1 1 4 4281 1 1 36 ILE HG22 H 4.390 -5.230 0.307 1.00 . A A . 36 ILE HG22 1 1 4 4282 1 1 36 ILE HG23 H 3.557 -4.342 -0.931 1.00 . A A . 36 ILE HG23 1 1 4 4283 1 1 36 ILE N N 1.951 -6.268 -2.361 1.00 . A A . 36 ILE N 1 1 4 4284 1 1 36 ILE O O 2.606 -8.256 -0.275 1.00 . A A . 36 ILE O 1 1 4 4285 1 1 37 PRO C C 2.205 -10.780 -0.102 1.00 . A A . 37 PRO C 1 1 4 4286 1 1 37 PRO CA C 2.748 -10.801 -1.540 1.00 . A A . 37 PRO CA 1 1 4 4287 1 1 37 PRO CB C 4.045 -11.596 -1.705 1.00 . A A . 37 PRO CB 1 1 4 4288 1 1 37 PRO CD C 4.020 -9.675 -3.239 1.00 . A A . 37 PRO CD 1 1 4 4289 1 1 37 PRO CG C 4.745 -10.993 -2.937 1.00 . A A . 37 PRO CG 1 1 4 4290 1 1 37 PRO HA H 1.977 -11.240 -2.172 1.00 . A A . 37 PRO HA 1 1 4 4291 1 1 37 PRO HB2 H 4.670 -11.460 -0.821 1.00 . A A . 37 PRO HB2 1 1 4 4292 1 1 37 PRO HB3 H 3.849 -12.659 -1.821 1.00 . A A . 37 PRO HB3 1 1 4 4293 1 1 37 PRO HD2 H 4.708 -8.840 -3.347 1.00 . A A . 37 PRO HD2 1 1 4 4294 1 1 37 PRO HD3 H 3.439 -9.758 -4.157 1.00 . A A . 37 PRO HD3 1 1 4 4295 1 1 37 PRO HG2 H 5.801 -10.815 -2.732 1.00 . A A . 37 PRO HG2 1 1 4 4296 1 1 37 PRO HG3 H 4.681 -11.672 -3.788 1.00 . A A . 37 PRO HG3 1 1 4 4297 1 1 37 PRO N N 3.121 -9.517 -2.105 1.00 . A A . 37 PRO N 1 1 4 4298 1 1 37 PRO O O 1.255 -10.071 0.203 1.00 . A A . 37 PRO O 1 1 4 4299 1 1 38 HIS C C 1.605 -10.660 2.660 1.00 . A A . 38 HIS C 1 1 4 4300 1 1 38 HIS CA C 2.485 -11.795 2.125 1.00 . A A . 38 HIS CA 1 1 4 4301 1 1 38 HIS CB C 3.721 -12.112 2.989 1.00 . A A . 38 HIS CB 1 1 4 4302 1 1 38 HIS CD2 C 5.222 -10.431 1.723 1.00 . A A . 38 HIS CD2 1 1 4 4303 1 1 38 HIS CE1 C 7.202 -10.941 2.610 1.00 . A A . 38 HIS CE1 1 1 4 4304 1 1 38 HIS CG C 5.005 -11.427 2.603 1.00 . A A . 38 HIS CG 1 1 4 4305 1 1 38 HIS H H 3.619 -12.157 0.366 1.00 . A A . 38 HIS H 1 1 4 4306 1 1 38 HIS HA H 1.855 -12.661 2.169 1.00 . A A . 38 HIS HA 1 1 4 4307 1 1 38 HIS HB2 H 3.497 -11.862 4.032 1.00 . A A . 38 HIS HB2 1 1 4 4308 1 1 38 HIS HB3 H 3.891 -13.193 2.943 1.00 . A A . 38 HIS HB3 1 1 4 4309 1 1 38 HIS HD1 H 6.472 -12.504 3.837 1.00 . A A . 38 HIS HD1 1 1 4 4310 1 1 38 HIS HD2 H 4.475 -9.959 1.115 1.00 . A A . 38 HIS HD2 1 1 4 4311 1 1 38 HIS HE1 H 8.265 -10.961 2.838 1.00 . A A . 38 HIS HE1 1 1 4 4312 1 1 38 HIS N N 2.854 -11.625 0.728 1.00 . A A . 38 HIS N 1 1 4 4313 1 1 38 HIS ND1 N 6.314 -11.769 3.178 1.00 . A A . 38 HIS ND1 1 1 4 4314 1 1 38 HIS NE2 N 6.655 -10.094 1.724 1.00 . A A . 38 HIS NE2 1 1 4 4315 1 1 38 HIS O O 0.437 -10.511 2.322 1.00 . A A . 38 HIS O 1 1 4 4316 1 1 39 GLU C C 0.417 -8.562 4.439 1.00 . A A . 39 GLU C 1 1 4 4317 1 1 39 GLU CA C 1.580 -9.509 4.758 1.00 . A A . 39 GLU CA 1 1 4 4318 1 1 39 GLU CB C 2.576 -8.881 5.728 1.00 . A A . 39 GLU CB 1 1 4 4319 1 1 39 GLU CD C 4.447 -9.565 7.246 1.00 . A A . 39 GLU CD 1 1 4 4320 1 1 39 GLU CG C 3.835 -9.737 5.855 1.00 . A A . 39 GLU CG 1 1 4 4321 1 1 39 GLU H H 3.242 -10.022 3.401 1.00 . A A . 39 GLU H 1 1 4 4322 1 1 39 GLU HA H 1.179 -10.421 5.193 1.00 . A A . 39 GLU HA 1 1 4 4323 1 1 39 GLU HB2 H 2.843 -7.885 5.375 1.00 . A A . 39 GLU HB2 1 1 4 4324 1 1 39 GLU HB3 H 2.113 -8.784 6.713 1.00 . A A . 39 GLU HB3 1 1 4 4325 1 1 39 GLU HG2 H 3.594 -10.789 5.708 1.00 . A A . 39 GLU HG2 1 1 4 4326 1 1 39 GLU HG3 H 4.569 -9.461 5.099 1.00 . A A . 39 GLU HG3 1 1 4 4327 1 1 39 GLU N N 2.262 -9.907 3.538 1.00 . A A . 39 GLU N 1 1 4 4328 1 1 39 GLU O O 0.173 -8.195 3.296 1.00 . A A . 39 GLU O 1 1 4 4329 1 1 39 GLU OE1 O 3.746 -9.809 8.228 1.00 . A A . 39 GLU OE1 1 1 4 4330 1 1 39 GLU OE2 O 5.616 -9.192 7.332 1.00 . A A . 39 GLU OE2 1 1 4 4331 1 1 40 PRO C C 0.081 -5.836 6.185 1.00 . A A . 40 PRO C 1 1 4 4332 1 1 40 PRO CA C -0.913 -6.896 5.690 1.00 . A A . 40 PRO CA 1 1 4 4333 1 1 40 PRO CB C -1.980 -7.094 6.771 1.00 . A A . 40 PRO CB 1 1 4 4334 1 1 40 PRO CD C -0.666 -9.170 6.554 1.00 . A A . 40 PRO CD 1 1 4 4335 1 1 40 PRO CG C -1.779 -8.499 7.361 1.00 . A A . 40 PRO CG 1 1 4 4336 1 1 40 PRO HA H -1.357 -6.573 4.747 1.00 . A A . 40 PRO HA 1 1 4 4337 1 1 40 PRO HB2 H -1.884 -6.336 7.549 1.00 . A A . 40 PRO HB2 1 1 4 4338 1 1 40 PRO HB3 H -2.978 -7.001 6.344 1.00 . A A . 40 PRO HB3 1 1 4 4339 1 1 40 PRO HD2 H 0.200 -9.392 7.177 1.00 . A A . 40 PRO HD2 1 1 4 4340 1 1 40 PRO HD3 H -1.010 -10.097 6.094 1.00 . A A . 40 PRO HD3 1 1 4 4341 1 1 40 PRO HG2 H -1.502 -8.435 8.414 1.00 . A A . 40 PRO HG2 1 1 4 4342 1 1 40 PRO HG3 H -2.700 -9.078 7.297 1.00 . A A . 40 PRO HG3 1 1 4 4343 1 1 40 PRO N N -0.305 -8.210 5.526 1.00 . A A . 40 PRO N 1 1 4 4344 1 1 40 PRO O O 0.287 -5.664 7.380 1.00 . A A . 40 PRO O 1 1 4 4345 1 1 41 HIS C C 1.385 -3.144 4.022 1.00 . A A . 41 HIS C 1 1 4 4346 1 1 41 HIS CA C 0.821 -3.703 5.325 1.00 . A A . 41 HIS CA 1 1 4 4347 1 1 41 HIS CB C 1.698 -3.341 6.534 1.00 . A A . 41 HIS CB 1 1 4 4348 1 1 41 HIS CD2 C 4.175 -3.925 6.753 1.00 . A A . 41 HIS CD2 1 1 4 4349 1 1 41 HIS CE1 C 4.063 -6.122 7.130 1.00 . A A . 41 HIS CE1 1 1 4 4350 1 1 41 HIS CG C 2.873 -4.256 6.750 1.00 . A A . 41 HIS CG 1 1 4 4351 1 1 41 HIS H H 1.174 -5.605 4.462 1.00 . A A . 41 HIS H 1 1 4 4352 1 1 41 HIS HA H -0.155 -3.265 5.467 1.00 . A A . 41 HIS HA 1 1 4 4353 1 1 41 HIS HB2 H 2.068 -2.323 6.395 1.00 . A A . 41 HIS HB2 1 1 4 4354 1 1 41 HIS HB3 H 1.080 -3.342 7.435 1.00 . A A . 41 HIS HB3 1 1 4 4355 1 1 41 HIS HD1 H 1.947 -6.225 7.066 1.00 . A A . 41 HIS HD1 1 1 4 4356 1 1 41 HIS HD2 H 4.564 -2.937 6.590 1.00 . A A . 41 HIS HD2 1 1 4 4357 1 1 41 HIS HE1 H 4.332 -7.167 7.268 1.00 . A A . 41 HIS HE1 1 1 4 4358 1 1 41 HIS N N 0.679 -5.144 5.198 1.00 . A A . 41 HIS N 1 1 4 4359 1 1 41 HIS ND1 N 2.796 -5.701 7.001 1.00 . A A . 41 HIS ND1 1 1 4 4360 1 1 41 HIS NE2 N 4.971 -5.137 7.012 1.00 . A A . 41 HIS NE2 1 1 4 4361 1 1 41 HIS O O 0.688 -2.631 3.155 1.00 . A A . 41 HIS O 1 1 4 4362 1 1 42 ARG C C 3.708 -3.208 1.774 1.00 . A A . 42 ARG C 1 1 4 4363 1 1 42 ARG CA C 3.443 -4.029 3.011 1.00 . A A . 42 ARG CA 1 1 4 4364 1 1 42 ARG CB C 2.631 -5.238 2.614 1.00 . A A . 42 ARG CB 1 1 4 4365 1 1 42 ARG CD C 4.072 -7.150 3.317 1.00 . A A . 42 ARG CD 1 1 4 4366 1 1 42 ARG CG C 2.806 -6.347 3.613 1.00 . A A . 42 ARG CG 1 1 4 4367 1 1 42 ARG CZ C 6.215 -7.574 4.321 1.00 . A A . 42 ARG CZ 1 1 4 4368 1 1 42 ARG H H 3.017 -3.256 4.956 1.00 . A A . 42 ARG H 1 1 4 4369 1 1 42 ARG HA H 4.386 -4.305 3.453 1.00 . A A . 42 ARG HA 1 1 4 4370 1 1 42 ARG HB2 H 1.576 -4.987 2.512 1.00 . A A . 42 ARG HB2 1 1 4 4371 1 1 42 ARG HB3 H 2.959 -5.573 1.641 1.00 . A A . 42 ARG HB3 1 1 4 4372 1 1 42 ARG HD2 H 3.850 -8.173 3.018 1.00 . A A . 42 ARG HD2 1 1 4 4373 1 1 42 ARG HD3 H 4.653 -6.670 2.530 1.00 . A A . 42 ARG HD3 1 1 4 4374 1 1 42 ARG HE H 4.578 -6.983 5.397 1.00 . A A . 42 ARG HE 1 1 4 4375 1 1 42 ARG HG2 H 2.843 -5.937 4.626 1.00 . A A . 42 ARG HG2 1 1 4 4376 1 1 42 ARG HG3 H 1.905 -6.939 3.504 1.00 . A A . 42 ARG HG3 1 1 4 4377 1 1 42 ARG HH11 H 6.288 -7.635 2.300 1.00 . A A . 42 ARG HH11 1 1 4 4378 1 1 42 ARG HH12 H 7.758 -7.149 3.078 1.00 . A A . 42 ARG HH12 1 1 4 4379 1 1 42 ARG HH21 H 6.589 -8.900 5.806 1.00 . A A . 42 ARG HH21 1 1 4 4380 1 1 42 ARG HH22 H 7.735 -7.611 5.660 1.00 . A A . 42 ARG HH22 1 1 4 4381 1 1 42 ARG N N 2.713 -3.287 4.017 1.00 . A A . 42 ARG N 1 1 4 4382 1 1 42 ARG NE N 4.930 -7.205 4.487 1.00 . A A . 42 ARG NE 1 1 4 4383 1 1 42 ARG NH1 N 6.803 -7.442 3.135 1.00 . A A . 42 ARG NH1 1 1 4 4384 1 1 42 ARG NH2 N 6.903 -8.069 5.347 1.00 . A A . 42 ARG NH2 1 1 4 4385 1 1 42 ARG O O 4.825 -2.899 1.377 1.00 . A A . 42 ARG O 1 1 4 4386 1 1 43 CYS C C 3.690 -1.790 -0.629 1.00 . A A . 43 CYS C 1 1 4 4387 1 1 43 CYS CA C 2.365 -2.298 -0.073 1.00 . A A . 43 CYS CA 1 1 4 4388 1 1 43 CYS CB C 1.426 -1.116 -0.038 1.00 . A A . 43 CYS CB 1 1 4 4389 1 1 43 CYS H H 1.891 -3.071 1.992 1.00 . A A . 43 CYS H 1 1 4 4390 1 1 43 CYS HA H 2.006 -3.057 -0.768 1.00 . A A . 43 CYS HA 1 1 4 4391 1 1 43 CYS HB2 H 1.567 -0.673 -1.022 1.00 . A A . 43 CYS HB2 1 1 4 4392 1 1 43 CYS HB3 H 0.388 -1.436 0.052 1.00 . A A . 43 CYS HB3 1 1 4 4393 1 1 43 CYS N N 2.529 -2.917 1.235 1.00 . A A . 43 CYS N 1 1 4 4394 1 1 43 CYS O O 4.438 -1.064 0.014 1.00 . A A . 43 CYS O 1 1 4 4395 1 1 43 CYS SG S 1.818 0.095 1.255 1.00 . A A . 43 CYS SG 1 1 4 4396 1 1 44 GLN C C 5.000 -1.670 -3.959 1.00 . A A . 44 GLN C 1 1 4 4397 1 1 44 GLN CA C 5.182 -1.913 -2.468 1.00 . A A . 44 GLN CA 1 1 4 4398 1 1 44 GLN CB C 6.187 -3.022 -2.191 1.00 . A A . 44 GLN CB 1 1 4 4399 1 1 44 GLN CD C 8.662 -3.048 -1.888 1.00 . A A . 44 GLN CD 1 1 4 4400 1 1 44 GLN CG C 7.529 -2.778 -2.879 1.00 . A A . 44 GLN CG 1 1 4 4401 1 1 44 GLN H H 3.183 -2.665 -2.408 1.00 . A A . 44 GLN H 1 1 4 4402 1 1 44 GLN HA H 5.497 -0.995 -1.984 1.00 . A A . 44 GLN HA 1 1 4 4403 1 1 44 GLN HB2 H 6.338 -3.104 -1.118 1.00 . A A . 44 GLN HB2 1 1 4 4404 1 1 44 GLN HB3 H 5.770 -3.970 -2.508 1.00 . A A . 44 GLN HB3 1 1 4 4405 1 1 44 GLN HE21 H 8.257 -5.038 -1.767 1.00 . A A . 44 GLN HE21 1 1 4 4406 1 1 44 GLN HE22 H 8.685 -4.262 -0.254 1.00 . A A . 44 GLN HE22 1 1 4 4407 1 1 44 GLN HG2 H 7.646 -3.435 -3.741 1.00 . A A . 44 GLN HG2 1 1 4 4408 1 1 44 GLN HG3 H 7.602 -1.749 -3.232 1.00 . A A . 44 GLN HG3 1 1 4 4409 1 1 44 GLN N N 3.905 -2.216 -1.882 1.00 . A A . 44 GLN N 1 1 4 4410 1 1 44 GLN NE2 N 8.523 -4.221 -1.245 1.00 . A A . 44 GLN NE2 1 1 4 4411 1 1 44 GLN O O 4.591 -2.526 -4.734 1.00 . A A . 44 GLN O 1 1 4 4412 1 1 44 GLN OE1 O 9.582 -2.256 -1.722 1.00 . A A . 44 GLN OE1 1 1 4 4413 1 1 45 MET C C 3.477 -0.093 -5.829 1.00 . A A . 45 MET C 1 1 4 4414 1 1 45 MET CA C 4.314 0.510 -4.695 1.00 . A A . 45 MET CA 1 1 4 4415 1 1 45 MET CB C 5.003 1.770 -5.218 1.00 . A A . 45 MET CB 1 1 4 4416 1 1 45 MET CE C 5.770 0.378 -8.792 1.00 . A A . 45 MET CE 1 1 4 4417 1 1 45 MET CG C 6.009 1.442 -6.321 1.00 . A A . 45 MET CG 1 1 4 4418 1 1 45 MET H H 6.232 -0.123 -3.912 1.00 . A A . 45 MET H 1 1 4 4419 1 1 45 MET HA H 3.681 0.718 -3.824 1.00 . A A . 45 MET HA 1 1 4 4420 1 1 45 MET HB2 H 4.260 2.478 -5.586 1.00 . A A . 45 MET HB2 1 1 4 4421 1 1 45 MET HB3 H 5.537 2.258 -4.407 1.00 . A A . 45 MET HB3 1 1 4 4422 1 1 45 MET HE1 H 6.797 0.080 -8.578 1.00 . A A . 45 MET HE1 1 1 4 4423 1 1 45 MET HE2 H 5.102 -0.416 -8.460 1.00 . A A . 45 MET HE2 1 1 4 4424 1 1 45 MET HE3 H 5.659 0.507 -9.868 1.00 . A A . 45 MET HE3 1 1 4 4425 1 1 45 MET HG2 H 6.949 1.960 -6.137 1.00 . A A . 45 MET HG2 1 1 4 4426 1 1 45 MET HG3 H 6.226 0.374 -6.322 1.00 . A A . 45 MET HG3 1 1 4 4427 1 1 45 MET N N 5.346 -0.418 -4.269 1.00 . A A . 45 MET N 1 1 4 4428 1 1 45 MET O O 3.665 0.237 -6.994 1.00 . A A . 45 MET O 1 1 4 4429 1 1 45 MET SD S 5.382 1.912 -7.939 1.00 . A A . 45 MET SD 1 1 4 4430 1 1 46 PHE C C 2.683 -2.020 -7.675 1.00 . A A . 46 PHE C 1 1 4 4431 1 1 46 PHE CA C 2.126 -2.113 -6.239 1.00 . A A . 46 PHE CA 1 1 4 4432 1 1 46 PHE CB C 0.592 -2.130 -6.283 1.00 . A A . 46 PHE CB 1 1 4 4433 1 1 46 PHE CD1 C 0.805 -4.258 -7.702 1.00 . A A . 46 PHE CD1 1 1 4 4434 1 1 46 PHE CD2 C -1.339 -2.997 -7.692 1.00 . A A . 46 PHE CD2 1 1 4 4435 1 1 46 PHE CE1 C 0.249 -5.200 -8.635 1.00 . A A . 46 PHE CE1 1 1 4 4436 1 1 46 PHE CE2 C -1.903 -3.943 -8.618 1.00 . A A . 46 PHE CE2 1 1 4 4437 1 1 46 PHE CG C 0.018 -3.145 -7.232 1.00 . A A . 46 PHE CG 1 1 4 4438 1 1 46 PHE CZ C -1.107 -5.044 -9.090 1.00 . A A . 46 PHE CZ 1 1 4 4439 1 1 46 PHE H H 2.030 -0.774 -4.579 1.00 . A A . 46 PHE H 1 1 4 4440 1 1 46 PHE HA H 2.507 -3.007 -5.736 1.00 . A A . 46 PHE HA 1 1 4 4441 1 1 46 PHE HB2 H 0.191 -2.312 -5.286 1.00 . A A . 46 PHE HB2 1 1 4 4442 1 1 46 PHE HB3 H 0.241 -1.149 -6.597 1.00 . A A . 46 PHE HB3 1 1 4 4443 1 1 46 PHE HD1 H 1.817 -4.387 -7.347 1.00 . A A . 46 PHE HD1 1 1 4 4444 1 1 46 PHE HD2 H -1.938 -2.170 -7.340 1.00 . A A . 46 PHE HD2 1 1 4 4445 1 1 46 PHE HE1 H 0.852 -6.017 -9.002 1.00 . A A . 46 PHE HE1 1 1 4 4446 1 1 46 PHE HE2 H -2.920 -3.825 -8.961 1.00 . A A . 46 PHE HE2 1 1 4 4447 1 1 46 PHE HZ H -1.527 -5.753 -9.788 1.00 . A A . 46 PHE HZ 1 1 4 4448 1 1 46 PHE N N 2.536 -0.971 -5.420 1.00 . A A . 46 PHE N 1 1 4 4449 1 1 46 PHE O O 2.027 -1.518 -8.579 1.00 . A A . 46 PHE O 1 1 4 4450 1 1 47 CYS C C 5.229 -4.330 -8.825 1.30 . A A . 47 CYS C 1 1 4 4451 1 1 47 CYS CA C 4.231 -3.197 -9.075 0.80 . A A . 47 CYS CA 1 1 4 4452 1 1 47 CYS CB C 4.808 -2.197 -10.082 0.60 . A A . 47 CYS CB 1 1 4 4453 1 1 47 CYS H H 4.598 -2.460 -7.091 1.00 . A A . 47 CYS H 1 1 4 4454 1 1 47 CYS HA H 3.295 -3.619 -9.441 1.10 . A A . 47 CYS HA 1 1 4 4455 1 1 47 CYS HB2 H 5.760 -1.811 -9.716 0.90 . A A . 47 CYS HB2 1 1 4 4456 1 1 47 CYS HB3 H 5.019 -2.706 -11.023 0.90 . A A . 47 CYS HB3 1 1 4 4457 1 1 47 CYS N N 3.918 -2.534 -7.821 0.60 . A A . 47 CYS N 1 1 4 4458 1 1 47 CYS O O 5.884 -4.400 -7.792 1.90 . A A . 47 CYS O 1 1 4 4459 1 1 47 CYS SG S 3.696 -0.805 -10.412 1.30 . A A . 47 CYS SG 1 1 4 4460 1 1 48 ASN C C 6.633 -7.145 -10.481 1.90 . A A . 48 ASN C 1 1 4 4461 1 1 48 ASN CA C 5.564 -6.597 -9.532 2.30 . A A . 48 ASN CA 1 1 4 4462 1 1 48 ASN CB C 4.273 -7.410 -9.643 3.00 . A A . 48 ASN CB 1 1 4 4463 1 1 48 ASN CG C 4.272 -8.528 -8.599 3.70 . A A . 48 ASN CG 1 1 4 4464 1 1 48 ASN H H 5.159 -4.907 -10.788 2.00 . A A . 48 ASN H 1 1 4 4465 1 1 48 ASN HA H 5.946 -6.614 -8.511 2.70 . A A . 48 ASN HA 1 1 4 4466 1 1 48 ASN HB2 H 3.404 -6.773 -9.480 3.30 . A A . 48 ASN HB2 1 1 4 4467 1 1 48 ASN HB3 H 4.180 -7.852 -10.635 3.20 . A A . 48 ASN HB3 1 1 4 4468 1 1 48 ASN HD21 H 4.388 -7.473 -6.850 1.00 . A A . 48 ASN HD21 1 1 4 4469 1 1 48 ASN N N 5.296 -5.206 -9.844 1.70 . A A . 48 ASN N 1 1 4 4470 1 1 48 ASN ND2 N 3.849 -8.120 -7.388 4.10 . A A . 48 ASN ND2 1 1 4 4471 1 1 48 ASN O O 7.763 -7.415 -10.091 2.30 . A A . 48 ASN O 1 1 4 4472 1 1 48 ASN OD1 O 4.626 -9.669 -8.873 4.40 . A A . 48 ASN OD1 1 1 4 4473 1 1 49 GLN C C 7.602 -7.327 -13.749 1.80 . A A . 49 GLN C 1 1 4 4474 1 1 49 GLN CA C 6.957 -8.156 -12.633 2.00 . A A . 49 GLN CA 1 1 4 4475 1 1 49 GLN CB C 6.038 -9.236 -13.213 2.20 . A A . 49 GLN CB 1 1 4 4476 1 1 49 GLN CD C 4.703 -10.049 -15.171 3.40 . A A . 49 GLN CD 1 1 4 4477 1 1 49 GLN CG C 5.493 -8.872 -14.597 2.70 . A A . 49 GLN CG 1 1 4 4478 1 1 49 GLN H H 5.386 -6.808 -12.071 2.50 . A A . 49 GLN H 1 1 4 4479 1 1 49 GLN HA H 7.743 -8.605 -12.026 2.50 . A A . 49 GLN HA 1 1 4 4480 1 1 49 GLN HB2 H 6.582 -10.178 -13.275 2.60 . A A . 49 GLN HB2 1 1 4 4481 1 1 49 GLN HB3 H 5.206 -9.405 -12.531 2.10 . A A . 49 GLN HB3 1 1 4 4482 1 1 49 GLN HE21 H 3.018 -8.909 -15.197 4.50 . A A . 49 GLN HE21 1 1 4 4483 1 1 49 GLN HE22 H 2.757 -10.640 -15.094 4.10 . A A . 49 GLN HE22 1 1 4 4484 1 1 49 GLN HG2 H 4.840 -8.002 -14.536 2.70 . A A . 49 GLN HG2 1 1 4 4485 1 1 49 GLN HG3 H 6.305 -8.632 -15.283 2.80 . A A . 49 GLN HG3 1 1 4 4486 1 1 49 GLN N N 6.200 -7.290 -11.748 2.00 . A A . 49 GLN N 1 1 4 4487 1 1 49 GLN NE2 N 3.373 -9.848 -15.152 4.00 . A A . 49 GLN NE2 1 1 4 4488 1 1 49 GLN O O 6.931 -6.699 -14.559 2.20 . A A . 49 GLN O 1 1 4 4489 1 1 49 GLN OE1 O 5.258 -11.055 -15.596 3.70 . A A . 49 GLN OE1 1 1 4 4490 1 1 50 THR C C 9.312 -4.899 -13.528 1.50 . A A . 50 THR C 1 1 4 4491 1 1 50 THR CA C 9.691 -6.224 -14.231 1.80 . A A . 50 THR CA 1 1 4 4492 1 1 50 THR CB C 9.468 -6.084 -15.740 1.90 . A A . 50 THR CB 1 1 4 4493 1 1 50 THR CG2 C 10.770 -5.777 -16.480 2.30 . A A . 50 THR CG2 1 1 4 4494 1 1 50 THR H H 9.426 -8.180 -13.385 2.00 . A A . 50 THR H 1 1 4 4495 1 1 50 THR HA H 10.740 -6.437 -14.025 2.10 . A A . 50 THR HA 1 1 4 4496 1 1 50 THR HB H 8.749 -5.286 -15.927 2.20 . A A . 50 THR HB 1 1 4 4497 1 1 50 THR HG1 H 9.404 -7.986 -15.877 2.50 . A A . 50 THR HG1 1 1 4 4498 1 1 50 THR HG21 H 11.109 -4.763 -16.268 2.40 . A A . 50 THR HG21 1 1 4 4499 1 1 50 THR HG22 H 10.634 -5.868 -17.557 2.60 . A A . 50 THR HG22 1 1 4 4500 1 1 50 THR HG23 H 11.559 -6.466 -16.181 2.80 . A A . 50 THR HG23 1 1 4 4501 1 1 50 THR N N 8.947 -7.373 -13.729 1.70 . A A . 50 THR N 1 1 4 4502 1 1 50 THR O O 9.776 -3.834 -13.914 2.20 . A A . 50 THR O 1 1 4 4503 1 1 50 THR OG1 O 8.914 -7.268 -16.257 2.20 . A A . 50 THR OG1 1 1 4 4504 1 1 51 ALA C C 7.056 -3.244 -13.507 0.60 . A A . 51 ALA C 1 1 4 4505 1 1 51 ALA CA C 7.470 -3.977 -12.224 0.60 . A A . 51 ALA CA 1 1 4 4506 1 1 51 ALA CB C 8.024 -2.980 -11.206 0.70 . A A . 51 ALA CB 1 1 4 4507 1 1 51 ALA H H 8.501 -5.820 -11.900 0.90 . A A . 51 ALA H 1 1 4 4508 1 1 51 ALA HA H 6.599 -4.491 -11.818 0.70 . A A . 51 ALA HA 1 1 4 4509 1 1 51 ALA HB1 H 7.359 -2.122 -11.104 1.20 . A A . 51 ALA HB1 1 1 4 4510 1 1 51 ALA HB2 H 9.004 -2.614 -11.513 1.00 . A A . 51 ALA HB2 1 1 4 4511 1 1 51 ALA HB3 H 8.126 -3.444 -10.225 1.30 . A A . 51 ALA HB3 1 1 4 4512 1 1 51 ALA N N 8.457 -5.012 -12.488 0.80 . A A . 51 ALA N 1 1 4 4513 1 1 51 ALA O O 7.378 -3.634 -14.622 1.10 . A A . 51 ALA O 1 1 4 4514 1 1 52 CYS C C 5.686 -0.607 -15.034 0.80 . A A . 52 CYS C 1 1 4 4515 1 1 52 CYS CA C 5.257 -1.804 -14.179 0.80 . A A . 52 CYS CA 1 1 4 4516 1 1 52 CYS CB C 4.021 -1.453 -13.365 0.90 . A A . 52 CYS CB 1 1 4 4517 1 1 52 CYS H H 6.334 -1.723 -12.349 0.90 . A A . 52 CYS H 1 1 4 4518 1 1 52 CYS HA H 5.079 -2.678 -14.807 0.80 . A A . 52 CYS HA 1 1 4 4519 1 1 52 CYS HB2 H 3.198 -1.200 -14.033 1.10 . A A . 52 CYS HB2 1 1 4 4520 1 1 52 CYS HB3 H 3.703 -2.321 -12.789 1.00 . A A . 52 CYS HB3 1 1 4 4521 1 1 52 CYS N N 6.309 -2.157 -13.249 0.70 . A A . 52 CYS N 1 1 4 4522 1 1 52 CYS O O 6.736 -0.012 -14.831 1.20 . A A . 52 CYS O 1 1 4 4523 1 1 52 CYS SG S 4.315 -0.080 -12.220 1.00 . A A . 52 CYS SG 1 1 4 4524 1 1 53 PRO C C 3.297 1.548 -15.307 0.80 . A A . 53 PRO C 1 1 4 4525 1 1 53 PRO CA C 4.378 1.074 -16.277 0.70 . A A . 53 PRO CA 1 1 4 4526 1 1 53 PRO CB C 3.762 1.030 -17.673 0.90 . A A . 53 PRO CB 1 1 4 4527 1 1 53 PRO CD C 4.285 -1.268 -16.946 0.80 . A A . 53 PRO CD 1 1 4 4528 1 1 53 PRO CG C 3.553 -0.448 -18.012 0.90 . A A . 53 PRO CG 1 1 4 4529 1 1 53 PRO HA H 5.234 1.749 -16.240 0.80 . A A . 53 PRO HA 1 1 4 4530 1 1 53 PRO HB2 H 2.813 1.567 -17.690 1.00 . A A . 53 PRO HB2 1 1 4 4531 1 1 53 PRO HB3 H 4.423 1.500 -18.401 1.10 . A A . 53 PRO HB3 1 1 4 4532 1 1 53 PRO HD2 H 3.609 -1.954 -16.434 0.80 . A A . 53 PRO HD2 1 1 4 4533 1 1 53 PRO HD3 H 5.106 -1.840 -17.377 0.90 . A A . 53 PRO HD3 1 1 4 4534 1 1 53 PRO HG2 H 2.489 -0.677 -18.002 0.90 . A A . 53 PRO HG2 1 1 4 4535 1 1 53 PRO HG3 H 3.943 -0.664 -19.005 1.00 . A A . 53 PRO HG3 1 1 4 4536 1 1 53 PRO N N 4.803 -0.290 -16.007 0.60 . A A . 53 PRO N 1 1 4 4537 1 1 53 PRO O O 2.604 0.767 -14.667 1.60 . A A . 53 PRO O 1 1 4 4538 1 1 54 ALA C C 0.858 2.752 -14.582 0.90 . A A . 54 ALA C 1 1 4 4539 1 1 54 ALA CA C 2.198 3.435 -14.361 0.80 . A A . 54 ALA CA 1 1 4 4540 1 1 54 ALA CB C 1.996 4.928 -14.584 0.80 . A A . 54 ALA CB 1 1 4 4541 1 1 54 ALA H H 3.965 3.422 -15.617 1.40 . A A . 54 ALA H 1 1 4 4542 1 1 54 ALA HA H 2.554 3.260 -13.346 0.70 . A A . 54 ALA HA 1 1 4 4543 1 1 54 ALA HB1 H 1.924 5.443 -13.625 1.20 . A A . 54 ALA HB1 1 1 4 4544 1 1 54 ALA HB2 H 1.064 5.102 -15.122 1.40 . A A . 54 ALA HB2 1 1 4 4545 1 1 54 ALA HB3 H 2.818 5.352 -15.155 1.30 . A A . 54 ALA HB3 1 1 4 4546 1 1 54 ALA N N 3.203 2.885 -15.255 0.80 . A A . 54 ALA N 1 1 4 4547 1 1 54 ALA O O 0.700 1.877 -15.425 1.50 . A A . 54 ALA O 1 1 4 4548 1 1 55 ASP C C -2.072 4.475 -13.104 1.10 . A A . 55 ASP C 1 1 4 4549 1 1 55 ASP CA C -1.253 3.898 -14.264 1.20 . A A . 55 ASP CA 1 1 4 4550 1 1 55 ASP CB C -2.093 2.839 -14.951 1.40 . A A . 55 ASP CB 1 1 4 4551 1 1 55 ASP CG C -2.961 3.462 -16.047 2.10 . A A . 55 ASP CG 1 1 4 4552 1 1 55 ASP H H -0.072 2.992 -12.784 1.40 . A A . 55 ASP H 1 1 4 4553 1 1 55 ASP HA H -0.920 4.683 -14.943 1.30 . A A . 55 ASP HA 1 1 4 4554 1 1 55 ASP HB2 H -1.442 2.076 -15.370 1.50 . A A . 55 ASP HB2 1 1 4 4555 1 1 55 ASP HB3 H -2.713 2.356 -14.201 1.80 . A A . 55 ASP HB3 1 1 4 4556 1 1 55 ASP N N -0.086 3.223 -13.748 1.00 . A A . 55 ASP N 1 1 4 4557 1 1 55 ASP O O -3.068 3.897 -12.685 1.50 . A A . 55 ASP O 1 1 4 4558 1 1 55 ASP OD1 O -3.194 4.669 -15.996 2.80 . A A . 55 ASP OD1 1 1 4 4559 1 1 55 ASP OD2 O -3.394 2.734 -16.938 2.60 . A A . 55 ASP OD2 1 1 4 4560 1 1 56 CYS C C -3.813 6.665 -12.693 0.80 . A A . 56 CYS C 1 1 4 4561 1 1 56 CYS CA C -2.516 6.489 -11.903 0.80 . A A . 56 CYS CA 1 1 4 4562 1 1 56 CYS CB C -1.801 7.815 -11.681 0.90 . A A . 56 CYS CB 1 1 4 4563 1 1 56 CYS H H -0.660 5.904 -12.434 1.10 . A A . 56 CYS H 1 1 4 4564 1 1 56 CYS HA H -2.713 6.017 -10.942 0.70 . A A . 56 CYS HA 1 1 4 4565 1 1 56 CYS HB2 H -2.171 8.554 -12.392 1.00 . A A . 56 CYS HB2 1 1 4 4566 1 1 56 CYS HB3 H -2.040 8.129 -10.672 0.90 . A A . 56 CYS HB3 1 1 4 4567 1 1 56 CYS N N -1.605 5.636 -12.610 0.90 . A A . 56 CYS N 1 1 4 4568 1 1 56 CYS O O -4.076 5.985 -13.678 1.10 . A A . 56 CYS O 1 1 4 4569 1 1 56 CYS SG S 0.008 7.751 -11.799 1.30 . A A . 56 CYS SG 1 1 4 4570 1 1 57 ASP C C -6.692 7.310 -13.400 0.90 . A A . 57 ASP C 1 1 4 4571 1 1 57 ASP CA C -6.013 7.369 -12.025 1.00 . A A . 57 ASP CA 1 1 4 4572 1 1 57 ASP CB C -6.628 8.455 -11.141 1.10 . A A . 57 ASP CB 1 1 4 4573 1 1 57 ASP CG C -8.122 8.195 -10.935 1.60 . A A . 57 ASP CG 1 1 4 4574 1 1 57 ASP H H -4.189 8.481 -11.855 1.10 . A A . 57 ASP H 1 1 4 4575 1 1 57 ASP HA H -6.097 6.393 -11.550 1.20 . A A . 57 ASP HA 1 1 4 4576 1 1 57 ASP HB2 H -6.140 8.467 -10.166 1.20 . A A . 57 ASP HB2 1 1 4 4577 1 1 57 ASP HB3 H -6.491 9.440 -11.588 1.10 . A A . 57 ASP HB3 1 1 4 4578 1 1 57 ASP N N -4.595 7.628 -12.180 0.80 . A A . 57 ASP N 1 1 4 4579 1 1 57 ASP O O -6.990 6.244 -13.924 1.00 . A A . 57 ASP O 1 1 4 4580 1 1 57 ASP OD1 O -8.540 7.044 -11.056 2.20 . A A . 57 ASP OD1 1 1 4 4581 1 1 57 ASP OD2 O -8.849 9.146 -10.655 2.00 . A A . 57 ASP OD2 1 1 4 4582 1 1 58 PRO C C -4.825 9.829 -13.851 1.20 . A A . 58 PRO C 1 1 4 4583 1 1 58 PRO CA C -5.922 9.232 -14.736 1.20 . A A . 58 PRO CA 1 1 4 4584 1 1 58 PRO CB C -6.691 10.353 -15.446 1.40 . A A . 58 PRO CB 1 1 4 4585 1 1 58 PRO CD C -8.229 9.157 -13.931 1.30 . A A . 58 PRO CD 1 1 4 4586 1 1 58 PRO CG C -8.130 10.331 -14.908 1.50 . A A . 58 PRO CG 1 1 4 4587 1 1 58 PRO HA H -5.468 8.553 -15.459 1.30 . A A . 58 PRO HA 1 1 4 4588 1 1 58 PRO HB2 H -6.229 11.324 -15.266 1.50 . A A . 58 PRO HB2 1 1 4 4589 1 1 58 PRO HB3 H -6.688 10.188 -16.523 1.70 . A A . 58 PRO HB3 1 1 4 4590 1 1 58 PRO HD2 H -8.454 9.500 -12.921 1.30 . A A . 58 PRO HD2 1 1 4 4591 1 1 58 PRO HD3 H -8.996 8.445 -14.238 1.40 . A A . 58 PRO HD3 1 1 4 4592 1 1 58 PRO HG2 H -8.369 11.269 -14.406 1.50 . A A . 58 PRO HG2 1 1 4 4593 1 1 58 PRO HG3 H -8.840 10.207 -15.726 1.70 . A A . 58 PRO HG3 1 1 4 4594 1 1 58 PRO N N -6.922 8.520 -13.957 1.00 . A A . 58 PRO N 1 1 4 4595 1 1 58 PRO O O -3.698 9.351 -13.806 1.50 . A A . 58 PRO O 1 1 4 4596 1 1 59 ASN C C -3.547 11.885 -11.720 1.30 . A A . 59 ASN C 1 1 4 4597 1 1 59 ASN CA C -4.331 12.020 -13.015 1.30 . A A . 59 ASN CA 1 1 4 4598 1 1 59 ASN CB C -5.157 13.315 -13.010 1.50 . A A . 59 ASN CB 1 1 4 4599 1 1 59 ASN CG C -4.616 14.350 -14.003 1.90 . A A . 59 ASN CG 1 1 4 4600 1 1 59 ASN H H -6.177 11.063 -12.880 1.10 . A A . 59 ASN H 1 1 4 4601 1 1 59 ASN HA H -3.652 11.931 -13.838 1.50 . A A . 59 ASN HA 1 1 4 4602 1 1 59 ASN HB2 H -6.195 13.095 -13.278 1.70 . A A . 59 ASN HB2 1 1 4 4603 1 1 59 ASN HB3 H -5.142 13.755 -12.010 1.70 . A A . 59 ASN HB3 1 1 4 4604 1 1 59 ASN HD21 H -2.923 13.330 -13.946 2.10 . A A . 59 ASN HD21 1 1 4 4605 1 1 59 ASN HD22 H -2.735 14.976 -14.565 2.50 . A A . 59 ASN HD22 1 1 4 4606 1 1 59 ASN N N -5.235 10.909 -13.160 1.10 . A A . 59 ASN N 1 1 4 4607 1 1 59 ASN ND2 N -3.295 14.228 -14.199 2.00 . A A . 59 ASN ND2 1 1 4 4608 1 1 59 ASN O O -2.328 11.791 -11.660 1.70 . A A . 59 ASN O 1 1 4 4609 1 1 59 ASN OD1 O -5.338 15.184 -14.536 2.70 . A A . 59 ASN OD1 1 1 4 4610 1 1 60 THR C C -4.097 11.507 -8.312 0.90 . A A . 60 THR C 1 1 4 4611 1 1 60 THR CA C -4.055 12.524 -9.454 1.20 . A A . 60 THR CA 1 1 4 4612 1 1 60 THR CB C -4.937 13.745 -9.210 1.40 . A A . 60 THR CB 1 1 4 4613 1 1 60 THR CG2 C -6.361 13.425 -9.614 1.40 . A A . 60 THR CG2 1 1 4 4614 1 1 60 THR H H -5.324 11.797 -11.097 1.00 . A A . 60 THR H 1 1 4 4615 1 1 60 THR HA H -3.069 12.905 -9.555 1.40 . A A . 60 THR HA 1 1 4 4616 1 1 60 THR HB H -4.564 14.599 -9.777 1.90 . A A . 60 THR HB 1 1 4 4617 1 1 60 THR HG1 H -5.435 13.460 -7.390 2.30 . A A . 60 THR HG1 1 1 4 4618 1 1 60 THR HG21 H -6.489 12.342 -9.623 1.90 . A A . 60 THR HG21 1 1 4 4619 1 1 60 THR HG22 H -6.558 13.804 -10.613 1.80 . A A . 60 THR HG22 1 1 4 4620 1 1 60 THR HG23 H -7.058 13.862 -8.905 1.70 . A A . 60 THR HG23 1 1 4 4621 1 1 60 THR N N -4.410 11.891 -10.711 1.10 . A A . 60 THR N 1 1 4 4622 1 1 60 THR O O -3.142 10.810 -7.995 1.10 . A A . 60 THR O 1 1 4 4623 1 1 60 THR OG1 O -4.901 14.095 -7.850 2.10 . A A . 60 THR OG1 1 1 4 4624 1 1 61 GLN C C -4.673 10.578 -5.500 0.90 . A A . 61 GLN C 1 1 4 4625 1 1 61 GLN CA C -5.682 10.605 -6.673 0.80 . A A . 61 GLN CA 1 1 4 4626 1 1 61 GLN CB C -5.887 9.209 -7.268 1.00 . A A . 61 GLN CB 1 1 4 4627 1 1 61 GLN CD C -5.933 6.736 -6.877 1.90 . A A . 61 GLN CD 1 1 4 4628 1 1 61 GLN CG C -5.548 8.092 -6.281 1.40 . A A . 61 GLN CG 1 1 4 4629 1 1 61 GLN H H -5.855 12.236 -8.159 1.20 . A A . 61 GLN H 1 1 4 4630 1 1 61 GLN HA H -6.618 11.003 -6.284 0.70 . A A . 61 GLN HA 1 1 4 4631 1 1 61 GLN HB2 H -6.921 9.103 -7.594 1.60 . A A . 61 GLN HB2 1 1 4 4632 1 1 61 GLN HB3 H -5.276 9.102 -8.165 1.60 . A A . 61 GLN HB3 1 1 4 4633 1 1 61 GLN HE21 H -7.548 6.134 -5.796 2.60 . A A . 61 GLN HE21 1 1 4 4634 1 1 61 GLN HE22 H -6.095 5.175 -5.582 2.80 . A A . 61 GLN HE22 1 1 4 4635 1 1 61 GLN HG2 H -4.483 8.106 -6.045 1.80 . A A . 61 GLN HG2 1 1 4 4636 1 1 61 GLN HG3 H -6.088 8.234 -5.346 1.90 . A A . 61 GLN HG3 1 1 4 4637 1 1 61 GLN N N -5.304 11.514 -7.745 0.90 . A A . 61 GLN N 1 1 4 4638 1 1 61 GLN NE2 N -6.583 5.944 -6.007 2.40 . A A . 61 GLN NE2 1 1 4 4639 1 1 61 GLN O O -4.786 9.772 -4.585 1.50 . A A . 61 GLN O 1 1 4 4640 1 1 61 GLN OE1 O -5.665 6.439 -8.036 2.40 . A A . 61 GLN OE1 1 1 4 4641 1 1 62 ALA C C -2.037 9.679 -5.398 0.90 . A A . 62 ALA C 1 1 4 4642 1 1 62 ALA CA C -2.328 11.172 -5.212 1.00 . A A . 62 ALA CA 1 1 4 4643 1 1 62 ALA CB C -2.040 11.596 -3.770 1.30 . A A . 62 ALA CB 1 1 4 4644 1 1 62 ALA H H -3.955 12.421 -5.873 1.50 . A A . 62 ALA H 1 1 4 4645 1 1 62 ALA HA H -1.709 11.725 -5.913 1.20 . A A . 62 ALA HA 1 1 4 4646 1 1 62 ALA HB1 H -2.888 12.133 -3.346 1.70 . A A . 62 ALA HB1 1 1 4 4647 1 1 62 ALA HB2 H -1.170 12.251 -3.726 1.60 . A A . 62 ALA HB2 1 1 4 4648 1 1 62 ALA HB3 H -1.840 10.727 -3.144 1.70 . A A . 62 ALA HB3 1 1 4 4649 1 1 62 ALA N N -3.699 11.505 -5.564 1.00 . A A . 62 ALA N 1 1 4 4650 1 1 62 ALA O O -2.377 8.843 -4.569 1.80 . A A . 62 ALA O 1 1 4 4651 1 1 63 SER C C -0.301 7.822 -8.063 0.60 . A A . 63 SER C 1 1 4 4652 1 1 63 SER CA C -1.421 8.056 -7.051 0.50 . A A . 63 SER CA 1 1 4 4653 1 1 63 SER CB C -2.753 7.813 -7.750 0.60 . A A . 63 SER CB 1 1 4 4654 1 1 63 SER H H -0.885 10.132 -7.028 1.20 . A A . 63 SER H 1 1 4 4655 1 1 63 SER HA H -1.285 7.395 -6.194 0.50 . A A . 63 SER HA 1 1 4 4656 1 1 63 SER HB2 H -3.411 8.671 -7.628 1.20 . A A . 63 SER HB2 1 1 4 4657 1 1 63 SER HB3 H -2.595 7.657 -8.818 0.90 . A A . 63 SER HB3 1 1 4 4658 1 1 63 SER HG H -3.734 6.921 -6.378 1.60 . A A . 63 SER HG 1 1 4 4659 1 1 63 SER N N -1.382 9.414 -6.543 0.60 . A A . 63 SER N 1 1 4 4660 1 1 63 SER O O -0.485 7.148 -9.070 1.60 . A A . 63 SER O 1 1 4 4661 1 1 63 SER OG O -3.394 6.677 -7.229 1.30 . A A . 63 SER OG 1 1 4 4662 1 1 64 CYS C C 3.289 8.188 -7.562 0.50 . A A . 64 CYS C 1 1 4 4663 1 1 64 CYS CA C 2.036 7.867 -8.384 0.50 . A A . 64 CYS CA 1 1 4 4664 1 1 64 CYS CB C 2.160 8.470 -9.782 0.50 . A A . 64 CYS CB 1 1 4 4665 1 1 64 CYS H H 0.913 9.218 -7.159 1.40 . A A . 64 CYS H 1 1 4 4666 1 1 64 CYS HA H 1.864 6.792 -8.428 0.60 . A A . 64 CYS HA 1 1 4 4667 1 1 64 CYS HB2 H 2.896 9.273 -9.759 0.70 . A A . 64 CYS HB2 1 1 4 4668 1 1 64 CYS HB3 H 2.528 7.715 -10.474 0.70 . A A . 64 CYS HB3 1 1 4 4669 1 1 64 CYS N N 0.863 8.408 -7.741 0.60 . A A . 64 CYS N 1 1 4 4670 1 1 64 CYS O O 4.116 9.004 -7.949 1.10 . A A . 64 CYS O 1 1 4 4671 1 1 64 CYS SG S 0.599 9.136 -10.420 1.30 . A A . 64 CYS SG 1 1 4 4672 1 1 65 GLU C C 5.806 7.957 -6.110 1.00 . A A . 65 GLU C 1 1 4 4673 1 1 65 GLU CA C 4.419 7.875 -5.466 1.10 . A A . 65 GLU CA 1 1 4 4674 1 1 65 GLU CB C 4.444 6.876 -4.311 1.30 . A A . 65 GLU CB 1 1 4 4675 1 1 65 GLU CD C 5.612 8.766 -3.149 1.90 . A A . 65 GLU CD 1 1 4 4676 1 1 65 GLU CG C 4.707 7.546 -2.962 1.50 . A A . 65 GLU CG 1 1 4 4677 1 1 65 GLU H H 2.778 6.722 -6.210 1.60 . A A . 65 GLU H 1 1 4 4678 1 1 65 GLU HA H 4.163 8.870 -5.160 1.30 . A A . 65 GLU HA 1 1 4 4679 1 1 65 GLU HB2 H 3.501 6.334 -4.280 1.30 . A A . 65 GLU HB2 1 1 4 4680 1 1 65 GLU HB3 H 5.211 6.129 -4.509 1.50 . A A . 65 GLU HB3 1 1 4 4681 1 1 65 GLU HG2 H 3.771 7.866 -2.502 1.70 . A A . 65 GLU HG2 1 1 4 4682 1 1 65 GLU HG3 H 5.192 6.848 -2.279 1.70 . A A . 65 GLU HG3 1 1 4 4683 1 1 65 GLU N N 3.373 7.499 -6.409 1.00 . A A . 65 GLU N 1 1 4 4684 1 1 65 GLU O O 6.626 8.824 -5.833 1.10 . A A . 65 GLU O 1 1 4 4685 1 1 65 GLU OE1 O 6.801 8.581 -3.403 2.40 . A A . 65 GLU OE1 1 1 4 4686 1 1 65 GLU OE2 O 5.116 9.886 -3.039 1.90 . A A . 65 GLU OE2 1 1 4 4687 1 1 66 CYS C C 8.216 6.332 -7.680 0.90 . A A . 66 CYS C 1 1 4 4688 1 1 66 CYS CA C 7.005 6.002 -6.802 1.00 . A A . 66 CYS CA 1 1 4 4689 1 1 66 CYS CB C 6.413 4.659 -7.214 1.20 . A A . 66 CYS CB 1 1 4 4690 1 1 66 CYS H H 5.090 6.608 -7.281 1.10 . A A . 66 CYS H 1 1 4 4691 1 1 66 CYS HA H 7.246 6.023 -5.740 1.10 . A A . 66 CYS HA 1 1 4 4692 1 1 66 CYS HB2 H 6.900 4.328 -8.130 1.20 . A A . 66 CYS HB2 1 1 4 4693 1 1 66 CYS HB3 H 6.635 3.962 -6.424 1.50 . A A . 66 CYS HB3 1 1 4 4694 1 1 66 CYS N N 5.964 6.968 -6.983 1.00 . A A . 66 CYS N 1 1 4 4695 1 1 66 CYS O O 8.695 5.509 -8.450 1.10 . A A . 66 CYS O 1 1 4 4696 1 1 66 CYS SG S 4.614 4.598 -7.461 1.70 . A A . 66 CYS SG 1 1 4 4697 1 1 67 PRO C C 9.595 7.553 -5.223 0.90 . A A . 67 PRO C 1 1 4 4698 1 1 67 PRO CA C 9.815 7.927 -6.691 0.90 . A A . 67 PRO CA 1 1 4 4699 1 1 67 PRO CB C 9.977 9.445 -6.819 0.90 . A A . 67 PRO CB 1 1 4 4700 1 1 67 PRO CD C 8.099 8.716 -8.246 0.80 . A A . 67 PRO CD 1 1 4 4701 1 1 67 PRO CG C 8.895 9.942 -7.791 0.80 . A A . 67 PRO CG 1 1 4 4702 1 1 67 PRO HA H 10.702 7.412 -7.060 1.10 . A A . 67 PRO HA 1 1 4 4703 1 1 67 PRO HB2 H 9.853 9.922 -5.843 1.00 . A A . 67 PRO HB2 1 1 4 4704 1 1 67 PRO HB3 H 10.970 9.689 -7.204 0.80 . A A . 67 PRO HB3 1 1 4 4705 1 1 67 PRO HD2 H 7.040 8.811 -8.007 0.70 . A A . 67 PRO HD2 1 1 4 4706 1 1 67 PRO HD3 H 8.195 8.554 -9.320 0.90 . A A . 67 PRO HD3 1 1 4 4707 1 1 67 PRO HG2 H 8.242 10.661 -7.296 0.80 . A A . 67 PRO HG2 1 1 4 4708 1 1 67 PRO HG3 H 9.349 10.441 -8.647 1.00 . A A . 67 PRO HG3 1 1 4 4709 1 1 67 PRO N N 8.675 7.592 -7.530 0.80 . A A . 67 PRO N 1 1 4 4710 1 1 67 PRO O O 8.474 7.481 -4.736 1.30 . A A . 67 PRO O 1 1 4 4711 1 1 68 GLU C C 10.067 4.974 -4.263 1.10 . A A . 68 GLU C 1 1 4 4712 1 1 68 GLU CA C 11.219 5.980 -4.292 1.20 . A A . 68 GLU CA 1 1 4 4713 1 1 68 GLU CB C 11.973 5.942 -2.960 1.50 . A A . 68 GLU CB 1 1 4 4714 1 1 68 GLU CD C 13.391 7.188 -1.317 2.80 . A A . 68 GLU CD 1 1 4 4715 1 1 68 GLU CG C 12.838 7.185 -2.744 2.10 . A A . 68 GLU CG 1 1 4 4716 1 1 68 GLU H H 11.303 8.108 -4.265 1.60 . A A . 68 GLU H 1 1 4 4717 1 1 68 GLU HA H 11.873 5.722 -5.124 1.30 . A A . 68 GLU HA 1 1 4 4718 1 1 68 GLU HB2 H 11.261 5.849 -2.140 1.90 . A A . 68 GLU HB2 1 1 4 4719 1 1 68 GLU HB3 H 12.603 5.054 -2.921 1.90 . A A . 68 GLU HB3 1 1 4 4720 1 1 68 GLU HG2 H 13.672 7.201 -3.446 2.40 . A A . 68 GLU HG2 1 1 4 4721 1 1 68 GLU HG3 H 12.257 8.095 -2.898 2.50 . A A . 68 GLU HG3 1 1 4 4722 1 1 68 GLU N N 10.745 7.332 -4.554 1.20 . A A . 68 GLU N 1 1 4 4723 1 1 68 GLU O O 9.491 4.667 -3.226 1.20 . A A . 68 GLU O 1 1 4 4724 1 1 68 GLU OE1 O 13.238 6.181 -0.627 3.40 . A A . 68 GLU OE1 1 1 4 4725 1 1 68 GLU OE2 O 13.970 8.195 -0.913 3.30 . A A . 68 GLU OE2 1 1 4 4726 1 1 69 GLY C C 10.831 3.598 -7.516 1.20 . A A . 69 GLY C 1 1 4 4727 1 1 69 GLY CA C 10.614 3.421 -6.009 1.50 . A A . 69 GLY CA 1 1 4 4728 1 1 69 GLY H H 9.097 4.938 -6.054 1.40 . A A . 69 GLY H 1 1 4 4729 1 1 69 GLY HA2 H 11.567 3.453 -5.479 1.70 . A A . 69 GLY HA2 1 1 4 4730 1 1 69 GLY HA3 H 10.100 2.479 -5.805 1.80 . A A . 69 GLY HA3 1 1 4 4731 1 1 69 GLY N N 9.787 4.492 -5.485 1.20 . A A . 69 GLY N 1 1 4 4732 1 1 69 GLY O O 10.773 2.651 -8.291 1.40 . A A . 69 GLY O 1 1 4 4733 1 1 70 TYR C C 12.325 3.983 -9.834 0.80 . A A . 70 TYR C 1 1 4 4734 1 1 70 TYR CA C 11.841 5.226 -9.066 0.80 . A A . 70 TYR CA 1 1 4 4735 1 1 70 TYR CB C 13.015 6.141 -8.693 0.60 . A A . 70 TYR CB 1 1 4 4736 1 1 70 TYR CD1 C 13.922 4.641 -6.840 1.30 . A A . 70 TYR CD1 1 1 4 4737 1 1 70 TYR CD2 C 15.461 5.424 -8.631 1.50 . A A . 70 TYR CD2 1 1 4 4738 1 1 70 TYR CE1 C 15.003 3.913 -6.227 1.40 . A A . 70 TYR CE1 1 1 4 4739 1 1 70 TYR CE2 C 16.543 4.695 -8.025 1.70 . A A . 70 TYR CE2 1 1 4 4740 1 1 70 TYR CG C 14.147 5.397 -8.044 0.70 . A A . 70 TYR CG 1 1 4 4741 1 1 70 TYR CZ C 16.312 3.938 -6.824 1.10 . A A . 70 TYR CZ 1 1 4 4742 1 1 70 TYR H H 10.641 5.606 -7.337 1.00 . A A . 70 TYR H 1 1 4 4743 1 1 70 TYR HA H 11.144 5.768 -9.705 0.90 . A A . 70 TYR HA 1 1 4 4744 1 1 70 TYR HB2 H 13.396 6.639 -9.585 0.60 . A A . 70 TYR HB2 1 1 4 4745 1 1 70 TYR HB3 H 12.678 6.923 -8.012 0.60 . A A . 70 TYR HB3 1 1 4 4746 1 1 70 TYR HD1 H 12.937 4.617 -6.399 2.10 . A A . 70 TYR HD1 1 1 4 4747 1 1 70 TYR HD2 H 15.636 5.995 -9.531 2.30 . A A . 70 TYR HD2 1 1 4 4748 1 1 70 TYR HE1 H 14.831 3.352 -5.321 2.10 . A A . 70 TYR HE1 1 1 4 4749 1 1 70 TYR HE2 H 17.525 4.713 -8.473 2.50 . A A . 70 TYR HE2 1 1 4 4750 1 1 70 TYR HH H 17.478 2.421 -6.720 1.50 . A A . 70 TYR HH 1 1 4 4751 1 1 70 TYR N N 11.077 4.878 -7.871 0.90 . A A . 70 TYR N 1 1 4 4752 1 1 70 TYR O O 12.985 3.106 -9.291 1.10 . A A . 70 TYR O 1 1 4 4753 1 1 70 TYR OH O 17.345 3.231 -6.245 1.30 . A A . 70 TYR OH 1 1 4 4754 1 1 71 ILE C C 10.940 5.504 -12.725 0.90 . A A . 71 ILE C 1 1 4 4755 1 1 71 ILE CA C 12.199 5.164 -11.923 1.00 . A A . 71 ILE CA 1 1 4 4756 1 1 71 ILE CB C 13.379 4.915 -12.867 1.20 . A A . 71 ILE CB 1 1 4 4757 1 1 71 ILE CD1 C 15.361 6.436 -12.427 1.80 . A A . 71 ILE CD1 1 1 4 4758 1 1 71 ILE CG1 C 14.712 5.082 -12.136 1.40 . A A . 71 ILE CG1 1 1 4 4759 1 1 71 ILE CG2 C 13.307 5.834 -14.087 1.80 . A A . 71 ILE CG2 1 1 4 4760 1 1 71 ILE H H 11.516 3.174 -11.530 1.10 . A A . 71 ILE H 1 1 4 4761 1 1 71 ILE HA H 12.416 5.972 -11.225 1.20 . A A . 71 ILE HA 1 1 4 4762 1 1 71 ILE HB H 13.316 3.885 -13.218 1.70 . A A . 71 ILE HB 1 1 4 4763 1 1 71 ILE HD11 H 15.983 6.385 -13.320 2.20 . A A . 71 ILE HD11 1 1 4 4764 1 1 71 ILE HD12 H 15.991 6.753 -11.597 2.30 . A A . 71 ILE HD12 1 1 4 4765 1 1 71 ILE HD13 H 14.603 7.203 -12.587 2.10 . A A . 71 ILE HD13 1 1 4 4766 1 1 71 ILE HG12 H 14.559 4.973 -11.062 1.60 . A A . 71 ILE HG12 1 1 4 4767 1 1 71 ILE HG13 H 15.393 4.284 -12.434 1.70 . A A . 71 ILE HG13 1 1 4 4768 1 1 71 ILE HG21 H 12.587 5.457 -14.813 2.30 . A A . 71 ILE HG21 1 1 4 4769 1 1 71 ILE HG22 H 14.277 5.906 -14.579 2.20 . A A . 71 ILE HG22 1 1 4 4770 1 1 71 ILE HG23 H 13.000 6.839 -13.799 2.20 . A A . 71 ILE HG23 1 1 4 4771 1 1 71 ILE N N 11.952 3.978 -11.126 0.90 . A A . 71 ILE N 1 1 4 4772 1 1 71 ILE O O 10.446 4.709 -13.515 0.90 . A A . 71 ILE O 1 1 4 4773 1 1 72 LEU C C 10.250 7.120 -14.893 0.80 . A A . 72 LEU C 1 1 4 4774 1 1 72 LEU CA C 9.694 7.424 -13.498 0.80 . A A . 72 LEU CA 1 1 4 4775 1 1 72 LEU CB C 9.725 8.935 -13.251 0.80 . A A . 72 LEU CB 1 1 4 4776 1 1 72 LEU CD1 C 7.799 10.530 -13.009 0.60 . A A . 72 LEU CD1 1 1 4 4777 1 1 72 LEU CD2 C 7.773 8.355 -11.771 0.70 . A A . 72 LEU CD2 1 1 4 4778 1 1 72 LEU CG C 8.650 9.472 -12.309 0.70 . A A . 72 LEU CG 1 1 4 4779 1 1 72 LEU H H 10.522 7.114 -11.546 0.90 . A A . 72 LEU H 1 1 4 4780 1 1 72 LEU HA H 8.686 7.028 -13.451 0.80 . A A . 72 LEU HA 1 1 4 4781 1 1 72 LEU HB2 H 10.693 9.197 -12.840 1.00 . A A . 72 LEU HB2 1 1 4 4782 1 1 72 LEU HB3 H 9.624 9.450 -14.201 1.00 . A A . 72 LEU HB3 1 1 4 4783 1 1 72 LEU HD11 H 8.100 11.533 -12.707 1.10 . A A . 72 LEU HD11 1 1 4 4784 1 1 72 LEU HD12 H 6.745 10.402 -12.763 1.10 . A A . 72 LEU HD12 1 1 4 4785 1 1 72 LEU HD13 H 7.905 10.456 -14.092 1.20 . A A . 72 LEU HD13 1 1 4 4786 1 1 72 LEU HD21 H 8.393 7.553 -11.372 1.40 . A A . 72 LEU HD21 1 1 4 4787 1 1 72 LEU HD22 H 7.157 7.950 -12.573 1.20 . A A . 72 LEU HD22 1 1 4 4788 1 1 72 LEU HD23 H 7.120 8.729 -10.986 1.20 . A A . 72 LEU HD23 1 1 4 4789 1 1 72 LEU HG H 9.149 9.946 -11.463 0.70 . A A . 72 LEU HG 1 1 4 4790 1 1 72 LEU N N 10.460 6.736 -12.470 0.80 . A A . 72 LEU N 1 1 4 4791 1 1 72 LEU O O 11.410 7.366 -15.202 0.90 . A A . 72 LEU O 1 1 4 4792 1 1 73 ASP C C 7.135 6.566 -16.821 1.20 . A A . 73 ASP C 1 1 4 4793 1 1 73 ASP CA C 8.204 7.400 -16.092 1.00 . A A . 73 ASP CA 1 1 4 4794 1 1 73 ASP CB C 8.722 8.612 -16.881 1.50 . A A . 73 ASP CB 1 1 4 4795 1 1 73 ASP CG C 9.738 8.165 -17.933 2.00 . A A . 73 ASP CG 1 1 4 4796 1 1 73 ASP H H 9.414 5.628 -16.024 0.80 . A A . 73 ASP H 1 1 4 4797 1 1 73 ASP HA H 7.743 7.758 -15.186 1.20 . A A . 73 ASP HA 1 1 4 4798 1 1 73 ASP HB2 H 7.898 9.121 -17.381 1.90 . A A . 73 ASP HB2 1 1 4 4799 1 1 73 ASP HB3 H 9.197 9.329 -16.212 1.90 . A A . 73 ASP HB3 1 1 4 4800 1 1 73 ASP N N 9.328 6.571 -15.703 0.90 . A A . 73 ASP N 1 1 4 4801 1 1 73 ASP O O 6.452 5.720 -16.260 1.70 . A A . 73 ASP O 1 1 4 4802 1 1 73 ASP OD1 O 9.653 7.024 -18.382 2.80 . A A . 73 ASP OD1 1 1 4 4803 1 1 73 ASP OD2 O 10.603 8.965 -18.290 2.30 . A A . 73 ASP OD2 1 1 4 4804 1 1 74 ASP C C 5.138 5.448 -18.598 1.40 . A A . 74 ASP C 1 1 4 4805 1 1 74 ASP CA C 5.792 6.805 -18.822 1.80 . A A . 74 ASP CA 1 1 4 4806 1 1 74 ASP CB C 6.021 7.047 -20.314 2.60 . A A . 74 ASP CB 1 1 4 4807 1 1 74 ASP CG C 6.805 5.874 -20.908 3.20 . A A . 74 ASP CG 1 1 4 4808 1 1 74 ASP H H 7.836 7.467 -18.330 1.40 . A A . 74 ASP H 1 1 4 4809 1 1 74 ASP HA H 5.137 7.554 -18.380 2.30 . A A . 74 ASP HA 1 1 4 4810 1 1 74 ASP HB2 H 5.071 7.142 -20.840 3.00 . A A . 74 ASP HB2 1 1 4 4811 1 1 74 ASP HB3 H 6.585 7.966 -20.472 3.10 . A A . 74 ASP HB3 1 1 4 4812 1 1 74 ASP N N 7.053 6.896 -18.107 1.30 . A A . 74 ASP N 1 1 4 4813 1 1 74 ASP O O 5.473 4.443 -19.213 1.80 . A A . 74 ASP O 1 1 4 4814 1 1 74 ASP OD1 O 7.664 5.331 -20.215 3.70 . A A . 74 ASP OD1 1 1 4 4815 1 1 74 ASP OD2 O 6.548 5.518 -22.057 3.60 . A A . 74 ASP OD2 1 1 4 4816 1 1 75 GLY C C 3.081 7.623 -16.781 1.10 . A A . 75 GLY C 1 1 4 4817 1 1 75 GLY CA C 3.104 6.495 -17.836 1.10 . A A . 75 GLY CA 1 1 4 4818 1 1 75 GLY H H 4.305 5.055 -16.791 1.30 . A A . 75 GLY H 1 1 4 4819 1 1 75 GLY HA2 H 3.262 6.938 -18.810 1.50 . A A . 75 GLY HA2 1 1 4 4820 1 1 75 GLY HA3 H 2.168 5.946 -17.802 1.30 . A A . 75 GLY HA3 1 1 4 4821 1 1 75 GLY N N 4.175 5.514 -17.665 1.00 . A A . 75 GLY N 1 1 4 4822 1 1 75 GLY O O 2.387 8.624 -16.913 1.40 . A A . 75 GLY O 1 1 4 4823 1 1 76 PHE C C 4.418 7.116 -13.333 0.80 . A A . 76 PHE C 1 1 4 4824 1 1 76 PHE CA C 3.797 8.009 -14.436 0.90 . A A . 76 PHE CA 1 1 4 4825 1 1 76 PHE CB C 2.336 8.300 -14.072 1.00 . A A . 76 PHE CB 1 1 4 4826 1 1 76 PHE CD1 C 2.880 10.129 -12.380 1.80 . A A . 76 PHE CD1 1 1 4 4827 1 1 76 PHE CD2 C 1.290 10.620 -14.230 2.00 . A A . 76 PHE CD2 1 1 4 4828 1 1 76 PHE CE1 C 2.723 11.472 -11.886 2.50 . A A . 76 PHE CE1 1 1 4 4829 1 1 76 PHE CE2 C 1.131 11.964 -13.739 2.70 . A A . 76 PHE CE2 1 1 4 4830 1 1 76 PHE CG C 2.166 9.698 -13.555 1.20 . A A . 76 PHE CG 1 1 4 4831 1 1 76 PHE CZ C 1.848 12.388 -12.566 2.80 . A A . 76 PHE CZ 1 1 4 4832 1 1 76 PHE H H 4.528 6.644 -15.983 1.00 . A A . 76 PHE H 1 1 4 4833 1 1 76 PHE HA H 4.373 8.933 -14.508 0.80 . A A . 76 PHE HA 1 1 4 4834 1 1 76 PHE HB2 H 1.676 8.163 -14.927 1.60 . A A . 76 PHE HB2 1 1 4 4835 1 1 76 PHE HB3 H 2.006 7.604 -13.301 1.30 . A A . 76 PHE HB3 1 1 4 4836 1 1 76 PHE HD1 H 3.534 9.441 -11.866 2.30 . A A . 76 PHE HD1 1 1 4 4837 1 1 76 PHE HD2 H 0.747 10.301 -15.107 2.50 . A A . 76 PHE HD2 1 1 4 4838 1 1 76 PHE HE1 H 3.263 11.790 -11.006 3.20 . A A . 76 PHE HE1 1 1 4 4839 1 1 76 PHE HE2 H 0.474 12.652 -14.250 3.50 . A A . 76 PHE HE2 1 1 4 4840 1 1 76 PHE HZ H 1.728 13.396 -12.195 3.50 . A A . 76 PHE HZ 1 1 4 4841 1 1 76 PHE N N 3.892 7.377 -15.747 0.90 . A A . 76 PHE N 1 1 4 4842 1 1 76 PHE O O 4.078 7.230 -12.162 0.80 . A A . 76 PHE O 1 1 4 4843 1 1 77 ILE C C 5.037 4.622 -11.946 0.70 . A A . 77 ILE C 1 1 4 4844 1 1 77 ILE CA C 5.146 4.827 -13.457 0.80 . A A . 77 ILE CA 1 1 4 4845 1 1 77 ILE CB C 6.259 4.000 -14.113 0.90 . A A . 77 ILE CB 1 1 4 4846 1 1 77 ILE CD1 C 7.775 2.013 -13.729 1.20 . A A . 77 ILE CD1 1 1 4 4847 1 1 77 ILE CG1 C 6.358 2.571 -13.581 1.10 . A A . 77 ILE CG1 1 1 4 4848 1 1 77 ILE CG2 C 7.597 4.710 -13.991 0.90 . A A . 77 ILE CG2 1 1 4 4849 1 1 77 ILE H H 5.866 6.482 -14.584 0.80 . A A . 77 ILE H 1 1 4 4850 1 1 77 ILE HA H 4.212 4.541 -13.921 0.80 . A A . 77 ILE HA 1 1 4 4851 1 1 77 ILE HB H 6.022 3.916 -15.173 0.90 . A A . 77 ILE HB 1 1 4 4852 1 1 77 ILE HD11 H 8.499 2.653 -13.223 1.50 . A A . 77 ILE HD11 1 1 4 4853 1 1 77 ILE HD12 H 8.059 1.947 -14.779 1.60 . A A . 77 ILE HD12 1 1 4 4854 1 1 77 ILE HD13 H 7.851 1.016 -13.296 1.70 . A A . 77 ILE HD13 1 1 4 4855 1 1 77 ILE HG12 H 6.081 2.546 -12.534 1.30 . A A . 77 ILE HG12 1 1 4 4856 1 1 77 ILE HG13 H 5.654 1.930 -14.114 1.10 . A A . 77 ILE HG13 1 1 4 4857 1 1 77 ILE HG21 H 8.365 4.157 -14.527 1.10 . A A . 77 ILE HG21 1 1 4 4858 1 1 77 ILE HG22 H 7.881 4.794 -12.943 1.40 . A A . 77 ILE HG22 1 1 4 4859 1 1 77 ILE HG23 H 7.545 5.712 -14.411 1.40 . A A . 77 ILE HG23 1 1 4 4860 1 1 77 ILE N N 5.339 6.231 -13.773 0.80 . A A . 77 ILE N 1 1 4 4861 1 1 77 ILE O O 5.650 5.313 -11.142 0.80 . A A . 77 ILE O 1 1 4 4862 1 1 78 CYS C C 2.411 2.600 -10.203 0.70 . A A . 78 CYS C 1 1 4 4863 1 1 78 CYS CA C 3.577 3.606 -10.326 0.50 . A A . 78 CYS CA 1 1 4 4864 1 1 78 CYS CB C 3.088 5.016 -10.005 0.40 . A A . 78 CYS CB 1 1 4 4865 1 1 78 CYS H H 4.166 2.858 -12.290 0.50 . A A . 78 CYS H 1 1 4 4866 1 1 78 CYS HA H 4.359 3.312 -9.626 0.60 . A A . 78 CYS HA 1 1 4 4867 1 1 78 CYS HB2 H 2.923 5.571 -10.928 0.70 . A A . 78 CYS HB2 1 1 4 4868 1 1 78 CYS HB3 H 2.132 4.968 -9.483 0.70 . A A . 78 CYS HB3 1 1 4 4869 1 1 78 CYS N N 4.203 3.613 -11.637 0.50 . A A . 78 CYS N 1 1 4 4870 1 1 78 CYS O O 1.835 2.451 -9.132 1.70 . A A . 78 CYS O 1 1 4 4871 1 1 78 CYS SG S 4.271 5.918 -8.980 1.00 . A A . 78 CYS SG 1 1 4 4872 1 1 79 THR C C 1.044 0.008 -12.462 0.90 . A A . 79 THR C 1 1 4 4873 1 1 79 THR CA C 1.120 0.843 -11.180 0.70 . A A . 79 THR CA 1 1 4 4874 1 1 79 THR CB C -0.265 1.412 -10.867 0.90 . A A . 79 THR CB 1 1 4 4875 1 1 79 THR CG2 C -1.023 0.540 -9.865 1.60 . A A . 79 THR CG2 1 1 4 4876 1 1 79 THR H H 2.485 2.149 -12.211 1.30 . A A . 79 THR H 1 1 4 4877 1 1 79 THR HA H 1.479 0.217 -10.364 0.80 . A A . 79 THR HA 1 1 4 4878 1 1 79 THR HB H -0.840 1.481 -11.790 0.70 . A A . 79 THR HB 1 1 4 4879 1 1 79 THR HG1 H -0.997 2.956 -10.021 2.00 . A A . 79 THR HG1 1 1 4 4880 1 1 79 THR HG21 H -0.918 0.930 -8.853 2.00 . A A . 79 THR HG21 1 1 4 4881 1 1 79 THR HG22 H -0.645 -0.482 -9.874 2.20 . A A . 79 THR HG22 1 1 4 4882 1 1 79 THR HG23 H -2.086 0.509 -10.106 2.10 . A A . 79 THR HG23 1 1 4 4883 1 1 79 THR N N 2.085 1.922 -11.323 0.70 . A A . 79 THR N 1 1 4 4884 1 1 79 THR O O 0.568 0.457 -13.497 1.50 . A A . 79 THR O 1 1 4 4885 1 1 79 THR OG1 O -0.144 2.716 -10.357 1.70 . A A . 79 THR OG1 1 1 4 4886 1 1 80 ASP C C -0.607 -2.196 -12.994 1.10 . A A . 80 ASP C 1 1 4 4887 1 1 80 ASP CA C 0.918 -2.289 -13.109 1.20 . A A . 80 ASP CA 1 1 4 4888 1 1 80 ASP CB C 1.418 -3.650 -12.629 1.70 . A A . 80 ASP CB 1 1 4 4889 1 1 80 ASP CG C 0.502 -4.765 -13.135 2.40 . A A . 80 ASP CG 1 1 4 4890 1 1 80 ASP H H 2.362 -1.413 -11.791 0.80 . A A . 80 ASP H 1 1 4 4891 1 1 80 ASP HA H 1.217 -2.115 -14.141 1.50 . A A . 80 ASP HA 1 1 4 4892 1 1 80 ASP HB2 H 2.429 -3.839 -12.996 1.80 . A A . 80 ASP HB2 1 1 4 4893 1 1 80 ASP HB3 H 1.435 -3.670 -11.540 2.10 . A A . 80 ASP HB3 1 1 4 4894 1 1 80 ASP N N 1.532 -1.237 -12.322 0.80 . A A . 80 ASP N 1 1 4 4895 1 1 80 ASP O O -1.202 -2.560 -11.987 1.90 . A A . 80 ASP O 1 1 4 4896 1 1 80 ASP OD1 O 0.562 -5.080 -14.323 2.90 . A A . 80 ASP OD1 1 1 4 4897 1 1 80 ASP OD2 O -0.260 -5.305 -12.336 2.90 . A A . 80 ASP OD2 1 1 4 4898 1 1 81 ILE C C -2.854 -3.496 -14.027 1.60 . A A . 81 ILE C 1 1 4 4899 1 1 81 ILE CA C -2.561 -2.042 -14.417 1.30 . A A . 81 ILE CA 1 1 4 4900 1 1 81 ILE CB C -2.800 -1.850 -15.915 1.70 . A A . 81 ILE CB 1 1 4 4901 1 1 81 ILE CD1 C -0.779 -0.891 -17.105 3.00 . A A . 81 ILE CD1 1 1 4 4902 1 1 81 ILE CG1 C -2.111 -0.583 -16.421 2.50 . A A . 81 ILE CG1 1 1 4 4903 1 1 81 ILE CG2 C -4.297 -1.816 -16.229 1.90 . A A . 81 ILE CG2 1 1 4 4904 1 1 81 ILE H H -0.707 -1.001 -14.645 1.50 . A A . 81 ILE H 1 1 4 4905 1 1 81 ILE HA H -3.198 -1.372 -13.840 1.50 . A A . 81 ILE HA 1 1 4 4906 1 1 81 ILE HB H -2.366 -2.702 -16.438 2.20 . A A . 81 ILE HB 1 1 4 4907 1 1 81 ILE HD11 H -0.710 -1.949 -17.361 3.20 . A A . 81 ILE HD11 1 1 4 4908 1 1 81 ILE HD12 H 0.059 -0.646 -16.452 3.40 . A A . 81 ILE HD12 1 1 4 4909 1 1 81 ILE HD13 H -0.671 -0.314 -18.023 3.30 . A A . 81 ILE HD13 1 1 4 4910 1 1 81 ILE HG12 H -2.768 -0.063 -17.119 2.70 . A A . 81 ILE HG12 1 1 4 4911 1 1 81 ILE HG13 H -1.943 0.099 -15.587 3.00 . A A . 81 ILE HG13 1 1 4 4912 1 1 81 ILE HG21 H -4.668 -2.813 -16.464 2.20 . A A . 81 ILE HG21 1 1 4 4913 1 1 81 ILE HG22 H -4.500 -1.171 -17.084 2.30 . A A . 81 ILE HG22 1 1 4 4914 1 1 81 ILE HG23 H -4.864 -1.437 -15.378 2.30 . A A . 81 ILE HG23 1 1 4 4915 1 1 81 ILE N N -1.188 -1.685 -14.097 1.00 . A A . 81 ILE N 1 1 4 4916 1 1 81 ILE O O -1.966 -4.265 -13.682 2.40 . A A . 81 ILE O 1 1 4 4917 1 1 82 ASP C C -4.533 -6.218 -14.025 2.70 . A A . 82 ASP C 1 1 4 4918 1 1 82 ASP CA C -4.654 -4.890 -13.275 2.60 . A A . 82 ASP CA 1 1 4 4919 1 1 82 ASP CB C -6.113 -4.627 -12.901 3.50 . A A . 82 ASP CB 1 1 4 4920 1 1 82 ASP CG C -6.441 -5.311 -11.573 3.90 . A A . 82 ASP CG 1 1 4 4921 1 1 82 ASP H H -4.770 -3.313 -14.724 2.10 . A A . 82 ASP H 1 1 4 4922 1 1 82 ASP HA H -4.018 -4.915 -12.389 3.00 . A A . 82 ASP HA 1 1 4 4923 1 1 82 ASP HB2 H -6.298 -3.557 -12.802 3.90 . A A . 82 ASP HB2 1 1 4 4924 1 1 82 ASP HB3 H -6.782 -5.010 -13.671 3.90 . A A . 82 ASP HB3 1 1 4 4925 1 1 82 ASP N N -4.160 -3.810 -14.107 1.90 . A A . 82 ASP N 1 1 4 4926 1 1 82 ASP O O -5.516 -6.891 -14.312 3.30 . A A . 82 ASP O 1 1 4 4927 1 1 82 ASP OD1 O -5.537 -5.893 -10.974 4.50 . A A . 82 ASP OD1 1 1 4 4928 1 1 82 ASP OD2 O -7.595 -5.256 -11.152 4.20 . A A . 82 ASP OD2 1 1 4 4929 1 1 83 GLU C C -2.117 -7.808 -12.580 1.00 . A A . 83 GLU C 1 1 4 4930 1 1 83 GLU CA C -2.793 -7.865 -13.952 1.00 . A A . 83 GLU CA 1 1 4 4931 1 1 83 GLU CB C -1.809 -8.376 -15.005 1.00 . A A . 83 GLU CB 1 1 4 4932 1 1 83 GLU CD C -1.601 -10.397 -16.468 1.00 . A A . 83 GLU CD 1 1 4 4933 1 1 83 GLU CG C -2.502 -9.225 -16.071 1.00 . A A . 83 GLU CG 1 1 4 4934 1 1 83 GLU H H -2.657 -5.892 -14.779 1.00 . A A . 83 GLU H 1 1 4 4935 1 1 83 GLU HA H -3.675 -8.503 -13.895 1.00 . A A . 83 GLU HA 1 1 4 4936 1 1 83 GLU HB2 H -1.310 -7.531 -15.479 1.00 . A A . 83 GLU HB2 1 1 4 4937 1 1 83 GLU HB3 H -1.029 -8.965 -14.521 1.00 . A A . 83 GLU HB3 1 1 4 4938 1 1 83 GLU HG2 H -3.448 -9.617 -15.697 1.00 . A A . 83 GLU HG2 1 1 4 4939 1 1 83 GLU HG3 H -2.717 -8.629 -16.958 1.00 . A A . 83 GLU HG3 1 1 4 4940 1 1 83 GLU N N -3.262 -6.543 -14.320 1.00 . A A . 83 GLU N 1 1 4 4941 1 1 83 GLU O O -0.897 -7.952 -12.521 1.00 . A A . 83 GLU O 1 1 4 4942 1 1 83 GLU OXT O -2.819 -7.621 -11.587 1.00 . A A . 83 GLU OXT 1 1 4 4943 1 1 83 GLU OE1 O -1.019 -11.017 -15.579 1.00 . A A . 83 GLU OE1 1 1 4 4944 1 1 83 GLU OE2 O -1.492 -10.676 -17.660 1.00 . A A . 83 GLU OE2 1 1 4 4945 2 2 1 NAG C1 C -13.712 4.612 8.424 1.00 . B A . 121 NAG C1 1 1 4 4946 2 2 1 NAG C2 C -14.322 4.257 7.073 1.00 . B A . 121 NAG C2 1 1 4 4947 2 2 1 NAG C3 C -15.136 5.415 6.496 1.00 . B A . 121 NAG C3 1 1 4 4948 2 2 1 NAG C4 C -14.369 6.734 6.584 1.00 . B A . 121 NAG C4 1 1 4 4949 2 2 1 NAG C5 C -13.690 6.908 7.945 1.00 . B A . 121 NAG C5 1 1 4 4950 2 2 1 NAG C6 C -14.008 8.269 8.566 1.00 . B A . 121 NAG C6 1 1 4 4951 2 2 1 NAG C7 C -13.329 2.714 5.521 1.00 . B A . 121 NAG C7 1 1 4 4952 2 2 1 NAG C8 C -12.242 1.738 5.972 1.00 . B A . 121 NAG C8 1 1 4 4953 2 2 1 NAG H1 H -12.624 4.569 8.394 1.00 . B A . 121 NAG H1 1 1 4 4954 2 2 1 NAG H2 H -14.946 3.369 7.180 1.00 . B A . 121 NAG H2 1 1 4 4955 2 2 1 NAG H3 H -15.386 5.205 5.456 1.00 . B A . 121 NAG H3 1 1 4 4956 2 2 1 NAG H4 H -15.052 7.564 6.408 1.00 . B A . 121 NAG H4 1 1 4 4957 2 2 1 NAG H5 H -12.611 6.815 7.822 1.00 . B A . 121 NAG H5 1 1 4 4958 2 2 1 NAG H61 H -15.038 8.305 8.920 1.00 . B A . 121 NAG H61 1 1 4 4959 2 2 1 NAG H62 H -13.874 9.071 7.841 1.00 . B A . 121 NAG H62 1 1 4 4960 2 2 1 NAG H81 H -11.757 1.278 5.112 1.00 . B A . 121 NAG H81 1 1 4 4961 2 2 1 NAG H82 H -11.498 2.262 6.564 1.00 . B A . 121 NAG H82 1 1 4 4962 2 2 1 NAG H83 H -12.682 0.957 6.586 1.00 . B A . 121 NAG H83 1 1 4 4963 2 2 1 NAG HN2 H -12.498 4.527 5.985 1.00 . B A . 121 NAG HN2 1 1 4 4964 2 2 1 NAG HO3 H -16.788 6.298 6.854 1.00 . B A . 121 NAG HO3 1 1 4 4965 2 2 1 NAG HO4 H -12.983 7.624 5.621 1.00 . B A . 121 NAG HO4 1 1 4 4966 2 2 1 NAG HO6 H -13.657 8.314 10.441 1.00 . B A . 121 NAG HO6 1 1 4 4967 2 2 1 NAG N2 N -13.261 3.903 6.148 1.00 . B A . 121 NAG N2 1 1 4 4968 2 2 1 NAG O3 O -16.347 5.533 7.198 1.00 . B A . 121 NAG O3 1 1 4 4969 2 2 1 NAG O4 O -13.397 6.773 5.570 1.00 . B A . 121 NAG O4 1 1 4 4970 2 2 1 NAG O5 O -14.131 5.897 8.819 1.00 . B A . 121 NAG O5 1 1 4 4971 2 2 1 NAG O6 O -13.163 8.523 9.659 1.00 . B A . 121 NAG O6 1 1 4 4972 2 2 1 NAG O7 O -14.162 2.408 4.677 1.00 . B A . 121 NAG O7 1 1 4 4973 3 2 1 NAG C1 C 2.600 -8.655 -6.876 1.00 . C A . 148 NAG C1 1 1 4 4974 3 2 1 NAG C2 C 1.497 -7.606 -7.008 1.00 . C A . 148 NAG C2 1 1 4 4975 3 2 1 NAG C3 C 0.317 -8.119 -7.832 1.00 . C A . 148 NAG C3 1 1 4 4976 3 2 1 NAG C4 C -0.119 -9.515 -7.389 1.00 . C A . 148 NAG C4 1 1 4 4977 3 2 1 NAG C5 C 1.078 -10.422 -7.101 1.00 . C A . 148 NAG C5 1 1 4 4978 3 2 1 NAG C6 C 0.916 -11.791 -7.763 1.00 . C A . 148 NAG C6 1 1 4 4979 3 2 1 NAG C7 C 1.487 -6.087 -5.148 1.00 . C A . 148 NAG C7 1 1 4 4980 3 2 1 NAG C8 C 0.373 -5.093 -4.798 1.00 . C A . 148 NAG C8 1 1 4 4981 3 2 1 NAG H1 H 2.777 -8.906 -5.830 1.00 . C A . 148 NAG H1 1 1 4 4982 3 2 1 NAG H2 H 1.901 -6.694 -7.447 1.00 . C A . 148 NAG H2 1 1 4 4983 3 2 1 NAG H3 H -0.523 -7.432 -7.736 1.00 . C A . 148 NAG H3 1 1 4 4984 3 2 1 NAG H4 H -0.735 -9.966 -8.167 1.00 . C A . 148 NAG H4 1 1 4 4985 3 2 1 NAG H5 H 1.177 -10.552 -6.024 1.00 . C A . 148 NAG H5 1 1 4 4986 3 2 1 NAG H61 H 0.751 -11.685 -8.835 1.00 . C A . 148 NAG H61 1 1 4 4987 3 2 1 NAG H62 H 0.066 -12.327 -7.342 1.00 . C A . 148 NAG H62 1 1 4 4988 3 2 1 NAG H81 H -0.358 -5.044 -5.604 1.00 . C A . 148 NAG H81 1 1 4 4989 3 2 1 NAG H82 H -0.139 -5.409 -3.891 1.00 . C A . 148 NAG H82 1 1 4 4990 3 2 1 NAG H83 H 0.794 -4.100 -4.640 1.00 . C A . 148 NAG H83 1 1 4 4991 3 2 1 NAG HN2 H 0.382 -7.810 -5.188 1.00 . C A . 148 NAG HN2 1 1 4 4992 3 2 1 NAG HO3 H 0.583 -9.060 -9.469 1.00 . C A . 148 NAG HO3 1 1 4 4993 3 2 1 NAG HO4 H -0.904 -8.501 -5.976 1.00 . C A . 148 NAG HO4 1 1 4 4994 3 2 1 NAG HO6 H 2.758 -11.983 -7.306 1.00 . C A . 148 NAG HO6 1 1 4 4995 3 2 1 NAG N2 N 1.027 -7.232 -5.686 1.00 . C A . 148 NAG N2 1 1 4 4996 3 2 1 NAG O3 O 0.670 -8.158 -9.192 1.00 . C A . 148 NAG O3 1 1 4 4997 3 2 1 NAG O4 O -0.917 -9.413 -6.237 1.00 . C A . 148 NAG O4 1 1 4 4998 3 2 1 NAG O5 O 2.250 -9.816 -7.590 1.00 . C A . 148 NAG O5 1 1 4 4999 3 2 1 NAG O6 O 2.067 -12.574 -7.573 1.00 . C A . 148 NAG O6 1 1 4 5000 3 2 1 NAG O7 O 2.667 -5.833 -4.940 1.00 . C A . 148 NAG O7 1 1 5 5001 1 1 1 HIS C C 5.046 -9.017 22.480 1.00 . A A . 1 HIS C 1 1 5 5002 1 1 1 HIS CA C 4.811 -10.235 23.376 1.00 . A A . 1 HIS CA 1 1 5 5003 1 1 1 HIS CB C 5.540 -11.440 22.782 1.00 . A A . 1 HIS CB 1 1 5 5004 1 1 1 HIS CD2 C 8.067 -11.335 22.482 1.00 . A A . 1 HIS CD2 1 1 5 5005 1 1 1 HIS CE1 C 8.749 -11.743 24.575 1.00 . A A . 1 HIS CE1 1 1 5 5006 1 1 1 HIS CG C 6.969 -11.510 23.239 1.00 . A A . 1 HIS CG 1 1 5 5007 1 1 1 HIS H1 H 3.029 -9.949 24.356 1.00 . A A . 1 HIS H1 1 1 5 5008 1 1 1 HIS H2 H 2.876 -10.212 22.685 1.00 . A A . 1 HIS H2 1 1 5 5009 1 1 1 HIS H3 H 3.237 -11.509 23.719 1.00 . A A . 1 HIS H3 1 1 5 5010 1 1 1 HIS HA H 5.215 -10.011 24.363 1.00 . A A . 1 HIS HA 1 1 5 5011 1 1 1 HIS HB2 H 5.026 -12.359 23.067 1.00 . A A . 1 HIS HB2 1 1 5 5012 1 1 1 HIS HB3 H 5.511 -11.390 21.694 1.00 . A A . 1 HIS HB3 1 1 5 5013 1 1 1 HIS HD2 H 8.078 -11.123 21.429 1.00 . A A . 1 HIS HD2 1 1 5 5014 1 1 1 HIS HE1 H 9.377 -11.892 25.449 1.00 . A A . 1 HIS HE1 1 1 5 5015 1 1 1 HIS HE2 H 10.190 -11.400 23.056 1.00 . A A . 1 HIS HE2 1 1 5 5016 1 1 1 HIS N N 3.386 -10.495 23.546 1.00 . A A . 1 HIS N 1 1 5 5017 1 1 1 HIS ND1 N 7.405 -11.785 24.619 1.00 . A A . 1 HIS ND1 1 1 5 5018 1 1 1 HIS NE2 N 9.239 -11.484 23.354 1.00 . A A . 1 HIS NE2 1 1 5 5019 1 1 1 HIS O O 4.331 -8.773 21.516 1.00 . A A . 1 HIS O 1 1 5 5020 1 1 2 MET C C 4.859 -6.188 23.052 1.00 . A A . 2 MET C 1 1 5 5021 1 1 2 MET CA C 5.850 -7.135 23.730 1.00 . A A . 2 MET CA 1 1 5 5022 1 1 2 MET CB C 7.163 -6.409 24.019 1.00 . A A . 2 MET CB 1 1 5 5023 1 1 2 MET CE C 9.995 -5.292 25.502 1.00 . A A . 2 MET CE 1 1 5 5024 1 1 2 MET CG C 7.790 -6.871 25.335 1.00 . A A . 2 MET CG 1 1 5 5025 1 1 2 MET H H 7.026 -8.506 22.574 1.00 . A A . 2 MET H 1 1 5 5026 1 1 2 MET HA H 5.408 -7.528 24.646 1.00 . A A . 2 MET HA 1 1 5 5027 1 1 2 MET HB2 H 7.863 -6.581 23.201 1.00 . A A . 2 MET HB2 1 1 5 5028 1 1 2 MET HB3 H 6.986 -5.335 24.056 1.00 . A A . 2 MET HB3 1 1 5 5029 1 1 2 MET HE1 H 9.869 -4.703 24.594 1.00 . A A . 2 MET HE1 1 1 5 5030 1 1 2 MET HE2 H 11.032 -5.210 25.831 1.00 . A A . 2 MET HE2 1 1 5 5031 1 1 2 MET HE3 H 9.349 -4.884 26.278 1.00 . A A . 2 MET HE3 1 1 5 5032 1 1 2 MET HG2 H 7.554 -6.165 26.131 1.00 . A A . 2 MET HG2 1 1 5 5033 1 1 2 MET HG3 H 7.378 -7.837 25.627 1.00 . A A . 2 MET HG3 1 1 5 5034 1 1 2 MET N N 6.099 -8.276 22.870 1.00 . A A . 2 MET N 1 1 5 5035 1 1 2 MET O O 4.789 -6.091 21.833 1.00 . A A . 2 MET O 1 1 5 5036 1 1 2 MET SD S 9.578 -7.015 25.188 1.00 . A A . 2 MET SD 1 1 5 5037 1 1 3 GLU C C 2.899 -3.563 24.754 1.00 . A A . 3 GLU C 1 1 5 5038 1 1 3 GLU CA C 3.930 -4.078 23.743 1.00 . A A . 3 GLU CA 1 1 5 5039 1 1 3 GLU CB C 3.496 -3.794 22.300 1.00 . A A . 3 GLU CB 1 1 5 5040 1 1 3 GLU CD C 4.545 -2.169 20.661 1.00 . A A . 3 GLU CD 1 1 5 5041 1 1 3 GLU CG C 4.699 -3.505 21.396 1.00 . A A . 3 GLU CG 1 1 5 5042 1 1 3 GLU H H 3.659 -5.978 24.693 1.00 . A A . 3 GLU H 1 1 5 5043 1 1 3 GLU HA H 4.898 -3.624 23.955 1.00 . A A . 3 GLU HA 1 1 5 5044 1 1 3 GLU HB2 H 2.958 -4.663 21.913 1.00 . A A . 3 GLU HB2 1 1 5 5045 1 1 3 GLU HB3 H 2.804 -2.949 22.274 1.00 . A A . 3 GLU HB3 1 1 5 5046 1 1 3 GLU HG2 H 5.617 -3.479 21.983 1.00 . A A . 3 GLU HG2 1 1 5 5047 1 1 3 GLU HG3 H 4.812 -4.291 20.650 1.00 . A A . 3 GLU HG3 1 1 5 5048 1 1 3 GLU N N 4.100 -5.507 23.929 1.00 . A A . 3 GLU N 1 1 5 5049 1 1 3 GLU O O 2.355 -4.308 25.560 1.00 . A A . 3 GLU O 1 1 5 5050 1 1 3 GLU OE1 O 3.807 -1.308 21.137 1.00 . A A . 3 GLU OE1 1 1 5 5051 1 1 3 GLU OE2 O 5.169 -2.004 19.615 1.00 . A A . 3 GLU OE2 1 1 5 5052 1 1 4 PRO C C 0.279 -2.071 23.948 1.00 . A A . 4 PRO C 1 1 5 5053 1 1 4 PRO CA C 1.365 -1.629 24.932 1.00 . A A . 4 PRO CA 1 1 5 5054 1 1 4 PRO CB C 1.583 -0.124 24.778 1.00 . A A . 4 PRO CB 1 1 5 5055 1 1 4 PRO CD C 3.707 -1.293 24.308 1.00 . A A . 4 PRO CD 1 1 5 5056 1 1 4 PRO CG C 3.021 0.072 24.283 1.00 . A A . 4 PRO CG 1 1 5 5057 1 1 4 PRO HA H 1.052 -1.875 25.946 1.00 . A A . 4 PRO HA 1 1 5 5058 1 1 4 PRO HB2 H 0.873 0.291 24.063 1.00 . A A . 4 PRO HB2 1 1 5 5059 1 1 4 PRO HB3 H 1.430 0.386 25.729 1.00 . A A . 4 PRO HB3 1 1 5 5060 1 1 4 PRO HD2 H 4.132 -1.548 23.338 1.00 . A A . 4 PRO HD2 1 1 5 5061 1 1 4 PRO HD3 H 4.502 -1.323 25.054 1.00 . A A . 4 PRO HD3 1 1 5 5062 1 1 4 PRO HG2 H 3.011 0.461 23.266 1.00 . A A . 4 PRO HG2 1 1 5 5063 1 1 4 PRO HG3 H 3.551 0.775 24.922 1.00 . A A . 4 PRO HG3 1 1 5 5064 1 1 4 PRO N N 2.663 -2.236 24.659 1.00 . A A . 4 PRO N 1 1 5 5065 1 1 4 PRO O O -0.561 -1.295 23.509 1.00 . A A . 4 PRO O 1 1 5 5066 1 1 5 VAL C C -1.524 -3.198 22.090 1.00 . A A . 5 VAL C 1 1 5 5067 1 1 5 VAL CA C -0.220 -3.911 22.440 1.00 . A A . 5 VAL CA 1 1 5 5068 1 1 5 VAL CB C -0.450 -5.412 22.589 1.00 . A A . 5 VAL CB 1 1 5 5069 1 1 5 VAL CG1 C -0.939 -5.776 23.994 1.00 . A A . 5 VAL CG1 1 1 5 5070 1 1 5 VAL CG2 C -1.402 -5.942 21.518 1.00 . A A . 5 VAL CG2 1 1 5 5071 1 1 5 VAL H H 1.010 -3.914 24.201 1.00 . A A . 5 VAL H 1 1 5 5072 1 1 5 VAL HA H 0.503 -3.720 21.647 1.00 . A A . 5 VAL HA 1 1 5 5073 1 1 5 VAL HB H 0.515 -5.879 22.420 1.00 . A A . 5 VAL HB 1 1 5 5074 1 1 5 VAL HG11 H -0.957 -6.856 24.133 1.00 . A A . 5 VAL HG11 1 1 5 5075 1 1 5 VAL HG12 H -0.287 -5.357 24.760 1.00 . A A . 5 VAL HG12 1 1 5 5076 1 1 5 VAL HG13 H -1.947 -5.400 24.171 1.00 . A A . 5 VAL HG13 1 1 5 5077 1 1 5 VAL HG21 H -1.582 -5.187 20.754 1.00 . A A . 5 VAL HG21 1 1 5 5078 1 1 5 VAL HG22 H -0.982 -6.820 21.026 1.00 . A A . 5 VAL HG22 1 1 5 5079 1 1 5 VAL HG23 H -2.361 -6.223 21.953 1.00 . A A . 5 VAL HG23 1 1 5 5080 1 1 5 VAL N N 0.375 -3.375 23.649 1.00 . A A . 5 VAL N 1 1 5 5081 1 1 5 VAL O O -2.447 -3.067 22.884 1.00 . A A . 5 VAL O 1 1 5 5082 1 1 6 ASP C C -3.796 -3.650 20.537 1.00 . A A . 6 ASP C 1 1 5 5083 1 1 6 ASP CA C -2.603 -2.927 19.889 1.00 . A A . 6 ASP CA 1 1 5 5084 1 1 6 ASP CB C -2.049 -3.638 18.643 1.00 . A A . 6 ASP CB 1 1 5 5085 1 1 6 ASP CG C -2.804 -4.919 18.265 1.00 . A A . 6 ASP CG 1 1 5 5086 1 1 6 ASP H H -0.597 -2.483 20.479 1.00 . A A . 6 ASP H 1 1 5 5087 1 1 6 ASP HA H -2.930 -1.924 19.623 1.00 . A A . 6 ASP HA 1 1 5 5088 1 1 6 ASP HB2 H -2.070 -2.966 17.787 1.00 . A A . 6 ASP HB2 1 1 5 5089 1 1 6 ASP HB3 H -1.000 -3.882 18.804 1.00 . A A . 6 ASP HB3 1 1 5 5090 1 1 6 ASP N N -1.496 -2.754 20.822 1.00 . A A . 6 ASP N 1 1 5 5091 1 1 6 ASP O O -3.655 -4.666 21.206 1.00 . A A . 6 ASP O 1 1 5 5092 1 1 6 ASP OD1 O -3.025 -5.756 19.139 1.00 . A A . 6 ASP OD1 1 1 5 5093 1 1 6 ASP OD2 O -3.159 -5.065 17.098 1.00 . A A . 6 ASP OD2 1 1 5 5094 1 1 7 PRO C C -4.925 -2.048 18.028 1.00 . A A . 7 PRO C 1 1 5 5095 1 1 7 PRO CA C -5.601 -3.034 18.974 1.00 . A A . 7 PRO CA 1 1 5 5096 1 1 7 PRO CB C -7.033 -2.573 19.193 1.00 . A A . 7 PRO CB 1 1 5 5097 1 1 7 PRO CD C -5.786 -2.445 21.323 1.00 . A A . 7 PRO CD 1 1 5 5098 1 1 7 PRO CG C -7.101 -2.077 20.633 1.00 . A A . 7 PRO CG 1 1 5 5099 1 1 7 PRO HA H -5.586 -4.037 18.550 1.00 . A A . 7 PRO HA 1 1 5 5100 1 1 7 PRO HB2 H -7.295 -1.777 18.497 1.00 . A A . 7 PRO HB2 1 1 5 5101 1 1 7 PRO HB3 H -7.728 -3.397 19.037 1.00 . A A . 7 PRO HB3 1 1 5 5102 1 1 7 PRO HD2 H -5.277 -1.565 21.711 1.00 . A A . 7 PRO HD2 1 1 5 5103 1 1 7 PRO HD3 H -5.942 -3.159 22.131 1.00 . A A . 7 PRO HD3 1 1 5 5104 1 1 7 PRO HG2 H -7.230 -0.998 20.625 1.00 . A A . 7 PRO HG2 1 1 5 5105 1 1 7 PRO HG3 H -7.942 -2.549 21.131 1.00 . A A . 7 PRO HG3 1 1 5 5106 1 1 7 PRO N N -4.983 -3.053 20.286 1.00 . A A . 7 PRO N 1 1 5 5107 1 1 7 PRO O O -4.979 -0.832 18.167 1.00 . A A . 7 PRO O 1 1 5 5108 1 1 8 CYS C C -2.838 -0.969 15.989 1.00 . A A . 8 CYS C 1 1 5 5109 1 1 8 CYS CA C -3.896 -2.087 15.812 1.00 . A A . 8 CYS CA 1 1 5 5110 1 1 8 CYS CB C -5.198 -1.574 15.242 1.00 . A A . 8 CYS CB 1 1 5 5111 1 1 8 CYS H H -4.544 -3.667 17.164 1.00 . A A . 8 CYS H 1 1 5 5112 1 1 8 CYS HA H -3.477 -2.861 15.171 1.00 . A A . 8 CYS HA 1 1 5 5113 1 1 8 CYS HB2 H -5.853 -2.431 15.100 1.00 . A A . 8 CYS HB2 1 1 5 5114 1 1 8 CYS HB3 H -5.647 -0.959 16.018 1.00 . A A . 8 CYS HB3 1 1 5 5115 1 1 8 CYS N N -4.306 -2.719 17.057 1.00 . A A . 8 CYS N 1 1 5 5116 1 1 8 CYS O O -2.348 -0.393 15.025 1.00 . A A . 8 CYS O 1 1 5 5117 1 1 8 CYS SG S -5.082 -0.668 13.686 1.00 . A A . 8 CYS SG 1 1 5 5118 1 1 9 PHE C C -0.138 -0.291 16.810 1.00 . A A . 9 PHE C 1 1 5 5119 1 1 9 PHE CA C -1.372 0.070 17.664 1.00 . A A . 9 PHE CA 1 1 5 5120 1 1 9 PHE CB C -1.155 -0.124 19.172 1.00 . A A . 9 PHE CB 1 1 5 5121 1 1 9 PHE CD1 C -0.675 2.339 19.636 1.00 . A A . 9 PHE CD1 1 1 5 5122 1 1 9 PHE CD2 C 0.947 0.617 20.410 1.00 . A A . 9 PHE CD2 1 1 5 5123 1 1 9 PHE CE1 C 0.157 3.374 20.191 1.00 . A A . 9 PHE CE1 1 1 5 5124 1 1 9 PHE CE2 C 1.783 1.650 20.961 1.00 . A A . 9 PHE CE2 1 1 5 5125 1 1 9 PHE CG C -0.285 0.956 19.744 1.00 . A A . 9 PHE CG 1 1 5 5126 1 1 9 PHE CZ C 1.386 3.028 20.853 1.00 . A A . 9 PHE CZ 1 1 5 5127 1 1 9 PHE H H -3.257 -0.996 17.900 1.00 . A A . 9 PHE H 1 1 5 5128 1 1 9 PHE HA H -1.615 1.112 17.513 1.00 . A A . 9 PHE HA 1 1 5 5129 1 1 9 PHE HB2 H -2.113 -0.121 19.695 1.00 . A A . 9 PHE HB2 1 1 5 5130 1 1 9 PHE HB3 H -0.671 -1.087 19.342 1.00 . A A . 9 PHE HB3 1 1 5 5131 1 1 9 PHE HD1 H -1.594 2.601 19.133 1.00 . A A . 9 PHE HD1 1 1 5 5132 1 1 9 PHE HD2 H 1.242 -0.418 20.496 1.00 . A A . 9 PHE HD2 1 1 5 5133 1 1 9 PHE HE1 H -0.141 4.409 20.111 1.00 . A A . 9 PHE HE1 1 1 5 5134 1 1 9 PHE HE2 H 2.711 1.392 21.452 1.00 . A A . 9 PHE HE2 1 1 5 5135 1 1 9 PHE HZ H 2.014 3.803 21.267 1.00 . A A . 9 PHE HZ 1 1 5 5136 1 1 9 PHE N N -2.535 -0.707 17.272 1.00 . A A . 9 PHE N 1 1 5 5137 1 1 9 PHE O O -0.114 -0.120 15.597 1.00 . A A . 9 PHE O 1 1 5 5138 1 1 10 ARG C C 1.760 -2.075 15.662 1.00 . A A . 10 ARG C 1 1 5 5139 1 1 10 ARG CA C 1.823 -1.800 17.152 1.00 . A A . 10 ARG CA 1 1 5 5140 1 1 10 ARG CB C 1.525 -3.070 17.947 1.00 . A A . 10 ARG CB 1 1 5 5141 1 1 10 ARG CD C 2.967 -5.084 18.480 1.00 . A A . 10 ARG CD 1 1 5 5142 1 1 10 ARG CG C 2.766 -3.581 18.676 1.00 . A A . 10 ARG CG 1 1 5 5143 1 1 10 ARG CZ C 2.058 -6.409 16.699 1.00 . A A . 10 ARG CZ 1 1 5 5144 1 1 10 ARG H H 0.810 -0.504 18.505 1.00 . A A . 10 ARG H 1 1 5 5145 1 1 10 ARG HA H 2.791 -1.418 17.413 1.00 . A A . 10 ARG HA 1 1 5 5146 1 1 10 ARG HB2 H 0.754 -2.845 18.691 1.00 . A A . 10 ARG HB2 1 1 5 5147 1 1 10 ARG HB3 H 1.127 -3.843 17.283 1.00 . A A . 10 ARG HB3 1 1 5 5148 1 1 10 ARG HD2 H 3.947 -5.411 18.829 1.00 . A A . 10 ARG HD2 1 1 5 5149 1 1 10 ARG HD3 H 2.198 -5.665 18.989 1.00 . A A . 10 ARG HD3 1 1 5 5150 1 1 10 ARG HE H 3.424 -4.917 16.393 1.00 . A A . 10 ARG HE 1 1 5 5151 1 1 10 ARG HG2 H 3.649 -3.042 18.335 1.00 . A A . 10 ARG HG2 1 1 5 5152 1 1 10 ARG HG3 H 2.673 -3.348 19.734 1.00 . A A . 10 ARG HG3 1 1 5 5153 1 1 10 ARG HH11 H 0.241 -5.955 17.468 1.00 . A A . 10 ARG HH11 1 1 5 5154 1 1 10 ARG HH12 H 0.267 -6.271 15.765 1.00 . A A . 10 ARG HH12 1 1 5 5155 1 1 10 ARG HH21 H 3.361 -7.949 16.863 1.00 . A A . 10 ARG HH21 1 1 5 5156 1 1 10 ARG HH22 H 2.109 -8.160 15.685 1.00 . A A . 10 ARG HH22 1 1 5 5157 1 1 10 ARG N N 0.877 -0.772 17.551 1.00 . A A . 10 ARG N 1 1 5 5158 1 1 10 ARG NE N 2.886 -5.416 17.071 1.00 . A A . 10 ARG NE 1 1 5 5159 1 1 10 ARG NH1 N 0.747 -6.194 16.639 1.00 . A A . 10 ARG NH1 1 1 5 5160 1 1 10 ARG NH2 N 2.550 -7.606 16.390 1.00 . A A . 10 ARG NH2 1 1 5 5161 1 1 10 ARG O O 2.683 -1.880 14.881 1.00 . A A . 10 ARG O 1 1 5 5162 1 1 11 ALA C C 1.417 -3.447 13.258 1.00 . A A . 11 ALA C 1 1 5 5163 1 1 11 ALA CA C 0.169 -3.101 14.096 1.00 . A A . 11 ALA CA 1 1 5 5164 1 1 11 ALA CB C -0.755 -2.109 13.384 1.00 . A A . 11 ALA CB 1 1 5 5165 1 1 11 ALA H H -0.004 -2.331 16.197 1.00 . A A . 11 ALA H 1 1 5 5166 1 1 11 ALA HA H -0.369 -4.024 14.314 1.00 . A A . 11 ALA HA 1 1 5 5167 1 1 11 ALA HB1 H -0.352 -1.098 13.432 1.00 . A A . 11 ALA HB1 1 1 5 5168 1 1 11 ALA HB2 H -0.886 -2.375 12.335 1.00 . A A . 11 ALA HB2 1 1 5 5169 1 1 11 ALA HB3 H -1.741 -2.099 13.850 1.00 . A A . 11 ALA HB3 1 1 5 5170 1 1 11 ALA N N 0.549 -2.548 15.389 1.00 . A A . 11 ALA N 1 1 5 5171 1 1 11 ALA O O 2.379 -4.014 13.762 1.00 . A A . 11 ALA O 1 1 5 5172 1 1 12 ASN C C 2.298 -1.961 9.955 1.00 . A A . 12 ASN C 1 1 5 5173 1 1 12 ASN CA C 2.578 -2.686 11.288 1.00 . A A . 12 ASN CA 1 1 5 5174 1 1 12 ASN CB C 3.424 -3.933 11.024 1.00 . A A . 12 ASN CB 1 1 5 5175 1 1 12 ASN CG C 4.394 -4.166 12.184 1.00 . A A . 12 ASN CG 1 1 5 5176 1 1 12 ASN H H 0.470 -3.063 11.483 1.00 . A A . 12 ASN H 1 1 5 5177 1 1 12 ASN HA H 3.095 -2.006 11.964 1.00 . A A . 12 ASN HA 1 1 5 5178 1 1 12 ASN HB2 H 2.789 -4.812 10.915 1.00 . A A . 12 ASN HB2 1 1 5 5179 1 1 12 ASN HB3 H 3.996 -3.820 10.103 1.00 . A A . 12 ASN HB3 1 1 5 5180 1 1 12 ASN HD21 H 3.673 -5.610 13.423 1.00 . A A . 12 ASN HD21 1 1 5 5181 1 1 12 ASN HD22 H 4.922 -6.129 12.307 1.00 . A A . 12 ASN HD22 1 1 5 5182 1 1 12 ASN N N 1.346 -3.076 11.964 1.00 . A A . 12 ASN N 1 1 5 5183 1 1 12 ASN ND2 N 4.324 -5.414 12.683 1.00 . A A . 12 ASN ND2 1 1 5 5184 1 1 12 ASN O O 3.082 -2.029 9.016 1.00 . A A . 12 ASN O 1 1 5 5185 1 1 12 ASN OD1 O 5.144 -3.286 12.590 1.00 . A A . 12 ASN OD1 1 1 5 5186 1 1 13 CYS C C 1.956 0.198 8.156 1.00 . A A . 13 CYS C 1 1 5 5187 1 1 13 CYS CA C 0.752 -0.501 8.775 1.00 . A A . 13 CYS CA 1 1 5 5188 1 1 13 CYS CB C -0.358 0.469 9.173 1.00 . A A . 13 CYS CB 1 1 5 5189 1 1 13 CYS H H 0.476 -1.419 10.662 1.00 . A A . 13 CYS H 1 1 5 5190 1 1 13 CYS HA H 0.357 -1.223 8.059 1.00 . A A . 13 CYS HA 1 1 5 5191 1 1 13 CYS HB2 H -0.001 1.300 9.784 1.00 . A A . 13 CYS HB2 1 1 5 5192 1 1 13 CYS HB3 H -0.830 0.868 8.274 1.00 . A A . 13 CYS HB3 1 1 5 5193 1 1 13 CYS N N 1.141 -1.272 9.936 1.00 . A A . 13 CYS N 1 1 5 5194 1 1 13 CYS O O 2.498 1.172 8.662 1.00 . A A . 13 CYS O 1 1 5 5195 1 1 13 CYS SG S -1.567 -0.461 10.127 1.00 . A A . 13 CYS SG 1 1 5 5196 1 1 14 GLU C C 2.273 1.823 5.922 1.00 . A A . 14 GLU C 1 1 5 5197 1 1 14 GLU CA C 2.615 0.327 5.786 1.00 . A A . 14 GLU CA 1 1 5 5198 1 1 14 GLU CB C 1.821 -0.274 4.620 1.00 . A A . 14 GLU CB 1 1 5 5199 1 1 14 GLU CD C 3.271 0.288 2.652 1.00 . A A . 14 GLU CD 1 1 5 5200 1 1 14 GLU CG C 1.938 0.572 3.349 1.00 . A A . 14 GLU CG 1 1 5 5201 1 1 14 GLU H H 2.258 -1.406 7.042 1.00 . A A . 14 GLU H 1 1 5 5202 1 1 14 GLU HA H 3.680 0.212 5.609 1.00 . A A . 14 GLU HA 1 1 5 5203 1 1 14 GLU HB2 H 2.120 -1.299 4.401 1.00 . A A . 14 GLU HB2 1 1 5 5204 1 1 14 GLU HB3 H 0.782 -0.339 4.926 1.00 . A A . 14 GLU HB3 1 1 5 5205 1 1 14 GLU HG2 H 1.115 0.349 2.672 1.00 . A A . 14 GLU HG2 1 1 5 5206 1 1 14 GLU HG3 H 1.890 1.638 3.566 1.00 . A A . 14 GLU HG3 1 1 5 5207 1 1 14 GLU N N 2.318 -0.409 7.012 1.00 . A A . 14 GLU N 1 1 5 5208 1 1 14 GLU O O 3.118 2.668 6.194 1.00 . A A . 14 GLU O 1 1 5 5209 1 1 14 GLU OE1 O 3.812 -0.801 2.838 1.00 . A A . 14 GLU OE1 1 1 5 5210 1 1 14 GLU OE2 O 3.753 1.160 1.931 1.00 . A A . 14 GLU OE2 1 1 5 5211 1 1 15 TYR C C -0.007 3.100 7.654 1.00 . A A . 15 TYR C 1 1 5 5212 1 1 15 TYR CA C 0.333 3.277 6.170 1.00 . A A . 15 TYR CA 1 1 5 5213 1 1 15 TYR CB C -0.885 3.509 5.265 1.00 . A A . 15 TYR CB 1 1 5 5214 1 1 15 TYR CD1 C -2.007 5.693 6.044 1.00 . A A . 15 TYR CD1 1 1 5 5215 1 1 15 TYR CD2 C -0.887 5.597 3.826 1.00 . A A . 15 TYR CD2 1 1 5 5216 1 1 15 TYR CE1 C -2.434 7.040 5.770 1.00 . A A . 15 TYR CE1 1 1 5 5217 1 1 15 TYR CE2 C -1.310 6.943 3.549 1.00 . A A . 15 TYR CE2 1 1 5 5218 1 1 15 TYR CG C -1.251 4.953 5.062 1.00 . A A . 15 TYR CG 1 1 5 5219 1 1 15 TYR CZ C -2.087 7.665 4.522 1.00 . A A . 15 TYR CZ 1 1 5 5220 1 1 15 TYR H H 0.421 1.390 5.206 1.00 . A A . 15 TYR H 1 1 5 5221 1 1 15 TYR HA H 1.044 4.089 6.076 1.00 . A A . 15 TYR HA 1 1 5 5222 1 1 15 TYR HB2 H -0.634 3.115 4.285 1.00 . A A . 15 TYR HB2 1 1 5 5223 1 1 15 TYR HB3 H -1.744 2.937 5.616 1.00 . A A . 15 TYR HB3 1 1 5 5224 1 1 15 TYR HD1 H -2.264 5.255 6.994 1.00 . A A . 15 TYR HD1 1 1 5 5225 1 1 15 TYR HD2 H -0.291 5.061 3.102 1.00 . A A . 15 TYR HD2 1 1 5 5226 1 1 15 TYR HE1 H -3.025 7.579 6.497 1.00 . A A . 15 TYR HE1 1 1 5 5227 1 1 15 TYR HE2 H -1.060 7.407 2.606 1.00 . A A . 15 TYR HE2 1 1 5 5228 1 1 15 TYR HH H -3.393 8.939 3.933 1.00 . A A . 15 TYR HH 1 1 5 5229 1 1 15 TYR N N 0.970 2.065 5.699 1.00 . A A . 15 TYR N 1 1 5 5230 1 1 15 TYR O O 0.844 2.795 8.480 1.00 . A A . 15 TYR O 1 1 5 5231 1 1 15 TYR OH O -2.500 8.953 4.254 1.00 . A A . 15 TYR OH 1 1 5 5232 1 1 16 GLN C C -2.785 2.249 9.573 1.00 . A A . 16 GLN C 1 1 5 5233 1 1 16 GLN CA C -1.750 3.327 9.300 1.00 . A A . 16 GLN CA 1 1 5 5234 1 1 16 GLN CB C -2.268 4.708 9.690 1.00 . A A . 16 GLN CB 1 1 5 5235 1 1 16 GLN CD C -2.323 6.437 11.511 1.00 . A A . 16 GLN CD 1 1 5 5236 1 1 16 GLN CG C -1.808 5.054 11.106 1.00 . A A . 16 GLN CG 1 1 5 5237 1 1 16 GLN H H -1.813 3.672 7.143 1.00 . A A . 16 GLN H 1 1 5 5238 1 1 16 GLN HA H -0.902 3.074 9.916 1.00 . A A . 16 GLN HA 1 1 5 5239 1 1 16 GLN HB2 H -1.860 5.441 9.007 1.00 . A A . 16 GLN HB2 1 1 5 5240 1 1 16 GLN HB3 H -3.361 4.737 9.593 1.00 . A A . 16 GLN HB3 1 1 5 5241 1 1 16 GLN HE21 H -3.653 5.711 12.869 1.00 . A A . 16 GLN HE21 1 1 5 5242 1 1 16 GLN HE22 H -4.229 7.042 11.883 1.00 . A A . 16 GLN HE22 1 1 5 5243 1 1 16 GLN HG2 H -2.156 4.309 11.822 1.00 . A A . 16 GLN HG2 1 1 5 5244 1 1 16 GLN HG3 H -0.718 5.052 11.149 1.00 . A A . 16 GLN HG3 1 1 5 5245 1 1 16 GLN N N -1.297 3.322 7.924 1.00 . A A . 16 GLN N 1 1 5 5246 1 1 16 GLN NE2 N -3.508 6.392 12.145 1.00 . A A . 16 GLN NE2 1 1 5 5247 1 1 16 GLN O O -2.955 1.286 8.837 1.00 . A A . 16 GLN O 1 1 5 5248 1 1 16 GLN OE1 O -1.693 7.458 11.266 1.00 . A A . 16 GLN OE1 1 1 5 5249 1 1 17 CYS C C -5.410 1.420 11.673 1.00 . A A . 17 CYS C 1 1 5 5250 1 1 17 CYS CA C -3.884 1.403 11.545 1.00 . A A . 17 CYS CA 1 1 5 5251 1 1 17 CYS CB C -3.219 1.487 12.923 1.00 . A A . 17 CYS CB 1 1 5 5252 1 1 17 CYS H H -3.218 3.435 11.037 1.00 . A A . 17 CYS H 1 1 5 5253 1 1 17 CYS HA H -3.568 0.488 11.046 1.00 . A A . 17 CYS HA 1 1 5 5254 1 1 17 CYS HB2 H -2.403 0.766 12.978 1.00 . A A . 17 CYS HB2 1 1 5 5255 1 1 17 CYS HB3 H -2.783 2.472 13.077 1.00 . A A . 17 CYS HB3 1 1 5 5256 1 1 17 CYS N N -3.435 2.508 10.719 1.00 . A A . 17 CYS N 1 1 5 5257 1 1 17 CYS O O -5.989 2.187 12.432 1.00 . A A . 17 CYS O 1 1 5 5258 1 1 17 CYS SG S -4.364 1.140 14.273 1.00 . A A . 17 CYS SG 1 1 5 5259 1 1 18 GLN C C -7.771 -0.937 11.755 1.00 . A A . 18 GLN C 1 1 5 5260 1 1 18 GLN CA C -7.443 0.342 10.976 1.00 . A A . 18 GLN CA 1 1 5 5261 1 1 18 GLN CB C -8.017 0.232 9.571 1.00 . A A . 18 GLN CB 1 1 5 5262 1 1 18 GLN CD C -9.935 1.847 9.605 1.00 . A A . 18 GLN CD 1 1 5 5263 1 1 18 GLN CG C -9.540 0.369 9.562 1.00 . A A . 18 GLN CG 1 1 5 5264 1 1 18 GLN H H -5.496 0.101 10.123 1.00 . A A . 18 GLN H 1 1 5 5265 1 1 18 GLN HA H -7.839 1.222 11.477 1.00 . A A . 18 GLN HA 1 1 5 5266 1 1 18 GLN HB2 H -7.569 0.996 8.930 1.00 . A A . 18 GLN HB2 1 1 5 5267 1 1 18 GLN HB3 H -7.730 -0.742 9.177 1.00 . A A . 18 GLN HB3 1 1 5 5268 1 1 18 GLN HE21 H -8.296 2.625 8.680 1.00 . A A . 18 GLN HE21 1 1 5 5269 1 1 18 GLN HE22 H -9.842 3.103 8.007 1.00 . A A . 18 GLN HE22 1 1 5 5270 1 1 18 GLN HG2 H -9.962 -0.084 8.665 1.00 . A A . 18 GLN HG2 1 1 5 5271 1 1 18 GLN HG3 H -9.973 -0.139 10.424 1.00 . A A . 18 GLN HG3 1 1 5 5272 1 1 18 GLN N N -6.007 0.518 10.875 1.00 . A A . 18 GLN N 1 1 5 5273 1 1 18 GLN NE2 N -9.301 2.592 8.682 1.00 . A A . 18 GLN NE2 1 1 5 5274 1 1 18 GLN O O -7.567 -2.047 11.278 1.00 . A A . 18 GLN O 1 1 5 5275 1 1 18 GLN OE1 O -10.753 2.273 10.412 1.00 . A A . 18 GLN OE1 1 1 5 5276 1 1 19 PRO C C -10.283 -2.246 12.967 1.00 . A A . 19 PRO C 1 1 5 5277 1 1 19 PRO CA C -9.047 -1.730 13.713 1.00 . A A . 19 PRO CA 1 1 5 5278 1 1 19 PRO CB C -9.427 -1.072 15.037 1.00 . A A . 19 PRO CB 1 1 5 5279 1 1 19 PRO CD C -8.073 0.508 13.726 1.00 . A A . 19 PRO CD 1 1 5 5280 1 1 19 PRO CG C -8.572 0.194 15.136 1.00 . A A . 19 PRO CG 1 1 5 5281 1 1 19 PRO HA H -8.392 -2.565 13.934 1.00 . A A . 19 PRO HA 1 1 5 5282 1 1 19 PRO HB2 H -10.488 -0.824 15.055 1.00 . A A . 19 PRO HB2 1 1 5 5283 1 1 19 PRO HB3 H -9.226 -1.741 15.873 1.00 . A A . 19 PRO HB3 1 1 5 5284 1 1 19 PRO HD2 H -8.647 1.324 13.288 1.00 . A A . 19 PRO HD2 1 1 5 5285 1 1 19 PRO HD3 H -7.017 0.772 13.718 1.00 . A A . 19 PRO HD3 1 1 5 5286 1 1 19 PRO HG2 H -9.149 1.022 15.540 1.00 . A A . 19 PRO HG2 1 1 5 5287 1 1 19 PRO HG3 H -7.721 0.006 15.791 1.00 . A A . 19 PRO HG3 1 1 5 5288 1 1 19 PRO N N -8.295 -0.719 12.982 1.00 . A A . 19 PRO N 1 1 5 5289 1 1 19 PRO O O -11.408 -1.824 13.203 1.00 . A A . 19 PRO O 1 1 5 5290 1 1 20 LEU C C -11.650 -4.284 10.684 1.00 . A A . 20 LEU C 1 1 5 5291 1 1 20 LEU CA C -10.767 -4.397 11.910 1.00 . A A . 20 LEU CA 1 1 5 5292 1 1 20 LEU CB C -11.526 -4.757 13.192 1.00 . A A . 20 LEU CB 1 1 5 5293 1 1 20 LEU CD1 C -12.665 -6.880 13.904 1.00 . A A . 20 LEU CD1 1 1 5 5294 1 1 20 LEU CD2 C -14.033 -4.951 13.040 1.00 . A A . 20 LEU CD2 1 1 5 5295 1 1 20 LEU CG C -12.701 -5.694 12.940 1.00 . A A . 20 LEU CG 1 1 5 5296 1 1 20 LEU H H -9.240 -3.005 11.398 1.00 . A A . 20 LEU H 1 1 5 5297 1 1 20 LEU HA H -10.083 -5.184 11.700 1.00 . A A . 20 LEU HA 1 1 5 5298 1 1 20 LEU HB2 H -10.838 -5.264 13.869 1.00 . A A . 20 LEU HB2 1 1 5 5299 1 1 20 LEU HB3 H -11.886 -3.867 13.698 1.00 . A A . 20 LEU HB3 1 1 5 5300 1 1 20 LEU HD11 H -12.996 -6.583 14.900 1.00 . A A . 20 LEU HD11 1 1 5 5301 1 1 20 LEU HD12 H -13.317 -7.683 13.559 1.00 . A A . 20 LEU HD12 1 1 5 5302 1 1 20 LEU HD13 H -11.655 -7.279 13.991 1.00 . A A . 20 LEU HD13 1 1 5 5303 1 1 20 LEU HD21 H -13.884 -3.872 12.989 1.00 . A A . 20 LEU HD21 1 1 5 5304 1 1 20 LEU HD22 H -14.705 -5.241 12.232 1.00 . A A . 20 LEU HD22 1 1 5 5305 1 1 20 LEU HD23 H -14.530 -5.171 13.985 1.00 . A A . 20 LEU HD23 1 1 5 5306 1 1 20 LEU HG H -12.587 -6.078 11.931 1.00 . A A . 20 LEU HG 1 1 5 5307 1 1 20 LEU N N -9.978 -3.181 12.047 1.00 . A A . 20 LEU N 1 1 5 5308 1 1 20 LEU O O -11.386 -4.787 9.603 1.00 . A A . 20 LEU O 1 1 5 5309 1 1 21 ASN C C -14.653 -4.357 9.743 1.00 . A A . 21 ASN C 1 1 5 5310 1 1 21 ASN CA C -13.645 -3.213 9.935 1.00 . A A . 21 ASN CA 1 1 5 5311 1 1 21 ASN CB C -12.934 -2.889 8.626 1.00 . A A . 21 ASN CB 1 1 5 5312 1 1 21 ASN CG C -13.772 -1.887 7.833 1.00 . A A . 21 ASN CG 1 1 5 5313 1 1 21 ASN H H -12.236 -2.981 11.689 1.00 . A A . 21 ASN H 1 1 5 5314 1 1 21 ASN HA H -14.219 -2.367 10.290 1.00 . A A . 21 ASN HA 1 1 5 5315 1 1 21 ASN HB2 H -11.948 -2.462 8.823 1.00 . A A . 21 ASN HB2 1 1 5 5316 1 1 21 ASN HB3 H -12.820 -3.797 8.033 1.00 . A A . 21 ASN HB3 1 1 5 5317 1 1 21 ASN HD21 H -12.085 -1.067 7.015 1.00 . A A . 21 ASN HD21 1 1 5 5318 1 1 21 ASN N N -12.682 -3.519 10.981 1.00 . A A . 21 ASN N 1 1 5 5319 1 1 21 ASN ND2 N -13.040 -0.912 7.268 1.00 . A A . 21 ASN ND2 1 1 5 5320 1 1 21 ASN O O -15.814 -4.131 9.423 1.00 . A A . 21 ASN O 1 1 5 5321 1 1 21 ASN OD1 O -14.990 -1.993 7.744 1.00 . A A . 21 ASN OD1 1 1 5 5322 1 1 22 GLN C C -13.343 -7.294 8.375 1.00 . A A . 22 GLN C 1 1 5 5323 1 1 22 GLN CA C -14.553 -6.715 9.121 1.00 . A A . 22 GLN CA 1 1 5 5324 1 1 22 GLN CB C -15.639 -6.319 8.114 1.00 . A A . 22 GLN CB 1 1 5 5325 1 1 22 GLN CD C -17.936 -7.309 8.092 1.00 . A A . 22 GLN CD 1 1 5 5326 1 1 22 GLN CG C -17.025 -6.275 8.756 1.00 . A A . 22 GLN CG 1 1 5 5327 1 1 22 GLN H H -13.442 -5.706 10.651 1.00 . A A . 22 GLN H 1 1 5 5328 1 1 22 GLN HA H -14.933 -7.472 9.807 1.00 . A A . 22 GLN HA 1 1 5 5329 1 1 22 GLN HB2 H -15.401 -5.345 7.686 1.00 . A A . 22 GLN HB2 1 1 5 5330 1 1 22 GLN HB3 H -15.646 -7.029 7.287 1.00 . A A . 22 GLN HB3 1 1 5 5331 1 1 22 GLN HE21 H -19.804 -7.006 8.843 1.00 . A A . 22 GLN HE21 1 1 5 5332 1 1 22 GLN HE22 H -19.576 -6.536 7.169 1.00 . A A . 22 GLN HE22 1 1 5 5333 1 1 22 GLN HG2 H -16.961 -6.493 9.822 1.00 . A A . 22 GLN HG2 1 1 5 5334 1 1 22 GLN HG3 H -17.470 -5.286 8.646 1.00 . A A . 22 GLN HG3 1 1 5 5335 1 1 22 GLN N N -14.148 -5.587 9.955 1.00 . A A . 22 GLN N 1 1 5 5336 1 1 22 GLN NE2 N -19.221 -6.915 8.029 1.00 . A A . 22 GLN NE2 1 1 5 5337 1 1 22 GLN O O -13.222 -8.498 8.185 1.00 . A A . 22 GLN O 1 1 5 5338 1 1 22 GLN OE1 O -17.505 -8.376 7.671 1.00 . A A . 22 GLN OE1 1 1 5 5339 1 1 23 THR C C -10.514 -7.680 8.758 1.00 . A A . 23 THR C 1 1 5 5340 1 1 23 THR CA C -11.102 -6.781 7.671 1.00 . A A . 23 THR CA 1 1 5 5341 1 1 23 THR CB C -10.210 -5.563 7.433 1.00 . A A . 23 THR CB 1 1 5 5342 1 1 23 THR CG2 C -9.174 -5.825 6.340 1.00 . A A . 23 THR CG2 1 1 5 5343 1 1 23 THR H H -12.715 -5.390 8.022 1.00 . A A . 23 THR H 1 1 5 5344 1 1 23 THR HA H -11.199 -7.394 6.801 1.00 . A A . 23 THR HA 1 1 5 5345 1 1 23 THR HB H -9.699 -5.292 8.360 1.00 . A A . 23 THR HB 1 1 5 5346 1 1 23 THR HG1 H -10.432 -3.816 6.705 1.00 . A A . 23 THR HG1 1 1 5 5347 1 1 23 THR HG21 H -9.540 -6.564 5.628 1.00 . A A . 23 THR HG21 1 1 5 5348 1 1 23 THR HG22 H -8.949 -4.911 5.790 1.00 . A A . 23 THR HG22 1 1 5 5349 1 1 23 THR HG23 H -8.244 -6.199 6.769 1.00 . A A . 23 THR HG23 1 1 5 5350 1 1 23 THR N N -12.464 -6.360 7.966 1.00 . A A . 23 THR N 1 1 5 5351 1 1 23 THR O O -9.845 -8.676 8.511 1.00 . A A . 23 THR O 1 1 5 5352 1 1 23 THR OG1 O -11.014 -4.473 7.062 1.00 . A A . 23 THR OG1 1 1 5 5353 1 1 24 SER C C -8.627 -7.359 10.974 1.00 . A A . 24 SER C 1 1 5 5354 1 1 24 SER CA C -10.121 -7.629 11.149 1.00 . A A . 24 SER CA 1 1 5 5355 1 1 24 SER CB C -10.479 -9.049 11.518 1.00 . A A . 24 SER CB 1 1 5 5356 1 1 24 SER H H -11.528 -6.521 9.928 1.00 . A A . 24 SER H 1 1 5 5357 1 1 24 SER HA H -10.512 -7.033 11.967 1.00 . A A . 24 SER HA 1 1 5 5358 1 1 24 SER HB2 H -10.147 -9.259 12.531 1.00 . A A . 24 SER HB2 1 1 5 5359 1 1 24 SER HB3 H -11.565 -9.109 11.514 1.00 . A A . 24 SER HB3 1 1 5 5360 1 1 24 SER HG H -9.771 -10.779 11.138 1.00 . A A . 24 SER HG 1 1 5 5361 1 1 24 SER N N -10.835 -7.228 9.967 1.00 . A A . 24 SER N 1 1 5 5362 1 1 24 SER O O -7.952 -7.857 10.080 1.00 . A A . 24 SER O 1 1 5 5363 1 1 24 SER OG O -9.943 -9.997 10.630 1.00 . A A . 24 SER OG 1 1 5 5364 1 1 25 TYR C C -6.396 -5.295 10.802 1.00 . A A . 25 TYR C 1 1 5 5365 1 1 25 TYR CA C -7.670 -5.197 11.621 1.00 . A A . 25 TYR CA 1 1 5 5366 1 1 25 TYR CB C -7.368 -4.497 12.948 1.00 . A A . 25 TYR CB 1 1 5 5367 1 1 25 TYR CD1 C -6.681 -6.388 14.517 1.00 . A A . 25 TYR CD1 1 1 5 5368 1 1 25 TYR CD2 C -4.945 -4.819 13.670 1.00 . A A . 25 TYR CD2 1 1 5 5369 1 1 25 TYR CE1 C -5.672 -7.119 15.238 1.00 . A A . 25 TYR CE1 1 1 5 5370 1 1 25 TYR CE2 C -3.932 -5.549 14.389 1.00 . A A . 25 TYR CE2 1 1 5 5371 1 1 25 TYR CG C -6.320 -5.239 13.726 1.00 . A A . 25 TYR CG 1 1 5 5372 1 1 25 TYR CZ C -4.298 -6.699 15.171 1.00 . A A . 25 TYR CZ 1 1 5 5373 1 1 25 TYR H H -8.613 -6.702 12.817 1.00 . A A . 25 TYR H 1 1 5 5374 1 1 25 TYR HA H -8.404 -4.632 11.019 1.00 . A A . 25 TYR HA 1 1 5 5375 1 1 25 TYR HB2 H -7.037 -3.461 12.814 1.00 . A A . 25 TYR HB2 1 1 5 5376 1 1 25 TYR HB3 H -8.289 -4.489 13.525 1.00 . A A . 25 TYR HB3 1 1 5 5377 1 1 25 TYR HD1 H -7.712 -6.703 14.569 1.00 . A A . 25 TYR HD1 1 1 5 5378 1 1 25 TYR HD2 H -4.670 -3.952 13.087 1.00 . A A . 25 TYR HD2 1 1 5 5379 1 1 25 TYR HE1 H -5.946 -7.981 15.826 1.00 . A A . 25 TYR HE1 1 1 5 5380 1 1 25 TYR HE2 H -2.901 -5.233 14.338 1.00 . A A . 25 TYR HE2 1 1 5 5381 1 1 25 TYR HH H -2.541 -7.449 15.340 1.00 . A A . 25 TYR HH 1 1 5 5382 1 1 25 TYR N N -8.199 -6.524 11.928 1.00 . A A . 25 TYR N 1 1 5 5383 1 1 25 TYR O O -5.600 -6.221 10.899 1.00 . A A . 25 TYR O 1 1 5 5384 1 1 25 TYR OH O -3.330 -7.399 15.863 1.00 . A A . 25 TYR OH 1 1 5 5385 1 1 26 LEU C C -4.469 -3.718 8.483 1.00 . A A . 26 LEU C 1 1 5 5386 1 1 26 LEU CA C -5.785 -4.469 8.662 1.00 . A A . 26 LEU CA 1 1 5 5387 1 1 26 LEU CB C -6.880 -4.130 7.667 1.00 . A A . 26 LEU CB 1 1 5 5388 1 1 26 LEU CD1 C -7.020 -2.093 6.246 1.00 . A A . 26 LEU CD1 1 1 5 5389 1 1 26 LEU CD2 C -8.697 -2.525 8.059 1.00 . A A . 26 LEU CD2 1 1 5 5390 1 1 26 LEU CG C -7.238 -2.660 7.640 1.00 . A A . 26 LEU CG 1 1 5 5391 1 1 26 LEU H H -6.894 -3.458 10.183 1.00 . A A . 26 LEU H 1 1 5 5392 1 1 26 LEU HA H -5.616 -5.528 8.549 1.00 . A A . 26 LEU HA 1 1 5 5393 1 1 26 LEU HB2 H -6.622 -4.487 6.668 1.00 . A A . 26 LEU HB2 1 1 5 5394 1 1 26 LEU HB3 H -7.770 -4.656 8.010 1.00 . A A . 26 LEU HB3 1 1 5 5395 1 1 26 LEU HD11 H -7.885 -2.301 5.616 1.00 . A A . 26 LEU HD11 1 1 5 5396 1 1 26 LEU HD12 H -6.872 -1.016 6.290 1.00 . A A . 26 LEU HD12 1 1 5 5397 1 1 26 LEU HD13 H -6.144 -2.551 5.786 1.00 . A A . 26 LEU HD13 1 1 5 5398 1 1 26 LEU HD21 H -8.777 -2.537 9.146 1.00 . A A . 26 LEU HD21 1 1 5 5399 1 1 26 LEU HD22 H -9.129 -1.603 7.680 1.00 . A A . 26 LEU HD22 1 1 5 5400 1 1 26 LEU HD23 H -9.268 -3.369 7.674 1.00 . A A . 26 LEU HD23 1 1 5 5401 1 1 26 LEU HG H -6.593 -2.135 8.344 1.00 . A A . 26 LEU HG 1 1 5 5402 1 1 26 LEU N N -6.298 -4.238 9.989 1.00 . A A . 26 LEU N 1 1 5 5403 1 1 26 LEU O O -3.517 -3.908 9.229 1.00 . A A . 26 LEU O 1 1 5 5404 1 1 27 CYS C C -4.538 -0.568 6.610 1.00 . A A . 27 CYS C 1 1 5 5405 1 1 27 CYS CA C -3.933 -1.538 7.627 1.00 . A A . 27 CYS CA 1 1 5 5406 1 1 27 CYS CB C -2.416 -1.568 7.502 1.00 . A A . 27 CYS CB 1 1 5 5407 1 1 27 CYS H H -4.945 -3.196 6.622 1.00 . A A . 27 CYS H 1 1 5 5408 1 1 27 CYS HA H -4.192 -1.211 8.636 1.00 . A A . 27 CYS HA 1 1 5 5409 1 1 27 CYS HB2 H -2.133 -2.219 6.677 1.00 . A A . 27 CYS HB2 1 1 5 5410 1 1 27 CYS HB3 H -2.045 -0.561 7.293 1.00 . A A . 27 CYS HB3 1 1 5 5411 1 1 27 CYS N N -4.486 -2.870 7.448 1.00 . A A . 27 CYS N 1 1 5 5412 1 1 27 CYS O O -4.796 -0.893 5.457 1.00 . A A . 27 CYS O 1 1 5 5413 1 1 27 CYS SG S -1.643 -2.165 9.024 1.00 . A A . 27 CYS SG 1 1 5 5414 1 1 28 VAL C C -4.474 1.899 5.105 1.00 . A A . 28 VAL C 1 1 5 5415 1 1 28 VAL CA C -5.312 1.727 6.378 1.00 . A A . 28 VAL CA 1 1 5 5416 1 1 28 VAL CB C -5.369 3.025 7.216 1.00 . A A . 28 VAL CB 1 1 5 5417 1 1 28 VAL CG1 C -5.467 2.814 8.736 1.00 . A A . 28 VAL CG1 1 1 5 5418 1 1 28 VAL CG2 C -4.218 3.966 6.892 1.00 . A A . 28 VAL CG2 1 1 5 5419 1 1 28 VAL H H -4.442 0.789 8.092 1.00 . A A . 28 VAL H 1 1 5 5420 1 1 28 VAL HA H -6.316 1.401 6.104 1.00 . A A . 28 VAL HA 1 1 5 5421 1 1 28 VAL HB H -6.264 3.568 6.934 1.00 . A A . 28 VAL HB 1 1 5 5422 1 1 28 VAL HG11 H -6.494 2.895 9.077 1.00 . A A . 28 VAL HG11 1 1 5 5423 1 1 28 VAL HG12 H -5.081 1.866 9.103 1.00 . A A . 28 VAL HG12 1 1 5 5424 1 1 28 VAL HG13 H -4.913 3.599 9.243 1.00 . A A . 28 VAL HG13 1 1 5 5425 1 1 28 VAL HG21 H -4.433 4.557 6.002 1.00 . A A . 28 VAL HG21 1 1 5 5426 1 1 28 VAL HG22 H -4.030 4.653 7.717 1.00 . A A . 28 VAL HG22 1 1 5 5427 1 1 28 VAL HG23 H -3.317 3.393 6.709 1.00 . A A . 28 VAL HG23 1 1 5 5428 1 1 28 VAL N N -4.733 0.644 7.149 1.00 . A A . 28 VAL N 1 1 5 5429 1 1 28 VAL O O -3.296 1.569 5.073 1.00 . A A . 28 VAL O 1 1 5 5430 1 1 29 CYS C C -4.259 3.659 2.087 1.00 . A A . 29 CYS C 1 1 5 5431 1 1 29 CYS CA C -4.497 2.296 2.747 1.00 . A A . 29 CYS CA 1 1 5 5432 1 1 29 CYS CB C -5.347 1.423 1.831 1.00 . A A . 29 CYS CB 1 1 5 5433 1 1 29 CYS H H -6.148 2.425 4.131 1.00 . A A . 29 CYS H 1 1 5 5434 1 1 29 CYS HA H -3.548 1.815 2.910 1.00 . A A . 29 CYS HA 1 1 5 5435 1 1 29 CYS HB2 H -6.367 1.373 2.220 1.00 . A A . 29 CYS HB2 1 1 5 5436 1 1 29 CYS HB3 H -5.393 1.893 0.847 1.00 . A A . 29 CYS HB3 1 1 5 5437 1 1 29 CYS N N -5.152 2.397 4.052 1.00 . A A . 29 CYS N 1 1 5 5438 1 1 29 CYS O O -3.218 3.960 1.516 1.00 . A A . 29 CYS O 1 1 5 5439 1 1 29 CYS SG S -4.704 -0.267 1.671 1.00 . A A . 29 CYS SG 1 1 5 5440 1 1 30 ALA C C -5.190 5.986 0.346 1.00 . A A . 30 ALA C 1 1 5 5441 1 1 30 ALA CA C -5.306 5.835 1.868 1.00 . A A . 30 ALA CA 1 1 5 5442 1 1 30 ALA CB C -4.155 6.549 2.579 1.00 . A A . 30 ALA CB 1 1 5 5443 1 1 30 ALA H H -5.862 3.989 2.957 1.00 . A A . 30 ALA H 1 1 5 5444 1 1 30 ALA HA H -6.274 6.244 2.155 1.00 . A A . 30 ALA HA 1 1 5 5445 1 1 30 ALA HB1 H -3.398 6.876 1.865 1.00 . A A . 30 ALA HB1 1 1 5 5446 1 1 30 ALA HB2 H -4.518 7.427 3.114 1.00 . A A . 30 ALA HB2 1 1 5 5447 1 1 30 ALA HB3 H -3.676 5.889 3.301 1.00 . A A . 30 ALA HB3 1 1 5 5448 1 1 30 ALA N N -5.335 4.429 2.237 1.00 . A A . 30 ALA N 1 1 5 5449 1 1 30 ALA O O -4.204 6.485 -0.181 1.00 . A A . 30 ALA O 1 1 5 5450 1 1 31 GLU C C -5.292 5.559 -2.573 1.00 . A A . 31 GLU C 1 1 5 5451 1 1 31 GLU CA C -6.214 4.849 -1.574 1.00 . A A . 31 GLU CA 1 1 5 5452 1 1 31 GLU CB C -7.654 4.768 -2.085 1.00 . A A . 31 GLU CB 1 1 5 5453 1 1 31 GLU CD C -7.905 7.170 -2.739 1.00 . A A . 31 GLU CD 1 1 5 5454 1 1 31 GLU CG C -7.948 5.724 -3.238 1.00 . A A . 31 GLU CG 1 1 5 5455 1 1 31 GLU H H -7.183 5.446 0.115 1.00 . A A . 31 GLU H 1 1 5 5456 1 1 31 GLU HA H -5.850 3.844 -1.363 1.00 . A A . 31 GLU HA 1 1 5 5457 1 1 31 GLU HB2 H -7.862 3.743 -2.371 1.00 . A A . 31 GLU HB2 1 1 5 5458 1 1 31 GLU HB3 H -8.355 4.981 -1.277 1.00 . A A . 31 GLU HB3 1 1 5 5459 1 1 31 GLU HG2 H -7.213 5.601 -4.032 1.00 . A A . 31 GLU HG2 1 1 5 5460 1 1 31 GLU HG3 H -8.936 5.525 -3.647 1.00 . A A . 31 GLU HG3 1 1 5 5461 1 1 31 GLU N N -6.281 5.536 -0.305 1.00 . A A . 31 GLU N 1 1 5 5462 1 1 31 GLU O O -4.877 6.696 -2.387 1.00 . A A . 31 GLU O 1 1 5 5463 1 1 31 GLU OE1 O -8.827 7.576 -2.034 1.00 . A A . 31 GLU OE1 1 1 5 5464 1 1 31 GLU OE2 O -6.949 7.874 -3.062 1.00 . A A . 31 GLU OE2 1 1 5 5465 1 1 32 GLY C C -3.540 2.872 -3.935 1.00 . A A . 32 GLY C 1 1 5 5466 1 1 32 GLY CA C -3.644 4.394 -3.881 1.00 . A A . 32 GLY CA 1 1 5 5467 1 1 32 GLY H H -5.747 4.524 -4.278 1.00 . A A . 32 GLY H 1 1 5 5468 1 1 32 GLY HA2 H -3.307 4.846 -4.815 1.00 . A A . 32 GLY HA2 1 1 5 5469 1 1 32 GLY HA3 H -3.064 4.763 -3.039 1.00 . A A . 32 GLY HA3 1 1 5 5470 1 1 32 GLY N N -5.017 4.801 -3.653 1.00 . A A . 32 GLY N 1 1 5 5471 1 1 32 GLY O O -2.937 2.284 -4.822 1.00 . A A . 32 GLY O 1 1 5 5472 1 1 33 PHE C C -4.394 0.314 -1.551 1.00 . A A . 33 PHE C 1 1 5 5473 1 1 33 PHE CA C -3.474 1.459 -1.971 1.00 . A A . 33 PHE CA 1 1 5 5474 1 1 33 PHE CB C -3.041 2.321 -0.783 1.00 . A A . 33 PHE CB 1 1 5 5475 1 1 33 PHE CD1 C -0.631 2.432 -1.567 1.00 . A A . 33 PHE CD1 1 1 5 5476 1 1 33 PHE CD2 C -1.768 4.533 -0.885 1.00 . A A . 33 PHE CD2 1 1 5 5477 1 1 33 PHE CE1 C 0.582 3.160 -1.816 1.00 . A A . 33 PHE CE1 1 1 5 5478 1 1 33 PHE CE2 C -0.560 5.270 -1.142 1.00 . A A . 33 PHE CE2 1 1 5 5479 1 1 33 PHE CG C -1.806 3.110 -1.091 1.00 . A A . 33 PHE CG 1 1 5 5480 1 1 33 PHE CZ C 0.617 4.583 -1.606 1.00 . A A . 33 PHE CZ 1 1 5 5481 1 1 33 PHE H H -5.140 2.541 -2.761 1.00 . A A . 33 PHE H 1 1 5 5482 1 1 33 PHE HA H -2.604 1.009 -2.461 1.00 . A A . 33 PHE HA 1 1 5 5483 1 1 33 PHE HB2 H -3.845 2.980 -0.427 1.00 . A A . 33 PHE HB2 1 1 5 5484 1 1 33 PHE HB3 H -2.746 1.665 0.023 1.00 . A A . 33 PHE HB3 1 1 5 5485 1 1 33 PHE HD1 H -0.669 1.371 -1.757 1.00 . A A . 33 PHE HD1 1 1 5 5486 1 1 33 PHE HD2 H -2.650 5.043 -0.533 1.00 . A A . 33 PHE HD2 1 1 5 5487 1 1 33 PHE HE1 H 1.457 2.624 -2.154 1.00 . A A . 33 PHE HE1 1 1 5 5488 1 1 33 PHE HE2 H -0.544 6.336 -0.984 1.00 . A A . 33 PHE HE2 1 1 5 5489 1 1 33 PHE HZ H 1.525 5.135 -1.801 1.00 . A A . 33 PHE HZ 1 1 5 5490 1 1 33 PHE N N -4.188 2.291 -2.919 1.00 . A A . 33 PHE N 1 1 5 5491 1 1 33 PHE O O -5.303 0.454 -0.743 1.00 . A A . 33 PHE O 1 1 5 5492 1 1 34 ALA C C -4.132 -3.232 -2.355 1.00 . A A . 34 ALA C 1 1 5 5493 1 1 34 ALA CA C -4.929 -1.986 -1.985 1.00 . A A . 34 ALA CA 1 1 5 5494 1 1 34 ALA CB C -6.183 -1.871 -2.853 1.00 . A A . 34 ALA CB 1 1 5 5495 1 1 34 ALA H H -3.285 -0.878 -2.784 1.00 . A A . 34 ALA H 1 1 5 5496 1 1 34 ALA HA H -5.179 -2.013 -0.924 1.00 . A A . 34 ALA HA 1 1 5 5497 1 1 34 ALA HB1 H -5.932 -1.543 -3.861 1.00 . A A . 34 ALA HB1 1 1 5 5498 1 1 34 ALA HB2 H -6.695 -2.830 -2.930 1.00 . A A . 34 ALA HB2 1 1 5 5499 1 1 34 ALA HB3 H -6.881 -1.148 -2.430 1.00 . A A . 34 ALA HB3 1 1 5 5500 1 1 34 ALA N N -4.085 -0.828 -2.184 1.00 . A A . 34 ALA N 1 1 5 5501 1 1 34 ALA O O -3.441 -3.281 -3.365 1.00 . A A . 34 ALA O 1 1 5 5502 1 1 35 PRO C C -2.304 -5.567 -2.122 1.00 . A A . 35 PRO C 1 1 5 5503 1 1 35 PRO CA C -3.113 -4.975 -0.969 1.00 . A A . 35 PRO CA 1 1 5 5504 1 1 35 PRO CB C -3.698 -6.085 -0.091 1.00 . A A . 35 PRO CB 1 1 5 5505 1 1 35 PRO CD C -5.540 -4.677 -0.944 1.00 . A A . 35 PRO CD 1 1 5 5506 1 1 35 PRO CG C -5.224 -5.900 -0.079 1.00 . A A . 35 PRO CG 1 1 5 5507 1 1 35 PRO HA H -2.472 -4.315 -0.383 1.00 . A A . 35 PRO HA 1 1 5 5508 1 1 35 PRO HB2 H -3.435 -7.065 -0.489 1.00 . A A . 35 PRO HB2 1 1 5 5509 1 1 35 PRO HB3 H -3.301 -6.017 0.921 1.00 . A A . 35 PRO HB3 1 1 5 5510 1 1 35 PRO HD2 H -6.207 -4.930 -1.768 1.00 . A A . 35 PRO HD2 1 1 5 5511 1 1 35 PRO HD3 H -5.997 -3.882 -0.355 1.00 . A A . 35 PRO HD3 1 1 5 5512 1 1 35 PRO HG2 H -5.719 -6.785 -0.478 1.00 . A A . 35 PRO HG2 1 1 5 5513 1 1 35 PRO HG3 H -5.583 -5.752 0.940 1.00 . A A . 35 PRO HG3 1 1 5 5514 1 1 35 PRO N N -4.257 -4.232 -1.461 1.00 . A A . 35 PRO N 1 1 5 5515 1 1 35 PRO O O -2.678 -6.562 -2.731 1.00 . A A . 35 PRO O 1 1 5 5516 1 1 36 ILE C C 0.043 -6.999 -2.595 1.00 . A A . 36 ILE C 1 1 5 5517 1 1 36 ILE CA C -0.064 -5.541 -3.061 1.00 . A A . 36 ILE CA 1 1 5 5518 1 1 36 ILE CB C 1.225 -4.773 -2.747 1.00 . A A . 36 ILE CB 1 1 5 5519 1 1 36 ILE CD1 C 3.232 -6.048 -1.924 1.00 . A A . 36 ILE CD1 1 1 5 5520 1 1 36 ILE CG1 C 2.477 -5.551 -3.144 1.00 . A A . 36 ILE CG1 1 1 5 5521 1 1 36 ILE CG2 C 1.234 -4.354 -1.278 1.00 . A A . 36 ILE CG2 1 1 5 5522 1 1 36 ILE H H -1.084 -3.910 -2.162 1.00 . A A . 36 ILE H 1 1 5 5523 1 1 36 ILE HA H -0.276 -5.473 -4.125 1.00 . A A . 36 ILE HA 1 1 5 5524 1 1 36 ILE HB H 1.250 -3.865 -3.337 1.00 . A A . 36 ILE HB 1 1 5 5525 1 1 36 ILE HD11 H 2.528 -6.400 -1.170 1.00 . A A . 36 ILE HD11 1 1 5 5526 1 1 36 ILE HD12 H 3.899 -6.861 -2.200 1.00 . A A . 36 ILE HD12 1 1 5 5527 1 1 36 ILE HD13 H 3.822 -5.238 -1.495 1.00 . A A . 36 ILE HD13 1 1 5 5528 1 1 36 ILE HG12 H 2.220 -6.395 -3.780 1.00 . A A . 36 ILE HG12 1 1 5 5529 1 1 36 ILE HG13 H 3.128 -4.908 -3.737 1.00 . A A . 36 ILE HG13 1 1 5 5530 1 1 36 ILE HG21 H 0.693 -3.420 -1.118 1.00 . A A . 36 ILE HG21 1 1 5 5531 1 1 36 ILE HG22 H 0.718 -5.117 -0.691 1.00 . A A . 36 ILE HG22 1 1 5 5532 1 1 36 ILE HG23 H 2.232 -4.222 -0.860 1.00 . A A . 36 ILE HG23 1 1 5 5533 1 1 36 ILE N N -1.170 -4.884 -2.378 1.00 . A A . 36 ILE N 1 1 5 5534 1 1 36 ILE O O -0.179 -7.315 -1.432 1.00 . A A . 36 ILE O 1 1 5 5535 1 1 37 PRO C C 2.001 -9.118 -2.155 1.00 . A A . 37 PRO C 1 1 5 5536 1 1 37 PRO CA C 0.922 -9.189 -3.234 1.00 . A A . 37 PRO CA 1 1 5 5537 1 1 37 PRO CB C 1.538 -9.694 -4.537 1.00 . A A . 37 PRO CB 1 1 5 5538 1 1 37 PRO CD C 0.345 -7.585 -4.984 1.00 . A A . 37 PRO CD 1 1 5 5539 1 1 37 PRO CG C 1.034 -8.774 -5.659 1.00 . A A . 37 PRO CG 1 1 5 5540 1 1 37 PRO HA H 0.109 -9.837 -2.911 1.00 . A A . 37 PRO HA 1 1 5 5541 1 1 37 PRO HB2 H 2.625 -9.631 -4.462 1.00 . A A . 37 PRO HB2 1 1 5 5542 1 1 37 PRO HB3 H 1.267 -10.733 -4.724 1.00 . A A . 37 PRO HB3 1 1 5 5543 1 1 37 PRO HD2 H 0.873 -6.659 -5.213 1.00 . A A . 37 PRO HD2 1 1 5 5544 1 1 37 PRO HD3 H -0.691 -7.486 -5.309 1.00 . A A . 37 PRO HD3 1 1 5 5545 1 1 37 PRO HG2 H 1.862 -8.435 -6.280 1.00 . A A . 37 PRO HG2 1 1 5 5546 1 1 37 PRO HG3 H 0.332 -9.305 -6.302 1.00 . A A . 37 PRO HG3 1 1 5 5547 1 1 37 PRO N N 0.394 -7.877 -3.559 1.00 . A A . 37 PRO N 1 1 5 5548 1 1 37 PRO O O 3.165 -8.873 -2.446 1.00 . A A . 37 PRO O 1 1 5 5549 1 1 38 HIS C C -0.391 -10.293 0.323 1.00 . A A . 38 HIS C 1 1 5 5550 1 1 38 HIS CA C 0.894 -10.565 -0.486 1.00 . A A . 38 HIS CA 1 1 5 5551 1 1 38 HIS CB C 1.802 -11.498 0.349 1.00 . A A . 38 HIS CB 1 1 5 5552 1 1 38 HIS CD2 C 4.042 -10.719 -0.558 1.00 . A A . 38 HIS CD2 1 1 5 5553 1 1 38 HIS CE1 C 5.205 -10.376 1.308 1.00 . A A . 38 HIS CE1 1 1 5 5554 1 1 38 HIS CG C 3.253 -11.097 0.451 1.00 . A A . 38 HIS CG 1 1 5 5555 1 1 38 HIS H H 1.657 -8.582 -0.227 1.00 . A A . 38 HIS H 1 1 5 5556 1 1 38 HIS HA H 0.586 -11.033 -1.404 1.00 . A A . 38 HIS HA 1 1 5 5557 1 1 38 HIS HB2 H 1.375 -11.531 1.356 1.00 . A A . 38 HIS HB2 1 1 5 5558 1 1 38 HIS HB3 H 1.749 -12.507 -0.072 1.00 . A A . 38 HIS HB3 1 1 5 5559 1 1 38 HIS HD1 H 3.839 -11.428 2.538 1.00 . A A . 38 HIS HD1 1 1 5 5560 1 1 38 HIS HD2 H 3.734 -10.740 -1.572 1.00 . A A . 38 HIS HD2 1 1 5 5561 1 1 38 HIS HE1 H 5.746 -9.716 1.975 1.00 . A A . 38 HIS HE1 1 1 5 5562 1 1 38 HIS N N 1.547 -9.314 -0.899 1.00 . A A . 38 HIS N 1 1 5 5563 1 1 38 HIS ND1 N 4.055 -10.975 1.674 1.00 . A A . 38 HIS ND1 1 1 5 5564 1 1 38 HIS NE2 N 5.337 -10.275 -0.027 1.00 . A A . 38 HIS NE2 1 1 5 5565 1 1 38 HIS O O -1.398 -10.982 0.220 1.00 . A A . 38 HIS O 1 1 5 5566 1 1 39 GLU C C -1.725 -8.208 2.755 1.00 . A A . 39 GLU C 1 1 5 5567 1 1 39 GLU CA C -0.629 -9.256 2.520 1.00 . A A . 39 GLU CA 1 1 5 5568 1 1 39 GLU CB C 0.573 -8.956 3.429 1.00 . A A . 39 GLU CB 1 1 5 5569 1 1 39 GLU CD C 2.078 -10.958 3.633 1.00 . A A . 39 GLU CD 1 1 5 5570 1 1 39 GLU CG C 1.887 -9.596 2.960 1.00 . A A . 39 GLU CG 1 1 5 5571 1 1 39 GLU H H 0.472 -8.669 0.713 1.00 . A A . 39 GLU H 1 1 5 5572 1 1 39 GLU HA H -1.010 -10.256 2.713 1.00 . A A . 39 GLU HA 1 1 5 5573 1 1 39 GLU HB2 H 0.705 -7.876 3.484 1.00 . A A . 39 GLU HB2 1 1 5 5574 1 1 39 GLU HB3 H 0.344 -9.313 4.437 1.00 . A A . 39 GLU HB3 1 1 5 5575 1 1 39 GLU HG2 H 1.896 -9.704 1.888 1.00 . A A . 39 GLU HG2 1 1 5 5576 1 1 39 GLU HG3 H 2.761 -8.976 3.146 1.00 . A A . 39 GLU HG3 1 1 5 5577 1 1 39 GLU N N -0.244 -9.230 1.119 1.00 . A A . 39 GLU N 1 1 5 5578 1 1 39 GLU O O -1.905 -7.279 1.976 1.00 . A A . 39 GLU O 1 1 5 5579 1 1 39 GLU OE1 O 1.163 -11.778 3.570 1.00 . A A . 39 GLU OE1 1 1 5 5580 1 1 39 GLU OE2 O 3.136 -11.182 4.219 1.00 . A A . 39 GLU OE2 1 1 5 5581 1 1 40 PRO C C -2.031 -6.440 5.342 1.00 . A A . 40 PRO C 1 1 5 5582 1 1 40 PRO CA C -3.060 -7.320 4.625 1.00 . A A . 40 PRO CA 1 1 5 5583 1 1 40 PRO CB C -3.954 -8.000 5.666 1.00 . A A . 40 PRO CB 1 1 5 5584 1 1 40 PRO CD C -2.751 -9.736 4.387 1.00 . A A . 40 PRO CD 1 1 5 5585 1 1 40 PRO CG C -3.727 -9.514 5.546 1.00 . A A . 40 PRO CG 1 1 5 5586 1 1 40 PRO HA H -3.651 -6.699 3.951 1.00 . A A . 40 PRO HA 1 1 5 5587 1 1 40 PRO HB2 H -3.702 -7.654 6.668 1.00 . A A . 40 PRO HB2 1 1 5 5588 1 1 40 PRO HB3 H -5.002 -7.758 5.486 1.00 . A A . 40 PRO HB3 1 1 5 5589 1 1 40 PRO HD2 H -1.835 -10.224 4.722 1.00 . A A . 40 PRO HD2 1 1 5 5590 1 1 40 PRO HD3 H -3.202 -10.345 3.603 1.00 . A A . 40 PRO HD3 1 1 5 5591 1 1 40 PRO HG2 H -3.315 -9.915 6.472 1.00 . A A . 40 PRO HG2 1 1 5 5592 1 1 40 PRO HG3 H -4.671 -10.027 5.357 1.00 . A A . 40 PRO HG3 1 1 5 5593 1 1 40 PRO N N -2.448 -8.409 3.878 1.00 . A A . 40 PRO N 1 1 5 5594 1 1 40 PRO O O -1.714 -6.640 6.508 1.00 . A A . 40 PRO O 1 1 5 5595 1 1 41 HIS C C -1.037 -3.140 4.012 1.00 . A A . 41 HIS C 1 1 5 5596 1 1 41 HIS CA C -1.404 -4.125 5.117 1.00 . A A . 41 HIS CA 1 1 5 5597 1 1 41 HIS CB C -0.401 -4.084 6.283 1.00 . A A . 41 HIS CB 1 1 5 5598 1 1 41 HIS CD2 C 2.083 -4.666 6.196 1.00 . A A . 41 HIS CD2 1 1 5 5599 1 1 41 HIS CE1 C 1.988 -6.853 5.749 1.00 . A A . 41 HIS CE1 1 1 5 5600 1 1 41 HIS CG C 0.783 -4.995 6.112 1.00 . A A . 41 HIS CG 1 1 5 5601 1 1 41 HIS H H -1.159 -5.667 3.664 1.00 . A A . 41 HIS H 1 1 5 5602 1 1 41 HIS HA H -2.371 -3.835 5.483 1.00 . A A . 41 HIS HA 1 1 5 5603 1 1 41 HIS HB2 H -0.034 -3.061 6.395 1.00 . A A . 41 HIS HB2 1 1 5 5604 1 1 41 HIS HB3 H -0.916 -4.349 7.209 1.00 . A A . 41 HIS HB3 1 1 5 5605 1 1 41 HIS HD1 H -0.118 -6.941 5.610 1.00 . A A . 41 HIS HD1 1 1 5 5606 1 1 41 HIS HD2 H 2.461 -3.679 6.386 1.00 . A A . 41 HIS HD2 1 1 5 5607 1 1 41 HIS HE1 H 2.262 -7.857 5.436 1.00 . A A . 41 HIS HE1 1 1 5 5608 1 1 41 HIS N N -1.533 -5.462 4.565 1.00 . A A . 41 HIS N 1 1 5 5609 1 1 41 HIS ND1 N 0.718 -6.433 5.816 1.00 . A A . 41 HIS ND1 1 1 5 5610 1 1 41 HIS NE2 N 2.887 -5.881 5.980 1.00 . A A . 41 HIS NE2 1 1 5 5611 1 1 41 HIS O O -1.865 -2.429 3.456 1.00 . A A . 41 HIS O 1 1 5 5612 1 1 42 ARG C C 0.810 -2.027 1.675 1.00 . A A . 42 ARG C 1 1 5 5613 1 1 42 ARG CA C 1.035 -3.199 2.591 1.00 . A A . 42 ARG CA 1 1 5 5614 1 1 42 ARG CB C 0.737 -4.452 1.801 1.00 . A A . 42 ARG CB 1 1 5 5615 1 1 42 ARG CD C 2.107 -6.534 2.100 1.00 . A A . 42 ARG CD 1 1 5 5616 1 1 42 ARG CG C 0.907 -5.726 2.602 1.00 . A A . 42 ARG CG 1 1 5 5617 1 1 42 ARG CZ C 4.330 -7.123 2.803 1.00 . A A . 42 ARG CZ 1 1 5 5618 1 1 42 ARG H H 0.699 -3.514 4.665 1.00 . A A . 42 ARG H 1 1 5 5619 1 1 42 ARG HA H 2.062 -3.154 2.881 1.00 . A A . 42 ARG HA 1 1 5 5620 1 1 42 ARG HB2 H -0.256 -4.402 1.355 1.00 . A A . 42 ARG HB2 1 1 5 5621 1 1 42 ARG HB3 H 1.457 -4.456 0.999 1.00 . A A . 42 ARG HB3 1 1 5 5622 1 1 42 ARG HD2 H 1.822 -7.549 1.829 1.00 . A A . 42 ARG HD2 1 1 5 5623 1 1 42 ARG HD3 H 2.584 -6.072 1.236 1.00 . A A . 42 ARG HD3 1 1 5 5624 1 1 42 ARG HE H 2.924 -6.324 4.062 1.00 . A A . 42 ARG HE 1 1 5 5625 1 1 42 ARG HG2 H 1.026 -5.479 3.660 1.00 . A A . 42 ARG HG2 1 1 5 5626 1 1 42 ARG HG3 H -0.007 -6.311 2.483 1.00 . A A . 42 ARG HG3 1 1 5 5627 1 1 42 ARG HH11 H 4.063 -7.011 0.798 1.00 . A A . 42 ARG HH11 1 1 5 5628 1 1 42 ARG HH12 H 5.399 -7.984 1.314 1.00 . A A . 42 ARG HH12 1 1 5 5629 1 1 42 ARG HH21 H 5.128 -6.927 4.653 1.00 . A A . 42 ARG HH21 1 1 5 5630 1 1 42 ARG HH22 H 6.032 -7.916 3.552 1.00 . A A . 42 ARG HH22 1 1 5 5631 1 1 42 ARG N N 0.290 -3.158 3.836 1.00 . A A . 42 ARG N 1 1 5 5632 1 1 42 ARG NE N 3.121 -6.630 3.132 1.00 . A A . 42 ARG NE 1 1 5 5633 1 1 42 ARG NH1 N 4.621 -7.395 1.533 1.00 . A A . 42 ARG NH1 1 1 5 5634 1 1 42 ARG NH2 N 5.239 -7.340 3.748 1.00 . A A . 42 ARG NH2 1 1 5 5635 1 1 42 ARG O O 1.687 -1.239 1.344 1.00 . A A . 42 ARG O 1 1 5 5636 1 1 43 CYS C C 0.137 -0.553 -0.583 1.00 . A A . 43 CYS C 1 1 5 5637 1 1 43 CYS CA C -0.887 -1.513 -0.004 1.00 . A A . 43 CYS CA 1 1 5 5638 1 1 43 CYS CB C -2.217 -0.802 0.080 1.00 . A A . 43 CYS CB 1 1 5 5639 1 1 43 CYS H H -0.985 -2.413 2.017 1.00 . A A . 43 CYS H 1 1 5 5640 1 1 43 CYS HA H -0.968 -2.345 -0.699 1.00 . A A . 43 CYS HA 1 1 5 5641 1 1 43 CYS HB2 H -2.184 -0.047 -0.708 1.00 . A A . 43 CYS HB2 1 1 5 5642 1 1 43 CYS HB3 H -2.983 -1.521 -0.176 1.00 . A A . 43 CYS HB3 1 1 5 5643 1 1 43 CYS N N -0.451 -2.041 1.273 1.00 . A A . 43 CYS N 1 1 5 5644 1 1 43 CYS O O 0.617 0.371 0.062 1.00 . A A . 43 CYS O 1 1 5 5645 1 1 43 CYS SG S -2.666 -0.068 1.677 1.00 . A A . 43 CYS SG 1 1 5 5646 1 1 44 GLN C C 1.575 -0.214 -3.859 1.00 . A A . 44 GLN C 1 1 5 5647 1 1 44 GLN CA C 1.658 -0.334 -2.350 1.00 . A A . 44 GLN CA 1 1 5 5648 1 1 44 GLN CB C 2.787 -1.279 -1.949 1.00 . A A . 44 GLN CB 1 1 5 5649 1 1 44 GLN CD C 5.236 -1.304 -1.414 1.00 . A A . 44 GLN CD 1 1 5 5650 1 1 44 GLN CG C 3.919 -0.549 -1.225 1.00 . A A . 44 GLN CG 1 1 5 5651 1 1 44 GLN H H -0.208 -1.380 -2.428 1.00 . A A . 44 GLN H 1 1 5 5652 1 1 44 GLN HA H 1.725 0.654 -1.896 1.00 . A A . 44 GLN HA 1 1 5 5653 1 1 44 GLN HB2 H 2.385 -2.070 -1.314 1.00 . A A . 44 GLN HB2 1 1 5 5654 1 1 44 GLN HB3 H 3.167 -1.769 -2.845 1.00 . A A . 44 GLN HB3 1 1 5 5655 1 1 44 GLN HE21 H 4.286 -3.022 -0.880 1.00 . A A . 44 GLN HE21 1 1 5 5656 1 1 44 GLN HE22 H 6.035 -3.059 -0.762 1.00 . A A . 44 GLN HE22 1 1 5 5657 1 1 44 GLN HG2 H 4.034 0.463 -1.612 1.00 . A A . 44 GLN HG2 1 1 5 5658 1 1 44 GLN HG3 H 3.706 -0.473 -0.159 1.00 . A A . 44 GLN HG3 1 1 5 5659 1 1 44 GLN N N 0.415 -0.844 -1.858 1.00 . A A . 44 GLN N 1 1 5 5660 1 1 44 GLN NE2 N 5.181 -2.576 -0.980 1.00 . A A . 44 GLN NE2 1 1 5 5661 1 1 44 GLN O O 1.985 -1.085 -4.616 1.00 . A A . 44 GLN O 1 1 5 5662 1 1 44 GLN OE1 O 6.221 -0.773 -1.913 1.00 . A A . 44 GLN OE1 1 1 5 5663 1 1 45 MET C C -0.823 -0.326 -5.266 1.00 . A A . 45 MET C 1 1 5 5664 1 1 45 MET CA C -0.395 1.003 -4.628 1.00 . A A . 45 MET CA 1 1 5 5665 1 1 45 MET CB C -0.549 2.118 -5.673 1.00 . A A . 45 MET CB 1 1 5 5666 1 1 45 MET CE C 2.642 0.530 -7.429 1.00 . A A . 45 MET CE 1 1 5 5667 1 1 45 MET CG C 0.664 2.215 -6.601 1.00 . A A . 45 MET CG 1 1 5 5668 1 1 45 MET H H 1.593 1.750 -4.179 1.00 . A A . 45 MET H 1 1 5 5669 1 1 45 MET HA H -0.992 1.185 -3.720 1.00 . A A . 45 MET HA 1 1 5 5670 1 1 45 MET HB2 H -1.424 1.929 -6.293 1.00 . A A . 45 MET HB2 1 1 5 5671 1 1 45 MET HB3 H -0.712 3.075 -5.176 1.00 . A A . 45 MET HB3 1 1 5 5672 1 1 45 MET HE1 H 2.984 -0.322 -8.018 1.00 . A A . 45 MET HE1 1 1 5 5673 1 1 45 MET HE2 H 3.143 1.428 -7.791 1.00 . A A . 45 MET HE2 1 1 5 5674 1 1 45 MET HE3 H 2.921 0.372 -6.388 1.00 . A A . 45 MET HE3 1 1 5 5675 1 1 45 MET HG2 H 0.550 3.062 -7.277 1.00 . A A . 45 MET HG2 1 1 5 5676 1 1 45 MET HG3 H 1.571 2.385 -6.021 1.00 . A A . 45 MET HG3 1 1 5 5677 1 1 45 MET N N 1.007 0.943 -4.227 1.00 . A A . 45 MET N 1 1 5 5678 1 1 45 MET O O -0.016 -1.052 -5.834 1.00 . A A . 45 MET O 1 1 5 5679 1 1 45 MET SD S 0.856 0.711 -7.575 1.00 . A A . 45 MET SD 1 1 5 5680 1 1 46 PHE C C -2.149 -1.446 -7.454 1.00 . A A . 46 PHE C 1 1 5 5681 1 1 46 PHE CA C -2.782 -1.517 -6.045 1.00 . A A . 46 PHE CA 1 1 5 5682 1 1 46 PHE CB C -4.292 -1.204 -5.965 1.00 . A A . 46 PHE CB 1 1 5 5683 1 1 46 PHE CD1 C -4.875 0.898 -7.290 1.00 . A A . 46 PHE CD1 1 1 5 5684 1 1 46 PHE CD2 C -5.470 -1.328 -8.231 1.00 . A A . 46 PHE CD2 1 1 5 5685 1 1 46 PHE CE1 C -5.429 1.539 -8.453 1.00 . A A . 46 PHE CE1 1 1 5 5686 1 1 46 PHE CE2 C -6.025 -0.690 -9.394 1.00 . A A . 46 PHE CE2 1 1 5 5687 1 1 46 PHE CG C -4.888 -0.538 -7.176 1.00 . A A . 46 PHE CG 1 1 5 5688 1 1 46 PHE CZ C -6.003 0.744 -9.505 1.00 . A A . 46 PHE CZ 1 1 5 5689 1 1 46 PHE H H -2.741 -0.226 -4.433 1.00 . A A . 46 PHE H 1 1 5 5690 1 1 46 PHE HA H -2.583 -2.506 -5.628 1.00 . A A . 46 PHE HA 1 1 5 5691 1 1 46 PHE HB2 H -4.822 -2.122 -5.744 1.00 . A A . 46 PHE HB2 1 1 5 5692 1 1 46 PHE HB3 H -4.491 -0.554 -5.112 1.00 . A A . 46 PHE HB3 1 1 5 5693 1 1 46 PHE HD1 H -4.448 1.496 -6.498 1.00 . A A . 46 PHE HD1 1 1 5 5694 1 1 46 PHE HD2 H -5.490 -2.404 -8.144 1.00 . A A . 46 PHE HD2 1 1 5 5695 1 1 46 PHE HE1 H -5.415 2.616 -8.534 1.00 . A A . 46 PHE HE1 1 1 5 5696 1 1 46 PHE HE2 H -6.458 -1.287 -10.184 1.00 . A A . 46 PHE HE2 1 1 5 5697 1 1 46 PHE HZ H -6.415 1.225 -10.380 1.00 . A A . 46 PHE HZ 1 1 5 5698 1 1 46 PHE N N -2.136 -0.593 -5.141 1.00 . A A . 46 PHE N 1 1 5 5699 1 1 46 PHE O O -2.317 -0.479 -8.186 1.00 . A A . 46 PHE O 1 1 5 5700 1 1 47 CYS C C -0.931 -3.448 -9.984 1.30 . A A . 47 CYS C 1 1 5 5701 1 1 47 CYS CA C -0.510 -2.447 -8.901 0.80 . A A . 47 CYS CA 1 1 5 5702 1 1 47 CYS CB C 0.928 -2.715 -8.449 0.60 . A A . 47 CYS CB 1 1 5 5703 1 1 47 CYS H H -1.515 -3.382 -7.250 1.00 . A A . 47 CYS H 1 1 5 5704 1 1 47 CYS HA H -0.601 -1.434 -9.293 1.10 . A A . 47 CYS HA 1 1 5 5705 1 1 47 CYS HB2 H 1.469 -1.771 -8.372 0.90 . A A . 47 CYS HB2 1 1 5 5706 1 1 47 CYS HB3 H 0.925 -3.159 -7.455 0.90 . A A . 47 CYS HB3 1 1 5 5707 1 1 47 CYS N N -1.417 -2.533 -7.769 0.60 . A A . 47 CYS N 1 1 5 5708 1 1 47 CYS O O -1.332 -3.079 -11.081 1.90 . A A . 47 CYS O 1 1 5 5709 1 1 47 CYS SG S 1.842 -3.812 -9.564 1.30 . A A . 47 CYS SG 1 1 5 5710 1 1 48 ASN C C -1.475 -5.906 -11.640 1.90 . A A . 48 ASN C 1 1 5 5711 1 1 48 ASN CA C -1.746 -5.704 -10.145 2.30 . A A . 48 ASN CA 1 1 5 5712 1 1 48 ASN CB C -3.184 -5.225 -9.933 3.00 . A A . 48 ASN CB 1 1 5 5713 1 1 48 ASN CG C -3.805 -5.941 -8.732 3.70 . A A . 48 ASN CG 1 1 5 5714 1 1 48 ASN H H -0.092 -5.017 -8.968 2.00 . A A . 48 ASN H 1 1 5 5715 1 1 48 ASN HA H -1.565 -6.640 -9.617 2.70 . A A . 48 ASN HA 1 1 5 5716 1 1 48 ASN HB2 H -3.214 -4.150 -9.757 3.30 . A A . 48 ASN HB2 1 1 5 5717 1 1 48 ASN HB3 H -3.789 -5.431 -10.816 3.20 . A A . 48 ASN HB3 1 1 5 5718 1 1 48 ASN HD21 H -4.954 -7.010 -10.044 1.00 . A A . 48 ASN HD21 1 1 5 5719 1 1 48 ASN N N -0.813 -4.734 -9.601 1.70 . A A . 48 ASN N 1 1 5 5720 1 1 48 ASN ND2 N -4.691 -6.888 -9.087 4.10 . A A . 48 ASN ND2 1 1 5 5721 1 1 48 ASN O O -2.102 -5.294 -12.496 2.30 . A A . 48 ASN O 1 1 5 5722 1 1 48 ASN OD1 O -3.503 -5.655 -7.580 4.40 . A A . 48 ASN OD1 1 1 5 5723 1 1 49 GLN C C 0.361 -8.986 -12.558 1.80 . A A . 49 GLN C 1 1 5 5724 1 1 49 GLN CA C -0.885 -8.167 -12.207 2.00 . A A . 49 GLN CA 1 1 5 5725 1 1 49 GLN CB C -1.875 -8.179 -13.373 2.20 . A A . 49 GLN CB 1 1 5 5726 1 1 49 GLN CD C -1.343 -8.101 -15.821 3.40 . A A . 49 GLN CD 1 1 5 5727 1 1 49 GLN CG C -1.420 -7.286 -14.528 2.70 . A A . 49 GLN CG 1 1 5 5728 1 1 49 GLN H H 0.460 -6.534 -11.867 2.50 . A A . 49 GLN H 1 1 5 5729 1 1 49 GLN HA H -1.340 -8.575 -11.305 2.50 . A A . 49 GLN HA 1 1 5 5730 1 1 49 GLN HB2 H -2.003 -9.201 -13.730 2.60 . A A . 49 GLN HB2 1 1 5 5731 1 1 49 GLN HB3 H -2.853 -7.851 -13.022 2.10 . A A . 49 GLN HB3 1 1 5 5732 1 1 49 GLN HE21 H -0.873 -6.367 -16.774 4.50 . A A . 49 GLN HE21 1 1 5 5733 1 1 49 GLN HE22 H -0.897 -7.799 -17.785 4.10 . A A . 49 GLN HE22 1 1 5 5734 1 1 49 GLN HG2 H -2.114 -6.459 -14.671 2.70 . A A . 49 GLN HG2 1 1 5 5735 1 1 49 GLN HG3 H -0.438 -6.861 -14.321 2.80 . A A . 49 GLN HG3 1 1 5 5736 1 1 49 GLN N N -0.503 -6.803 -11.890 2.00 . A A . 49 GLN N 1 1 5 5737 1 1 49 GLN NE2 N -1.007 -7.356 -16.889 4.00 . A A . 49 GLN NE2 1 1 5 5738 1 1 49 GLN O O 0.939 -9.669 -11.722 2.20 . A A . 49 GLN O 1 1 5 5739 1 1 49 GLN OE1 O -1.569 -9.305 -15.844 3.70 . A A . 49 GLN OE1 1 1 5 5740 1 1 50 THR C C 2.547 -7.248 -14.344 1.50 . A A . 50 THR C 1 1 5 5741 1 1 50 THR CA C 2.148 -8.724 -14.140 1.80 . A A . 50 THR CA 1 1 5 5742 1 1 50 THR CB C 2.488 -9.522 -15.399 1.90 . A A . 50 THR CB 1 1 5 5743 1 1 50 THR CG2 C 2.160 -11.007 -15.242 2.30 . A A . 50 THR CG2 1 1 5 5744 1 1 50 THR H H 0.051 -8.890 -14.583 2.00 . A A . 50 THR H 1 1 5 5745 1 1 50 THR HA H 2.680 -9.122 -13.275 2.10 . A A . 50 THR HA 1 1 5 5746 1 1 50 THR HB H 3.548 -9.407 -15.627 2.20 . A A . 50 THR HB 1 1 5 5747 1 1 50 THR HG1 H 1.365 -9.734 -16.927 2.50 . A A . 50 THR HG1 1 1 5 5748 1 1 50 THR HG21 H 2.501 -11.575 -16.108 2.40 . A A . 50 THR HG21 1 1 5 5749 1 1 50 THR HG22 H 1.085 -11.160 -15.143 2.60 . A A . 50 THR HG22 1 1 5 5750 1 1 50 THR HG23 H 2.643 -11.422 -14.357 2.80 . A A . 50 THR HG23 1 1 5 5751 1 1 50 THR N N 0.729 -8.871 -13.848 1.70 . A A . 50 THR N 1 1 5 5752 1 1 50 THR O O 3.489 -6.945 -15.066 2.20 . A A . 50 THR O 1 1 5 5753 1 1 50 THR OG1 O 1.771 -8.998 -16.488 2.20 . A A . 50 THR OG1 1 1 5 5754 1 1 51 ALA C C 3.159 -4.321 -13.936 0.60 . A A . 51 ALA C 1 1 5 5755 1 1 51 ALA CA C 2.373 -5.230 -12.984 0.60 . A A . 51 ALA CA 1 1 5 5756 1 1 51 ALA CB C 3.266 -5.697 -11.836 0.70 . A A . 51 ALA CB 1 1 5 5757 1 1 51 ALA H H 0.880 -6.687 -13.366 0.90 . A A . 51 ALA H 1 1 5 5758 1 1 51 ALA HA H 1.531 -4.644 -12.617 0.70 . A A . 51 ALA HA 1 1 5 5759 1 1 51 ALA HB1 H 2.667 -6.032 -10.990 1.20 . A A . 51 ALA HB1 1 1 5 5760 1 1 51 ALA HB2 H 3.908 -4.886 -11.492 1.00 . A A . 51 ALA HB2 1 1 5 5761 1 1 51 ALA HB3 H 3.904 -6.522 -12.153 1.30 . A A . 51 ALA HB3 1 1 5 5762 1 1 51 ALA N N 1.780 -6.369 -13.663 0.80 . A A . 51 ALA N 1 1 5 5763 1 1 51 ALA O O 3.451 -4.636 -15.083 1.10 . A A . 51 ALA O 1 1 5 5764 1 1 52 CYS C C 2.970 -0.808 -13.907 0.80 . A A . 52 CYS C 1 1 5 5765 1 1 52 CYS CA C 2.416 -2.137 -13.371 0.80 . A A . 52 CYS CA 1 1 5 5766 1 1 52 CYS CB C 1.865 -1.991 -11.950 0.90 . A A . 52 CYS CB 1 1 5 5767 1 1 52 CYS H H 4.054 -3.191 -12.544 0.90 . A A . 52 CYS H 1 1 5 5768 1 1 52 CYS HA H 1.609 -2.507 -14.005 0.80 . A A . 52 CYS HA 1 1 5 5769 1 1 52 CYS HB2 H 1.583 -0.963 -11.759 1.00 . A A . 52 CYS HB2 1 1 5 5770 1 1 52 CYS HB3 H 0.948 -2.571 -11.856 1.10 . A A . 52 CYS HB3 1 1 5 5771 1 1 52 CYS N N 3.454 -3.150 -13.341 0.70 . A A . 52 CYS N 1 1 5 5772 1 1 52 CYS O O 2.652 0.271 -13.422 1.20 . A A . 52 CYS O 1 1 5 5773 1 1 52 CYS SG S 3.002 -2.530 -10.651 1.00 . A A . 52 CYS SG 1 1 5 5774 1 1 53 PRO C C 5.261 1.065 -14.634 0.80 . A A . 53 PRO C 1 1 5 5775 1 1 53 PRO CA C 5.186 -0.439 -14.909 0.70 . A A . 53 PRO CA 1 1 5 5776 1 1 53 PRO CB C 5.771 -0.732 -16.291 0.90 . A A . 53 PRO CB 1 1 5 5777 1 1 53 PRO CD C 3.459 -1.597 -16.192 0.80 . A A . 53 PRO CD 1 1 5 5778 1 1 53 PRO CG C 4.690 -1.466 -17.095 0.90 . A A . 53 PRO CG 1 1 5 5779 1 1 53 PRO HA H 5.748 -0.966 -14.138 0.80 . A A . 53 PRO HA 1 1 5 5780 1 1 53 PRO HB2 H 6.053 0.196 -16.788 1.00 . A A . 53 PRO HB2 1 1 5 5781 1 1 53 PRO HB3 H 6.669 -1.344 -16.206 1.10 . A A . 53 PRO HB3 1 1 5 5782 1 1 53 PRO HD2 H 2.593 -1.102 -16.630 0.80 . A A . 53 PRO HD2 1 1 5 5783 1 1 53 PRO HD3 H 3.208 -2.642 -16.012 0.90 . A A . 53 PRO HD3 1 1 5 5784 1 1 53 PRO HG2 H 4.446 -0.904 -17.996 0.90 . A A . 53 PRO HG2 1 1 5 5785 1 1 53 PRO HG3 H 5.052 -2.448 -17.399 1.00 . A A . 53 PRO HG3 1 1 5 5786 1 1 53 PRO N N 3.826 -0.949 -14.944 0.60 . A A . 53 PRO N 1 1 5 5787 1 1 53 PRO O O 4.263 1.769 -14.541 1.60 . A A . 53 PRO O 1 1 5 5788 1 1 54 ALA C C 6.203 3.437 -15.998 0.90 . A A . 54 ALA C 1 1 5 5789 1 1 54 ALA CA C 7.000 2.805 -14.839 0.80 . A A . 54 ALA CA 1 1 5 5790 1 1 54 ALA CB C 8.483 2.696 -15.202 0.80 . A A . 54 ALA CB 1 1 5 5791 1 1 54 ALA H H 7.178 0.824 -14.073 1.40 . A A . 54 ALA H 1 1 5 5792 1 1 54 ALA HA H 6.870 3.416 -13.947 0.70 . A A . 54 ALA HA 1 1 5 5793 1 1 54 ALA HB1 H 9.065 3.482 -14.722 1.20 . A A . 54 ALA HB1 1 1 5 5794 1 1 54 ALA HB2 H 8.637 2.773 -16.277 1.40 . A A . 54 ALA HB2 1 1 5 5795 1 1 54 ALA HB3 H 8.880 1.732 -14.887 1.30 . A A . 54 ALA HB3 1 1 5 5796 1 1 54 ALA N N 6.535 1.470 -14.488 0.80 . A A . 54 ALA N 1 1 5 5797 1 1 54 ALA O O 5.044 3.128 -16.244 1.50 . A A . 54 ALA O 1 1 5 5798 1 1 55 ASP C C 5.240 6.004 -17.264 1.10 . A A . 55 ASP C 1 1 5 5799 1 1 55 ASP CA C 6.364 5.105 -17.774 1.20 . A A . 55 ASP CA 1 1 5 5800 1 1 55 ASP CB C 5.953 4.093 -18.830 1.40 . A A . 55 ASP CB 1 1 5 5801 1 1 55 ASP CG C 4.859 4.629 -19.755 2.10 . A A . 55 ASP CG 1 1 5 5802 1 1 55 ASP H H 7.916 4.354 -16.608 1.40 . A A . 55 ASP H 1 1 5 5803 1 1 55 ASP HA H 7.171 5.740 -18.137 1.30 . A A . 55 ASP HA 1 1 5 5804 1 1 55 ASP HB2 H 6.830 3.822 -19.415 1.80 . A A . 55 ASP HB2 1 1 5 5805 1 1 55 ASP HB3 H 5.622 3.189 -18.322 1.50 . A A . 55 ASP HB3 1 1 5 5806 1 1 55 ASP N N 6.927 4.349 -16.681 1.00 . A A . 55 ASP N 1 1 5 5807 1 1 55 ASP O O 4.105 5.987 -17.724 1.50 . A A . 55 ASP O 1 1 5 5808 1 1 55 ASP OD1 O 5.161 5.480 -20.590 2.60 . A A . 55 ASP OD1 1 1 5 5809 1 1 55 ASP OD2 O 3.717 4.187 -19.631 2.80 . A A . 55 ASP OD2 1 1 5 5810 1 1 56 CYS C C 5.657 8.871 -17.594 0.80 . A A . 56 CYS C 1 1 5 5811 1 1 56 CYS CA C 5.443 8.206 -16.231 0.80 . A A . 56 CYS CA 1 1 5 5812 1 1 56 CYS CB C 6.431 8.770 -15.220 0.90 . A A . 56 CYS CB 1 1 5 5813 1 1 56 CYS H H 6.074 6.458 -15.410 1.10 . A A . 56 CYS H 1 1 5 5814 1 1 56 CYS HA H 4.425 8.358 -15.872 0.70 . A A . 56 CYS HA 1 1 5 5815 1 1 56 CYS HB2 H 7.293 9.191 -15.740 1.00 . A A . 56 CYS HB2 1 1 5 5816 1 1 56 CYS HB3 H 5.915 9.554 -14.685 0.90 . A A . 56 CYS HB3 1 1 5 5817 1 1 56 CYS N N 5.671 6.788 -16.261 0.90 . A A . 56 CYS N 1 1 5 5818 1 1 56 CYS O O 5.936 8.234 -18.602 1.10 . A A . 56 CYS O 1 1 5 5819 1 1 56 CYS SG S 7.010 7.603 -13.964 1.30 . A A . 56 CYS SG 1 1 5 5820 1 1 57 ASP C C 6.953 10.454 -19.502 0.90 . A A . 57 ASP C 1 1 5 5821 1 1 57 ASP CA C 6.363 11.124 -18.257 1.00 . A A . 57 ASP CA 1 1 5 5822 1 1 57 ASP CB C 7.469 11.635 -17.328 1.10 . A A . 57 ASP CB 1 1 5 5823 1 1 57 ASP CG C 8.627 12.245 -18.120 1.60 . A A . 57 ASP CG 1 1 5 5824 1 1 57 ASP H H 4.855 10.580 -16.856 1.10 . A A . 57 ASP H 1 1 5 5825 1 1 57 ASP HA H 5.723 11.948 -18.575 1.20 . A A . 57 ASP HA 1 1 5 5826 1 1 57 ASP HB2 H 7.076 12.394 -16.651 1.20 . A A . 57 ASP HB2 1 1 5 5827 1 1 57 ASP HB3 H 7.856 10.823 -16.717 1.10 . A A . 57 ASP HB3 1 1 5 5828 1 1 57 ASP N N 5.500 10.209 -17.523 0.80 . A A . 57 ASP N 1 1 5 5829 1 1 57 ASP O O 7.743 9.521 -19.430 1.00 . A A . 57 ASP O 1 1 5 5830 1 1 57 ASP OD1 O 9.288 11.514 -18.857 2.00 . A A . 57 ASP OD1 1 1 5 5831 1 1 57 ASP OD2 O 8.860 13.445 -17.984 2.20 . A A . 57 ASP OD2 1 1 5 5832 1 1 58 PRO C C 7.677 13.188 -20.634 1.20 . A A . 58 PRO C 1 1 5 5833 1 1 58 PRO CA C 7.301 11.938 -21.435 1.20 . A A . 58 PRO CA 1 1 5 5834 1 1 58 PRO CB C 6.417 12.321 -22.625 1.40 . A A . 58 PRO CB 1 1 5 5835 1 1 58 PRO CD C 5.207 10.693 -21.217 1.30 . A A . 58 PRO CD 1 1 5 5836 1 1 58 PRO CG C 5.101 11.541 -22.486 1.50 . A A . 58 PRO CG 1 1 5 5837 1 1 58 PRO HA H 8.214 11.450 -21.776 1.30 . A A . 58 PRO HA 1 1 5 5838 1 1 58 PRO HB2 H 6.225 13.394 -22.631 1.50 . A A . 58 PRO HB2 1 1 5 5839 1 1 58 PRO HB3 H 6.912 12.071 -23.563 1.70 . A A . 58 PRO HB3 1 1 5 5840 1 1 58 PRO HD2 H 4.426 10.946 -20.501 1.30 . A A . 58 PRO HD2 1 1 5 5841 1 1 58 PRO HD3 H 5.140 9.629 -21.443 1.40 . A A . 58 PRO HD3 1 1 5 5842 1 1 58 PRO HG2 H 4.257 12.227 -22.416 1.50 . A A . 58 PRO HG2 1 1 5 5843 1 1 58 PRO HG3 H 4.939 10.907 -23.357 1.70 . A A . 58 PRO HG3 1 1 5 5844 1 1 58 PRO N N 6.511 10.999 -20.656 1.00 . A A . 58 PRO N 1 1 5 5845 1 1 58 PRO O O 8.844 13.468 -20.389 1.50 . A A . 58 PRO O 1 1 5 5846 1 1 59 ASN C C 6.596 15.432 -18.327 1.30 . A A . 59 ASN C 1 1 5 5847 1 1 59 ASN CA C 6.816 15.284 -19.824 1.30 . A A . 59 ASN CA 1 1 5 5848 1 1 59 ASN CB C 5.822 16.172 -20.562 1.50 . A A . 59 ASN CB 1 1 5 5849 1 1 59 ASN CG C 6.530 17.372 -21.196 1.90 . A A . 59 ASN CG 1 1 5 5850 1 1 59 ASN H H 5.673 13.570 -20.310 1.10 . A A . 59 ASN H 1 1 5 5851 1 1 59 ASN HA H 7.841 15.510 -20.035 1.50 . A A . 59 ASN HA 1 1 5 5852 1 1 59 ASN HB2 H 5.322 15.595 -21.343 1.70 . A A . 59 ASN HB2 1 1 5 5853 1 1 59 ASN HB3 H 5.064 16.526 -19.861 1.70 . A A . 59 ASN HB3 1 1 5 5854 1 1 59 ASN HD21 H 6.600 16.322 -22.938 2.10 . A A . 59 ASN HD21 1 1 5 5855 1 1 59 ASN HD22 H 6.989 18.029 -23.064 2.50 . A A . 59 ASN HD22 1 1 5 5856 1 1 59 ASN N N 6.610 13.914 -20.253 1.10 . A A . 59 ASN N 1 1 5 5857 1 1 59 ASN ND2 N 6.724 17.227 -22.519 2.00 . A A . 59 ASN ND2 1 1 5 5858 1 1 59 ASN O O 7.399 15.956 -17.564 1.70 . A A . 59 ASN O 1 1 5 5859 1 1 59 ASN OD1 O 6.869 18.347 -20.537 2.70 . A A . 59 ASN OD1 1 1 5 5860 1 1 60 THR C C 4.770 15.621 -15.693 0.90 . A A . 60 THR C 1 1 5 5861 1 1 60 THR CA C 4.483 15.680 -17.208 1.20 . A A . 60 THR CA 1 1 5 5862 1 1 60 THR CB C 3.047 15.228 -17.485 1.40 . A A . 60 THR CB 1 1 5 5863 1 1 60 THR CG2 C 2.862 14.727 -18.919 1.40 . A A . 60 THR CG2 1 1 5 5864 1 1 60 THR H H 5.231 14.186 -18.674 1.00 . A A . 60 THR H 1 1 5 5865 1 1 60 THR HA H 4.640 16.706 -17.533 1.40 . A A . 60 THR HA 1 1 5 5866 1 1 60 THR HB H 2.366 16.060 -17.305 1.90 . A A . 60 THR HB 1 1 5 5867 1 1 60 THR HG1 H 2.218 14.619 -15.879 2.30 . A A . 60 THR HG1 1 1 5 5868 1 1 60 THR HG21 H 1.848 14.918 -19.271 1.90 . A A . 60 THR HG21 1 1 5 5869 1 1 60 THR HG22 H 3.043 13.654 -18.979 1.80 . A A . 60 THR HG22 1 1 5 5870 1 1 60 THR HG23 H 3.555 15.224 -19.597 1.70 . A A . 60 THR HG23 1 1 5 5871 1 1 60 THR N N 5.418 14.907 -18.013 1.10 . A A . 60 THR N 1 1 5 5872 1 1 60 THR O O 4.069 16.240 -14.902 1.10 . A A . 60 THR O 1 1 5 5873 1 1 60 THR OG1 O 2.697 14.207 -16.586 2.10 . A A . 60 THR OG1 1 1 5 5874 1 1 61 GLN C C 4.540 14.052 -13.391 0.90 . A A . 61 GLN C 1 1 5 5875 1 1 61 GLN CA C 5.867 14.021 -14.164 0.80 . A A . 61 GLN CA 1 1 5 5876 1 1 61 GLN CB C 7.064 14.391 -13.279 1.00 . A A . 61 GLN CB 1 1 5 5877 1 1 61 GLN CD C 5.794 16.547 -13.036 1.90 . A A . 61 GLN CD 1 1 5 5878 1 1 61 GLN CG C 6.810 15.609 -12.387 1.40 . A A . 61 GLN CG 1 1 5 5879 1 1 61 GLN H H 6.564 14.849 -16.034 1.20 . A A . 61 GLN H 1 1 5 5880 1 1 61 GLN HA H 6.003 13.007 -14.534 0.70 . A A . 61 GLN HA 1 1 5 5881 1 1 61 GLN HB2 H 7.317 13.534 -12.654 1.60 . A A . 61 GLN HB2 1 1 5 5882 1 1 61 GLN HB3 H 7.935 14.574 -13.909 1.60 . A A . 61 GLN HB3 1 1 5 5883 1 1 61 GLN HE21 H 7.212 17.749 -13.857 2.80 . A A . 61 GLN HE21 1 1 5 5884 1 1 61 GLN HE22 H 5.834 17.403 -14.885 2.60 . A A . 61 GLN HE22 1 1 5 5885 1 1 61 GLN HG2 H 6.434 15.302 -11.411 1.80 . A A . 61 GLN HG2 1 1 5 5886 1 1 61 GLN HG3 H 7.736 16.159 -12.220 1.90 . A A . 61 GLN HG3 1 1 5 5887 1 1 61 GLN N N 5.838 14.872 -15.348 0.90 . A A . 61 GLN N 1 1 5 5888 1 1 61 GLN NE2 N 6.327 17.300 -14.015 2.40 . A A . 61 GLN NE2 1 1 5 5889 1 1 61 GLN O O 3.464 14.227 -13.948 1.50 . A A . 61 GLN O 1 1 5 5890 1 1 61 GLN OE1 O 4.624 16.585 -12.674 2.40 . A A . 61 GLN OE1 1 1 5 5891 1 1 62 ALA C C 2.551 12.607 -12.055 0.90 . A A . 62 ALA C 1 1 5 5892 1 1 62 ALA CA C 3.572 13.425 -11.249 1.00 . A A . 62 ALA CA 1 1 5 5893 1 1 62 ALA CB C 2.906 14.663 -10.645 1.30 . A A . 62 ALA CB 1 1 5 5894 1 1 62 ALA H H 5.613 13.924 -11.676 1.50 . A A . 62 ALA H 1 1 5 5895 1 1 62 ALA HA H 3.987 12.793 -10.465 1.20 . A A . 62 ALA HA 1 1 5 5896 1 1 62 ALA HB1 H 1.835 14.507 -10.516 1.70 . A A . 62 ALA HB1 1 1 5 5897 1 1 62 ALA HB2 H 3.046 15.535 -11.283 1.60 . A A . 62 ALA HB2 1 1 5 5898 1 1 62 ALA HB3 H 3.330 14.891 -9.668 1.70 . A A . 62 ALA HB3 1 1 5 5899 1 1 62 ALA N N 4.700 13.829 -12.073 1.00 . A A . 62 ALA N 1 1 5 5900 1 1 62 ALA O O 1.345 12.758 -11.907 1.80 . A A . 62 ALA O 1 1 5 5901 1 1 63 SER C C 2.450 9.531 -12.141 0.60 . A A . 63 SER C 1 1 5 5902 1 1 63 SER CA C 2.372 10.547 -13.278 0.50 . A A . 63 SER CA 1 1 5 5903 1 1 63 SER CB C 2.880 10.015 -14.623 0.60 . A A . 63 SER CB 1 1 5 5904 1 1 63 SER H H 4.048 11.854 -13.247 1.20 . A A . 63 SER H 1 1 5 5905 1 1 63 SER HA H 1.340 10.827 -13.383 0.50 . A A . 63 SER HA 1 1 5 5906 1 1 63 SER HB2 H 2.607 10.687 -15.437 1.20 . A A . 63 SER HB2 1 1 5 5907 1 1 63 SER HB3 H 3.965 9.919 -14.615 0.90 . A A . 63 SER HB3 1 1 5 5908 1 1 63 SER HG H 2.616 8.521 -15.779 1.60 . A A . 63 SER HG 1 1 5 5909 1 1 63 SER N N 3.117 11.731 -12.906 0.60 . A A . 63 SER N 1 1 5 5910 1 1 63 SER O O 1.694 9.548 -11.178 1.60 . A A . 63 SER O 1 1 5 5911 1 1 63 SER OG O 2.333 8.752 -14.904 1.30 . A A . 63 SER OG 1 1 5 5912 1 1 64 CYS C C 3.475 8.089 -9.974 0.50 . A A . 64 CYS C 1 1 5 5913 1 1 64 CYS CA C 3.762 7.614 -11.405 0.50 . A A . 64 CYS CA 1 1 5 5914 1 1 64 CYS CB C 5.229 7.195 -11.560 0.50 . A A . 64 CYS CB 1 1 5 5915 1 1 64 CYS H H 3.819 8.828 -13.265 1.40 . A A . 64 CYS H 1 1 5 5916 1 1 64 CYS HA H 3.100 6.780 -11.640 0.60 . A A . 64 CYS HA 1 1 5 5917 1 1 64 CYS HB2 H 5.635 6.915 -10.590 0.70 . A A . 64 CYS HB2 1 1 5 5918 1 1 64 CYS HB3 H 5.291 6.306 -12.189 0.70 . A A . 64 CYS HB3 1 1 5 5919 1 1 64 CYS N N 3.438 8.663 -12.357 0.60 . A A . 64 CYS N 1 1 5 5920 1 1 64 CYS O O 4.276 8.766 -9.340 1.10 . A A . 64 CYS O 1 1 5 5921 1 1 64 CYS SG S 6.300 8.473 -12.260 1.30 . A A . 64 CYS SG 1 1 5 5922 1 1 65 GLU C C 2.603 7.605 -7.013 1.00 . A A . 65 GLU C 1 1 5 5923 1 1 65 GLU CA C 1.799 8.133 -8.217 1.10 . A A . 65 GLU CA 1 1 5 5924 1 1 65 GLU CB C 0.353 7.684 -8.060 1.30 . A A . 65 GLU CB 1 1 5 5925 1 1 65 GLU CD C -0.876 9.855 -7.803 1.90 . A A . 65 GLU CD 1 1 5 5926 1 1 65 GLU CG C -0.426 8.575 -7.096 1.50 . A A . 65 GLU CG 1 1 5 5927 1 1 65 GLU H H 1.695 7.101 -10.097 1.60 . A A . 65 GLU H 1 1 5 5928 1 1 65 GLU HA H 1.910 9.209 -8.234 1.30 . A A . 65 GLU HA 1 1 5 5929 1 1 65 GLU HB2 H -0.105 7.668 -9.045 1.50 . A A . 65 GLU HB2 1 1 5 5930 1 1 65 GLU HB3 H 0.332 6.657 -7.696 1.30 . A A . 65 GLU HB3 1 1 5 5931 1 1 65 GLU HG2 H -1.301 8.048 -6.717 1.70 . A A . 65 GLU HG2 1 1 5 5932 1 1 65 GLU HG3 H 0.198 8.840 -6.243 1.70 . A A . 65 GLU HG3 1 1 5 5933 1 1 65 GLU N N 2.272 7.685 -9.526 1.00 . A A . 65 GLU N 1 1 5 5934 1 1 65 GLU O O 2.359 7.963 -5.867 1.10 . A A . 65 GLU O 1 1 5 5935 1 1 65 GLU OE1 O -1.196 9.789 -8.989 1.90 . A A . 65 GLU OE1 1 1 5 5936 1 1 65 GLU OE2 O -0.903 10.903 -7.159 2.40 . A A . 65 GLU OE2 1 1 5 5937 1 1 66 CYS C C 4.626 5.707 -5.427 0.90 . A A . 66 CYS C 1 1 5 5938 1 1 66 CYS CA C 3.744 5.504 -6.662 1.00 . A A . 66 CYS CA 1 1 5 5939 1 1 66 CYS CB C 4.392 4.547 -7.663 1.20 . A A . 66 CYS CB 1 1 5 5940 1 1 66 CYS H H 3.791 6.723 -8.327 1.10 . A A . 66 CYS H 1 1 5 5941 1 1 66 CYS HA H 2.739 5.181 -6.388 1.10 . A A . 66 CYS HA 1 1 5 5942 1 1 66 CYS HB2 H 5.397 4.323 -7.319 1.20 . A A . 66 CYS HB2 1 1 5 5943 1 1 66 CYS HB3 H 3.802 3.644 -7.688 1.50 . A A . 66 CYS HB3 1 1 5 5944 1 1 66 CYS N N 3.562 6.744 -7.360 1.00 . A A . 66 CYS N 1 1 5 5945 1 1 66 CYS O O 5.241 6.748 -5.233 1.10 . A A . 66 CYS O 1 1 5 5946 1 1 66 CYS SG S 4.555 5.139 -9.374 1.70 . A A . 66 CYS SG 1 1 5 5947 1 1 67 PRO C C 4.035 5.531 -2.395 0.90 . A A . 67 PRO C 1 1 5 5948 1 1 67 PRO CA C 3.745 4.496 -3.474 0.90 . A A . 67 PRO CA 1 1 5 5949 1 1 67 PRO CB C 3.960 3.066 -2.964 0.90 . A A . 67 PRO CB 1 1 5 5950 1 1 67 PRO CD C 5.581 3.535 -4.764 0.80 . A A . 67 PRO CD 1 1 5 5951 1 1 67 PRO CG C 5.225 2.537 -3.657 0.80 . A A . 67 PRO CG 1 1 5 5952 1 1 67 PRO HA H 2.724 4.622 -3.782 1.10 . A A . 67 PRO HA 1 1 5 5953 1 1 67 PRO HB2 H 4.050 3.030 -1.874 1.00 . A A . 67 PRO HB2 1 1 5 5954 1 1 67 PRO HB3 H 3.108 2.445 -3.255 0.80 . A A . 67 PRO HB3 1 1 5 5955 1 1 67 PRO HD2 H 6.605 3.894 -4.660 0.70 . A A . 67 PRO HD2 1 1 5 5956 1 1 67 PRO HD3 H 5.465 3.090 -5.752 0.90 . A A . 67 PRO HD3 1 1 5 5957 1 1 67 PRO HG2 H 6.043 2.449 -2.942 0.80 . A A . 67 PRO HG2 1 1 5 5958 1 1 67 PRO HG3 H 5.048 1.547 -4.079 1.00 . A A . 67 PRO HG3 1 1 5 5959 1 1 67 PRO N N 4.649 4.637 -4.603 0.80 . A A . 67 PRO N 1 1 5 5960 1 1 67 PRO O O 3.326 6.509 -2.193 1.30 . A A . 67 PRO O 1 1 5 5961 1 1 68 GLU C C 5.837 7.328 -0.650 1.10 . A A . 68 GLU C 1 1 5 5962 1 1 68 GLU CA C 5.443 5.851 -0.467 1.20 . A A . 68 GLU CA 1 1 5 5963 1 1 68 GLU CB C 6.600 5.113 0.207 1.50 . A A . 68 GLU CB 1 1 5 5964 1 1 68 GLU CD C 7.273 3.066 1.478 2.80 . A A . 68 GLU CD 1 1 5 5965 1 1 68 GLU CG C 6.252 3.654 0.502 2.10 . A A . 68 GLU CG 1 1 5 5966 1 1 68 GLU H H 5.319 4.234 -1.955 1.60 . A A . 68 GLU H 1 1 5 5967 1 1 68 GLU HA H 4.553 5.764 0.154 1.30 . A A . 68 GLU HA 1 1 5 5968 1 1 68 GLU HB2 H 7.483 5.158 -0.430 1.90 . A A . 68 GLU HB2 1 1 5 5969 1 1 68 GLU HB3 H 6.861 5.620 1.136 1.90 . A A . 68 GLU HB3 1 1 5 5970 1 1 68 GLU HG2 H 5.257 3.576 0.940 2.40 . A A . 68 GLU HG2 1 1 5 5971 1 1 68 GLU HG3 H 6.259 3.064 -0.415 2.50 . A A . 68 GLU HG3 1 1 5 5972 1 1 68 GLU N N 5.133 5.184 -1.724 1.20 . A A . 68 GLU N 1 1 5 5973 1 1 68 GLU O O 6.501 7.912 0.198 1.20 . A A . 68 GLU O 1 1 5 5974 1 1 68 GLU OE1 O 8.463 3.096 1.171 3.40 . A A . 68 GLU OE1 1 1 5 5975 1 1 68 GLU OE2 O 6.865 2.584 2.534 3.30 . A A . 68 GLU OE2 1 1 5 5976 1 1 69 GLY C C 7.601 7.598 -2.818 1.20 . A A . 69 GLY C 1 1 5 5977 1 1 69 GLY CA C 6.374 8.505 -2.670 1.50 . A A . 69 GLY CA 1 1 5 5978 1 1 69 GLY H H 4.424 7.872 -2.012 1.40 . A A . 69 GLY H 1 1 5 5979 1 1 69 GLY HA2 H 5.888 8.654 -3.636 1.80 . A A . 69 GLY HA2 1 1 5 5980 1 1 69 GLY HA3 H 6.658 9.465 -2.235 1.70 . A A . 69 GLY HA3 1 1 5 5981 1 1 69 GLY N N 5.398 7.897 -1.786 1.20 . A A . 69 GLY N 1 1 5 5982 1 1 69 GLY O O 8.473 7.546 -1.959 1.40 . A A . 69 GLY O 1 1 5 5983 1 1 70 TYR C C 10.025 6.552 -3.764 0.80 . A A . 70 TYR C 1 1 5 5984 1 1 70 TYR CA C 8.828 6.709 -4.710 0.80 . A A . 70 TYR CA 1 1 5 5985 1 1 70 TYR CB C 9.052 7.880 -5.674 0.60 . A A . 70 TYR CB 1 1 5 5986 1 1 70 TYR CD1 C 7.749 9.893 -4.807 1.30 . A A . 70 TYR CD1 1 1 5 5987 1 1 70 TYR CD2 C 10.213 9.811 -4.474 1.50 . A A . 70 TYR CD2 1 1 5 5988 1 1 70 TYR CE1 C 7.695 11.160 -4.128 1.40 . A A . 70 TYR CE1 1 1 5 5989 1 1 70 TYR CE2 C 10.164 11.081 -3.799 1.70 . A A . 70 TYR CE2 1 1 5 5990 1 1 70 TYR CG C 9.005 9.209 -4.978 0.70 . A A . 70 TYR CG 1 1 5 5991 1 1 70 TYR CZ C 8.905 11.754 -3.624 1.10 . A A . 70 TYR CZ 1 1 5 5992 1 1 70 TYR H H 6.733 6.529 -4.322 1.00 . A A . 70 TYR H 1 1 5 5993 1 1 70 TYR HA H 8.701 5.779 -5.264 0.90 . A A . 70 TYR HA 1 1 5 5994 1 1 70 TYR HB2 H 10.017 7.776 -6.170 0.60 . A A . 70 TYR HB2 1 1 5 5995 1 1 70 TYR HB3 H 8.292 7.866 -6.455 0.60 . A A . 70 TYR HB3 1 1 5 5996 1 1 70 TYR HD1 H 6.841 9.453 -5.194 2.10 . A A . 70 TYR HD1 1 1 5 5997 1 1 70 TYR HD2 H 11.159 9.304 -4.600 2.30 . A A . 70 TYR HD2 1 1 5 5998 1 1 70 TYR HE1 H 6.749 11.664 -3.994 2.10 . A A . 70 TYR HE1 1 1 5 5999 1 1 70 TYR HE2 H 11.072 11.529 -3.424 2.50 . A A . 70 TYR HE2 1 1 5 6000 1 1 70 TYR HH H 8.055 13.023 -2.464 1.50 . A A . 70 TYR HH 1 1 5 6001 1 1 70 TYR N N 7.594 6.890 -3.962 0.90 . A A . 70 TYR N 1 1 5 6002 1 1 70 TYR O O 10.476 7.497 -3.128 1.10 . A A . 70 TYR O 1 1 5 6003 1 1 70 TYR OH O 8.855 12.968 -2.970 1.30 . A A . 70 TYR OH 1 1 5 6004 1 1 71 ILE C C 12.216 3.697 -4.645 0.90 . A A . 71 ILE C 1 1 5 6005 1 1 71 ILE CA C 11.917 5.091 -4.039 1.00 . A A . 71 ILE CA 1 1 5 6006 1 1 71 ILE CB C 12.739 5.302 -2.765 1.20 . A A . 71 ILE CB 1 1 5 6007 1 1 71 ILE CD1 C 14.034 7.477 -2.744 1.80 . A A . 71 ILE CD1 1 1 5 6008 1 1 71 ILE CG1 C 14.070 5.986 -3.079 1.40 . A A . 71 ILE CG1 1 1 5 6009 1 1 71 ILE CG2 C 12.963 3.988 -2.015 1.80 . A A . 71 ILE CG2 1 1 5 6010 1 1 71 ILE H H 9.919 4.524 -3.487 1.10 . A A . 71 ILE H 1 1 5 6011 1 1 71 ILE HA H 12.170 5.851 -4.778 1.20 . A A . 71 ILE HA 1 1 5 6012 1 1 71 ILE HB H 12.170 5.963 -2.111 1.70 . A A . 71 ILE HB 1 1 5 6013 1 1 71 ILE HD11 H 13.943 7.632 -1.669 2.20 . A A . 71 ILE HD11 1 1 5 6014 1 1 71 ILE HD12 H 13.187 7.964 -3.227 2.30 . A A . 71 ILE HD12 1 1 5 6015 1 1 71 ILE HD13 H 14.945 7.974 -3.080 2.10 . A A . 71 ILE HD13 1 1 5 6016 1 1 71 ILE HG12 H 14.870 5.505 -2.517 1.60 . A A . 71 ILE HG12 1 1 5 6017 1 1 71 ILE HG13 H 14.308 5.855 -4.135 1.70 . A A . 71 ILE HG13 1 1 5 6018 1 1 71 ILE HG21 H 13.943 3.570 -2.247 2.30 . A A . 71 ILE HG21 1 1 5 6019 1 1 71 ILE HG22 H 12.208 3.251 -2.288 2.20 . A A . 71 ILE HG22 1 1 5 6020 1 1 71 ILE HG23 H 12.907 4.141 -0.938 2.20 . A A . 71 ILE HG23 1 1 5 6021 1 1 71 ILE N N 10.508 5.295 -3.727 0.90 . A A . 71 ILE N 1 1 5 6022 1 1 71 ILE O O 13.365 3.371 -4.915 0.90 . A A . 71 ILE O 1 1 5 6023 1 1 72 LEU C C 11.739 2.606 -7.196 0.80 . A A . 72 LEU C 1 1 5 6024 1 1 72 LEU CA C 10.610 2.740 -6.173 0.80 . A A . 72 LEU CA 1 1 5 6025 1 1 72 LEU CB C 9.761 3.968 -6.470 0.80 . A A . 72 LEU CB 1 1 5 6026 1 1 72 LEU CD1 C 8.035 4.393 -8.229 0.70 . A A . 72 LEU CD1 1 1 5 6027 1 1 72 LEU CD2 C 10.308 5.447 -8.392 0.60 . A A . 72 LEU CD2 1 1 5 6028 1 1 72 LEU CG C 9.528 4.214 -7.955 0.70 . A A . 72 LEU CG 1 1 5 6029 1 1 72 LEU H H 10.626 2.558 -4.054 0.90 . A A . 72 LEU H 1 1 5 6030 1 1 72 LEU HA H 10.018 1.825 -6.174 0.80 . A A . 72 LEU HA 1 1 5 6031 1 1 72 LEU HB2 H 8.798 3.900 -5.976 1.00 . A A . 72 LEU HB2 1 1 5 6032 1 1 72 LEU HB3 H 10.268 4.821 -6.030 1.00 . A A . 72 LEU HB3 1 1 5 6033 1 1 72 LEU HD11 H 7.870 5.100 -9.042 1.40 . A A . 72 LEU HD11 1 1 5 6034 1 1 72 LEU HD12 H 7.523 4.769 -7.343 1.20 . A A . 72 LEU HD12 1 1 5 6035 1 1 72 LEU HD13 H 7.571 3.445 -8.498 1.20 . A A . 72 LEU HD13 1 1 5 6036 1 1 72 LEU HD21 H 9.637 6.295 -8.523 1.10 . A A . 72 LEU HD21 1 1 5 6037 1 1 72 LEU HD22 H 10.829 5.262 -9.330 1.10 . A A . 72 LEU HD22 1 1 5 6038 1 1 72 LEU HD23 H 11.046 5.713 -7.636 1.20 . A A . 72 LEU HD23 1 1 5 6039 1 1 72 LEU HG H 9.886 3.355 -8.521 0.70 . A A . 72 LEU HG 1 1 5 6040 1 1 72 LEU N N 11.146 2.898 -4.835 0.80 . A A . 72 LEU N 1 1 5 6041 1 1 72 LEU O O 12.745 3.303 -7.153 0.90 . A A . 72 LEU O 1 1 5 6042 1 1 73 ASP C C 12.467 0.284 -9.878 1.20 . A A . 73 ASP C 1 1 5 6043 1 1 73 ASP CA C 12.532 0.700 -8.410 1.00 . A A . 73 ASP CA 1 1 5 6044 1 1 73 ASP CB C 12.377 -0.519 -7.519 1.50 . A A . 73 ASP CB 1 1 5 6045 1 1 73 ASP CG C 12.434 -0.111 -6.045 2.00 . A A . 73 ASP CG 1 1 5 6046 1 1 73 ASP H H 10.604 1.615 -8.584 0.80 . A A . 73 ASP H 1 1 5 6047 1 1 73 ASP HA H 13.479 1.206 -8.221 1.20 . A A . 73 ASP HA 1 1 5 6048 1 1 73 ASP HB2 H 11.423 -0.998 -7.727 1.90 . A A . 73 ASP HB2 1 1 5 6049 1 1 73 ASP HB3 H 13.181 -1.220 -7.731 1.90 . A A . 73 ASP HB3 1 1 5 6050 1 1 73 ASP N N 11.488 1.660 -8.118 0.90 . A A . 73 ASP N 1 1 5 6051 1 1 73 ASP O O 11.856 -0.703 -10.270 1.70 . A A . 73 ASP O 1 1 5 6052 1 1 73 ASP OD1 O 13.436 0.476 -5.637 2.30 . A A . 73 ASP OD1 1 1 5 6053 1 1 73 ASP OD2 O 11.477 -0.384 -5.323 2.80 . A A . 73 ASP OD2 1 1 5 6054 1 1 74 ASP C C 12.783 -0.023 -12.723 1.40 . A A . 74 ASP C 1 1 5 6055 1 1 74 ASP CA C 13.807 0.696 -11.852 1.80 . A A . 74 ASP CA 1 1 5 6056 1 1 74 ASP CB C 14.992 -0.211 -11.520 2.60 . A A . 74 ASP CB 1 1 5 6057 1 1 74 ASP CG C 16.250 0.294 -12.229 3.20 . A A . 74 ASP CG 1 1 5 6058 1 1 74 ASP H H 13.358 2.000 -10.174 1.40 . A A . 74 ASP H 1 1 5 6059 1 1 74 ASP HA H 14.109 1.598 -12.385 2.30 . A A . 74 ASP HA 1 1 5 6060 1 1 74 ASP HB2 H 15.174 -0.224 -10.446 3.00 . A A . 74 ASP HB2 1 1 5 6061 1 1 74 ASP HB3 H 14.794 -1.236 -11.837 3.10 . A A . 74 ASP HB3 1 1 5 6062 1 1 74 ASP N N 13.160 1.141 -10.635 1.30 . A A . 74 ASP N 1 1 5 6063 1 1 74 ASP O O 12.811 -1.234 -12.904 1.80 . A A . 74 ASP O 1 1 5 6064 1 1 74 ASP OD1 O 16.463 1.505 -12.253 3.60 . A A . 74 ASP OD1 1 1 5 6065 1 1 74 ASP OD2 O 17.002 -0.530 -12.748 3.70 . A A . 74 ASP OD2 1 1 5 6066 1 1 75 GLY C C 10.541 2.300 -11.805 1.10 . A A . 75 GLY C 1 1 5 6067 1 1 75 GLY CA C 10.607 0.982 -12.572 1.10 . A A . 75 GLY CA 1 1 5 6068 1 1 75 GLY H H 12.056 1.353 -14.074 1.30 . A A . 75 GLY H 1 1 5 6069 1 1 75 GLY HA2 H 9.836 0.956 -13.338 1.50 . A A . 75 GLY HA2 1 1 5 6070 1 1 75 GLY HA3 H 10.457 0.145 -11.909 1.30 . A A . 75 GLY HA3 1 1 5 6071 1 1 75 GLY N N 11.878 0.825 -13.245 1.00 . A A . 75 GLY N 1 1 5 6072 1 1 75 GLY O O 11.026 2.472 -10.695 1.40 . A A . 75 GLY O 1 1 5 6073 1 1 76 PHE C C 7.945 3.870 -11.098 0.80 . A A . 76 PHE C 1 1 5 6074 1 1 76 PHE CA C 9.263 4.304 -11.769 0.90 . A A . 76 PHE CA 1 1 5 6075 1 1 76 PHE CB C 9.025 5.494 -12.706 1.00 . A A . 76 PHE CB 1 1 5 6076 1 1 76 PHE CD1 C 9.814 7.293 -11.080 1.80 . A A . 76 PHE CD1 1 1 5 6077 1 1 76 PHE CD2 C 10.861 7.151 -13.333 2.00 . A A . 76 PHE CD2 1 1 5 6078 1 1 76 PHE CE1 C 10.659 8.411 -10.756 2.50 . A A . 76 PHE CE1 1 1 5 6079 1 1 76 PHE CE2 C 11.708 8.269 -13.012 2.70 . A A . 76 PHE CE2 1 1 5 6080 1 1 76 PHE CG C 9.910 6.658 -12.370 1.20 . A A . 76 PHE CG 1 1 5 6081 1 1 76 PHE CZ C 11.605 8.899 -11.723 2.80 . A A . 76 PHE CZ 1 1 5 6082 1 1 76 PHE H H 9.494 2.766 -13.333 1.00 . A A . 76 PHE H 1 1 5 6083 1 1 76 PHE HA H 9.982 4.552 -10.988 0.80 . A A . 76 PHE HA 1 1 5 6084 1 1 76 PHE HB2 H 9.209 5.204 -13.739 1.60 . A A . 76 PHE HB2 1 1 5 6085 1 1 76 PHE HB3 H 7.984 5.813 -12.644 1.30 . A A . 76 PHE HB3 1 1 5 6086 1 1 76 PHE HD1 H 9.105 6.927 -10.352 2.30 . A A . 76 PHE HD1 1 1 5 6087 1 1 76 PHE HD2 H 10.941 6.679 -14.301 2.50 . A A . 76 PHE HD2 1 1 5 6088 1 1 76 PHE HE1 H 10.583 8.884 -9.788 3.20 . A A . 76 PHE HE1 1 1 5 6089 1 1 76 PHE HE2 H 12.419 8.636 -13.738 3.50 . A A . 76 PHE HE2 1 1 5 6090 1 1 76 PHE HZ H 12.239 9.741 -11.482 3.50 . A A . 76 PHE HZ 1 1 5 6091 1 1 76 PHE N N 9.851 3.194 -12.508 0.90 . A A . 76 PHE N 1 1 5 6092 1 1 76 PHE O O 6.994 4.634 -10.984 0.80 . A A . 76 PHE O 1 1 5 6093 1 1 77 ILE C C 5.597 2.149 -10.366 0.70 . A A . 77 ILE C 1 1 5 6094 1 1 77 ILE CA C 6.871 1.755 -11.114 0.80 . A A . 77 ILE CA 1 1 5 6095 1 1 77 ILE CB C 7.219 0.260 -10.975 0.90 . A A . 77 ILE CB 1 1 5 6096 1 1 77 ILE CD1 C 5.584 -0.280 -9.091 1.20 . A A . 77 ILE CD1 1 1 5 6097 1 1 77 ILE CG1 C 6.048 -0.608 -10.511 1.10 . A A . 77 ILE CG1 1 1 5 6098 1 1 77 ILE CG2 C 8.450 -0.003 -10.114 0.90 . A A . 77 ILE CG2 1 1 5 6099 1 1 77 ILE H H 8.880 2.197 -10.609 0.80 . A A . 77 ILE H 1 1 5 6100 1 1 77 ILE HA H 6.788 1.928 -12.184 0.80 . A A . 77 ILE HA 1 1 5 6101 1 1 77 ILE HB H 7.474 -0.079 -11.979 0.90 . A A . 77 ILE HB 1 1 5 6102 1 1 77 ILE HD11 H 6.304 0.364 -8.587 1.50 . A A . 77 ILE HD11 1 1 5 6103 1 1 77 ILE HD12 H 5.473 -1.190 -8.501 1.60 . A A . 77 ILE HD12 1 1 5 6104 1 1 77 ILE HD13 H 4.622 0.232 -9.102 1.70 . A A . 77 ILE HD13 1 1 5 6105 1 1 77 ILE HG12 H 5.227 -0.515 -11.217 1.30 . A A . 77 ILE HG12 1 1 5 6106 1 1 77 ILE HG13 H 6.353 -1.654 -10.546 1.10 . A A . 77 ILE HG13 1 1 5 6107 1 1 77 ILE HG21 H 8.227 0.181 -9.065 1.10 . A A . 77 ILE HG21 1 1 5 6108 1 1 77 ILE HG22 H 9.272 0.649 -10.406 1.40 . A A . 77 ILE HG22 1 1 5 6109 1 1 77 ILE HG23 H 8.778 -1.034 -10.237 1.40 . A A . 77 ILE HG23 1 1 5 6110 1 1 77 ILE N N 7.966 2.593 -10.669 0.80 . A A . 77 ILE N 1 1 5 6111 1 1 77 ILE O O 5.630 2.801 -9.330 0.80 . A A . 77 ILE O 1 1 5 6112 1 1 78 CYS C C 2.121 1.151 -10.677 0.70 . A A . 78 CYS C 1 1 5 6113 1 1 78 CYS CA C 3.204 2.237 -10.546 0.50 . A A . 78 CYS CA 1 1 5 6114 1 1 78 CYS CB C 2.922 3.547 -11.301 0.40 . A A . 78 CYS CB 1 1 5 6115 1 1 78 CYS H H 4.591 0.900 -11.558 0.50 . A A . 78 CYS H 1 1 5 6116 1 1 78 CYS HA H 3.322 2.458 -9.485 0.60 . A A . 78 CYS HA 1 1 5 6117 1 1 78 CYS HB2 H 3.774 3.776 -11.941 0.70 . A A . 78 CYS HB2 1 1 5 6118 1 1 78 CYS HB3 H 2.061 3.506 -11.963 0.70 . A A . 78 CYS HB3 1 1 5 6119 1 1 78 CYS N N 4.485 1.696 -10.961 0.50 . A A . 78 CYS N 1 1 5 6120 1 1 78 CYS O O 2.117 0.178 -9.933 1.70 . A A . 78 CYS O 1 1 5 6121 1 1 78 CYS SG S 2.684 4.918 -10.147 1.00 . A A . 78 CYS SG 1 1 5 6122 1 1 79 THR C C -0.681 0.362 -12.821 0.90 . A A . 79 THR C 1 1 5 6123 1 1 79 THR CA C -0.105 0.787 -11.467 0.70 . A A . 79 THR CA 1 1 5 6124 1 1 79 THR CB C -1.007 1.817 -10.787 0.90 . A A . 79 THR CB 1 1 5 6125 1 1 79 THR CG2 C -1.472 2.898 -11.763 1.60 . A A . 79 THR CG2 1 1 5 6126 1 1 79 THR H H 1.452 1.865 -12.476 1.30 . A A . 79 THR H 1 1 5 6127 1 1 79 THR HA H 0.023 -0.095 -10.840 0.80 . A A . 79 THR HA 1 1 5 6128 1 1 79 THR HB H -0.462 2.283 -9.967 0.70 . A A . 79 THR HB 1 1 5 6129 1 1 79 THR HG1 H -2.731 1.016 -10.939 2.00 . A A . 79 THR HG1 1 1 5 6130 1 1 79 THR HG21 H -1.140 3.882 -11.434 2.00 . A A . 79 THR HG21 1 1 5 6131 1 1 79 THR HG22 H -2.560 2.912 -11.835 2.20 . A A . 79 THR HG22 1 1 5 6132 1 1 79 THR HG23 H -1.071 2.726 -12.761 2.10 . A A . 79 THR HG23 1 1 5 6133 1 1 79 THR N N 1.214 1.358 -11.647 0.70 . A A . 79 THR N 1 1 5 6134 1 1 79 THR O O -1.815 0.669 -13.165 1.50 . A A . 79 THR O 1 1 5 6135 1 1 79 THR OG1 O -2.122 1.170 -10.229 1.70 . A A . 79 THR OG1 1 1 5 6136 1 1 80 ASP C C -1.313 -0.296 -15.487 1.10 . A A . 80 ASP C 1 1 5 6137 1 1 80 ASP CA C -0.347 -1.147 -14.658 1.20 . A A . 80 ASP CA 1 1 5 6138 1 1 80 ASP CB C -1.042 -2.378 -14.085 1.70 . A A . 80 ASP CB 1 1 5 6139 1 1 80 ASP CG C -0.907 -3.559 -15.048 2.40 . A A . 80 ASP CG 1 1 5 6140 1 1 80 ASP H H 1.111 -0.542 -13.234 0.80 . A A . 80 ASP H 1 1 5 6141 1 1 80 ASP HA H 0.507 -1.429 -15.275 1.50 . A A . 80 ASP HA 1 1 5 6142 1 1 80 ASP HB2 H -0.572 -2.636 -13.132 2.10 . A A . 80 ASP HB2 1 1 5 6143 1 1 80 ASP HB3 H -2.100 -2.179 -13.907 1.80 . A A . 80 ASP HB3 1 1 5 6144 1 1 80 ASP N N 0.177 -0.374 -13.553 0.80 . A A . 80 ASP N 1 1 5 6145 1 1 80 ASP O O -1.322 0.926 -15.417 1.90 . A A . 80 ASP O 1 1 5 6146 1 1 80 ASP OD1 O 0.209 -3.840 -15.481 2.90 . A A . 80 ASP OD1 1 1 5 6147 1 1 80 ASP OD2 O -1.921 -4.186 -15.354 2.90 . A A . 80 ASP OD2 1 1 5 6148 1 1 81 ILE C C -3.915 0.611 -15.958 1.60 . A A . 81 ILE C 1 1 5 6149 1 1 81 ILE CA C -3.257 -0.390 -16.914 1.30 . A A . 81 ILE CA 1 1 5 6150 1 1 81 ILE CB C -4.271 -1.456 -17.329 1.70 . A A . 81 ILE CB 1 1 5 6151 1 1 81 ILE CD1 C -3.662 -1.653 -19.783 3.00 . A A . 81 ILE CD1 1 1 5 6152 1 1 81 ILE CG1 C -3.700 -2.356 -18.426 2.50 . A A . 81 ILE CG1 1 1 5 6153 1 1 81 ILE CG2 C -5.584 -0.815 -17.780 1.90 . A A . 81 ILE CG2 1 1 5 6154 1 1 81 ILE H H -1.855 -1.961 -16.533 1.50 . A A . 81 ILE H 1 1 5 6155 1 1 81 ILE HA H -2.873 0.134 -17.790 1.50 . A A . 81 ILE HA 1 1 5 6156 1 1 81 ILE HB H -4.480 -2.077 -16.458 2.20 . A A . 81 ILE HB 1 1 5 6157 1 1 81 ILE HD11 H -4.574 -1.078 -19.949 3.20 . A A . 81 ILE HD11 1 1 5 6158 1 1 81 ILE HD12 H -3.568 -2.376 -20.592 3.40 . A A . 81 ILE HD12 1 1 5 6159 1 1 81 ILE HD13 H -2.816 -0.968 -19.842 3.30 . A A . 81 ILE HD13 1 1 5 6160 1 1 81 ILE HG12 H -2.694 -2.673 -18.151 2.70 . A A . 81 ILE HG12 1 1 5 6161 1 1 81 ILE HG13 H -4.301 -3.262 -18.502 3.00 . A A . 81 ILE HG13 1 1 5 6162 1 1 81 ILE HG21 H -6.178 -1.516 -18.365 2.20 . A A . 81 ILE HG21 1 1 5 6163 1 1 81 ILE HG22 H -5.396 0.064 -18.397 2.30 . A A . 81 ILE HG22 1 1 5 6164 1 1 81 ILE HG23 H -6.179 -0.503 -16.921 2.30 . A A . 81 ILE HG23 1 1 5 6165 1 1 81 ILE N N -2.115 -1.029 -16.282 1.00 . A A . 81 ILE N 1 1 5 6166 1 1 81 ILE O O -4.123 0.340 -14.782 2.40 . A A . 81 ILE O 1 1 5 6167 1 1 82 ASP C C -5.907 3.315 -17.419 2.70 . A A . 82 ASP C 1 1 5 6168 1 1 82 ASP CA C -5.538 2.342 -16.297 2.60 . A A . 82 ASP CA 1 1 5 6169 1 1 82 ASP CB C -5.536 3.066 -14.951 3.50 . A A . 82 ASP CB 1 1 5 6170 1 1 82 ASP CG C -6.934 3.612 -14.652 3.90 . A A . 82 ASP CG 1 1 5 6171 1 1 82 ASP H H -3.568 2.249 -17.137 2.10 . A A . 82 ASP H 1 1 5 6172 1 1 82 ASP HA H -6.239 1.508 -16.294 3.00 . A A . 82 ASP HA 1 1 5 6173 1 1 82 ASP HB2 H -5.242 2.389 -14.149 3.90 . A A . 82 ASP HB2 1 1 5 6174 1 1 82 ASP HB3 H -4.826 3.894 -14.962 3.90 . A A . 82 ASP HB3 1 1 5 6175 1 1 82 ASP N N -4.226 1.779 -16.549 1.90 . A A . 82 ASP N 1 1 5 6176 1 1 82 ASP O O -5.724 4.522 -17.314 3.30 . A A . 82 ASP O 1 1 5 6177 1 1 82 ASP OD1 O -7.890 3.147 -15.271 4.50 . A A . 82 ASP OD1 1 1 5 6178 1 1 82 ASP OD2 O -7.050 4.496 -13.805 4.20 . A A . 82 ASP OD2 1 1 5 6179 1 1 83 GLU C C -8.228 1.309 -19.378 1.00 . A A . 83 GLU C 1 1 5 6180 1 1 83 GLU CA C -7.876 2.548 -18.551 1.00 . A A . 83 GLU CA 1 1 5 6181 1 1 83 GLU CB C -8.508 3.794 -19.172 1.00 . A A . 83 GLU CB 1 1 5 6182 1 1 83 GLU CD C -6.983 5.513 -20.166 1.00 . A A . 83 GLU CD 1 1 5 6183 1 1 83 GLU CG C -7.777 4.234 -20.441 1.00 . A A . 83 GLU CG 1 1 5 6184 1 1 83 GLU H H -5.851 2.368 -19.232 1.00 . A A . 83 GLU H 1 1 5 6185 1 1 83 GLU HA H -8.214 2.406 -17.525 1.00 . A A . 83 GLU HA 1 1 5 6186 1 1 83 GLU HB2 H -9.554 3.596 -19.405 1.00 . A A . 83 GLU HB2 1 1 5 6187 1 1 83 GLU HB3 H -8.500 4.608 -18.446 1.00 . A A . 83 GLU HB3 1 1 5 6188 1 1 83 GLU HG2 H -7.092 3.457 -20.779 1.00 . A A . 83 GLU HG2 1 1 5 6189 1 1 83 GLU HG3 H -8.486 4.424 -21.246 1.00 . A A . 83 GLU HG3 1 1 5 6190 1 1 83 GLU N N -6.436 2.704 -18.494 1.00 . A A . 83 GLU N 1 1 5 6191 1 1 83 GLU O O -8.013 1.331 -20.589 1.00 . A A . 83 GLU O 1 1 5 6192 1 1 83 GLU OXT O -8.712 0.337 -18.801 1.00 . A A . 83 GLU OXT 1 1 5 6193 1 1 83 GLU OE1 O -7.536 6.428 -19.559 1.00 . A A . 83 GLU OE1 1 1 5 6194 1 1 83 GLU OE2 O -5.820 5.578 -20.563 1.00 . A A . 83 GLU OE2 1 1 5 6195 2 2 1 NAG C1 C -13.688 0.364 7.035 1.00 . B A . 121 NAG C1 1 1 5 6196 2 2 1 NAG C2 C -13.451 1.289 8.227 1.00 . B A . 121 NAG C2 1 1 5 6197 2 2 1 NAG C3 C -13.979 2.701 7.972 1.00 . B A . 121 NAG C3 1 1 5 6198 2 2 1 NAG C4 C -13.629 3.191 6.566 1.00 . B A . 121 NAG C4 1 1 5 6199 2 2 1 NAG C5 C -13.885 2.116 5.508 1.00 . B A . 121 NAG C5 1 1 5 6200 2 2 1 NAG C6 C -13.437 2.570 4.118 1.00 . B A . 121 NAG C6 1 1 5 6201 2 2 1 NAG C7 C -13.654 1.097 10.610 1.00 . B A . 121 NAG C7 1 1 5 6202 2 2 1 NAG C8 C -12.497 0.224 11.101 1.00 . B A . 121 NAG C8 1 1 5 6203 2 2 1 NAG H1 H -14.750 0.152 6.912 1.00 . B A . 121 NAG H1 1 1 5 6204 2 2 1 NAG H2 H -12.389 1.323 8.471 1.00 . B A . 121 NAG H2 1 1 5 6205 2 2 1 NAG H3 H -15.061 2.711 8.101 1.00 . B A . 121 NAG H3 1 1 5 6206 2 2 1 NAG H4 H -12.581 3.488 6.535 1.00 . B A . 121 NAG H4 1 1 5 6207 2 2 1 NAG H5 H -14.950 1.886 5.483 1.00 . B A . 121 NAG H5 1 1 5 6208 2 2 1 NAG H61 H -12.699 3.369 4.189 1.00 . B A . 121 NAG H61 1 1 5 6209 2 2 1 NAG H62 H -14.282 2.943 3.540 1.00 . B A . 121 NAG H62 1 1 5 6210 2 2 1 NAG H81 H -11.802 0.822 11.690 1.00 . B A . 121 NAG H81 1 1 5 6211 2 2 1 NAG H82 H -12.880 -0.587 11.721 1.00 . B A . 121 NAG H82 1 1 5 6212 2 2 1 NAG H83 H -11.964 -0.202 10.250 1.00 . B A . 121 NAG H83 1 1 5 6213 2 2 1 NAG HN2 H -14.874 0.101 9.303 1.00 . B A . 121 NAG HN2 1 1 5 6214 2 2 1 NAG HO3 H -13.534 4.457 8.569 1.00 . B A . 121 NAG HO3 1 1 5 6215 2 2 1 NAG HO4 H -14.652 4.255 5.357 1.00 . B A . 121 NAG HO4 1 1 5 6216 2 2 1 NAG HO6 H -12.569 0.873 4.055 1.00 . B A . 121 NAG HO6 1 1 5 6217 2 2 1 NAG N2 N -14.108 0.737 9.396 1.00 . B A . 121 NAG N2 1 1 5 6218 2 2 1 NAG O3 O -13.438 3.583 8.923 1.00 . B A . 121 NAG O3 1 1 5 6219 2 2 1 NAG O4 O -14.393 4.332 6.266 1.00 . B A . 121 NAG O4 1 1 5 6220 2 2 1 NAG O5 O -13.184 0.949 5.859 1.00 . B A . 121 NAG O5 1 1 5 6221 2 2 1 NAG O6 O -12.860 1.503 3.409 1.00 . B A . 121 NAG O6 1 1 5 6222 2 2 1 NAG O7 O -14.096 2.022 11.282 1.00 . B A . 121 NAG O7 1 1 5 6223 3 2 1 NAG C1 C -5.253 -7.728 -8.047 1.00 . C A . 148 NAG C1 1 1 5 6224 3 2 1 NAG C2 C -6.255 -6.926 -7.219 1.00 . C A . 148 NAG C2 1 1 5 6225 3 2 1 NAG C3 C -7.531 -7.721 -6.947 1.00 . C A . 148 NAG C3 1 1 5 6226 3 2 1 NAG C4 C -7.238 -9.196 -6.668 1.00 . C A . 148 NAG C4 1 1 5 6227 3 2 1 NAG C5 C -6.268 -9.805 -7.683 1.00 . C A . 148 NAG C5 1 1 5 6228 3 2 1 NAG C6 C -6.893 -10.994 -8.414 1.00 . C A . 148 NAG C6 1 1 5 6229 3 2 1 NAG C7 C -6.117 -5.463 -5.328 1.00 . C A . 148 NAG C7 1 1 5 6230 3 2 1 NAG C8 C -5.008 -4.501 -4.900 1.00 . C A . 148 NAG C8 1 1 5 6231 3 2 1 NAG H1 H -4.417 -8.069 -7.436 1.00 . C A . 148 NAG H1 1 1 5 6232 3 2 1 NAG H2 H -6.494 -5.988 -7.721 1.00 . C A . 148 NAG H2 1 1 5 6233 3 2 1 NAG H3 H -8.051 -7.289 -6.091 1.00 . C A . 148 NAG H3 1 1 5 6234 3 2 1 NAG H4 H -8.172 -9.757 -6.684 1.00 . C A . 148 NAG H4 1 1 5 6235 3 2 1 NAG H5 H -5.369 -10.138 -7.163 1.00 . C A . 148 NAG H5 1 1 5 6236 3 2 1 NAG H61 H -7.886 -10.743 -8.786 1.00 . C A . 148 NAG H61 1 1 5 6237 3 2 1 NAG H62 H -6.990 -11.851 -7.747 1.00 . C A . 148 NAG H62 1 1 5 6238 3 2 1 NAG H81 H -4.500 -4.097 -5.776 1.00 . C A . 148 NAG H81 1 1 5 6239 3 2 1 NAG H82 H -5.430 -3.676 -4.325 1.00 . C A . 148 NAG H82 1 1 5 6240 3 2 1 NAG H83 H -4.282 -5.035 -4.287 1.00 . C A . 148 NAG H83 1 1 5 6241 3 2 1 NAG HN2 H -4.901 -7.093 -5.565 1.00 . C A . 148 NAG HN2 1 1 5 6242 3 2 1 NAG HO3 H -8.006 -6.973 -8.636 1.00 . C A . 148 NAG HO3 1 1 5 6243 3 2 1 NAG HO4 H -6.229 -10.151 -5.361 1.00 . C A . 148 NAG HO4 1 1 5 6244 3 2 1 NAG HO6 H -5.305 -10.862 -9.462 1.00 . C A . 148 NAG HO6 1 1 5 6245 3 2 1 NAG N2 N -5.647 -6.555 -5.957 1.00 . C A . 148 NAG N2 1 1 5 6246 3 2 1 NAG O3 O -8.391 -7.614 -8.052 1.00 . C A . 148 NAG O3 1 1 5 6247 3 2 1 NAG O4 O -6.700 -9.328 -5.377 1.00 . C A . 148 NAG O4 1 1 5 6248 3 2 1 NAG O5 O -5.899 -8.833 -8.631 1.00 . C A . 148 NAG O5 1 1 5 6249 3 2 1 NAG O6 O -6.099 -11.378 -9.508 1.00 . C A . 148 NAG O6 1 1 5 6250 3 2 1 NAG O7 O -7.298 -5.233 -5.101 1.00 . C A . 148 NAG O7 1 1 6 6251 1 1 1 HIS C C 2.231 -8.939 26.871 1.00 . A A . 1 HIS C 1 1 6 6252 1 1 1 HIS CA C 1.076 -9.932 27.009 1.00 . A A . 1 HIS CA 1 1 6 6253 1 1 1 HIS CB C 1.505 -11.283 26.435 1.00 . A A . 1 HIS CB 1 1 6 6254 1 1 1 HIS CD2 C 0.957 -12.624 28.528 1.00 . A A . 1 HIS CD2 1 1 6 6255 1 1 1 HIS CE1 C 2.810 -13.863 28.724 1.00 . A A . 1 HIS CE1 1 1 6 6256 1 1 1 HIS CG C 1.773 -12.294 27.512 1.00 . A A . 1 HIS CG 1 1 6 6257 1 1 1 HIS H1 H -0.056 -9.592 25.330 1.00 . A A . 1 HIS H1 1 1 6 6258 1 1 1 HIS H2 H -0.959 -9.926 26.729 1.00 . A A . 1 HIS H2 1 1 6 6259 1 1 1 HIS H3 H -0.219 -8.409 26.538 1.00 . A A . 1 HIS H3 1 1 6 6260 1 1 1 HIS HA H 0.843 -10.039 28.068 1.00 . A A . 1 HIS HA 1 1 6 6261 1 1 1 HIS HB2 H 0.730 -11.663 25.769 1.00 . A A . 1 HIS HB2 1 1 6 6262 1 1 1 HIS HB3 H 2.403 -11.155 25.830 1.00 . A A . 1 HIS HB3 1 1 6 6263 1 1 1 HIS HD2 H -0.015 -12.206 28.714 1.00 . A A . 1 HIS HD2 1 1 6 6264 1 1 1 HIS HE1 H 3.540 -14.587 29.078 1.00 . A A . 1 HIS HE1 1 1 6 6265 1 1 1 HIS HE2 H 1.248 -14.091 30.141 1.00 . A A . 1 HIS HE2 1 1 6 6266 1 1 1 HIS N N -0.126 -9.429 26.354 1.00 . A A . 1 HIS N 1 1 6 6267 1 1 1 HIS ND1 N 2.999 -13.104 27.631 1.00 . A A . 1 HIS ND1 1 1 6 6268 1 1 1 HIS NE2 N 1.631 -13.654 29.328 1.00 . A A . 1 HIS NE2 1 1 6 6269 1 1 1 HIS O O 2.707 -8.360 27.840 1.00 . A A . 1 HIS O 1 1 6 6270 1 1 2 MET C C 2.227 -6.477 24.948 1.00 . A A . 2 MET C 1 1 6 6271 1 1 2 MET CA C 3.288 -7.543 25.230 1.00 . A A . 2 MET CA 1 1 6 6272 1 1 2 MET CB C 4.160 -7.768 23.995 1.00 . A A . 2 MET CB 1 1 6 6273 1 1 2 MET CE C 7.748 -6.145 22.851 1.00 . A A . 2 MET CE 1 1 6 6274 1 1 2 MET CG C 5.365 -6.827 23.965 1.00 . A A . 2 MET CG 1 1 6 6275 1 1 2 MET H H 2.510 -9.517 24.928 1.00 . A A . 2 MET H 1 1 6 6276 1 1 2 MET HA H 3.889 -7.238 26.087 1.00 . A A . 2 MET HA 1 1 6 6277 1 1 2 MET HB2 H 4.506 -8.802 23.979 1.00 . A A . 2 MET HB2 1 1 6 6278 1 1 2 MET HB3 H 3.562 -7.628 23.095 1.00 . A A . 2 MET HB3 1 1 6 6279 1 1 2 MET HE1 H 8.469 -6.221 22.036 1.00 . A A . 2 MET HE1 1 1 6 6280 1 1 2 MET HE2 H 8.145 -6.671 23.720 1.00 . A A . 2 MET HE2 1 1 6 6281 1 1 2 MET HE3 H 7.621 -5.093 23.107 1.00 . A A . 2 MET HE3 1 1 6 6282 1 1 2 MET HG2 H 5.051 -5.807 24.185 1.00 . A A . 2 MET HG2 1 1 6 6283 1 1 2 MET HG3 H 6.086 -7.115 24.730 1.00 . A A . 2 MET HG3 1 1 6 6284 1 1 2 MET N N 2.643 -8.788 25.600 1.00 . A A . 2 MET N 1 1 6 6285 1 1 2 MET O O 1.058 -6.624 25.281 1.00 . A A . 2 MET O 1 1 6 6286 1 1 2 MET SD S 6.172 -6.859 22.356 1.00 . A A . 2 MET SD 1 1 6 6287 1 1 3 GLU C C 0.500 -4.772 23.514 1.00 . A A . 3 GLU C 1 1 6 6288 1 1 3 GLU CA C 1.991 -4.859 23.181 1.00 . A A . 3 GLU CA 1 1 6 6289 1 1 3 GLU CB C 2.216 -5.741 21.952 1.00 . A A . 3 GLU CB 1 1 6 6290 1 1 3 GLU CD C 1.968 -8.109 21.150 1.00 . A A . 3 GLU CD 1 1 6 6291 1 1 3 GLU CG C 1.321 -6.982 21.960 1.00 . A A . 3 GLU CG 1 1 6 6292 1 1 3 GLU H H 3.572 -4.971 24.623 1.00 . A A . 3 GLU H 1 1 6 6293 1 1 3 GLU HA H 2.380 -3.856 23.015 1.00 . A A . 3 GLU HA 1 1 6 6294 1 1 3 GLU HB2 H 2.015 -5.159 21.049 1.00 . A A . 3 GLU HB2 1 1 6 6295 1 1 3 GLU HB3 H 3.265 -6.047 21.919 1.00 . A A . 3 GLU HB3 1 1 6 6296 1 1 3 GLU HG2 H 1.156 -7.331 22.979 1.00 . A A . 3 GLU HG2 1 1 6 6297 1 1 3 GLU HG3 H 0.346 -6.756 21.528 1.00 . A A . 3 GLU HG3 1 1 6 6298 1 1 3 GLU N N 2.721 -5.397 24.315 1.00 . A A . 3 GLU N 1 1 6 6299 1 1 3 GLU O O -0.218 -5.764 23.540 1.00 . A A . 3 GLU O 1 1 6 6300 1 1 3 GLU OE1 O 3.167 -8.032 20.886 1.00 . A A . 3 GLU OE1 1 1 6 6301 1 1 3 GLU OE2 O 1.264 -9.051 20.791 1.00 . A A . 3 GLU OE2 1 1 6 6302 1 1 4 PRO C C -1.164 -2.826 21.744 1.00 . A A . 4 PRO C 1 1 6 6303 1 1 4 PRO CA C -1.173 -2.977 23.268 1.00 . A A . 4 PRO CA 1 1 6 6304 1 1 4 PRO CB C -1.316 -1.599 23.921 1.00 . A A . 4 PRO CB 1 1 6 6305 1 1 4 PRO CD C 0.826 -2.603 24.626 1.00 . A A . 4 PRO CD 1 1 6 6306 1 1 4 PRO CG C -0.065 -1.368 24.781 1.00 . A A . 4 PRO CG 1 1 6 6307 1 1 4 PRO HA H -1.996 -3.628 23.561 1.00 . A A . 4 PRO HA 1 1 6 6308 1 1 4 PRO HB2 H -1.403 -0.824 23.160 1.00 . A A . 4 PRO HB2 1 1 6 6309 1 1 4 PRO HB3 H -2.215 -1.559 24.536 1.00 . A A . 4 PRO HB3 1 1 6 6310 1 1 4 PRO HD2 H 1.776 -2.344 24.159 1.00 . A A . 4 PRO HD2 1 1 6 6311 1 1 4 PRO HD3 H 1.031 -3.075 25.587 1.00 . A A . 4 PRO HD3 1 1 6 6312 1 1 4 PRO HG2 H 0.462 -0.472 24.454 1.00 . A A . 4 PRO HG2 1 1 6 6313 1 1 4 PRO HG3 H -0.342 -1.226 25.825 1.00 . A A . 4 PRO HG3 1 1 6 6314 1 1 4 PRO N N 0.081 -3.513 23.774 1.00 . A A . 4 PRO N 1 1 6 6315 1 1 4 PRO O O -0.121 -2.680 21.119 1.00 . A A . 4 PRO O 1 1 6 6316 1 1 5 VAL C C -3.851 -3.311 19.276 1.00 . A A . 5 VAL C 1 1 6 6317 1 1 5 VAL CA C -2.616 -3.757 20.069 1.00 . A A . 5 VAL CA 1 1 6 6318 1 1 5 VAL CB C -2.864 -5.178 20.562 1.00 . A A . 5 VAL CB 1 1 6 6319 1 1 5 VAL CG1 C -2.954 -6.155 19.390 1.00 . A A . 5 VAL CG1 1 1 6 6320 1 1 5 VAL CG2 C -1.807 -5.628 21.569 1.00 . A A . 5 VAL CG2 1 1 6 6321 1 1 5 VAL H H -3.130 -2.300 21.562 1.00 . A A . 5 VAL H 1 1 6 6322 1 1 5 VAL HA H -1.725 -3.716 19.446 1.00 . A A . 5 VAL HA 1 1 6 6323 1 1 5 VAL HB H -3.827 -5.162 21.064 1.00 . A A . 5 VAL HB 1 1 6 6324 1 1 5 VAL HG11 H -3.810 -6.821 19.504 1.00 . A A . 5 VAL HG11 1 1 6 6325 1 1 5 VAL HG12 H -3.067 -5.621 18.447 1.00 . A A . 5 VAL HG12 1 1 6 6326 1 1 5 VAL HG13 H -2.055 -6.768 19.325 1.00 . A A . 5 VAL HG13 1 1 6 6327 1 1 5 VAL HG21 H -0.842 -5.167 21.359 1.00 . A A . 5 VAL HG21 1 1 6 6328 1 1 5 VAL HG22 H -2.105 -5.358 22.581 1.00 . A A . 5 VAL HG22 1 1 6 6329 1 1 5 VAL HG23 H -1.676 -6.709 21.536 1.00 . A A . 5 VAL HG23 1 1 6 6330 1 1 5 VAL N N -2.393 -2.869 21.197 1.00 . A A . 5 VAL N 1 1 6 6331 1 1 5 VAL O O -4.689 -4.124 18.909 1.00 . A A . 5 VAL O 1 1 6 6332 1 1 6 ASP C C -5.512 -1.908 17.150 1.00 . A A . 6 ASP C 1 1 6 6333 1 1 6 ASP CA C -4.181 -1.425 17.748 1.00 . A A . 6 ASP CA 1 1 6 6334 1 1 6 ASP CB C -3.006 -1.681 16.802 1.00 . A A . 6 ASP CB 1 1 6 6335 1 1 6 ASP CG C -3.199 -2.960 15.978 1.00 . A A . 6 ASP CG 1 1 6 6336 1 1 6 ASP H H -3.462 -1.386 19.737 1.00 . A A . 6 ASP H 1 1 6 6337 1 1 6 ASP HA H -4.310 -0.357 17.918 1.00 . A A . 6 ASP HA 1 1 6 6338 1 1 6 ASP HB2 H -2.885 -0.819 16.153 1.00 . A A . 6 ASP HB2 1 1 6 6339 1 1 6 ASP HB3 H -2.073 -1.783 17.349 1.00 . A A . 6 ASP HB3 1 1 6 6340 1 1 6 ASP N N -3.902 -1.980 19.066 1.00 . A A . 6 ASP N 1 1 6 6341 1 1 6 ASP O O -5.954 -3.035 17.330 1.00 . A A . 6 ASP O 1 1 6 6342 1 1 6 ASP OD1 O -4.142 -3.027 15.190 1.00 . A A . 6 ASP OD1 1 1 6 6343 1 1 6 ASP OD2 O -2.399 -3.881 16.135 1.00 . A A . 6 ASP OD2 1 1 6 6344 1 1 7 PRO C C -4.594 -0.357 14.539 1.00 . A A . 7 PRO C 1 1 6 6345 1 1 7 PRO CA C -5.974 -0.869 14.960 1.00 . A A . 7 PRO CA 1 1 6 6346 1 1 7 PRO CB C -7.023 0.153 14.512 1.00 . A A . 7 PRO CB 1 1 6 6347 1 1 7 PRO CD C -7.062 -0.008 16.975 1.00 . A A . 7 PRO CD 1 1 6 6348 1 1 7 PRO CG C -7.700 0.701 15.777 1.00 . A A . 7 PRO CG 1 1 6 6349 1 1 7 PRO HA H -6.154 -1.844 14.507 1.00 . A A . 7 PRO HA 1 1 6 6350 1 1 7 PRO HB2 H -6.551 0.962 13.955 1.00 . A A . 7 PRO HB2 1 1 6 6351 1 1 7 PRO HB3 H -7.758 -0.311 13.855 1.00 . A A . 7 PRO HB3 1 1 6 6352 1 1 7 PRO HD2 H -6.532 0.696 17.616 1.00 . A A . 7 PRO HD2 1 1 6 6353 1 1 7 PRO HD3 H -7.809 -0.528 17.574 1.00 . A A . 7 PRO HD3 1 1 6 6354 1 1 7 PRO HG2 H -7.560 1.779 15.851 1.00 . A A . 7 PRO HG2 1 1 6 6355 1 1 7 PRO HG3 H -8.772 0.509 15.746 1.00 . A A . 7 PRO HG3 1 1 6 6356 1 1 7 PRO N N -6.126 -0.962 16.405 1.00 . A A . 7 PRO N 1 1 6 6357 1 1 7 PRO O O -3.815 -1.040 13.885 1.00 . A A . 7 PRO O 1 1 6 6358 1 1 8 CYS C C -1.965 1.297 15.264 1.00 . A A . 8 CYS C 1 1 6 6359 1 1 8 CYS CA C -3.205 1.596 14.419 1.00 . A A . 8 CYS CA 1 1 6 6360 1 1 8 CYS CB C -3.482 3.096 14.395 1.00 . A A . 8 CYS CB 1 1 6 6361 1 1 8 CYS H H -5.009 1.356 15.559 1.00 . A A . 8 CYS H 1 1 6 6362 1 1 8 CYS HA H -3.050 1.208 13.417 1.00 . A A . 8 CYS HA 1 1 6 6363 1 1 8 CYS HB2 H -4.347 3.304 13.762 1.00 . A A . 8 CYS HB2 1 1 6 6364 1 1 8 CYS HB3 H -3.724 3.417 15.407 1.00 . A A . 8 CYS HB3 1 1 6 6365 1 1 8 CYS N N -4.361 0.900 14.951 1.00 . A A . 8 CYS N 1 1 6 6366 1 1 8 CYS O O -0.896 0.995 14.751 1.00 . A A . 8 CYS O 1 1 6 6367 1 1 8 CYS SG S -2.078 4.069 13.799 1.00 . A A . 8 CYS SG 1 1 6 6368 1 1 9 PHE C C 0.097 0.615 17.175 1.00 . A A . 9 PHE C 1 1 6 6369 1 1 9 PHE CA C -1.211 1.302 17.626 1.00 . A A . 9 PHE CA 1 1 6 6370 1 1 9 PHE CB C -1.906 0.632 18.815 1.00 . A A . 9 PHE CB 1 1 6 6371 1 1 9 PHE CD1 C -1.736 2.379 20.669 1.00 . A A . 9 PHE CD1 1 1 6 6372 1 1 9 PHE CD2 C -0.362 0.310 20.809 1.00 . A A . 9 PHE CD2 1 1 6 6373 1 1 9 PHE CE1 C -1.162 2.845 21.903 1.00 . A A . 9 PHE CE1 1 1 6 6374 1 1 9 PHE CE2 C 0.215 0.772 22.043 1.00 . A A . 9 PHE CE2 1 1 6 6375 1 1 9 PHE CG C -1.334 1.113 20.114 1.00 . A A . 9 PHE CG 1 1 6 6376 1 1 9 PHE CZ C -0.186 2.041 22.590 1.00 . A A . 9 PHE CZ 1 1 6 6377 1 1 9 PHE H H -3.166 1.448 16.888 1.00 . A A . 9 PHE H 1 1 6 6378 1 1 9 PHE HA H -0.954 2.313 17.913 1.00 . A A . 9 PHE HA 1 1 6 6379 1 1 9 PHE HB2 H -2.976 0.855 18.756 1.00 . A A . 9 PHE HB2 1 1 6 6380 1 1 9 PHE HB3 H -1.798 -0.451 18.780 1.00 . A A . 9 PHE HB3 1 1 6 6381 1 1 9 PHE HD1 H -2.473 2.981 20.157 1.00 . A A . 9 PHE HD1 1 1 6 6382 1 1 9 PHE HD2 H -0.064 -0.645 20.403 1.00 . A A . 9 PHE HD2 1 1 6 6383 1 1 9 PHE HE1 H -1.461 3.797 22.311 1.00 . A A . 9 PHE HE1 1 1 6 6384 1 1 9 PHE HE2 H 0.949 0.163 22.551 1.00 . A A . 9 PHE HE2 1 1 6 6385 1 1 9 PHE HZ H 0.246 2.391 23.516 1.00 . A A . 9 PHE HZ 1 1 6 6386 1 1 9 PHE N N -2.215 1.399 16.582 1.00 . A A . 9 PHE N 1 1 6 6387 1 1 9 PHE O O 0.810 1.069 16.288 1.00 . A A . 9 PHE O 1 1 6 6388 1 1 10 ARG C C 1.521 -1.498 15.958 1.00 . A A . 10 ARG C 1 1 6 6389 1 1 10 ARG CA C 1.158 -1.607 17.431 1.00 . A A . 10 ARG CA 1 1 6 6390 1 1 10 ARG CB C 0.384 -2.890 17.720 1.00 . A A . 10 ARG CB 1 1 6 6391 1 1 10 ARG CD C 1.278 -5.251 17.982 1.00 . A A . 10 ARG CD 1 1 6 6392 1 1 10 ARG CG C 1.214 -3.843 18.573 1.00 . A A . 10 ARG CG 1 1 6 6393 1 1 10 ARG CZ C 3.620 -5.752 18.182 1.00 . A A . 10 ARG CZ 1 1 6 6394 1 1 10 ARG H H -0.007 -0.465 18.822 1.00 . A A . 10 ARG H 1 1 6 6395 1 1 10 ARG HA H 2.051 -1.571 18.021 1.00 . A A . 10 ARG HA 1 1 6 6396 1 1 10 ARG HB2 H -0.524 -2.633 18.275 1.00 . A A . 10 ARG HB2 1 1 6 6397 1 1 10 ARG HB3 H 0.074 -3.360 16.781 1.00 . A A . 10 ARG HB3 1 1 6 6398 1 1 10 ARG HD2 H 0.362 -5.810 18.171 1.00 . A A . 10 ARG HD2 1 1 6 6399 1 1 10 ARG HD3 H 1.468 -5.231 16.909 1.00 . A A . 10 ARG HD3 1 1 6 6400 1 1 10 ARG HE H 2.180 -6.678 19.302 1.00 . A A . 10 ARG HE 1 1 6 6401 1 1 10 ARG HG2 H 2.216 -3.436 18.695 1.00 . A A . 10 ARG HG2 1 1 6 6402 1 1 10 ARG HG3 H 0.792 -3.874 19.574 1.00 . A A . 10 ARG HG3 1 1 6 6403 1 1 10 ARG HH11 H 3.955 -3.784 17.837 1.00 . A A . 10 ARG HH11 1 1 6 6404 1 1 10 ARG HH12 H 4.003 -4.802 16.436 1.00 . A A . 10 ARG HH12 1 1 6 6405 1 1 10 ARG HH21 H 4.717 -7.449 18.072 1.00 . A A . 10 ARG HH21 1 1 6 6406 1 1 10 ARG HH22 H 5.234 -6.310 19.270 1.00 . A A . 10 ARG HH22 1 1 6 6407 1 1 10 ARG N N 0.379 -0.476 17.902 1.00 . A A . 10 ARG N 1 1 6 6408 1 1 10 ARG NE N 2.362 -5.996 18.592 1.00 . A A . 10 ARG NE 1 1 6 6409 1 1 10 ARG NH1 N 3.881 -4.691 17.422 1.00 . A A . 10 ARG NH1 1 1 6 6410 1 1 10 ARG NH2 N 4.605 -6.571 18.537 1.00 . A A . 10 ARG NH2 1 1 6 6411 1 1 10 ARG O O 2.668 -1.556 15.531 1.00 . A A . 10 ARG O 1 1 6 6412 1 1 11 ALA C C 1.620 -1.311 13.120 1.00 . A A . 11 ALA C 1 1 6 6413 1 1 11 ALA CA C 0.325 -1.695 13.845 1.00 . A A . 11 ALA CA 1 1 6 6414 1 1 11 ALA CB C -0.862 -0.979 13.203 1.00 . A A . 11 ALA CB 1 1 6 6415 1 1 11 ALA H H -0.316 -1.088 15.893 1.00 . A A . 11 ALA H 1 1 6 6416 1 1 11 ALA HA H 0.189 -2.776 13.804 1.00 . A A . 11 ALA HA 1 1 6 6417 1 1 11 ALA HB1 H -1.253 -1.552 12.361 1.00 . A A . 11 ALA HB1 1 1 6 6418 1 1 11 ALA HB2 H -1.667 -0.843 13.923 1.00 . A A . 11 ALA HB2 1 1 6 6419 1 1 11 ALA HB3 H -0.568 0.004 12.835 1.00 . A A . 11 ALA HB3 1 1 6 6420 1 1 11 ALA N N 0.408 -1.341 15.252 1.00 . A A . 11 ALA N 1 1 6 6421 1 1 11 ALA O O 2.353 -0.419 13.530 1.00 . A A . 11 ALA O 1 1 6 6422 1 1 12 ASN C C 2.586 -1.205 9.830 1.00 . A A . 12 ASN C 1 1 6 6423 1 1 12 ASN CA C 3.007 -1.744 11.201 1.00 . A A . 12 ASN CA 1 1 6 6424 1 1 12 ASN CB C 3.854 -3.004 11.010 1.00 . A A . 12 ASN CB 1 1 6 6425 1 1 12 ASN CG C 2.961 -4.205 10.690 1.00 . A A . 12 ASN CG 1 1 6 6426 1 1 12 ASN H H 1.209 -2.776 11.751 1.00 . A A . 12 ASN H 1 1 6 6427 1 1 12 ASN HA H 3.564 -0.975 11.736 1.00 . A A . 12 ASN HA 1 1 6 6428 1 1 12 ASN HB2 H 4.559 -2.866 10.189 1.00 . A A . 12 ASN HB2 1 1 6 6429 1 1 12 ASN HB3 H 4.431 -3.221 11.908 1.00 . A A . 12 ASN HB3 1 1 6 6430 1 1 12 ASN HD21 H 3.467 -5.191 12.397 1.00 . A A . 12 ASN HD21 1 1 6 6431 1 1 12 ASN HD22 H 3.292 -6.194 10.969 1.00 . A A . 12 ASN HD22 1 1 6 6432 1 1 12 ASN N N 1.838 -2.044 12.012 1.00 . A A . 12 ASN N 1 1 6 6433 1 1 12 ASN ND2 N 3.268 -5.295 11.417 1.00 . A A . 12 ASN ND2 1 1 6 6434 1 1 12 ASN O O 3.165 -1.541 8.804 1.00 . A A . 12 ASN O 1 1 6 6435 1 1 12 ASN OD1 O 2.068 -4.144 9.854 1.00 . A A . 12 ASN OD1 1 1 6 6436 1 1 13 CYS C C 2.271 0.651 7.764 1.00 . A A . 13 CYS C 1 1 6 6437 1 1 13 CYS CA C 1.090 0.293 8.663 1.00 . A A . 13 CYS CA 1 1 6 6438 1 1 13 CYS CB C 0.251 1.529 8.992 1.00 . A A . 13 CYS CB 1 1 6 6439 1 1 13 CYS H H 0.997 -0.276 10.706 1.00 . A A . 13 CYS H 1 1 6 6440 1 1 13 CYS HA H 0.486 -0.454 8.153 1.00 . A A . 13 CYS HA 1 1 6 6441 1 1 13 CYS HB2 H 0.803 2.205 9.652 1.00 . A A . 13 CYS HB2 1 1 6 6442 1 1 13 CYS HB3 H 0.034 2.074 8.070 1.00 . A A . 13 CYS HB3 1 1 6 6443 1 1 13 CYS N N 1.547 -0.350 9.880 1.00 . A A . 13 CYS N 1 1 6 6444 1 1 13 CYS O O 3.017 1.597 7.988 1.00 . A A . 13 CYS O 1 1 6 6445 1 1 13 CYS SG S -1.317 1.097 9.788 1.00 . A A . 13 CYS SG 1 1 6 6446 1 1 14 GLU C C 2.868 1.683 5.236 1.00 . A A . 14 GLU C 1 1 6 6447 1 1 14 GLU CA C 3.051 0.184 5.514 1.00 . A A . 14 GLU CA 1 1 6 6448 1 1 14 GLU CB C 2.561 -0.657 4.338 1.00 . A A . 14 GLU CB 1 1 6 6449 1 1 14 GLU CD C 2.521 0.951 2.418 1.00 . A A . 14 GLU CD 1 1 6 6450 1 1 14 GLU CG C 3.245 -0.249 3.033 1.00 . A A . 14 GLU CG 1 1 6 6451 1 1 14 GLU H H 1.976 -1.116 6.882 1.00 . A A . 14 GLU H 1 1 6 6452 1 1 14 GLU HA H 4.103 -0.020 5.677 1.00 . A A . 14 GLU HA 1 1 6 6453 1 1 14 GLU HB2 H 2.763 -1.710 4.537 1.00 . A A . 14 GLU HB2 1 1 6 6454 1 1 14 GLU HB3 H 1.482 -0.565 4.240 1.00 . A A . 14 GLU HB3 1 1 6 6455 1 1 14 GLU HG2 H 4.285 0.021 3.214 1.00 . A A . 14 GLU HG2 1 1 6 6456 1 1 14 GLU HG3 H 3.238 -1.075 2.323 1.00 . A A . 14 GLU HG3 1 1 6 6457 1 1 14 GLU N N 2.370 -0.208 6.738 1.00 . A A . 14 GLU N 1 1 6 6458 1 1 14 GLU O O 3.785 2.481 5.387 1.00 . A A . 14 GLU O 1 1 6 6459 1 1 14 GLU OE1 O 1.291 0.970 2.443 1.00 . A A . 14 GLU OE1 1 1 6 6460 1 1 14 GLU OE2 O 3.194 1.853 1.921 1.00 . A A . 14 GLU OE2 1 1 6 6461 1 1 15 TYR C C 0.883 3.670 6.436 1.00 . A A . 15 TYR C 1 1 6 6462 1 1 15 TYR CA C 1.186 3.379 4.960 1.00 . A A . 15 TYR CA 1 1 6 6463 1 1 15 TYR CB C -0.021 3.607 4.038 1.00 . A A . 15 TYR CB 1 1 6 6464 1 1 15 TYR CD1 C 0.690 5.426 2.407 1.00 . A A . 15 TYR CD1 1 1 6 6465 1 1 15 TYR CD2 C -0.987 5.973 4.162 1.00 . A A . 15 TYR CD2 1 1 6 6466 1 1 15 TYR CE1 C 0.587 6.764 1.888 1.00 . A A . 15 TYR CE1 1 1 6 6467 1 1 15 TYR CE2 C -1.092 7.312 3.646 1.00 . A A . 15 TYR CE2 1 1 6 6468 1 1 15 TYR CG C -0.103 5.020 3.539 1.00 . A A . 15 TYR CG 1 1 6 6469 1 1 15 TYR CZ C -0.302 7.708 2.511 1.00 . A A . 15 TYR CZ 1 1 6 6470 1 1 15 TYR H H 1.025 1.309 4.432 1.00 . A A . 15 TYR H 1 1 6 6471 1 1 15 TYR HA H 2.017 4.009 4.650 1.00 . A A . 15 TYR HA 1 1 6 6472 1 1 15 TYR HB2 H 0.090 2.969 3.171 1.00 . A A . 15 TYR HB2 1 1 6 6473 1 1 15 TYR HB3 H -0.957 3.332 4.537 1.00 . A A . 15 TYR HB3 1 1 6 6474 1 1 15 TYR HD1 H 1.364 4.721 1.944 1.00 . A A . 15 TYR HD1 1 1 6 6475 1 1 15 TYR HD2 H -1.575 5.685 5.020 1.00 . A A . 15 TYR HD2 1 1 6 6476 1 1 15 TYR HE1 H 1.169 7.057 1.027 1.00 . A A . 15 TYR HE1 1 1 6 6477 1 1 15 TYR HE2 H -1.772 8.017 4.103 1.00 . A A . 15 TYR HE2 1 1 6 6478 1 1 15 TYR HH H -0.981 9.005 1.271 1.00 . A A . 15 TYR HH 1 1 6 6479 1 1 15 TYR N N 1.628 2.003 4.824 1.00 . A A . 15 TYR N 1 1 6 6480 1 1 15 TYR O O 1.661 3.361 7.330 1.00 . A A . 15 TYR O 1 1 6 6481 1 1 15 TYR OH O -0.397 8.994 2.018 1.00 . A A . 15 TYR OH 1 1 6 6482 1 1 16 GLN C C -1.983 3.542 8.230 1.00 . A A . 16 GLN C 1 1 6 6483 1 1 16 GLN CA C -0.782 4.463 7.973 1.00 . A A . 16 GLN CA 1 1 6 6484 1 1 16 GLN CB C -1.143 5.928 8.224 1.00 . A A . 16 GLN CB 1 1 6 6485 1 1 16 GLN CD C -1.575 7.652 9.992 1.00 . A A . 16 GLN CD 1 1 6 6486 1 1 16 GLN CG C -0.949 6.287 9.697 1.00 . A A . 16 GLN CG 1 1 6 6487 1 1 16 GLN H H -0.754 4.547 5.769 1.00 . A A . 16 GLN H 1 1 6 6488 1 1 16 GLN HA H 0.031 4.163 8.630 1.00 . A A . 16 GLN HA 1 1 6 6489 1 1 16 GLN HB2 H -0.532 6.576 7.608 1.00 . A A . 16 GLN HB2 1 1 6 6490 1 1 16 GLN HB3 H -2.190 6.075 7.942 1.00 . A A . 16 GLN HB3 1 1 6 6491 1 1 16 GLN HE21 H -3.500 7.360 10.582 1.00 . A A . 16 GLN HE21 1 1 6 6492 1 1 16 GLN HE22 H -3.295 7.979 8.954 1.00 . A A . 16 GLN HE22 1 1 6 6493 1 1 16 GLN HG2 H -1.413 5.534 10.335 1.00 . A A . 16 GLN HG2 1 1 6 6494 1 1 16 GLN HG3 H 0.112 6.317 9.945 1.00 . A A . 16 GLN HG3 1 1 6 6495 1 1 16 GLN N N -0.290 4.289 6.619 1.00 . A A . 16 GLN N 1 1 6 6496 1 1 16 GLN NE2 N -2.910 7.665 9.828 1.00 . A A . 16 GLN NE2 1 1 6 6497 1 1 16 GLN O O -2.066 2.434 7.719 1.00 . A A . 16 GLN O 1 1 6 6498 1 1 16 GLN OE1 O -0.898 8.612 10.339 1.00 . A A . 16 GLN OE1 1 1 6 6499 1 1 17 CYS C C -5.229 3.407 9.331 1.00 . A A . 17 CYS C 1 1 6 6500 1 1 17 CYS CA C -3.784 3.207 9.797 1.00 . A A . 17 CYS CA 1 1 6 6501 1 1 17 CYS CB C -3.664 3.502 11.290 1.00 . A A . 17 CYS CB 1 1 6 6502 1 1 17 CYS H H -2.657 5.026 9.322 1.00 . A A . 17 CYS H 1 1 6 6503 1 1 17 CYS HA H -3.458 2.187 9.599 1.00 . A A . 17 CYS HA 1 1 6 6504 1 1 17 CYS HB2 H -4.123 4.463 11.521 1.00 . A A . 17 CYS HB2 1 1 6 6505 1 1 17 CYS HB3 H -4.206 2.744 11.857 1.00 . A A . 17 CYS HB3 1 1 6 6506 1 1 17 CYS N N -2.887 4.084 9.065 1.00 . A A . 17 CYS N 1 1 6 6507 1 1 17 CYS O O -5.832 4.455 9.530 1.00 . A A . 17 CYS O 1 1 6 6508 1 1 17 CYS SG S -1.939 3.524 11.840 1.00 . A A . 17 CYS SG 1 1 6 6509 1 1 18 GLN C C -7.220 0.871 9.972 1.00 . A A . 18 GLN C 1 1 6 6510 1 1 18 GLN CA C -7.127 1.988 8.934 1.00 . A A . 18 GLN CA 1 1 6 6511 1 1 18 GLN CB C -7.752 1.523 7.623 1.00 . A A . 18 GLN CB 1 1 6 6512 1 1 18 GLN CD C -9.187 3.100 6.306 1.00 . A A . 18 GLN CD 1 1 6 6513 1 1 18 GLN CG C -9.164 2.083 7.448 1.00 . A A . 18 GLN CG 1 1 6 6514 1 1 18 GLN H H -5.207 1.856 8.000 1.00 . A A . 18 GLN H 1 1 6 6515 1 1 18 GLN HA H -7.620 2.889 9.300 1.00 . A A . 18 GLN HA 1 1 6 6516 1 1 18 GLN HB2 H -7.116 1.853 6.798 1.00 . A A . 18 GLN HB2 1 1 6 6517 1 1 18 GLN HB3 H -7.786 0.431 7.603 1.00 . A A . 18 GLN HB3 1 1 6 6518 1 1 18 GLN HE21 H -7.736 4.118 7.302 1.00 . A A . 18 GLN HE21 1 1 6 6519 1 1 18 GLN HE22 H -8.114 4.718 5.697 1.00 . A A . 18 GLN HE22 1 1 6 6520 1 1 18 GLN HG2 H -9.872 1.284 7.227 1.00 . A A . 18 GLN HG2 1 1 6 6521 1 1 18 GLN HG3 H -9.498 2.573 8.362 1.00 . A A . 18 GLN HG3 1 1 6 6522 1 1 18 GLN N N -5.736 2.332 8.702 1.00 . A A . 18 GLN N 1 1 6 6523 1 1 18 GLN NE2 N -8.262 4.066 6.447 1.00 . A A . 18 GLN NE2 1 1 6 6524 1 1 18 GLN O O -6.495 -0.113 9.926 1.00 . A A . 18 GLN O 1 1 6 6525 1 1 18 GLN OE1 O -9.983 3.014 5.378 1.00 . A A . 18 GLN OE1 1 1 6 6526 1 1 19 PRO C C -10.267 -0.022 10.152 1.00 . A A . 19 PRO C 1 1 6 6527 1 1 19 PRO CA C -9.206 0.139 11.251 1.00 . A A . 19 PRO CA 1 1 6 6528 1 1 19 PRO CB C -9.855 0.685 12.523 1.00 . A A . 19 PRO CB 1 1 6 6529 1 1 19 PRO CD C -8.100 2.256 11.787 1.00 . A A . 19 PRO CD 1 1 6 6530 1 1 19 PRO CG C -9.090 1.957 12.912 1.00 . A A . 19 PRO CG 1 1 6 6531 1 1 19 PRO HA H -8.760 -0.831 11.460 1.00 . A A . 19 PRO HA 1 1 6 6532 1 1 19 PRO HB2 H -10.908 0.909 12.350 1.00 . A A . 19 PRO HB2 1 1 6 6533 1 1 19 PRO HB3 H -9.800 -0.053 13.324 1.00 . A A . 19 PRO HB3 1 1 6 6534 1 1 19 PRO HD2 H -8.386 3.149 11.232 1.00 . A A . 19 PRO HD2 1 1 6 6535 1 1 19 PRO HD3 H -7.089 2.390 12.171 1.00 . A A . 19 PRO HD3 1 1 6 6536 1 1 19 PRO HG2 H -9.775 2.790 13.051 1.00 . A A . 19 PRO HG2 1 1 6 6537 1 1 19 PRO HG3 H -8.551 1.799 13.845 1.00 . A A . 19 PRO HG3 1 1 6 6538 1 1 19 PRO N N -8.153 1.093 10.921 1.00 . A A . 19 PRO N 1 1 6 6539 1 1 19 PRO O O -11.189 0.775 10.019 1.00 . A A . 19 PRO O 1 1 6 6540 1 1 20 LEU C C -11.829 -2.681 10.082 1.00 . A A . 20 LEU C 1 1 6 6541 1 1 20 LEU CA C -11.129 -1.975 8.927 1.00 . A A . 20 LEU CA 1 1 6 6542 1 1 20 LEU CB C -10.683 -3.078 7.995 1.00 . A A . 20 LEU CB 1 1 6 6543 1 1 20 LEU CD1 C -12.198 -2.975 5.979 1.00 . A A . 20 LEU CD1 1 1 6 6544 1 1 20 LEU CD2 C -11.954 -5.141 7.248 1.00 . A A . 20 LEU CD2 1 1 6 6545 1 1 20 LEU CG C -11.954 -3.615 7.345 1.00 . A A . 20 LEU CG 1 1 6 6546 1 1 20 LEU H H -9.157 -1.293 9.051 1.00 . A A . 20 LEU H 1 1 6 6547 1 1 20 LEU HA H -11.842 -1.322 8.424 1.00 . A A . 20 LEU HA 1 1 6 6548 1 1 20 LEU HB2 H -9.955 -2.739 7.262 1.00 . A A . 20 LEU HB2 1 1 6 6549 1 1 20 LEU HB3 H -10.208 -3.846 8.600 1.00 . A A . 20 LEU HB3 1 1 6 6550 1 1 20 LEU HD11 H -11.302 -3.019 5.361 1.00 . A A . 20 LEU HD11 1 1 6 6551 1 1 20 LEU HD12 H -13.000 -3.489 5.448 1.00 . A A . 20 LEU HD12 1 1 6 6552 1 1 20 LEU HD13 H -12.484 -1.929 6.086 1.00 . A A . 20 LEU HD13 1 1 6 6553 1 1 20 LEU HD21 H -12.516 -5.583 8.070 1.00 . A A . 20 LEU HD21 1 1 6 6554 1 1 20 LEU HD22 H -12.415 -5.469 6.316 1.00 . A A . 20 LEU HD22 1 1 6 6555 1 1 20 LEU HD23 H -10.939 -5.536 7.277 1.00 . A A . 20 LEU HD23 1 1 6 6556 1 1 20 LEU HG H -12.765 -3.303 8.014 1.00 . A A . 20 LEU HG 1 1 6 6557 1 1 20 LEU N N -10.064 -1.110 9.383 1.00 . A A . 20 LEU N 1 1 6 6558 1 1 20 LEU O O -11.960 -3.892 10.167 1.00 . A A . 20 LEU O 1 1 6 6559 1 1 21 ASN C C -13.909 -3.204 12.081 1.00 . A A . 21 ASN C 1 1 6 6560 1 1 21 ASN CA C -13.093 -1.903 12.085 1.00 . A A . 21 ASN CA 1 1 6 6561 1 1 21 ASN CB C -14.053 -0.720 12.214 1.00 . A A . 21 ASN CB 1 1 6 6562 1 1 21 ASN CG C -15.023 -0.718 11.030 1.00 . A A . 21 ASN CG 1 1 6 6563 1 1 21 ASN H H -11.992 -0.986 10.307 1.00 . A A . 21 ASN H 1 1 6 6564 1 1 21 ASN HA H -12.387 -1.906 12.917 1.00 . A A . 21 ASN HA 1 1 6 6565 1 1 21 ASN HB2 H -14.631 -0.796 13.139 1.00 . A A . 21 ASN HB2 1 1 6 6566 1 1 21 ASN HB3 H -13.501 0.224 12.218 1.00 . A A . 21 ASN HB3 1 1 6 6567 1 1 21 ASN HD21 H -15.194 1.316 11.184 1.00 . A A . 21 ASN HD21 1 1 6 6568 1 1 21 ASN N N -12.315 -1.745 10.863 1.00 . A A . 21 ASN N 1 1 6 6569 1 1 21 ASN ND2 N -15.318 0.519 10.592 1.00 . A A . 21 ASN ND2 1 1 6 6570 1 1 21 ASN O O -14.084 -3.865 11.066 1.00 . A A . 21 ASN O 1 1 6 6571 1 1 21 ASN OD1 O -15.465 -1.757 10.555 1.00 . A A . 21 ASN OD1 1 1 6 6572 1 1 22 GLN C C -12.782 -3.931 15.044 1.00 . A A . 22 GLN C 1 1 6 6573 1 1 22 GLN CA C -13.830 -4.548 14.108 1.00 . A A . 22 GLN CA 1 1 6 6574 1 1 22 GLN CB C -13.262 -5.674 13.240 1.00 . A A . 22 GLN CB 1 1 6 6575 1 1 22 GLN CD C -13.838 -8.042 12.665 1.00 . A A . 22 GLN CD 1 1 6 6576 1 1 22 GLN CG C -14.361 -6.605 12.724 1.00 . A A . 22 GLN CG 1 1 6 6577 1 1 22 GLN H H -15.220 -3.000 13.626 1.00 . A A . 22 GLN H 1 1 6 6578 1 1 22 GLN HA H -14.645 -4.934 14.721 1.00 . A A . 22 GLN HA 1 1 6 6579 1 1 22 GLN HB2 H -12.719 -5.260 12.393 1.00 . A A . 22 GLN HB2 1 1 6 6580 1 1 22 GLN HB3 H -12.551 -6.255 13.825 1.00 . A A . 22 GLN HB3 1 1 6 6581 1 1 22 GLN HE21 H -12.504 -7.415 11.263 1.00 . A A . 22 GLN HE21 1 1 6 6582 1 1 22 GLN HE22 H -12.593 -9.151 11.499 1.00 . A A . 22 GLN HE22 1 1 6 6583 1 1 22 GLN HG2 H -15.232 -6.572 13.379 1.00 . A A . 22 GLN HG2 1 1 6 6584 1 1 22 GLN HG3 H -14.683 -6.304 11.727 1.00 . A A . 22 GLN HG3 1 1 6 6585 1 1 22 GLN N N -14.423 -3.503 13.290 1.00 . A A . 22 GLN N 1 1 6 6586 1 1 22 GLN NE2 N -12.893 -8.219 11.725 1.00 . A A . 22 GLN NE2 1 1 6 6587 1 1 22 GLN O O -13.102 -3.077 15.861 1.00 . A A . 22 GLN O 1 1 6 6588 1 1 22 GLN OE1 O -14.260 -8.915 13.413 1.00 . A A . 22 GLN OE1 1 1 6 6589 1 1 23 THR C C -10.417 -5.534 13.013 1.00 . A A . 23 THR C 1 1 6 6590 1 1 23 THR CA C -10.874 -4.204 13.615 1.00 . A A . 23 THR CA 1 1 6 6591 1 1 23 THR CB C -9.674 -3.278 13.785 1.00 . A A . 23 THR CB 1 1 6 6592 1 1 23 THR CG2 C -10.013 -2.073 14.664 1.00 . A A . 23 THR CG2 1 1 6 6593 1 1 23 THR H H -10.961 -4.427 15.719 1.00 . A A . 23 THR H 1 1 6 6594 1 1 23 THR HA H -11.600 -3.720 12.966 1.00 . A A . 23 THR HA 1 1 6 6595 1 1 23 THR HB H -9.355 -2.936 12.800 1.00 . A A . 23 THR HB 1 1 6 6596 1 1 23 THR HG1 H -8.283 -4.577 13.688 1.00 . A A . 23 THR HG1 1 1 6 6597 1 1 23 THR HG21 H -9.157 -1.405 14.762 1.00 . A A . 23 THR HG21 1 1 6 6598 1 1 23 THR HG22 H -10.838 -1.504 14.239 1.00 . A A . 23 THR HG22 1 1 6 6599 1 1 23 THR HG23 H -10.307 -2.391 15.664 1.00 . A A . 23 THR HG23 1 1 6 6600 1 1 23 THR N N -11.524 -4.395 14.897 1.00 . A A . 23 THR N 1 1 6 6601 1 1 23 THR O O -10.053 -6.485 13.695 1.00 . A A . 23 THR O 1 1 6 6602 1 1 23 THR OG1 O -8.606 -3.988 14.357 1.00 . A A . 23 THR OG1 1 1 6 6603 1 1 24 SER C C -8.154 -5.325 10.775 1.00 . A A . 24 SER C 1 1 6 6604 1 1 24 SER CA C -9.472 -6.119 10.825 1.00 . A A . 24 SER CA 1 1 6 6605 1 1 24 SER CB C -10.083 -6.277 9.437 1.00 . A A . 24 SER CB 1 1 6 6606 1 1 24 SER H H -11.110 -4.871 11.229 1.00 . A A . 24 SER H 1 1 6 6607 1 1 24 SER HA H -9.262 -7.068 11.269 1.00 . A A . 24 SER HA 1 1 6 6608 1 1 24 SER HB2 H -11.115 -5.927 9.444 1.00 . A A . 24 SER HB2 1 1 6 6609 1 1 24 SER HB3 H -9.559 -5.675 8.705 1.00 . A A . 24 SER HB3 1 1 6 6610 1 1 24 SER HG H -10.191 -8.149 9.790 1.00 . A A . 24 SER HG 1 1 6 6611 1 1 24 SER N N -10.477 -5.498 11.674 1.00 . A A . 24 SER N 1 1 6 6612 1 1 24 SER O O -7.055 -5.860 10.705 1.00 . A A . 24 SER O 1 1 6 6613 1 1 24 SER OG O -10.063 -7.617 9.016 1.00 . A A . 24 SER OG 1 1 6 6614 1 1 25 TYR C C -6.454 -3.311 9.460 1.00 . A A . 25 TYR C 1 1 6 6615 1 1 25 TYR CA C -7.465 -2.944 10.543 1.00 . A A . 25 TYR CA 1 1 6 6616 1 1 25 TYR CB C -6.766 -2.419 11.796 1.00 . A A . 25 TYR CB 1 1 6 6617 1 1 25 TYR CD1 C -6.139 -4.623 12.912 1.00 . A A . 25 TYR CD1 1 1 6 6618 1 1 25 TYR CD2 C -4.329 -3.072 12.198 1.00 . A A . 25 TYR CD2 1 1 6 6619 1 1 25 TYR CE1 C -5.155 -5.546 13.409 1.00 . A A . 25 TYR CE1 1 1 6 6620 1 1 25 TYR CE2 C -3.342 -3.993 12.694 1.00 . A A . 25 TYR CE2 1 1 6 6621 1 1 25 TYR CG C -5.734 -3.381 12.306 1.00 . A A . 25 TYR CG 1 1 6 6622 1 1 25 TYR CZ C -3.755 -5.231 13.300 1.00 . A A . 25 TYR CZ 1 1 6 6623 1 1 25 TYR H H -9.386 -3.917 10.977 1.00 . A A . 25 TYR H 1 1 6 6624 1 1 25 TYR HA H -8.110 -2.163 10.150 1.00 . A A . 25 TYR HA 1 1 6 6625 1 1 25 TYR HB2 H -6.297 -1.447 11.604 1.00 . A A . 25 TYR HB2 1 1 6 6626 1 1 25 TYR HB3 H -7.516 -2.248 12.562 1.00 . A A . 25 TYR HB3 1 1 6 6627 1 1 25 TYR HD1 H -7.189 -4.866 12.988 1.00 . A A . 25 TYR HD1 1 1 6 6628 1 1 25 TYR HD2 H -4.015 -2.143 11.744 1.00 . A A . 25 TYR HD2 1 1 6 6629 1 1 25 TYR HE1 H -5.467 -6.475 13.864 1.00 . A A . 25 TYR HE1 1 1 6 6630 1 1 25 TYR HE2 H -2.291 -3.757 12.610 1.00 . A A . 25 TYR HE2 1 1 6 6631 1 1 25 TYR HH H -1.944 -5.802 13.552 1.00 . A A . 25 TYR HH 1 1 6 6632 1 1 25 TYR N N -8.403 -4.015 10.823 1.00 . A A . 25 TYR N 1 1 6 6633 1 1 25 TYR O O -5.830 -4.364 9.433 1.00 . A A . 25 TYR O 1 1 6 6634 1 1 25 TYR OH O -2.810 -6.115 13.776 1.00 . A A . 25 TYR OH 1 1 6 6635 1 1 26 LEU C C -4.800 -2.012 6.629 1.00 . A A . 26 LEU C 1 1 6 6636 1 1 26 LEU CA C -6.131 -2.586 7.172 1.00 . A A . 26 LEU CA 1 1 6 6637 1 1 26 LEU CB C -7.342 -2.069 6.392 1.00 . A A . 26 LEU CB 1 1 6 6638 1 1 26 LEU CD1 C -6.320 -1.049 4.333 1.00 . A A . 26 LEU CD1 1 1 6 6639 1 1 26 LEU CD2 C -8.350 -0.007 5.367 1.00 . A A . 26 LEU CD2 1 1 6 6640 1 1 26 LEU CG C -7.053 -0.769 5.642 1.00 . A A . 26 LEU CG 1 1 6 6641 1 1 26 LEU H H -6.850 -1.486 8.899 1.00 . A A . 26 LEU H 1 1 6 6642 1 1 26 LEU HA H -6.078 -3.663 7.117 1.00 . A A . 26 LEU HA 1 1 6 6643 1 1 26 LEU HB2 H -7.673 -2.830 5.682 1.00 . A A . 26 LEU HB2 1 1 6 6644 1 1 26 LEU HB3 H -8.159 -1.898 7.102 1.00 . A A . 26 LEU HB3 1 1 6 6645 1 1 26 LEU HD11 H -5.497 -0.349 4.197 1.00 . A A . 26 LEU HD11 1 1 6 6646 1 1 26 LEU HD12 H -5.921 -2.062 4.321 1.00 . A A . 26 LEU HD12 1 1 6 6647 1 1 26 LEU HD13 H -6.996 -0.943 3.486 1.00 . A A . 26 LEU HD13 1 1 6 6648 1 1 26 LEU HD21 H -8.177 1.067 5.316 1.00 . A A . 26 LEU HD21 1 1 6 6649 1 1 26 LEU HD22 H -8.783 -0.317 4.417 1.00 . A A . 26 LEU HD22 1 1 6 6650 1 1 26 LEU HD23 H -9.087 -0.195 6.146 1.00 . A A . 26 LEU HD23 1 1 6 6651 1 1 26 LEU HG H -6.413 -0.147 6.267 1.00 . A A . 26 LEU HG 1 1 6 6652 1 1 26 LEU N N -6.367 -2.303 8.583 1.00 . A A . 26 LEU N 1 1 6 6653 1 1 26 LEU O O -4.259 -2.461 5.627 1.00 . A A . 26 LEU O 1 1 6 6654 1 1 27 CYS C C -3.210 0.275 5.596 1.00 . A A . 27 CYS C 1 1 6 6655 1 1 27 CYS CA C -3.229 -0.130 7.075 1.00 . A A . 27 CYS CA 1 1 6 6656 1 1 27 CYS CB C -1.921 -0.801 7.463 1.00 . A A . 27 CYS CB 1 1 6 6657 1 1 27 CYS H H -4.708 -1.103 8.310 1.00 . A A . 27 CYS H 1 1 6 6658 1 1 27 CYS HA H -3.398 0.752 7.687 1.00 . A A . 27 CYS HA 1 1 6 6659 1 1 27 CYS HB2 H -1.978 -1.829 7.107 1.00 . A A . 27 CYS HB2 1 1 6 6660 1 1 27 CYS HB3 H -1.091 -0.297 6.963 1.00 . A A . 27 CYS HB3 1 1 6 6661 1 1 27 CYS N N -4.320 -1.025 7.398 1.00 . A A . 27 CYS N 1 1 6 6662 1 1 27 CYS O O -3.410 -0.525 4.691 1.00 . A A . 27 CYS O 1 1 6 6663 1 1 27 CYS SG S -1.622 -0.849 9.252 1.00 . A A . 27 CYS SG 1 1 6 6664 1 1 28 VAL C C -2.696 2.196 3.105 1.00 . A A . 28 VAL C 1 1 6 6665 1 1 28 VAL CA C -3.572 2.310 4.355 1.00 . A A . 28 VAL CA 1 1 6 6666 1 1 28 VAL CB C -3.781 3.791 4.715 1.00 . A A . 28 VAL CB 1 1 6 6667 1 1 28 VAL CG1 C -4.985 4.364 3.964 1.00 . A A . 28 VAL CG1 1 1 6 6668 1 1 28 VAL CG2 C -3.946 4.069 6.214 1.00 . A A . 28 VAL CG2 1 1 6 6669 1 1 28 VAL H H -2.291 2.037 6.044 1.00 . A A . 28 VAL H 1 1 6 6670 1 1 28 VAL HA H -4.531 1.822 4.182 1.00 . A A . 28 VAL HA 1 1 6 6671 1 1 28 VAL HB H -2.896 4.335 4.385 1.00 . A A . 28 VAL HB 1 1 6 6672 1 1 28 VAL HG11 H -4.994 5.452 4.023 1.00 . A A . 28 VAL HG11 1 1 6 6673 1 1 28 VAL HG12 H -4.971 4.087 2.911 1.00 . A A . 28 VAL HG12 1 1 6 6674 1 1 28 VAL HG13 H -5.917 3.998 4.394 1.00 . A A . 28 VAL HG13 1 1 6 6675 1 1 28 VAL HG21 H -3.901 3.178 6.838 1.00 . A A . 28 VAL HG21 1 1 6 6676 1 1 28 VAL HG22 H -3.175 4.760 6.552 1.00 . A A . 28 VAL HG22 1 1 6 6677 1 1 28 VAL HG23 H -4.909 4.544 6.404 1.00 . A A . 28 VAL HG23 1 1 6 6678 1 1 28 VAL N N -2.926 1.579 5.427 1.00 . A A . 28 VAL N 1 1 6 6679 1 1 28 VAL O O -1.602 1.646 3.136 1.00 . A A . 28 VAL O 1 1 6 6680 1 1 29 CYS C C -2.201 3.564 -0.060 1.00 . A A . 29 CYS C 1 1 6 6681 1 1 29 CYS CA C -2.685 2.357 0.725 1.00 . A A . 29 CYS CA 1 1 6 6682 1 1 29 CYS CB C -3.759 1.618 -0.061 1.00 . A A . 29 CYS CB 1 1 6 6683 1 1 29 CYS H H -4.229 2.960 2.066 1.00 . A A . 29 CYS H 1 1 6 6684 1 1 29 CYS HA H -1.848 1.720 0.921 1.00 . A A . 29 CYS HA 1 1 6 6685 1 1 29 CYS HB2 H -4.704 2.151 0.051 1.00 . A A . 29 CYS HB2 1 1 6 6686 1 1 29 CYS HB3 H -3.497 1.635 -1.120 1.00 . A A . 29 CYS HB3 1 1 6 6687 1 1 29 CYS N N -3.260 2.729 2.007 1.00 . A A . 29 CYS N 1 1 6 6688 1 1 29 CYS O O -1.081 3.660 -0.547 1.00 . A A . 29 CYS O 1 1 6 6689 1 1 29 CYS SG S -4.004 -0.092 0.498 1.00 . A A . 29 CYS SG 1 1 6 6690 1 1 30 ALA C C -2.500 5.585 -2.157 1.00 . A A . 30 ALA C 1 1 6 6691 1 1 30 ALA CA C -2.939 5.762 -0.700 1.00 . A A . 30 ALA CA 1 1 6 6692 1 1 30 ALA CB C -1.879 6.517 0.103 1.00 . A A . 30 ALA CB 1 1 6 6693 1 1 30 ALA H H -3.864 4.163 0.546 1.00 . A A . 30 ALA H 1 1 6 6694 1 1 30 ALA HA H -3.897 6.280 -0.701 1.00 . A A . 30 ALA HA 1 1 6 6695 1 1 30 ALA HB1 H -2.061 6.422 1.173 1.00 . A A . 30 ALA HB1 1 1 6 6696 1 1 30 ALA HB2 H -0.883 6.126 -0.105 1.00 . A A . 30 ALA HB2 1 1 6 6697 1 1 30 ALA HB3 H -1.884 7.578 -0.148 1.00 . A A . 30 ALA HB3 1 1 6 6698 1 1 30 ALA N N -3.178 4.458 -0.114 1.00 . A A . 30 ALA N 1 1 6 6699 1 1 30 ALA O O -1.320 5.521 -2.480 1.00 . A A . 30 ALA O 1 1 6 6700 1 1 31 GLU C C -2.410 4.445 -4.902 1.00 . A A . 31 GLU C 1 1 6 6701 1 1 31 GLU CA C -3.643 4.475 -3.996 1.00 . A A . 31 GLU CA 1 1 6 6702 1 1 31 GLU CB C -4.895 4.778 -4.813 1.00 . A A . 31 GLU CB 1 1 6 6703 1 1 31 GLU CD C -6.765 3.428 -3.853 1.00 . A A . 31 GLU CD 1 1 6 6704 1 1 31 GLU CG C -5.750 3.532 -4.993 1.00 . A A . 31 GLU CG 1 1 6 6705 1 1 31 GLU H H -4.439 5.923 -2.799 1.00 . A A . 31 GLU H 1 1 6 6706 1 1 31 GLU HA H -3.776 3.530 -3.469 1.00 . A A . 31 GLU HA 1 1 6 6707 1 1 31 GLU HB2 H -5.497 5.546 -4.325 1.00 . A A . 31 GLU HB2 1 1 6 6708 1 1 31 GLU HB3 H -4.602 5.195 -5.772 1.00 . A A . 31 GLU HB3 1 1 6 6709 1 1 31 GLU HG2 H -6.282 3.577 -5.941 1.00 . A A . 31 GLU HG2 1 1 6 6710 1 1 31 GLU HG3 H -5.118 2.646 -4.984 1.00 . A A . 31 GLU HG3 1 1 6 6711 1 1 31 GLU N N -3.552 5.512 -2.996 1.00 . A A . 31 GLU N 1 1 6 6712 1 1 31 GLU O O -1.485 5.238 -4.777 1.00 . A A . 31 GLU O 1 1 6 6713 1 1 31 GLU OE1 O -7.249 4.465 -3.402 1.00 . A A . 31 GLU OE1 1 1 6 6714 1 1 31 GLU OE2 O -7.059 2.311 -3.429 1.00 . A A . 31 GLU OE2 1 1 6 6715 1 1 32 GLY C C -0.865 1.621 -5.396 1.00 . A A . 32 GLY C 1 1 6 6716 1 1 32 GLY CA C -1.254 2.826 -6.274 1.00 . A A . 32 GLY CA 1 1 6 6717 1 1 32 GLY H H -3.363 3.196 -6.207 1.00 . A A . 32 GLY H 1 1 6 6718 1 1 32 GLY HA2 H -1.417 2.501 -7.303 1.00 . A A . 32 GLY HA2 1 1 6 6719 1 1 32 GLY HA3 H -0.465 3.580 -6.244 1.00 . A A . 32 GLY HA3 1 1 6 6720 1 1 32 GLY N N -2.479 3.472 -5.829 1.00 . A A . 32 GLY N 1 1 6 6721 1 1 32 GLY O O 0.295 1.231 -5.337 1.00 . A A . 32 GLY O 1 1 6 6722 1 1 33 PHE C C -2.804 -0.498 -3.101 1.00 . A A . 33 PHE C 1 1 6 6723 1 1 33 PHE CA C -1.604 0.373 -3.478 1.00 . A A . 33 PHE CA 1 1 6 6724 1 1 33 PHE CB C -1.335 1.407 -2.383 1.00 . A A . 33 PHE CB 1 1 6 6725 1 1 33 PHE CD1 C 1.145 1.299 -1.772 1.00 . A A . 33 PHE CD1 1 1 6 6726 1 1 33 PHE CD2 C 0.325 3.156 -3.205 1.00 . A A . 33 PHE CD2 1 1 6 6727 1 1 33 PHE CE1 C 2.478 1.839 -1.831 1.00 . A A . 33 PHE CE1 1 1 6 6728 1 1 33 PHE CE2 C 1.655 3.701 -3.267 1.00 . A A . 33 PHE CE2 1 1 6 6729 1 1 33 PHE CG C 0.061 1.957 -2.455 1.00 . A A . 33 PHE CG 1 1 6 6730 1 1 33 PHE CZ C 2.732 3.041 -2.579 1.00 . A A . 33 PHE CZ 1 1 6 6731 1 1 33 PHE H H -2.830 1.151 -5.045 1.00 . A A . 33 PHE H 1 1 6 6732 1 1 33 PHE HA H -0.735 -0.267 -3.636 1.00 . A A . 33 PHE HA 1 1 6 6733 1 1 33 PHE HB2 H -2.045 2.236 -2.466 1.00 . A A . 33 PHE HB2 1 1 6 6734 1 1 33 PHE HB3 H -1.471 0.932 -1.412 1.00 . A A . 33 PHE HB3 1 1 6 6735 1 1 33 PHE HD1 H 0.967 0.382 -1.235 1.00 . A A . 33 PHE HD1 1 1 6 6736 1 1 33 PHE HD2 H -0.481 3.638 -3.732 1.00 . A A . 33 PHE HD2 1 1 6 6737 1 1 33 PHE HE1 H 3.287 1.339 -1.319 1.00 . A A . 33 PHE HE1 1 1 6 6738 1 1 33 PHE HE2 H 1.844 4.602 -3.833 1.00 . A A . 33 PHE HE2 1 1 6 6739 1 1 33 PHE HZ H 3.731 3.448 -2.624 1.00 . A A . 33 PHE HZ 1 1 6 6740 1 1 33 PHE N N -1.887 1.053 -4.727 1.00 . A A . 33 PHE N 1 1 6 6741 1 1 33 PHE O O -3.723 -0.072 -2.413 1.00 . A A . 33 PHE O 1 1 6 6742 1 1 34 ALA C C -3.536 -4.063 -3.505 1.00 . A A . 34 ALA C 1 1 6 6743 1 1 34 ALA CA C -3.900 -2.588 -3.414 1.00 . A A . 34 ALA CA 1 1 6 6744 1 1 34 ALA CB C -4.987 -2.264 -4.434 1.00 . A A . 34 ALA CB 1 1 6 6745 1 1 34 ALA H H -1.891 -2.067 -4.033 1.00 . A A . 34 ALA H 1 1 6 6746 1 1 34 ALA HA H -4.243 -2.395 -2.401 1.00 . A A . 34 ALA HA 1 1 6 6747 1 1 34 ALA HB1 H -5.960 -2.596 -4.069 1.00 . A A . 34 ALA HB1 1 1 6 6748 1 1 34 ALA HB2 H -5.041 -1.193 -4.620 1.00 . A A . 34 ALA HB2 1 1 6 6749 1 1 34 ALA HB3 H -4.794 -2.774 -5.377 1.00 . A A . 34 ALA HB3 1 1 6 6750 1 1 34 ALA N N -2.734 -1.744 -3.602 1.00 . A A . 34 ALA N 1 1 6 6751 1 1 34 ALA O O -3.437 -4.652 -4.573 1.00 . A A . 34 ALA O 1 1 6 6752 1 1 35 PRO C C -1.250 -5.928 -2.206 1.00 . A A . 35 PRO C 1 1 6 6753 1 1 35 PRO CA C -2.073 -4.764 -1.663 1.00 . A A . 35 PRO CA 1 1 6 6754 1 1 35 PRO CB C -2.366 -5.021 -0.189 1.00 . A A . 35 PRO CB 1 1 6 6755 1 1 35 PRO CD C -4.498 -4.891 -1.409 1.00 . A A . 35 PRO CD 1 1 6 6756 1 1 35 PRO CG C -3.878 -5.246 -0.051 1.00 . A A . 35 PRO CG 1 1 6 6757 1 1 35 PRO HA H -1.505 -3.843 -1.791 1.00 . A A . 35 PRO HA 1 1 6 6758 1 1 35 PRO HB2 H -1.811 -5.887 0.169 1.00 . A A . 35 PRO HB2 1 1 6 6759 1 1 35 PRO HB3 H -2.054 -4.147 0.380 1.00 . A A . 35 PRO HB3 1 1 6 6760 1 1 35 PRO HD2 H -5.100 -5.694 -1.832 1.00 . A A . 35 PRO HD2 1 1 6 6761 1 1 35 PRO HD3 H -5.128 -4.005 -1.330 1.00 . A A . 35 PRO HD3 1 1 6 6762 1 1 35 PRO HG2 H -4.082 -6.283 0.219 1.00 . A A . 35 PRO HG2 1 1 6 6763 1 1 35 PRO HG3 H -4.283 -4.623 0.747 1.00 . A A . 35 PRO HG3 1 1 6 6764 1 1 35 PRO N N -3.373 -4.611 -2.286 1.00 . A A . 35 PRO N 1 1 6 6765 1 1 35 PRO O O -1.764 -6.936 -2.677 1.00 . A A . 35 PRO O 1 1 6 6766 1 1 36 ILE C C 0.276 -7.976 -1.104 1.00 . A A . 36 ILE C 1 1 6 6767 1 1 36 ILE CA C 1.003 -6.770 -1.739 1.00 . A A . 36 ILE CA 1 1 6 6768 1 1 36 ILE CB C 2.084 -6.206 -0.813 1.00 . A A . 36 ILE CB 1 1 6 6769 1 1 36 ILE CD1 C 3.196 -7.376 1.142 1.00 . A A . 36 ILE CD1 1 1 6 6770 1 1 36 ILE CG1 C 3.067 -7.291 -0.370 1.00 . A A . 36 ILE CG1 1 1 6 6771 1 1 36 ILE CG2 C 1.471 -5.460 0.373 1.00 . A A . 36 ILE CG2 1 1 6 6772 1 1 36 ILE H H 0.395 -4.760 -2.211 1.00 . A A . 36 ILE H 1 1 6 6773 1 1 36 ILE HA H 1.470 -7.067 -2.668 1.00 . A A . 36 ILE HA 1 1 6 6774 1 1 36 ILE HB H 2.656 -5.479 -1.385 1.00 . A A . 36 ILE HB 1 1 6 6775 1 1 36 ILE HD11 H 3.265 -6.378 1.572 1.00 . A A . 36 ILE HD11 1 1 6 6776 1 1 36 ILE HD12 H 2.322 -7.877 1.558 1.00 . A A . 36 ILE HD12 1 1 6 6777 1 1 36 ILE HD13 H 4.085 -7.943 1.412 1.00 . A A . 36 ILE HD13 1 1 6 6778 1 1 36 ILE HG12 H 2.747 -8.265 -0.727 1.00 . A A . 36 ILE HG12 1 1 6 6779 1 1 36 ILE HG13 H 4.045 -7.103 -0.813 1.00 . A A . 36 ILE HG13 1 1 6 6780 1 1 36 ILE HG21 H 0.589 -4.897 0.073 1.00 . A A . 36 ILE HG21 1 1 6 6781 1 1 36 ILE HG22 H 1.190 -6.160 1.160 1.00 . A A . 36 ILE HG22 1 1 6 6782 1 1 36 ILE HG23 H 2.188 -4.754 0.793 1.00 . A A . 36 ILE HG23 1 1 6 6783 1 1 36 ILE N N 0.073 -5.701 -2.091 1.00 . A A . 36 ILE N 1 1 6 6784 1 1 36 ILE O O -0.640 -7.815 -0.308 1.00 . A A . 36 ILE O 1 1 6 6785 1 1 37 PRO C C 0.185 -10.402 0.689 1.00 . A A . 37 PRO C 1 1 6 6786 1 1 37 PRO CA C 0.352 -10.434 -0.837 1.00 . A A . 37 PRO CA 1 1 6 6787 1 1 37 PRO CB C 1.487 -11.387 -1.211 1.00 . A A . 37 PRO CB 1 1 6 6788 1 1 37 PRO CD C 1.619 -9.404 -2.644 1.00 . A A . 37 PRO CD 1 1 6 6789 1 1 37 PRO CG C 2.084 -10.857 -2.520 1.00 . A A . 37 PRO CG 1 1 6 6790 1 1 37 PRO HA H -0.584 -10.794 -1.265 1.00 . A A . 37 PRO HA 1 1 6 6791 1 1 37 PRO HB2 H 2.246 -11.369 -0.428 1.00 . A A . 37 PRO HB2 1 1 6 6792 1 1 37 PRO HB3 H 1.129 -12.410 -1.297 1.00 . A A . 37 PRO HB3 1 1 6 6793 1 1 37 PRO HD2 H 2.484 -8.744 -2.618 1.00 . A A . 37 PRO HD2 1 1 6 6794 1 1 37 PRO HD3 H 1.082 -9.239 -3.578 1.00 . A A . 37 PRO HD3 1 1 6 6795 1 1 37 PRO HG2 H 3.173 -10.912 -2.497 1.00 . A A . 37 PRO HG2 1 1 6 6796 1 1 37 PRO HG3 H 1.738 -11.447 -3.369 1.00 . A A . 37 PRO HG3 1 1 6 6797 1 1 37 PRO N N 0.722 -9.194 -1.508 1.00 . A A . 37 PRO N 1 1 6 6798 1 1 37 PRO O O -0.048 -9.371 1.307 1.00 . A A . 37 PRO O 1 1 6 6799 1 1 38 HIS C C -0.757 -10.803 3.312 1.00 . A A . 38 HIS C 1 1 6 6800 1 1 38 HIS CA C -0.122 -11.976 2.564 1.00 . A A . 38 HIS CA 1 1 6 6801 1 1 38 HIS CB C 0.975 -12.721 3.343 1.00 . A A . 38 HIS CB 1 1 6 6802 1 1 38 HIS CD2 C 2.704 -10.906 2.786 1.00 . A A . 38 HIS CD2 1 1 6 6803 1 1 38 HIS CE1 C 4.367 -11.466 4.150 1.00 . A A . 38 HIS CE1 1 1 6 6804 1 1 38 HIS CG C 2.295 -12.002 3.450 1.00 . A A . 38 HIS CG 1 1 6 6805 1 1 38 HIS H H 0.786 -12.337 0.683 1.00 . A A . 38 HIS H 1 1 6 6806 1 1 38 HIS HA H -0.929 -12.664 2.431 1.00 . A A . 38 HIS HA 1 1 6 6807 1 1 38 HIS HB2 H 0.582 -12.909 4.348 1.00 . A A . 38 HIS HB2 1 1 6 6808 1 1 38 HIS HB3 H 1.146 -13.691 2.865 1.00 . A A . 38 HIS HB3 1 1 6 6809 1 1 38 HIS HD1 H 3.388 -13.160 4.969 1.00 . A A . 38 HIS HD1 1 1 6 6810 1 1 38 HIS HD2 H 2.143 -10.369 2.053 1.00 . A A . 38 HIS HD2 1 1 6 6811 1 1 38 HIS HE1 H 5.265 -11.406 4.755 1.00 . A A . 38 HIS HE1 1 1 6 6812 1 1 38 HIS N N 0.335 -11.631 1.229 1.00 . A A . 38 HIS N 1 1 6 6813 1 1 38 HIS ND1 N 3.401 -12.381 4.342 1.00 . A A . 38 HIS ND1 1 1 6 6814 1 1 38 HIS NE2 N 4.059 -10.544 3.227 1.00 . A A . 38 HIS NE2 1 1 6 6815 1 1 38 HIS O O -1.877 -10.379 3.057 1.00 . A A . 38 HIS O 1 1 6 6816 1 1 39 GLU C C -0.953 -8.686 5.695 1.00 . A A . 39 GLU C 1 1 6 6817 1 1 39 GLU CA C -0.366 -10.078 5.612 1.00 . A A . 39 GLU CA 1 1 6 6818 1 1 39 GLU CB C 0.859 -9.916 6.494 1.00 . A A . 39 GLU CB 1 1 6 6819 1 1 39 GLU CD C 2.016 -11.702 7.831 1.00 . A A . 39 GLU CD 1 1 6 6820 1 1 39 GLU CG C 1.824 -11.091 6.441 1.00 . A A . 39 GLU CG 1 1 6 6821 1 1 39 GLU H H 0.995 -10.507 3.940 1.00 . A A . 39 GLU H 1 1 6 6822 1 1 39 GLU HA H -1.041 -10.867 5.929 1.00 . A A . 39 GLU HA 1 1 6 6823 1 1 39 GLU HB2 H 1.403 -9.070 6.091 1.00 . A A . 39 GLU HB2 1 1 6 6824 1 1 39 GLU HB3 H 0.535 -9.633 7.502 1.00 . A A . 39 GLU HB3 1 1 6 6825 1 1 39 GLU HG2 H 1.443 -11.835 5.757 1.00 . A A . 39 GLU HG2 1 1 6 6826 1 1 39 GLU HG3 H 2.784 -10.769 6.035 1.00 . A A . 39 GLU HG3 1 1 6 6827 1 1 39 GLU N N 0.067 -10.346 4.250 1.00 . A A . 39 GLU N 1 1 6 6828 1 1 39 GLU O O -0.254 -7.751 5.362 1.00 . A A . 39 GLU O 1 1 6 6829 1 1 39 GLU OE1 O 1.178 -12.503 8.241 1.00 . A A . 39 GLU OE1 1 1 6 6830 1 1 39 GLU OE2 O 3.002 -11.369 8.487 1.00 . A A . 39 GLU OE2 1 1 6 6831 1 1 40 PRO C C -2.213 -6.106 6.896 1.00 . A A . 40 PRO C 1 1 6 6832 1 1 40 PRO CA C -2.936 -7.297 6.205 1.00 . A A . 40 PRO CA 1 1 6 6833 1 1 40 PRO CB C -4.230 -7.604 6.967 1.00 . A A . 40 PRO CB 1 1 6 6834 1 1 40 PRO CD C -2.910 -9.682 6.797 1.00 . A A . 40 PRO CD 1 1 6 6835 1 1 40 PRO CG C -4.231 -9.101 7.304 1.00 . A A . 40 PRO CG 1 1 6 6836 1 1 40 PRO HA H -3.211 -7.035 5.184 1.00 . A A . 40 PRO HA 1 1 6 6837 1 1 40 PRO HB2 H -4.292 -7.011 7.879 1.00 . A A . 40 PRO HB2 1 1 6 6838 1 1 40 PRO HB3 H -5.096 -7.352 6.356 1.00 . A A . 40 PRO HB3 1 1 6 6839 1 1 40 PRO HD2 H -2.321 -10.099 7.614 1.00 . A A . 40 PRO HD2 1 1 6 6840 1 1 40 PRO HD3 H -3.076 -10.462 6.054 1.00 . A A . 40 PRO HD3 1 1 6 6841 1 1 40 PRO HG2 H -4.328 -9.250 8.380 1.00 . A A . 40 PRO HG2 1 1 6 6842 1 1 40 PRO HG3 H -5.075 -9.599 6.825 1.00 . A A . 40 PRO HG3 1 1 6 6843 1 1 40 PRO N N -2.203 -8.566 6.195 1.00 . A A . 40 PRO N 1 1 6 6844 1 1 40 PRO O O -2.575 -5.715 7.999 1.00 . A A . 40 PRO O 1 1 6 6845 1 1 41 HIS C C -0.173 -3.311 5.582 1.00 . A A . 41 HIS C 1 1 6 6846 1 1 41 HIS CA C -0.613 -4.292 6.689 1.00 . A A . 41 HIS CA 1 1 6 6847 1 1 41 HIS CB C 0.689 -4.576 7.410 1.00 . A A . 41 HIS CB 1 1 6 6848 1 1 41 HIS CD2 C 2.418 -4.824 5.555 1.00 . A A . 41 HIS CD2 1 1 6 6849 1 1 41 HIS CE1 C 2.505 -7.051 5.353 1.00 . A A . 41 HIS CE1 1 1 6 6850 1 1 41 HIS CG C 1.626 -5.334 6.511 1.00 . A A . 41 HIS CG 1 1 6 6851 1 1 41 HIS H H -0.635 -6.131 5.615 1.00 . A A . 41 HIS H 1 1 6 6852 1 1 41 HIS HA H -1.351 -3.817 7.336 1.00 . A A . 41 HIS HA 1 1 6 6853 1 1 41 HIS HB2 H 1.097 -3.587 7.593 1.00 . A A . 41 HIS HB2 1 1 6 6854 1 1 41 HIS HB3 H 0.534 -5.099 8.355 1.00 . A A . 41 HIS HB3 1 1 6 6855 1 1 41 HIS HD1 H 1.451 -7.423 7.158 1.00 . A A . 41 HIS HD1 1 1 6 6856 1 1 41 HIS HD2 H 2.593 -3.778 5.391 1.00 . A A . 41 HIS HD2 1 1 6 6857 1 1 41 HIS HE1 H 2.377 -7.975 4.791 1.00 . A A . 41 HIS HE1 1 1 6 6858 1 1 41 HIS N N -1.186 -5.551 6.207 1.00 . A A . 41 HIS N 1 1 6 6859 1 1 41 HIS ND1 N 1.801 -6.787 6.469 1.00 . A A . 41 HIS ND1 1 1 6 6860 1 1 41 HIS NE2 N 2.992 -5.935 4.779 1.00 . A A . 41 HIS NE2 1 1 6 6861 1 1 41 HIS O O 0.680 -2.458 5.792 1.00 . A A . 41 HIS O 1 1 6 6862 1 1 42 ARG C C 0.543 -2.980 2.365 1.00 . A A . 42 ARG C 1 1 6 6863 1 1 42 ARG CA C -0.060 -4.019 3.281 1.00 . A A . 42 ARG CA 1 1 6 6864 1 1 42 ARG CB C -1.001 -4.973 2.542 1.00 . A A . 42 ARG CB 1 1 6 6865 1 1 42 ARG CD C -1.470 -7.419 2.687 1.00 . A A . 42 ARG CD 1 1 6 6866 1 1 42 ARG CG C -1.277 -6.119 3.449 1.00 . A A . 42 ARG CG 1 1 6 6867 1 1 42 ARG CZ C -3.571 -8.374 2.029 1.00 . A A . 42 ARG CZ 1 1 6 6868 1 1 42 ARG H H -1.775 -3.553 4.548 1.00 . A A . 42 ARG H 1 1 6 6869 1 1 42 ARG HA H 0.763 -4.559 3.693 1.00 . A A . 42 ARG HA 1 1 6 6870 1 1 42 ARG HB2 H -1.938 -4.466 2.316 1.00 . A A . 42 ARG HB2 1 1 6 6871 1 1 42 ARG HB3 H -0.565 -5.357 1.624 1.00 . A A . 42 ARG HB3 1 1 6 6872 1 1 42 ARG HD2 H -1.455 -7.262 1.611 1.00 . A A . 42 ARG HD2 1 1 6 6873 1 1 42 ARG HD3 H -0.688 -8.127 2.942 1.00 . A A . 42 ARG HD3 1 1 6 6874 1 1 42 ARG HE H -3.018 -8.132 3.984 1.00 . A A . 42 ARG HE 1 1 6 6875 1 1 42 ARG HG2 H -0.383 -6.145 4.058 1.00 . A A . 42 ARG HG2 1 1 6 6876 1 1 42 ARG HG3 H -2.135 -5.869 4.065 1.00 . A A . 42 ARG HG3 1 1 6 6877 1 1 42 ARG HH11 H -2.709 -8.516 0.203 1.00 . A A . 42 ARG HH11 1 1 6 6878 1 1 42 ARG HH12 H -3.105 -10.025 0.955 1.00 . A A . 42 ARG HH12 1 1 6 6879 1 1 42 ARG HH21 H -5.353 -8.156 2.966 1.00 . A A . 42 ARG HH21 1 1 6 6880 1 1 42 ARG HH22 H -5.358 -7.799 1.271 1.00 . A A . 42 ARG HH22 1 1 6 6881 1 1 42 ARG N N -0.794 -3.482 4.418 1.00 . A A . 42 ARG N 1 1 6 6882 1 1 42 ARG NE N -2.750 -8.007 3.029 1.00 . A A . 42 ARG NE 1 1 6 6883 1 1 42 ARG NH1 N -3.088 -9.026 0.975 1.00 . A A . 42 ARG NH1 1 1 6 6884 1 1 42 ARG NH2 N -4.868 -8.086 2.094 1.00 . A A . 42 ARG NH2 1 1 6 6885 1 1 42 ARG O O 1.712 -2.616 2.399 1.00 . A A . 42 ARG O 1 1 6 6886 1 1 43 CYS C C 1.232 -1.636 0.018 1.00 . A A . 43 CYS C 1 1 6 6887 1 1 43 CYS CA C -0.230 -1.983 0.265 1.00 . A A . 43 CYS CA 1 1 6 6888 1 1 43 CYS CB C -1.119 -0.764 0.196 1.00 . A A . 43 CYS CB 1 1 6 6889 1 1 43 CYS H H -1.262 -2.595 2.051 1.00 . A A . 43 CYS H 1 1 6 6890 1 1 43 CYS HA H -0.508 -2.748 -0.461 1.00 . A A . 43 CYS HA 1 1 6 6891 1 1 43 CYS HB2 H -0.486 0.118 0.092 1.00 . A A . 43 CYS HB2 1 1 6 6892 1 1 43 CYS HB3 H -1.716 -0.916 -0.685 1.00 . A A . 43 CYS HB3 1 1 6 6893 1 1 43 CYS N N -0.410 -2.568 1.553 1.00 . A A . 43 CYS N 1 1 6 6894 1 1 43 CYS O O 1.843 -0.823 0.700 1.00 . A A . 43 CYS O 1 1 6 6895 1 1 43 CYS SG S -2.306 -0.542 1.546 1.00 . A A . 43 CYS SG 1 1 6 6896 1 1 44 GLN C C 3.136 -2.085 -2.960 1.00 . A A . 44 GLN C 1 1 6 6897 1 1 44 GLN CA C 3.070 -2.012 -1.447 1.00 . A A . 44 GLN CA 1 1 6 6898 1 1 44 GLN CB C 4.075 -2.973 -0.843 1.00 . A A . 44 GLN CB 1 1 6 6899 1 1 44 GLN CD C 6.282 -3.539 -1.882 1.00 . A A . 44 GLN CD 1 1 6 6900 1 1 44 GLN CG C 5.518 -2.511 -1.044 1.00 . A A . 44 GLN CG 1 1 6 6901 1 1 44 GLN H H 1.127 -2.872 -1.596 1.00 . A A . 44 GLN H 1 1 6 6902 1 1 44 GLN HA H 3.247 -0.995 -1.108 1.00 . A A . 44 GLN HA 1 1 6 6903 1 1 44 GLN HB2 H 3.863 -3.071 0.213 1.00 . A A . 44 GLN HB2 1 1 6 6904 1 1 44 GLN HB3 H 3.930 -3.949 -1.292 1.00 . A A . 44 GLN HB3 1 1 6 6905 1 1 44 GLN HE21 H 6.444 -4.938 -0.412 1.00 . A A . 44 GLN HE21 1 1 6 6906 1 1 44 GLN HE22 H 5.929 -5.540 -1.977 1.00 . A A . 44 GLN HE22 1 1 6 6907 1 1 44 GLN HG2 H 5.546 -1.547 -1.553 1.00 . A A . 44 GLN HG2 1 1 6 6908 1 1 44 GLN HG3 H 6.020 -2.394 -0.083 1.00 . A A . 44 GLN HG3 1 1 6 6909 1 1 44 GLN N N 1.731 -2.318 -1.024 1.00 . A A . 44 GLN N 1 1 6 6910 1 1 44 GLN NE2 N 6.213 -4.784 -1.378 1.00 . A A . 44 GLN NE2 1 1 6 6911 1 1 44 GLN O O 2.969 -3.121 -3.591 1.00 . A A . 44 GLN O 1 1 6 6912 1 1 44 GLN OE1 O 6.882 -3.224 -2.902 1.00 . A A . 44 GLN OE1 1 1 6 6913 1 1 45 MET C C 2.018 -1.395 -5.427 1.00 . A A . 45 MET C 1 1 6 6914 1 1 45 MET CA C 2.464 -0.320 -4.432 1.00 . A A . 45 MET CA 1 1 6 6915 1 1 45 MET CB C 3.097 0.900 -5.115 1.00 . A A . 45 MET CB 1 1 6 6916 1 1 45 MET CE C 2.917 0.151 -9.142 1.00 . A A . 45 MET CE 1 1 6 6917 1 1 45 MET CG C 3.567 0.634 -6.547 1.00 . A A . 45 MET CG 1 1 6 6918 1 1 45 MET H H 4.080 -0.378 -2.938 1.00 . A A . 45 MET H 1 1 6 6919 1 1 45 MET HA H 1.578 -0.029 -3.864 1.00 . A A . 45 MET HA 1 1 6 6920 1 1 45 MET HB2 H 2.383 1.723 -5.119 1.00 . A A . 45 MET HB2 1 1 6 6921 1 1 45 MET HB3 H 3.943 1.241 -4.517 1.00 . A A . 45 MET HB3 1 1 6 6922 1 1 45 MET HE1 H 2.927 -0.901 -8.866 1.00 . A A . 45 MET HE1 1 1 6 6923 1 1 45 MET HE2 H 2.267 0.286 -10.007 1.00 . A A . 45 MET HE2 1 1 6 6924 1 1 45 MET HE3 H 3.930 0.442 -9.423 1.00 . A A . 45 MET HE3 1 1 6 6925 1 1 45 MET HG2 H 4.482 1.190 -6.743 1.00 . A A . 45 MET HG2 1 1 6 6926 1 1 45 MET HG3 H 3.810 -0.417 -6.694 1.00 . A A . 45 MET HG3 1 1 6 6927 1 1 45 MET N N 3.396 -0.880 -3.467 1.00 . A A . 45 MET N 1 1 6 6928 1 1 45 MET O O 2.808 -2.165 -5.961 1.00 . A A . 45 MET O 1 1 6 6929 1 1 45 MET SD S 2.328 1.134 -7.753 1.00 . A A . 45 MET SD 1 1 6 6930 1 1 46 PHE C C 0.798 -2.280 -7.852 1.00 . A A . 46 PHE C 1 1 6 6931 1 1 46 PHE CA C 0.129 -2.417 -6.479 1.00 . A A . 46 PHE CA 1 1 6 6932 1 1 46 PHE CB C -1.394 -2.228 -6.557 1.00 . A A . 46 PHE CB 1 1 6 6933 1 1 46 PHE CD1 C -1.463 -4.200 -8.179 1.00 . A A . 46 PHE CD1 1 1 6 6934 1 1 46 PHE CD2 C -3.216 -2.440 -8.328 1.00 . A A . 46 PHE CD2 1 1 6 6935 1 1 46 PHE CE1 C -2.067 -4.899 -9.283 1.00 . A A . 46 PHE CE1 1 1 6 6936 1 1 46 PHE CE2 C -3.823 -3.137 -9.431 1.00 . A A . 46 PHE CE2 1 1 6 6937 1 1 46 PHE CG C -2.031 -2.967 -7.700 1.00 . A A . 46 PHE CG 1 1 6 6938 1 1 46 PHE CZ C -3.247 -4.366 -9.909 1.00 . A A . 46 PHE CZ 1 1 6 6939 1 1 46 PHE H H 0.102 -0.728 -5.158 1.00 . A A . 46 PHE H 1 1 6 6940 1 1 46 PHE HA H 0.381 -3.377 -6.021 1.00 . A A . 46 PHE HA 1 1 6 6941 1 1 46 PHE HB2 H -1.849 -2.577 -5.631 1.00 . A A . 46 PHE HB2 1 1 6 6942 1 1 46 PHE HB3 H -1.631 -1.168 -6.648 1.00 . A A . 46 PHE HB3 1 1 6 6943 1 1 46 PHE HD1 H -0.583 -4.608 -7.704 1.00 . A A . 46 PHE HD1 1 1 6 6944 1 1 46 PHE HD2 H -3.649 -1.519 -7.970 1.00 . A A . 46 PHE HD2 1 1 6 6945 1 1 46 PHE HE1 H -1.634 -5.822 -9.640 1.00 . A A . 46 PHE HE1 1 1 6 6946 1 1 46 PHE HE2 H -4.709 -2.737 -9.901 1.00 . A A . 46 PHE HE2 1 1 6 6947 1 1 46 PHE HZ H -3.701 -4.888 -10.737 1.00 . A A . 46 PHE HZ 1 1 6 6948 1 1 46 PHE N N 0.686 -1.405 -5.606 1.00 . A A . 46 PHE N 1 1 6 6949 1 1 46 PHE O O 0.784 -1.220 -8.466 1.00 . A A . 46 PHE O 1 1 6 6950 1 1 47 CYS C C 1.956 -5.069 -9.974 1.30 . A A . 47 CYS C 1 1 6 6951 1 1 47 CYS CA C 1.396 -3.670 -9.712 0.80 . A A . 47 CYS CA 1 1 6 6952 1 1 47 CYS CB C 2.255 -2.616 -10.411 0.60 . A A . 47 CYS CB 1 1 6 6953 1 1 47 CYS H H 1.791 -4.057 -7.639 1.00 . A A . 47 CYS H 1 1 6 6954 1 1 47 CYS HA H 0.361 -3.622 -10.050 1.10 . A A . 47 CYS HA 1 1 6 6955 1 1 47 CYS HB2 H 1.788 -1.635 -10.326 0.90 . A A . 47 CYS HB2 1 1 6 6956 1 1 47 CYS HB3 H 3.225 -2.557 -9.920 0.90 . A A . 47 CYS HB3 1 1 6 6957 1 1 47 CYS N N 1.378 -3.414 -8.284 0.60 . A A . 47 CYS N 1 1 6 6958 1 1 47 CYS O O 2.512 -5.718 -9.096 1.90 . A A . 47 CYS O 1 1 6 6959 1 1 47 CYS SG S 2.527 -2.965 -12.162 1.30 . A A . 47 CYS SG 1 1 6 6960 1 1 48 ASN C C 1.879 -7.111 -13.052 1.90 . A A . 48 ASN C 1 1 6 6961 1 1 48 ASN CA C 2.352 -6.751 -11.641 2.30 . A A . 48 ASN CA 1 1 6 6962 1 1 48 ASN CB C 1.955 -7.850 -10.652 3.00 . A A . 48 ASN CB 1 1 6 6963 1 1 48 ASN CG C 0.472 -7.736 -10.287 3.70 . A A . 48 ASN CG 1 1 6 6964 1 1 48 ASN H H 1.249 -4.931 -11.890 2.00 . A A . 48 ASN H 1 1 6 6965 1 1 48 ASN HA H 3.432 -6.606 -11.651 2.70 . A A . 48 ASN HA 1 1 6 6966 1 1 48 ASN HB2 H 2.137 -8.835 -11.083 3.30 . A A . 48 ASN HB2 1 1 6 6967 1 1 48 ASN HB3 H 2.549 -7.777 -9.741 3.20 . A A . 48 ASN HB3 1 1 6 6968 1 1 48 ASN HD21 H 0.065 -6.164 -9.039 1.00 . A A . 48 ASN HD21 1 1 6 6969 1 1 48 ASN N N 1.771 -5.483 -11.240 1.70 . A A . 48 ASN N 1 1 6 6970 1 1 48 ASN ND2 N 0.269 -7.142 -9.098 4.10 . A A . 48 ASN ND2 1 1 6 6971 1 1 48 ASN O O 0.811 -7.676 -13.249 2.30 . A A . 48 ASN O 1 1 6 6972 1 1 48 ASN OD1 O -0.411 -8.153 -11.027 4.40 . A A . 48 ASN OD1 1 1 6 6973 1 1 49 GLN C C 4.093 -7.398 -15.940 1.80 . A A . 49 GLN C 1 1 6 6974 1 1 49 GLN CA C 3.744 -7.697 -14.478 2.00 . A A . 49 GLN CA 1 1 6 6975 1 1 49 GLN CB C 3.216 -9.128 -14.344 2.20 . A A . 49 GLN CB 1 1 6 6976 1 1 49 GLN CD C 3.544 -11.550 -14.881 3.40 . A A . 49 GLN CD 1 1 6 6977 1 1 49 GLN CG C 4.027 -10.127 -15.170 2.70 . A A . 49 GLN CG 1 1 6 6978 1 1 49 GLN H H 2.711 -5.823 -14.401 2.50 . A A . 49 GLN H 1 1 6 6979 1 1 49 GLN HA H 4.628 -7.547 -13.859 2.50 . A A . 49 GLN HA 1 1 6 6980 1 1 49 GLN HB2 H 3.234 -9.425 -13.296 2.60 . A A . 49 GLN HB2 1 1 6 6981 1 1 49 GLN HB3 H 2.172 -9.161 -14.657 2.10 . A A . 49 GLN HB3 1 1 6 6982 1 1 49 GLN HE21 H 1.745 -10.940 -14.151 4.10 . A A . 49 GLN HE21 1 1 6 6983 1 1 49 GLN HE22 H 1.705 -12.380 -15.151 4.50 . A A . 49 GLN HE22 1 1 6 6984 1 1 49 GLN HG2 H 3.918 -9.925 -16.235 2.70 . A A . 49 GLN HG2 1 1 6 6985 1 1 49 GLN HG3 H 5.087 -10.057 -14.925 2.80 . A A . 49 GLN HG3 1 1 6 6986 1 1 49 GLN N N 2.750 -6.744 -14.013 2.00 . A A . 49 GLN N 1 1 6 6987 1 1 49 GLN NE2 N 2.212 -11.631 -14.713 4.00 . A A . 49 GLN NE2 1 1 6 6988 1 1 49 GLN O O 3.252 -7.462 -16.828 2.20 . A A . 49 GLN O 1 1 6 6989 1 1 49 GLN OE1 O 4.319 -12.497 -14.817 3.70 . A A . 49 GLN OE1 1 1 6 6990 1 1 50 THR C C 5.811 -4.643 -16.132 1.50 . A A . 50 THR C 1 1 6 6991 1 1 50 THR CA C 5.724 -5.933 -16.963 1.80 . A A . 50 THR CA 1 1 6 6992 1 1 50 THR CB C 4.705 -5.779 -18.096 1.90 . A A . 50 THR CB 1 1 6 6993 1 1 50 THR CG2 C 3.439 -5.043 -17.655 2.30 . A A . 50 THR CG2 1 1 6 6994 1 1 50 THR H H 6.108 -7.600 -15.673 2.00 . A A . 50 THR H 1 1 6 6995 1 1 50 THR HA H 6.711 -6.148 -17.372 2.10 . A A . 50 THR HA 1 1 6 6996 1 1 50 THR HB H 4.441 -6.762 -18.484 2.20 . A A . 50 THR HB 1 1 6 6997 1 1 50 THR HG1 H 5.705 -4.301 -18.770 2.50 . A A . 50 THR HG1 1 1 6 6998 1 1 50 THR HG21 H 2.600 -5.294 -18.304 2.40 . A A . 50 THR HG21 1 1 6 6999 1 1 50 THR HG22 H 3.584 -3.963 -17.699 2.60 . A A . 50 THR HG22 1 1 6 7000 1 1 50 THR HG23 H 3.162 -5.303 -16.634 2.80 . A A . 50 THR HG23 1 1 6 7001 1 1 50 THR N N 5.387 -7.071 -16.120 1.70 . A A . 50 THR N 1 1 6 7002 1 1 50 THR O O 6.672 -3.798 -16.347 2.20 . A A . 50 THR O 1 1 6 7003 1 1 50 THR OG1 O 5.301 -5.069 -19.152 2.20 . A A . 50 THR OG1 1 1 6 7004 1 1 51 ALA C C 4.332 -2.243 -15.829 0.60 . A A . 51 ALA C 1 1 6 7005 1 1 51 ALA CA C 4.420 -3.262 -14.703 0.60 . A A . 51 ALA CA 1 1 6 7006 1 1 51 ALA CB C 5.312 -2.740 -13.577 0.70 . A A . 51 ALA CB 1 1 6 7007 1 1 51 ALA H H 4.511 -5.394 -14.756 0.90 . A A . 51 ALA H 1 1 6 7008 1 1 51 ALA HA H 3.405 -3.405 -14.348 0.70 . A A . 51 ALA HA 1 1 6 7009 1 1 51 ALA HB1 H 4.843 -1.886 -13.085 1.20 . A A . 51 ALA HB1 1 1 6 7010 1 1 51 ALA HB2 H 6.279 -2.416 -13.961 1.00 . A A . 51 ALA HB2 1 1 6 7011 1 1 51 ALA HB3 H 5.480 -3.508 -12.823 1.30 . A A . 51 ALA HB3 1 1 6 7012 1 1 51 ALA N N 4.871 -4.559 -15.173 0.80 . A A . 51 ALA N 1 1 6 7013 1 1 51 ALA O O 4.935 -2.355 -16.889 1.10 . A A . 51 ALA O 1 1 6 7014 1 1 52 CYS C C 1.402 -0.941 -16.706 0.80 . A A . 52 CYS C 1 1 6 7015 1 1 52 CYS CA C 2.090 -1.505 -15.456 0.80 . A A . 52 CYS CA 1 1 6 7016 1 1 52 CYS CB C 1.485 -0.950 -14.167 0.90 . A A . 52 CYS CB 1 1 6 7017 1 1 52 CYS H H 3.878 -0.441 -15.010 0.90 . A A . 52 CYS H 1 1 6 7018 1 1 52 CYS HA H 1.986 -2.590 -15.477 0.80 . A A . 52 CYS HA 1 1 6 7019 1 1 52 CYS HB2 H 2.240 -0.382 -13.624 1.10 . A A . 52 CYS HB2 1 1 6 7020 1 1 52 CYS HB3 H 0.678 -0.260 -14.404 1.00 . A A . 52 CYS HB3 1 1 6 7021 1 1 52 CYS N N 3.512 -1.239 -15.482 0.70 . A A . 52 CYS N 1 1 6 7022 1 1 52 CYS O O 0.781 -1.674 -17.465 1.20 . A A . 52 CYS O 1 1 6 7023 1 1 52 CYS SG S 0.848 -2.247 -13.073 1.00 . A A . 52 CYS SG 1 1 6 7024 1 1 53 PRO C C 3.036 1.774 -15.469 0.80 . A A . 53 PRO C 1 1 6 7025 1 1 53 PRO CA C 2.789 1.122 -16.832 0.70 . A A . 53 PRO CA 1 1 6 7026 1 1 53 PRO CB C 2.628 2.250 -17.853 0.90 . A A . 53 PRO CB 1 1 6 7027 1 1 53 PRO CD C 0.446 1.171 -17.476 0.80 . A A . 53 PRO CD 1 1 6 7028 1 1 53 PRO CG C 1.127 2.369 -18.143 0.90 . A A . 53 PRO CG 1 1 6 7029 1 1 53 PRO HA H 3.628 0.477 -17.094 0.80 . A A . 53 PRO HA 1 1 6 7030 1 1 53 PRO HB2 H 3.017 3.192 -17.468 1.00 . A A . 53 PRO HB2 1 1 6 7031 1 1 53 PRO HB3 H 3.174 2.019 -18.767 1.10 . A A . 53 PRO HB3 1 1 6 7032 1 1 53 PRO HD2 H -0.246 1.488 -16.696 0.80 . A A . 53 PRO HD2 1 1 6 7033 1 1 53 PRO HD3 H -0.098 0.566 -18.201 0.90 . A A . 53 PRO HD3 1 1 6 7034 1 1 53 PRO HG2 H 0.739 3.302 -17.737 0.90 . A A . 53 PRO HG2 1 1 6 7035 1 1 53 PRO HG3 H 0.950 2.368 -19.218 1.00 . A A . 53 PRO HG3 1 1 6 7036 1 1 53 PRO N N 1.529 0.394 -16.896 0.60 . A A . 53 PRO N 1 1 6 7037 1 1 53 PRO O O 2.302 1.584 -14.507 1.60 . A A . 53 PRO O 1 1 6 7038 1 1 54 ALA C C 2.641 4.565 -15.539 0.90 . A A . 54 ALA C 1 1 6 7039 1 1 54 ALA CA C 4.044 4.001 -15.256 0.80 . A A . 54 ALA CA 1 1 6 7040 1 1 54 ALA CB C 5.112 4.688 -16.113 0.80 . A A . 54 ALA CB 1 1 6 7041 1 1 54 ALA H H 5.003 2.153 -15.725 1.40 . A A . 54 ALA H 1 1 6 7042 1 1 54 ALA HA H 4.255 4.180 -14.208 0.70 . A A . 54 ALA HA 1 1 6 7043 1 1 54 ALA HB1 H 5.464 5.602 -15.635 1.20 . A A . 54 ALA HB1 1 1 6 7044 1 1 54 ALA HB2 H 4.713 4.952 -17.092 1.40 . A A . 54 ALA HB2 1 1 6 7045 1 1 54 ALA HB3 H 5.971 4.034 -16.263 1.30 . A A . 54 ALA HB3 1 1 6 7046 1 1 54 ALA N N 4.126 2.562 -15.475 0.80 . A A . 54 ALA N 1 1 6 7047 1 1 54 ALA O O 1.622 3.895 -15.429 1.50 . A A . 54 ALA O 1 1 6 7048 1 1 55 ASP C C 0.994 6.678 -14.359 1.10 . A A . 55 ASP C 1 1 6 7049 1 1 55 ASP CA C 1.514 6.697 -15.794 1.20 . A A . 55 ASP CA 1 1 6 7050 1 1 55 ASP CB C 0.524 6.191 -16.824 1.40 . A A . 55 ASP CB 1 1 6 7051 1 1 55 ASP CG C -0.914 6.549 -16.445 2.10 . A A . 55 ASP CG 1 1 6 7052 1 1 55 ASP H H 3.477 6.209 -16.376 1.40 . A A . 55 ASP H 1 1 6 7053 1 1 55 ASP HA H 1.842 7.707 -16.039 1.30 . A A . 55 ASP HA 1 1 6 7054 1 1 55 ASP HB2 H 0.782 6.621 -17.790 1.50 . A A . 55 ASP HB2 1 1 6 7055 1 1 55 ASP HB3 H 0.643 5.114 -16.915 1.80 . A A . 55 ASP HB3 1 1 6 7056 1 1 55 ASP N N 2.681 5.859 -15.900 1.00 . A A . 55 ASP N 1 1 6 7057 1 1 55 ASP O O -0.089 6.197 -14.045 1.50 . A A . 55 ASP O 1 1 6 7058 1 1 55 ASP OD1 O -1.186 7.728 -16.227 2.80 . A A . 55 ASP OD1 1 1 6 7059 1 1 55 ASP OD2 O -1.745 5.645 -16.373 2.60 . A A . 55 ASP OD2 1 1 6 7060 1 1 56 CYS C C 0.414 9.252 -13.328 0.80 . A A . 56 CYS C 1 1 6 7061 1 1 56 CYS CA C 1.654 8.495 -12.850 0.80 . A A . 56 CYS CA 1 1 6 7062 1 1 56 CYS CB C 2.914 9.310 -13.100 0.90 . A A . 56 CYS CB 1 1 6 7063 1 1 56 CYS H H 2.859 7.044 -13.518 1.10 . A A . 56 CYS H 1 1 6 7064 1 1 56 CYS HA H 1.541 8.279 -11.790 0.70 . A A . 56 CYS HA 1 1 6 7065 1 1 56 CYS HB2 H 2.809 9.888 -14.022 1.00 . A A . 56 CYS HB2 1 1 6 7066 1 1 56 CYS HB3 H 3.028 9.981 -12.265 0.90 . A A . 56 CYS HB3 1 1 6 7067 1 1 56 CYS N N 1.881 7.247 -13.526 0.90 . A A . 56 CYS N 1 1 6 7068 1 1 56 CYS O O -0.350 8.835 -14.190 1.10 . A A . 56 CYS O 1 1 6 7069 1 1 56 CYS SG S 4.428 8.318 -13.189 1.30 . A A . 56 CYS SG 1 1 6 7070 1 1 57 ASP C C -1.729 11.566 -11.981 0.90 . A A . 57 ASP C 1 1 6 7071 1 1 57 ASP CA C -0.672 10.526 -11.601 1.00 . A A . 57 ASP CA 1 1 6 7072 1 1 57 ASP CB C 0.072 10.958 -10.340 1.10 . A A . 57 ASP CB 1 1 6 7073 1 1 57 ASP CG C -0.283 10.039 -9.171 1.60 . A A . 57 ASP CG 1 1 6 7074 1 1 57 ASP H H 0.999 11.117 -12.752 1.10 . A A . 57 ASP H 1 1 6 7075 1 1 57 ASP HA H -1.136 9.547 -11.485 1.20 . A A . 57 ASP HA 1 1 6 7076 1 1 57 ASP HB2 H 1.150 10.917 -10.504 1.20 . A A . 57 ASP HB2 1 1 6 7077 1 1 57 ASP HB3 H -0.178 11.987 -10.090 1.10 . A A . 57 ASP HB3 1 1 6 7078 1 1 57 ASP N N 0.295 10.414 -12.668 0.80 . A A . 57 ASP N 1 1 6 7079 1 1 57 ASP O O -1.540 12.387 -12.870 1.00 . A A . 57 ASP O 1 1 6 7080 1 1 57 ASP OD1 O -0.297 8.824 -9.362 2.20 . A A . 57 ASP OD1 1 1 6 7081 1 1 57 ASP OD2 O -0.541 10.548 -8.082 2.00 . A A . 57 ASP OD2 1 1 6 7082 1 1 58 PRO C C -4.112 13.523 -11.975 1.20 . A A . 58 PRO C 1 1 6 7083 1 1 58 PRO CA C -4.132 12.009 -11.715 1.20 . A A . 58 PRO CA 1 1 6 7084 1 1 58 PRO CB C -5.135 11.676 -10.607 1.40 . A A . 58 PRO CB 1 1 6 7085 1 1 58 PRO CD C -2.908 10.842 -9.945 1.30 . A A . 58 PRO CD 1 1 6 7086 1 1 58 PRO CG C -4.375 10.911 -9.514 1.50 . A A . 58 PRO CG 1 1 6 7087 1 1 58 PRO HA H -4.412 11.505 -12.639 1.30 . A A . 58 PRO HA 1 1 6 7088 1 1 58 PRO HB2 H -5.574 12.588 -10.201 1.50 . A A . 58 PRO HB2 1 1 6 7089 1 1 58 PRO HB3 H -5.948 11.067 -11.002 1.70 . A A . 58 PRO HB3 1 1 6 7090 1 1 58 PRO HD2 H -2.267 11.381 -9.246 1.30 . A A . 58 PRO HD2 1 1 6 7091 1 1 58 PRO HD3 H -2.560 9.811 -10.017 1.40 . A A . 58 PRO HD3 1 1 6 7092 1 1 58 PRO HG2 H -4.469 11.420 -8.555 1.50 . A A . 58 PRO HG2 1 1 6 7093 1 1 58 PRO HG3 H -4.782 9.907 -9.396 1.70 . A A . 58 PRO HG3 1 1 6 7094 1 1 58 PRO N N -2.860 11.477 -11.251 1.00 . A A . 58 PRO N 1 1 6 7095 1 1 58 PRO O O -4.908 14.045 -12.746 1.50 . A A . 58 PRO O 1 1 6 7096 1 1 59 ASN C C -2.129 16.064 -12.419 1.30 . A A . 59 ASN C 1 1 6 7097 1 1 59 ASN CA C -3.146 15.635 -11.378 1.30 . A A . 59 ASN CA 1 1 6 7098 1 1 59 ASN CB C -2.787 16.219 -10.011 1.50 . A A . 59 ASN CB 1 1 6 7099 1 1 59 ASN CG C -2.747 17.744 -10.093 1.90 . A A . 59 ASN CG 1 1 6 7100 1 1 59 ASN H H -2.450 13.729 -10.765 1.10 . A A . 59 ASN H 1 1 6 7101 1 1 59 ASN HA H -4.119 15.940 -11.703 1.50 . A A . 59 ASN HA 1 1 6 7102 1 1 59 ASN HB2 H -3.518 15.920 -9.255 1.70 . A A . 59 ASN HB2 1 1 6 7103 1 1 59 ASN HB3 H -1.797 15.869 -9.709 1.70 . A A . 59 ASN HB3 1 1 6 7104 1 1 59 ASN HD21 H -1.057 17.500 -11.157 2.10 . A A . 59 ASN HD21 1 1 6 7105 1 1 59 ASN HD22 H -1.410 19.165 -10.707 2.50 . A A . 59 ASN HD22 1 1 6 7106 1 1 59 ASN N N -3.163 14.192 -11.291 1.10 . A A . 59 ASN N 1 1 6 7107 1 1 59 ASN ND2 N -1.638 18.186 -10.706 2.00 . A A . 59 ASN ND2 1 1 6 7108 1 1 59 ASN O O -2.408 16.660 -13.452 1.70 . A A . 59 ASN O 1 1 6 7109 1 1 59 ASN OD1 O -3.640 18.449 -9.640 2.70 . A A . 59 ASN OD1 1 1 6 7110 1 1 60 THR C C 1.073 15.360 -13.471 0.90 . A A . 60 THR C 1 1 6 7111 1 1 60 THR CA C 0.273 16.299 -12.545 1.20 . A A . 60 THR CA 1 1 6 7112 1 1 60 THR CB C 1.162 16.781 -11.417 1.40 . A A . 60 THR CB 1 1 6 7113 1 1 60 THR CG2 C 1.682 15.572 -10.680 1.40 . A A . 60 THR CG2 1 1 6 7114 1 1 60 THR H H -1.043 15.144 -11.172 1.00 . A A . 60 THR H 1 1 6 7115 1 1 60 THR HA H -0.052 17.162 -13.091 1.40 . A A . 60 THR HA 1 1 6 7116 1 1 60 THR HB H 0.604 17.425 -10.738 1.90 . A A . 60 THR HB 1 1 6 7117 1 1 60 THR HG1 H 2.036 17.681 -12.851 2.30 . A A . 60 THR HG1 1 1 6 7118 1 1 60 THR HG21 H 0.891 14.823 -10.636 1.90 . A A . 60 THR HG21 1 1 6 7119 1 1 60 THR HG22 H 1.982 15.845 -9.673 1.80 . A A . 60 THR HG22 1 1 6 7120 1 1 60 THR HG23 H 2.527 15.154 -11.225 1.70 . A A . 60 THR HG23 1 1 6 7121 1 1 60 THR N N -0.928 15.683 -12.002 1.10 . A A . 60 THR N 1 1 6 7122 1 1 60 THR O O 2.238 15.605 -13.762 1.10 . A A . 60 THR O 1 1 6 7123 1 1 60 THR OG1 O 2.231 17.530 -11.936 2.10 . A A . 60 THR OG1 1 1 6 7124 1 1 61 GLN C C 2.070 12.797 -12.935 0.90 . A A . 61 GLN C 1 1 6 7125 1 1 61 GLN CA C 1.123 13.043 -14.119 0.80 . A A . 61 GLN CA 1 1 6 7126 1 1 61 GLN CB C 1.891 13.099 -15.442 1.00 . A A . 61 GLN CB 1 1 6 7127 1 1 61 GLN CD C 0.377 11.559 -16.704 1.90 . A A . 61 GLN CD 1 1 6 7128 1 1 61 GLN CG C 1.806 11.777 -16.205 1.40 . A A . 61 GLN CG 1 1 6 7129 1 1 61 GLN H H -0.593 14.345 -14.041 1.20 . A A . 61 GLN H 1 1 6 7130 1 1 61 GLN HA H 0.370 12.256 -14.149 0.70 . A A . 61 GLN HA 1 1 6 7131 1 1 61 GLN HB2 H 1.485 13.900 -16.057 1.60 . A A . 61 GLN HB2 1 1 6 7132 1 1 61 GLN HB3 H 2.937 13.348 -15.260 1.60 . A A . 61 GLN HB3 1 1 6 7133 1 1 61 GLN HE21 H 0.142 10.004 -15.412 2.60 . A A . 61 GLN HE21 1 1 6 7134 1 1 61 GLN HE22 H -1.328 10.857 -15.844 2.80 . A A . 61 GLN HE22 1 1 6 7135 1 1 61 GLN HG2 H 2.481 11.781 -17.061 1.80 . A A . 61 GLN HG2 1 1 6 7136 1 1 61 GLN HG3 H 2.091 10.942 -15.565 1.90 . A A . 61 GLN HG3 1 1 6 7137 1 1 61 GLN N N 0.397 14.284 -13.917 0.90 . A A . 61 GLN N 1 1 6 7138 1 1 61 GLN NE2 N -0.333 10.732 -15.917 2.40 . A A . 61 GLN NE2 1 1 6 7139 1 1 61 GLN O O 1.805 13.199 -11.808 1.50 . A A . 61 GLN O 1 1 6 7140 1 1 61 GLN OE1 O -0.045 12.100 -17.719 2.40 . A A . 61 GLN OE1 1 1 6 7141 1 1 62 ALA C C 4.262 12.821 -11.190 0.90 . A A . 62 ALA C 1 1 6 7142 1 1 62 ALA CA C 4.452 12.496 -12.673 1.00 . A A . 62 ALA CA 1 1 6 7143 1 1 62 ALA CB C 5.027 13.703 -13.416 1.30 . A A . 62 ALA CB 1 1 6 7144 1 1 62 ALA H H 3.153 11.440 -14.002 1.50 . A A . 62 ALA H 1 1 6 7145 1 1 62 ALA HA H 5.107 11.628 -12.760 1.20 . A A . 62 ALA HA 1 1 6 7146 1 1 62 ALA HB1 H 5.429 13.405 -14.384 1.70 . A A . 62 ALA HB1 1 1 6 7147 1 1 62 ALA HB2 H 5.830 14.166 -12.843 1.60 . A A . 62 ALA HB2 1 1 6 7148 1 1 62 ALA HB3 H 4.258 14.456 -13.590 1.70 . A A . 62 ALA HB3 1 1 6 7149 1 1 62 ALA N N 3.183 12.115 -13.266 1.00 . A A . 62 ALA N 1 1 6 7150 1 1 62 ALA O O 4.320 13.968 -10.763 1.80 . A A . 62 ALA O 1 1 6 7151 1 1 63 SER C C 4.577 10.520 -8.400 0.60 . A A . 63 SER C 1 1 6 7152 1 1 63 SER CA C 4.106 11.846 -9.002 0.50 . A A . 63 SER CA 1 1 6 7153 1 1 63 SER CB C 2.733 12.222 -8.445 0.60 . A A . 63 SER CB 1 1 6 7154 1 1 63 SER H H 3.824 10.847 -10.874 1.20 . A A . 63 SER H 1 1 6 7155 1 1 63 SER HA H 4.843 12.621 -8.792 0.50 . A A . 63 SER HA 1 1 6 7156 1 1 63 SER HB2 H 2.084 12.603 -9.234 1.20 . A A . 63 SER HB2 1 1 6 7157 1 1 63 SER HB3 H 2.244 11.356 -7.997 0.90 . A A . 63 SER HB3 1 1 6 7158 1 1 63 SER HG H 3.667 13.046 -7.000 1.60 . A A . 63 SER HG 1 1 6 7159 1 1 63 SER N N 4.031 11.725 -10.444 0.60 . A A . 63 SER N 1 1 6 7160 1 1 63 SER O O 3.996 9.994 -7.459 1.60 . A A . 63 SER O 1 1 6 7161 1 1 63 SER OG O 2.855 13.216 -7.459 1.30 . A A . 63 SER OG 1 1 6 7162 1 1 64 CYS C C 6.969 8.098 -8.263 0.50 . A A . 64 CYS C 1 1 6 7163 1 1 64 CYS CA C 5.794 8.582 -9.120 0.50 . A A . 64 CYS CA 1 1 6 7164 1 1 64 CYS CB C 5.995 8.194 -10.588 0.50 . A A . 64 CYS CB 1 1 6 7165 1 1 64 CYS H H 6.364 10.630 -9.394 1.40 . A A . 64 CYS H 1 1 6 7166 1 1 64 CYS HA H 4.868 8.160 -8.729 0.60 . A A . 64 CYS HA 1 1 6 7167 1 1 64 CYS HB2 H 6.278 9.076 -11.163 0.70 . A A . 64 CYS HB2 1 1 6 7168 1 1 64 CYS HB3 H 6.818 7.484 -10.676 0.70 . A A . 64 CYS HB3 1 1 6 7169 1 1 64 CYS N N 5.668 10.023 -9.011 0.60 . A A . 64 CYS N 1 1 6 7170 1 1 64 CYS O O 8.052 8.671 -8.263 1.10 . A A . 64 CYS O 1 1 6 7171 1 1 64 CYS SG S 4.516 7.461 -11.337 1.30 . A A . 64 CYS SG 1 1 6 7172 1 1 65 GLU C C 8.108 5.690 -5.993 1.00 . A A . 65 GLU C 1 1 6 7173 1 1 65 GLU CA C 7.178 6.894 -6.175 1.10 . A A . 65 GLU CA 1 1 6 7174 1 1 65 GLU CB C 6.005 6.814 -5.198 1.30 . A A . 65 GLU CB 1 1 6 7175 1 1 65 GLU CD C 6.832 8.138 -3.242 1.90 . A A . 65 GLU CD 1 1 6 7176 1 1 65 GLU CG C 6.467 6.739 -3.742 1.50 . A A . 65 GLU CG 1 1 6 7177 1 1 65 GLU H H 6.063 6.308 -7.916 1.60 . A A . 65 GLU H 1 1 6 7178 1 1 65 GLU HA H 7.772 7.771 -6.027 1.30 . A A . 65 GLU HA 1 1 6 7179 1 1 65 GLU HB2 H 5.361 7.683 -5.336 1.50 . A A . 65 GLU HB2 1 1 6 7180 1 1 65 GLU HB3 H 5.396 5.941 -5.433 1.30 . A A . 65 GLU HB3 1 1 6 7181 1 1 65 GLU HG2 H 5.677 6.333 -3.110 1.70 . A A . 65 GLU HG2 1 1 6 7182 1 1 65 GLU HG3 H 7.336 6.089 -3.646 1.70 . A A . 65 GLU HG3 1 1 6 7183 1 1 65 GLU N N 6.670 7.006 -7.537 1.00 . A A . 65 GLU N 1 1 6 7184 1 1 65 GLU O O 9.180 5.738 -5.404 1.10 . A A . 65 GLU O 1 1 6 7185 1 1 65 GLU OE1 O 5.932 8.965 -3.104 1.90 . A A . 65 GLU OE1 1 1 6 7186 1 1 65 GLU OE2 O 8.012 8.384 -2.998 2.40 . A A . 65 GLU OE2 1 1 6 7187 1 1 66 CYS C C 8.860 2.574 -6.596 0.90 . A A . 66 CYS C 1 1 6 7188 1 1 66 CYS CA C 7.609 3.290 -6.054 1.00 . A A . 66 CYS CA 1 1 6 7189 1 1 66 CYS CB C 6.289 2.660 -6.496 1.20 . A A . 66 CYS CB 1 1 6 7190 1 1 66 CYS H H 6.763 4.879 -7.104 1.10 . A A . 66 CYS H 1 1 6 7191 1 1 66 CYS HA H 7.664 3.388 -4.970 1.10 . A A . 66 CYS HA 1 1 6 7192 1 1 66 CYS HB2 H 6.475 1.884 -7.234 1.20 . A A . 66 CYS HB2 1 1 6 7193 1 1 66 CYS HB3 H 5.856 2.211 -5.619 1.50 . A A . 66 CYS HB3 1 1 6 7194 1 1 66 CYS N N 7.560 4.628 -6.571 1.00 . A A . 66 CYS N 1 1 6 7195 1 1 66 CYS O O 9.915 3.184 -6.713 1.10 . A A . 66 CYS O 1 1 6 7196 1 1 66 CYS SG S 5.015 3.761 -7.179 1.70 . A A . 66 CYS SG 1 1 6 7197 1 1 67 PRO C C 8.708 -0.066 -4.844 0.90 . A A . 67 PRO C 1 1 6 7198 1 1 67 PRO CA C 8.026 0.234 -6.181 0.90 . A A . 67 PRO CA 1 1 6 7199 1 1 67 PRO CB C 7.919 -0.974 -7.133 0.90 . A A . 67 PRO CB 1 1 6 7200 1 1 67 PRO CD C 9.139 0.836 -8.280 0.80 . A A . 67 PRO CD 1 1 6 7201 1 1 67 PRO CG C 8.640 -0.600 -8.434 0.80 . A A . 67 PRO CG 1 1 6 7202 1 1 67 PRO HA H 7.019 0.529 -5.906 1.10 . A A . 67 PRO HA 1 1 6 7203 1 1 67 PRO HB2 H 8.357 -1.893 -6.741 1.00 . A A . 67 PRO HB2 1 1 6 7204 1 1 67 PRO HB3 H 6.863 -1.165 -7.348 0.80 . A A . 67 PRO HB3 1 1 6 7205 1 1 67 PRO HD2 H 10.225 0.887 -8.346 0.70 . A A . 67 PRO HD2 1 1 6 7206 1 1 67 PRO HD3 H 8.716 1.485 -9.047 0.90 . A A . 67 PRO HD3 1 1 6 7207 1 1 67 PRO HG2 H 9.475 -1.276 -8.616 0.80 . A A . 67 PRO HG2 1 1 6 7208 1 1 67 PRO HG3 H 7.962 -0.680 -9.283 1.00 . A A . 67 PRO HG3 1 1 6 7209 1 1 67 PRO N N 8.701 1.275 -6.966 0.80 . A A . 67 PRO N 1 1 6 7210 1 1 67 PRO O O 9.179 0.830 -4.158 1.30 . A A . 67 PRO O 1 1 6 7211 1 1 68 GLU C C 10.563 -2.253 -5.885 1.10 . A A . 68 GLU C 1 1 6 7212 1 1 68 GLU CA C 9.919 -2.146 -4.496 1.20 . A A . 68 GLU CA 1 1 6 7213 1 1 68 GLU CB C 9.615 -3.558 -3.994 1.50 . A A . 68 GLU CB 1 1 6 7214 1 1 68 GLU CD C 9.193 -5.795 -5.047 2.80 . A A . 68 GLU CD 1 1 6 7215 1 1 68 GLU CG C 8.737 -4.335 -4.976 2.10 . A A . 68 GLU CG 1 1 6 7216 1 1 68 GLU H H 7.926 -1.584 -3.888 1.60 . A A . 68 GLU H 1 1 6 7217 1 1 68 GLU HA H 10.592 -1.644 -3.807 1.30 . A A . 68 GLU HA 1 1 6 7218 1 1 68 GLU HB2 H 10.549 -4.098 -3.837 1.90 . A A . 68 GLU HB2 1 1 6 7219 1 1 68 GLU HB3 H 9.121 -3.506 -3.024 1.90 . A A . 68 GLU HB3 1 1 6 7220 1 1 68 GLU HG2 H 7.695 -4.307 -4.661 2.40 . A A . 68 GLU HG2 1 1 6 7221 1 1 68 GLU HG3 H 8.796 -3.899 -5.973 2.50 . A A . 68 GLU HG3 1 1 6 7222 1 1 68 GLU N N 8.687 -1.363 -4.490 1.20 . A A . 68 GLU N 1 1 6 7223 1 1 68 GLU O O 10.973 -3.320 -6.326 1.20 . A A . 68 GLU O 1 1 6 7224 1 1 68 GLU OE1 O 10.308 -6.041 -5.507 3.40 . A A . 68 GLU OE1 1 1 6 7225 1 1 68 GLU OE2 O 8.428 -6.669 -4.641 3.30 . A A . 68 GLU OE2 1 1 6 7226 1 1 69 GLY C C 12.268 0.622 -5.914 1.20 . A A . 69 GLY C 1 1 6 7227 1 1 69 GLY CA C 11.911 -0.521 -6.873 1.50 . A A . 69 GLY CA 1 1 6 7228 1 1 69 GLY H H 9.795 -0.521 -6.550 1.40 . A A . 69 GLY H 1 1 6 7229 1 1 69 GLY HA2 H 12.646 -1.324 -6.793 1.80 . A A . 69 GLY HA2 1 1 6 7230 1 1 69 GLY HA3 H 11.858 -0.160 -7.901 1.70 . A A . 69 GLY HA3 1 1 6 7231 1 1 69 GLY N N 10.619 -1.082 -6.534 1.20 . A A . 69 GLY N 1 1 6 7232 1 1 69 GLY O O 13.424 0.798 -5.547 1.40 . A A . 69 GLY O 1 1 6 7233 1 1 70 TYR C C 12.787 3.226 -5.034 0.80 . A A . 70 TYR C 1 1 6 7234 1 1 70 TYR CA C 11.506 2.487 -4.617 0.80 . A A . 70 TYR CA 1 1 6 7235 1 1 70 TYR CB C 11.674 1.964 -3.186 0.60 . A A . 70 TYR CB 1 1 6 7236 1 1 70 TYR CD1 C 11.092 4.299 -2.334 1.50 . A A . 70 TYR CD1 1 1 6 7237 1 1 70 TYR CD2 C 12.807 2.957 -1.129 1.30 . A A . 70 TYR CD2 1 1 6 7238 1 1 70 TYR CE1 C 11.273 5.375 -1.396 1.70 . A A . 70 TYR CE1 1 1 6 7239 1 1 70 TYR CE2 C 12.990 4.031 -0.189 1.40 . A A . 70 TYR CE2 1 1 6 7240 1 1 70 TYR CG C 11.859 3.085 -2.206 0.70 . A A . 70 TYR CG 1 1 6 7241 1 1 70 TYR CZ C 12.223 5.240 -0.323 1.10 . A A . 70 TYR CZ 1 1 6 7242 1 1 70 TYR H H 10.264 1.138 -5.736 1.00 . A A . 70 TYR H 1 1 6 7243 1 1 70 TYR HA H 10.671 3.182 -4.696 0.90 . A A . 70 TYR HA 1 1 6 7244 1 1 70 TYR HB2 H 10.811 1.376 -2.879 0.60 . A A . 70 TYR HB2 1 1 6 7245 1 1 70 TYR HB3 H 12.541 1.306 -3.132 0.60 . A A . 70 TYR HB3 1 1 6 7246 1 1 70 TYR HD1 H 10.378 4.401 -3.138 2.30 . A A . 70 TYR HD1 1 1 6 7247 1 1 70 TYR HD2 H 13.382 2.048 -1.026 2.10 . A A . 70 TYR HD2 1 1 6 7248 1 1 70 TYR HE1 H 10.697 6.283 -1.496 2.50 . A A . 70 TYR HE1 1 1 6 7249 1 1 70 TYR HE2 H 13.704 3.929 0.615 2.10 . A A . 70 TYR HE2 1 1 6 7250 1 1 70 TYR HH H 13.034 6.014 1.231 1.50 . A A . 70 TYR HH 1 1 6 7251 1 1 70 TYR N N 11.221 1.384 -5.527 0.90 . A A . 70 TYR N 1 1 6 7252 1 1 70 TYR O O 13.567 3.668 -4.199 1.10 . A A . 70 TYR O 1 1 6 7253 1 1 70 TYR OH O 12.396 6.270 0.578 1.30 . A A . 70 TYR OH 1 1 6 7254 1 1 71 ILE C C 12.959 4.498 -8.502 0.90 . A A . 71 ILE C 1 1 6 7255 1 1 71 ILE CA C 12.896 4.642 -6.977 1.00 . A A . 71 ILE CA 1 1 6 7256 1 1 71 ILE CB C 14.041 5.507 -6.427 1.20 . A A . 71 ILE CB 1 1 6 7257 1 1 71 ILE CD1 C 13.054 6.558 -4.341 1.80 . A A . 71 ILE CD1 1 1 6 7258 1 1 71 ILE CG1 C 13.494 6.784 -5.788 1.40 . A A . 71 ILE CG1 1 1 6 7259 1 1 71 ILE CG2 C 15.107 5.844 -7.475 1.80 . A A . 71 ILE CG2 1 1 6 7260 1 1 71 ILE H H 13.193 2.527 -6.914 1.10 . A A . 71 ILE H 1 1 6 7261 1 1 71 ILE HA H 11.929 5.063 -6.701 1.20 . A A . 71 ILE HA 1 1 6 7262 1 1 71 ILE HB H 14.538 4.929 -5.648 1.70 . A A . 71 ILE HB 1 1 6 7263 1 1 71 ILE HD11 H 12.206 5.875 -4.295 2.20 . A A . 71 ILE HD11 1 1 6 7264 1 1 71 ILE HD12 H 12.756 7.498 -3.876 2.30 . A A . 71 ILE HD12 1 1 6 7265 1 1 71 ILE HD13 H 13.864 6.131 -3.750 2.10 . A A . 71 ILE HD13 1 1 6 7266 1 1 71 ILE HG12 H 14.257 7.561 -5.821 1.60 . A A . 71 ILE HG12 1 1 6 7267 1 1 71 ILE HG13 H 12.650 7.151 -6.372 1.70 . A A . 71 ILE HG13 1 1 6 7268 1 1 71 ILE HG21 H 15.975 6.306 -7.005 2.30 . A A . 71 ILE HG21 1 1 6 7269 1 1 71 ILE HG22 H 14.717 6.538 -8.219 2.20 . A A . 71 ILE HG22 1 1 6 7270 1 1 71 ILE HG23 H 15.442 4.946 -7.993 2.20 . A A . 71 ILE HG23 1 1 6 7271 1 1 71 ILE N N 12.954 3.328 -6.366 0.90 . A A . 71 ILE N 1 1 6 7272 1 1 71 ILE O O 13.253 3.438 -9.041 0.90 . A A . 71 ILE O 1 1 6 7273 1 1 72 LEU C C 11.228 4.420 -10.713 0.80 . A A . 72 LEU C 1 1 6 7274 1 1 72 LEU CA C 11.542 5.760 -10.031 0.80 . A A . 72 LEU CA 1 1 6 7275 1 1 72 LEU CB C 11.809 6.904 -11.018 0.80 . A A . 72 LEU CB 1 1 6 7276 1 1 72 LEU CD1 C 11.337 9.367 -11.290 0.60 . A A . 72 LEU CD1 1 1 6 7277 1 1 72 LEU CD2 C 11.108 8.262 -9.049 0.70 . A A . 72 LEU CD2 1 1 6 7278 1 1 72 LEU CG C 11.868 8.278 -10.361 0.70 . A A . 72 LEU CG 1 1 6 7279 1 1 72 LEU H H 13.236 6.462 -8.946 0.90 . A A . 72 LEU H 1 1 6 7280 1 1 72 LEU HA H 10.684 5.995 -9.423 0.80 . A A . 72 LEU HA 1 1 6 7281 1 1 72 LEU HB2 H 12.780 6.739 -11.457 1.00 . A A . 72 LEU HB2 1 1 6 7282 1 1 72 LEU HB3 H 11.075 6.895 -11.823 1.00 . A A . 72 LEU HB3 1 1 6 7283 1 1 72 LEU HD11 H 11.365 10.340 -10.801 1.10 . A A . 72 LEU HD11 1 1 6 7284 1 1 72 LEU HD12 H 10.307 9.161 -11.582 1.10 . A A . 72 LEU HD12 1 1 6 7285 1 1 72 LEU HD13 H 11.949 9.430 -12.190 1.20 . A A . 72 LEU HD13 1 1 6 7286 1 1 72 LEU HD21 H 11.613 7.606 -8.341 1.40 . A A . 72 LEU HD21 1 1 6 7287 1 1 72 LEU HD22 H 10.098 7.888 -9.212 1.20 . A A . 72 LEU HD22 1 1 6 7288 1 1 72 LEU HD23 H 11.056 9.266 -8.635 1.20 . A A . 72 LEU HD23 1 1 6 7289 1 1 72 LEU HG H 12.912 8.504 -10.145 0.70 . A A . 72 LEU HG 1 1 6 7290 1 1 72 LEU N N 12.685 5.651 -9.141 0.80 . A A . 72 LEU N 1 1 6 7291 1 1 72 LEU O O 11.191 3.367 -10.088 0.90 . A A . 72 LEU O 1 1 6 7292 1 1 73 ASP C C 11.538 2.639 -13.458 1.20 . A A . 73 ASP C 1 1 6 7293 1 1 73 ASP CA C 11.954 4.036 -12.992 1.00 . A A . 73 ASP CA 1 1 6 7294 1 1 73 ASP CB C 13.356 4.022 -12.371 1.50 . A A . 73 ASP CB 1 1 6 7295 1 1 73 ASP CG C 14.398 3.545 -13.385 2.00 . A A . 73 ASP CG 1 1 6 7296 1 1 73 ASP H H 10.185 5.075 -12.300 0.80 . A A . 73 ASP H 1 1 6 7297 1 1 73 ASP HA H 11.926 4.710 -13.848 1.20 . A A . 73 ASP HA 1 1 6 7298 1 1 73 ASP HB2 H 13.618 5.021 -12.021 1.90 . A A . 73 ASP HB2 1 1 6 7299 1 1 73 ASP HB3 H 13.368 3.370 -11.497 1.90 . A A . 73 ASP HB3 1 1 6 7300 1 1 73 ASP N N 10.984 4.539 -12.031 0.90 . A A . 73 ASP N 1 1 6 7301 1 1 73 ASP O O 10.654 2.002 -12.897 1.70 . A A . 73 ASP O 1 1 6 7302 1 1 73 ASP OD1 O 14.790 4.337 -14.241 2.80 . A A . 73 ASP OD1 1 1 6 7303 1 1 73 ASP OD2 O 14.805 2.387 -13.308 2.30 . A A . 73 ASP OD2 1 1 6 7304 1 1 74 ASP C C 10.385 2.937 -15.982 1.40 . A A . 74 ASP C 1 1 6 7305 1 1 74 ASP CA C 11.659 2.094 -15.847 1.80 . A A . 74 ASP CA 1 1 6 7306 1 1 74 ASP CB C 11.370 0.624 -16.159 2.60 . A A . 74 ASP CB 1 1 6 7307 1 1 74 ASP CG C 10.523 0.000 -15.048 3.20 . A A . 74 ASP CG 1 1 6 7308 1 1 74 ASP H H 13.223 2.035 -14.399 1.40 . A A . 74 ASP H 1 1 6 7309 1 1 74 ASP HA H 12.405 2.484 -16.539 2.30 . A A . 74 ASP HA 1 1 6 7310 1 1 74 ASP HB2 H 10.837 0.532 -17.105 3.00 . A A . 74 ASP HB2 1 1 6 7311 1 1 74 ASP HB3 H 12.301 0.064 -16.248 3.10 . A A . 74 ASP HB3 1 1 6 7312 1 1 74 ASP N N 12.249 2.218 -14.522 1.30 . A A . 74 ASP N 1 1 6 7313 1 1 74 ASP O O 9.268 2.445 -15.880 1.80 . A A . 74 ASP O 1 1 6 7314 1 1 74 ASP OD1 O 11.026 -0.139 -13.934 3.60 . A A . 74 ASP OD1 1 1 6 7315 1 1 74 ASP OD2 O 9.372 -0.343 -15.311 3.70 . A A . 74 ASP OD2 1 1 6 7316 1 1 75 GLY C C 9.002 6.049 -15.830 1.10 . A A . 75 GLY C 1 1 6 7317 1 1 75 GLY CA C 9.595 5.050 -16.822 1.10 . A A . 75 GLY CA 1 1 6 7318 1 1 75 GLY H H 11.511 4.638 -15.936 1.30 . A A . 75 GLY H 1 1 6 7319 1 1 75 GLY HA2 H 10.049 5.589 -17.628 1.50 . A A . 75 GLY HA2 1 1 6 7320 1 1 75 GLY HA3 H 8.827 4.377 -17.205 1.30 . A A . 75 GLY HA3 1 1 6 7321 1 1 75 GLY N N 10.640 4.237 -16.218 1.00 . A A . 75 GLY N 1 1 6 7322 1 1 75 GLY O O 8.822 7.235 -16.080 1.40 . A A . 75 GLY O 1 1 6 7323 1 1 76 PHE C C 7.794 5.073 -12.405 0.80 . A A . 76 PHE C 1 1 6 7324 1 1 76 PHE CA C 8.437 6.052 -13.423 0.90 . A A . 76 PHE CA 1 1 6 7325 1 1 76 PHE CB C 7.502 7.249 -13.633 1.00 . A A . 76 PHE CB 1 1 6 7326 1 1 76 PHE CD1 C 9.605 8.688 -13.963 2.00 . A A . 76 PHE CD1 1 1 6 7327 1 1 76 PHE CD2 C 7.466 9.770 -13.301 1.80 . A A . 76 PHE CD2 1 1 6 7328 1 1 76 PHE CE1 C 10.252 9.974 -13.975 2.70 . A A . 76 PHE CE1 1 1 6 7329 1 1 76 PHE CE2 C 8.110 11.056 -13.308 2.50 . A A . 76 PHE CE2 1 1 6 7330 1 1 76 PHE CG C 8.206 8.579 -13.630 1.20 . A A . 76 PHE CG 1 1 6 7331 1 1 76 PHE CZ C 9.504 11.157 -13.647 2.80 . A A . 76 PHE CZ 1 1 6 7332 1 1 76 PHE H H 8.875 4.438 -14.865 1.00 . A A . 76 PHE H 1 1 6 7333 1 1 76 PHE HA H 9.406 6.359 -13.029 0.80 . A A . 76 PHE HA 1 1 6 7334 1 1 76 PHE HB2 H 6.971 7.141 -14.578 1.60 . A A . 76 PHE HB2 1 1 6 7335 1 1 76 PHE HB3 H 6.749 7.260 -12.846 1.30 . A A . 76 PHE HB3 1 1 6 7336 1 1 76 PHE HD1 H 10.170 7.800 -14.204 2.50 . A A . 76 PHE HD1 1 1 6 7337 1 1 76 PHE HD2 H 6.417 9.699 -13.052 2.30 . A A . 76 PHE HD2 1 1 6 7338 1 1 76 PHE HE1 H 11.300 10.050 -14.226 3.50 . A A . 76 PHE HE1 1 1 6 7339 1 1 76 PHE HE2 H 7.549 11.945 -13.061 3.20 . A A . 76 PHE HE2 1 1 6 7340 1 1 76 PHE HZ H 9.990 12.121 -13.650 3.50 . A A . 76 PHE HZ 1 1 6 7341 1 1 76 PHE N N 8.709 5.409 -14.703 0.90 . A A . 76 PHE N 1 1 6 7342 1 1 76 PHE O O 7.286 5.489 -11.370 0.80 . A A . 76 PHE O 1 1 6 7343 1 1 77 ILE C C 5.675 3.133 -11.813 0.70 . A A . 77 ILE C 1 1 6 7344 1 1 77 ILE CA C 6.578 3.118 -13.048 0.80 . A A . 77 ILE CA 1 1 6 7345 1 1 77 ILE CB C 6.789 1.694 -13.596 0.90 . A A . 77 ILE CB 1 1 6 7346 1 1 77 ILE CD1 C 5.694 0.387 -11.709 1.20 . A A . 77 ILE CD1 1 1 6 7347 1 1 77 ILE CG1 C 5.678 0.712 -13.203 1.10 . A A . 77 ILE CG1 1 1 6 7348 1 1 77 ILE CG2 C 8.151 1.122 -13.216 0.90 . A A . 77 ILE CG2 1 1 6 7349 1 1 77 ILE H H 8.680 3.450 -13.198 0.80 . A A . 77 ILE H 1 1 6 7350 1 1 77 ILE HA H 6.144 3.707 -13.853 0.80 . A A . 77 ILE HA 1 1 6 7351 1 1 77 ILE HB H 6.771 1.772 -14.683 0.90 . A A . 77 ILE HB 1 1 6 7352 1 1 77 ILE HD11 H 6.605 0.760 -11.242 1.50 . A A . 77 ILE HD11 1 1 6 7353 1 1 77 ILE HD12 H 5.645 -0.689 -11.541 1.60 . A A . 77 ILE HD12 1 1 6 7354 1 1 77 ILE HD13 H 4.845 0.845 -11.203 1.70 . A A . 77 ILE HD13 1 1 6 7355 1 1 77 ILE HG12 H 4.699 1.091 -13.491 1.30 . A A . 77 ILE HG12 1 1 6 7356 1 1 77 ILE HG13 H 5.801 -0.207 -13.777 1.10 . A A . 77 ILE HG13 1 1 6 7357 1 1 77 ILE HG21 H 8.104 0.037 -13.140 1.10 . A A . 77 ILE HG21 1 1 6 7358 1 1 77 ILE HG22 H 8.482 1.523 -12.259 1.40 . A A . 77 ILE HG22 1 1 6 7359 1 1 77 ILE HG23 H 8.888 1.386 -13.972 1.40 . A A . 77 ILE HG23 1 1 6 7360 1 1 77 ILE N N 7.845 3.765 -12.749 0.80 . A A . 77 ILE N 1 1 6 7361 1 1 77 ILE O O 6.122 3.248 -10.679 0.80 . A A . 77 ILE O 1 1 6 7362 1 1 78 CYS C C 2.338 4.306 -11.951 0.70 . A A . 78 CYS C 1 1 6 7363 1 1 78 CYS CA C 3.299 3.352 -11.244 0.50 . A A . 78 CYS CA 1 1 6 7364 1 1 78 CYS CB C 3.826 3.986 -9.958 0.40 . A A . 78 CYS CB 1 1 6 7365 1 1 78 CYS H H 4.201 2.532 -13.016 0.50 . A A . 78 CYS H 1 1 6 7366 1 1 78 CYS HA H 2.769 2.426 -11.020 0.60 . A A . 78 CYS HA 1 1 6 7367 1 1 78 CYS HB2 H 4.622 4.698 -10.175 0.70 . A A . 78 CYS HB2 1 1 6 7368 1 1 78 CYS HB3 H 3.030 4.548 -9.470 0.70 . A A . 78 CYS HB3 1 1 6 7369 1 1 78 CYS N N 4.381 2.986 -12.143 0.50 . A A . 78 CYS N 1 1 6 7370 1 1 78 CYS O O 2.653 4.906 -12.970 1.70 . A A . 78 CYS O 1 1 6 7371 1 1 78 CYS SG S 4.423 2.718 -8.818 1.00 . A A . 78 CYS SG 1 1 6 7372 1 1 79 THR C C 0.036 2.919 -12.928 0.90 . A A . 79 THR C 1 1 6 7373 1 1 79 THR CA C 0.248 3.259 -11.453 0.70 . A A . 79 THR CA 1 1 6 7374 1 1 79 THR CB C -1.088 3.591 -10.789 0.90 . A A . 79 THR CB 1 1 6 7375 1 1 79 THR CG2 C -0.895 4.293 -9.444 1.60 . A A . 79 THR CG2 1 1 6 7376 1 1 79 THR H H 0.888 5.207 -10.820 1.30 . A A . 79 THR H 1 1 6 7377 1 1 79 THR HA H 0.740 2.423 -10.955 0.80 . A A . 79 THR HA 1 1 6 7378 1 1 79 THR HB H -1.659 2.674 -10.641 0.70 . A A . 79 THR HB 1 1 6 7379 1 1 79 THR HG1 H -2.612 3.923 -11.886 2.00 . A A . 79 THR HG1 1 1 6 7380 1 1 79 THR HG21 H -0.783 5.369 -9.579 2.00 . A A . 79 THR HG21 1 1 6 7381 1 1 79 THR HG22 H -0.004 3.922 -8.938 2.20 . A A . 79 THR HG22 1 1 6 7382 1 1 79 THR HG23 H -1.750 4.123 -8.790 2.10 . A A . 79 THR HG23 1 1 6 7383 1 1 79 THR N N 1.144 4.392 -11.339 0.70 . A A . 79 THR N 1 1 6 7384 1 1 79 THR O O -0.019 3.788 -13.789 1.50 . A A . 79 THR O 1 1 6 7385 1 1 79 THR OG1 O -1.840 4.416 -11.643 1.70 . A A . 79 THR OG1 1 1 6 7386 1 1 80 ASP C C -2.527 1.974 -13.450 1.10 . A A . 80 ASP C 1 1 6 7387 1 1 80 ASP CA C -1.332 1.036 -13.675 1.20 . A A . 80 ASP CA 1 1 6 7388 1 1 80 ASP CB C -1.612 -0.300 -12.988 1.70 . A A . 80 ASP CB 1 1 6 7389 1 1 80 ASP CG C -1.875 -1.383 -14.038 2.40 . A A . 80 ASP CG 1 1 6 7390 1 1 80 ASP H H 0.703 0.994 -13.018 0.80 . A A . 80 ASP H 1 1 6 7391 1 1 80 ASP HA H -1.182 0.899 -14.746 1.50 . A A . 80 ASP HA 1 1 6 7392 1 1 80 ASP HB2 H -0.761 -0.596 -12.372 2.10 . A A . 80 ASP HB2 1 1 6 7393 1 1 80 ASP HB3 H -2.490 -0.217 -12.344 1.80 . A A . 80 ASP HB3 1 1 6 7394 1 1 80 ASP N N -0.088 1.595 -13.154 0.80 . A A . 80 ASP N 1 1 6 7395 1 1 80 ASP O O -3.019 2.139 -12.340 1.90 . A A . 80 ASP O 1 1 6 7396 1 1 80 ASP OD1 O -1.108 -1.475 -14.995 2.90 . A A . 80 ASP OD1 1 1 6 7397 1 1 80 ASP OD2 O -2.847 -2.122 -13.885 2.90 . A A . 80 ASP OD2 1 1 6 7398 1 1 81 ILE C C -5.219 1.719 -14.155 1.60 . A A . 81 ILE C 1 1 6 7399 1 1 81 ILE CA C -4.369 2.853 -14.745 1.30 . A A . 81 ILE CA 1 1 6 7400 1 1 81 ILE CB C -4.683 3.051 -16.232 1.70 . A A . 81 ILE CB 1 1 6 7401 1 1 81 ILE CD1 C -5.297 5.481 -15.847 3.00 . A A . 81 ILE CD1 1 1 6 7402 1 1 81 ILE CG1 C -5.743 4.136 -16.421 2.50 . A A . 81 ILE CG1 1 1 6 7403 1 1 81 ILE CG2 C -5.120 1.746 -16.899 1.90 . A A . 81 ILE CG2 1 1 6 7404 1 1 81 ILE H H -2.288 2.922 -15.240 1.50 . A A . 81 ILE H 1 1 6 7405 1 1 81 ILE HA H -4.560 3.775 -14.196 1.50 . A A . 81 ILE HA 1 1 6 7406 1 1 81 ILE HB H -3.770 3.388 -16.723 2.20 . A A . 81 ILE HB 1 1 6 7407 1 1 81 ILE HD11 H -5.705 5.632 -14.848 3.20 . A A . 81 ILE HD11 1 1 6 7408 1 1 81 ILE HD12 H -5.637 6.304 -16.477 3.40 . A A . 81 ILE HD12 1 1 6 7409 1 1 81 ILE HD13 H -4.211 5.535 -15.777 3.30 . A A . 81 ILE HD13 1 1 6 7410 1 1 81 ILE HG12 H -5.968 4.248 -17.481 2.70 . A A . 81 ILE HG12 1 1 6 7411 1 1 81 ILE HG13 H -6.670 3.827 -15.939 3.00 . A A . 81 ILE HG13 1 1 6 7412 1 1 81 ILE HG21 H -6.175 1.547 -16.707 2.20 . A A . 81 ILE HG21 1 1 6 7413 1 1 81 ILE HG22 H -4.544 0.902 -16.520 2.30 . A A . 81 ILE HG22 1 1 6 7414 1 1 81 ILE HG23 H -4.978 1.794 -17.979 2.30 . A A . 81 ILE HG23 1 1 6 7415 1 1 81 ILE N N -2.952 2.570 -14.580 1.00 . A A . 81 ILE N 1 1 6 7416 1 1 81 ILE O O -4.718 0.672 -13.764 2.40 . A A . 81 ILE O 1 1 6 7417 1 1 82 ASP C C -7.191 -0.303 -14.529 2.70 . A A . 82 ASP C 1 1 6 7418 1 1 82 ASP CA C -7.439 0.957 -13.697 2.60 . A A . 82 ASP CA 1 1 6 7419 1 1 82 ASP CB C -8.890 1.422 -13.842 3.50 . A A . 82 ASP CB 1 1 6 7420 1 1 82 ASP CG C -9.092 2.141 -15.178 3.90 . A A . 82 ASP CG 1 1 6 7421 1 1 82 ASP H H -6.871 2.909 -14.382 2.10 . A A . 82 ASP H 1 1 6 7422 1 1 82 ASP HA H -7.203 0.749 -12.654 3.00 . A A . 82 ASP HA 1 1 6 7423 1 1 82 ASP HB2 H -9.571 0.572 -13.791 3.90 . A A . 82 ASP HB2 1 1 6 7424 1 1 82 ASP HB3 H -9.154 2.102 -13.032 3.90 . A A . 82 ASP HB3 1 1 6 7425 1 1 82 ASP N N -6.532 2.005 -14.121 1.90 . A A . 82 ASP N 1 1 6 7426 1 1 82 ASP O O -6.626 -1.285 -14.063 3.30 . A A . 82 ASP O 1 1 6 7427 1 1 82 ASP OD1 O -8.748 3.318 -15.269 4.20 . A A . 82 ASP OD1 1 1 6 7428 1 1 82 ASP OD2 O -9.594 1.516 -16.111 4.50 . A A . 82 ASP OD2 1 1 6 7429 1 1 83 GLU C C -7.654 -2.626 -16.067 1.00 . A A . 83 GLU C 1 1 6 7430 1 1 83 GLU CA C -8.408 -1.320 -16.324 1.00 . A A . 83 GLU CA 1 1 6 7431 1 1 83 GLU CB C -8.626 -1.122 -17.824 1.00 . A A . 83 GLU CB 1 1 6 7432 1 1 83 GLU CD C -9.572 -2.740 -19.485 1.00 . A A . 83 GLU CD 1 1 6 7433 1 1 83 GLU CG C -9.899 -1.815 -18.311 1.00 . A A . 83 GLU CG 1 1 6 7434 1 1 83 GLU H H -7.480 0.611 -16.339 1.00 . A A . 83 GLU H 1 1 6 7435 1 1 83 GLU HA H -9.357 -1.338 -15.787 1.00 . A A . 83 GLU HA 1 1 6 7436 1 1 83 GLU HB2 H -8.683 -0.057 -18.048 1.00 . A A . 83 GLU HB2 1 1 6 7437 1 1 83 GLU HB3 H -7.767 -1.510 -18.371 1.00 . A A . 83 GLU HB3 1 1 6 7438 1 1 83 GLU HG2 H -10.345 -2.405 -17.510 1.00 . A A . 83 GLU HG2 1 1 6 7439 1 1 83 GLU HG3 H -10.636 -1.080 -18.634 1.00 . A A . 83 GLU HG3 1 1 6 7440 1 1 83 GLU N N -7.652 -0.206 -15.788 1.00 . A A . 83 GLU N 1 1 6 7441 1 1 83 GLU O O -7.997 -3.323 -15.113 1.00 . A A . 83 GLU O 1 1 6 7442 1 1 83 GLU OXT O -6.734 -2.931 -16.824 1.00 . A A . 83 GLU OXT 1 1 6 7443 1 1 83 GLU OE1 O -8.513 -3.366 -19.464 1.00 . A A . 83 GLU OE1 1 1 6 7444 1 1 83 GLU OE2 O -10.380 -2.824 -20.409 1.00 . A A . 83 GLU OE2 1 1 6 7445 2 2 1 NAG C1 C -15.822 0.664 9.241 1.00 . B A . 121 NAG C1 1 1 6 7446 2 2 1 NAG C2 C -14.671 0.534 8.243 1.00 . B A . 121 NAG C2 1 1 6 7447 2 2 1 NAG C3 C -14.917 -0.572 7.217 1.00 . B A . 121 NAG C3 1 1 6 7448 2 2 1 NAG C4 C -16.333 -0.512 6.644 1.00 . B A . 121 NAG C4 1 1 6 7449 2 2 1 NAG C5 C -17.375 -0.180 7.714 1.00 . B A . 121 NAG C5 1 1 6 7450 2 2 1 NAG C6 C -18.593 -1.098 7.619 1.00 . B A . 121 NAG C6 1 1 6 7451 2 2 1 NAG C7 C -13.471 2.581 7.911 1.00 . B A . 121 NAG C7 1 1 6 7452 2 2 1 NAG C8 C -12.118 2.044 7.442 1.00 . B A . 121 NAG C8 1 1 6 7453 2 2 1 NAG H1 H -16.279 1.652 9.186 1.00 . B A . 121 NAG H1 1 1 6 7454 2 2 1 NAG H2 H -13.734 0.355 8.771 1.00 . B A . 121 NAG H2 1 1 6 7455 2 2 1 NAG H3 H -14.195 -0.480 6.406 1.00 . B A . 121 NAG H3 1 1 6 7456 2 2 1 NAG H4 H -16.578 -1.470 6.185 1.00 . B A . 121 NAG H4 1 1 6 7457 2 2 1 NAG H5 H -17.695 0.854 7.593 1.00 . B A . 121 NAG H5 1 1 6 7458 2 2 1 NAG H61 H -19.094 -1.181 8.583 1.00 . B A . 121 NAG H61 1 1 6 7459 2 2 1 NAG H62 H -18.301 -2.100 7.303 1.00 . B A . 121 NAG H62 1 1 6 7460 2 2 1 NAG H81 H -11.414 2.027 8.274 1.00 . B A . 121 NAG H81 1 1 6 7461 2 2 1 NAG H82 H -12.235 1.032 7.053 1.00 . B A . 121 NAG H82 1 1 6 7462 2 2 1 NAG H83 H -11.717 2.682 6.655 1.00 . B A . 121 NAG H83 1 1 6 7463 2 2 1 NAG HN2 H -15.121 2.067 6.813 1.00 . B A . 121 NAG HN2 1 1 6 7464 2 2 1 NAG HO3 H -13.791 -2.033 7.699 1.00 . B A . 121 NAG HO3 1 1 6 7465 2 2 1 NAG HO4 H -16.712 1.253 6.027 1.00 . B A . 121 NAG HO4 1 1 6 7466 2 2 1 NAG HO6 H -20.164 -1.278 6.552 1.00 . B A . 121 NAG HO6 1 1 6 7467 2 2 1 NAG N2 N -14.500 1.795 7.549 1.00 . B A . 121 NAG N2 1 1 6 7468 2 2 1 NAG O3 O -14.708 -1.823 7.819 1.00 . B A . 121 NAG O3 1 1 6 7469 2 2 1 NAG O4 O -16.384 0.458 5.628 1.00 . B A . 121 NAG O4 1 1 6 7470 2 2 1 NAG O5 O -16.792 -0.322 8.987 1.00 . B A . 121 NAG O5 1 1 6 7471 2 2 1 NAG O6 O -19.518 -0.598 6.686 1.00 . B A . 121 NAG O6 1 1 6 7472 2 2 1 NAG O7 O -13.569 3.622 8.550 1.00 . B A . 121 NAG O7 1 1 6 7473 3 2 1 NAG C1 C 0.356 -7.958 -7.903 1.00 . C A . 148 NAG C1 1 1 6 7474 3 2 1 NAG C2 C -0.595 -7.413 -6.836 1.00 . C A . 148 NAG C2 1 1 6 7475 3 2 1 NAG C3 C -1.690 -8.416 -6.472 1.00 . C A . 148 NAG C3 1 1 6 7476 3 2 1 NAG C4 C -1.118 -9.803 -6.181 1.00 . C A . 148 NAG C4 1 1 6 7477 3 2 1 NAG C5 C 0.069 -10.131 -7.088 1.00 . C A . 148 NAG C5 1 1 6 7478 3 2 1 NAG C6 C 0.045 -11.588 -7.551 1.00 . C A . 148 NAG C6 1 1 6 7479 3 2 1 NAG C7 C 0.319 -5.783 -5.323 1.00 . C A . 148 NAG C7 1 1 6 7480 3 2 1 NAG C8 C -0.983 -5.118 -4.867 1.00 . C A . 148 NAG C8 1 1 6 7481 3 2 1 NAG H1 H 1.392 -7.905 -7.567 1.00 . C A . 148 NAG H1 1 1 6 7482 3 2 1 NAG H2 H -1.042 -6.478 -7.174 1.00 . C A . 148 NAG H2 1 1 6 7483 3 2 1 NAG H3 H -2.235 -8.057 -5.599 1.00 . C A . 148 NAG H3 1 1 6 7484 3 2 1 NAG H4 H -1.897 -10.553 -6.319 1.00 . C A . 148 NAG H4 1 1 6 7485 3 2 1 NAG H5 H 0.996 -9.940 -6.549 1.00 . C A . 148 NAG H5 1 1 6 7486 3 2 1 NAG H61 H 0.276 -11.662 -8.614 1.00 . C A . 148 NAG H61 1 1 6 7487 3 2 1 NAG H62 H -0.936 -12.033 -7.388 1.00 . C A . 148 NAG H62 1 1 6 7488 3 2 1 NAG H81 H -0.794 -4.444 -4.030 1.00 . C A . 148 NAG H81 1 1 6 7489 3 2 1 NAG H82 H -1.425 -4.540 -5.678 1.00 . C A . 148 NAG H82 1 1 6 7490 3 2 1 NAG H83 H -1.688 -5.889 -4.561 1.00 . C A . 148 NAG H83 1 1 6 7491 3 2 1 NAG HN2 H 0.558 -7.800 -5.074 1.00 . C A . 148 NAG HN2 1 1 6 7492 3 2 1 NAG HO3 H -2.201 -9.029 -8.205 1.00 . C A . 148 NAG HO3 1 1 6 7493 3 2 1 NAG HO4 H -0.821 -10.772 -4.565 1.00 . C A . 148 NAG HO4 1 1 6 7494 3 2 1 NAG HO6 H 0.936 -12.077 -5.937 1.00 . C A . 148 NAG HO6 1 1 6 7495 3 2 1 NAG N2 N 0.162 -7.081 -5.644 1.00 . C A . 148 NAG N2 1 1 6 7496 3 2 1 NAG O3 O -2.612 -8.505 -7.529 1.00 . C A . 148 NAG O3 1 1 6 7497 3 2 1 NAG O4 O -0.712 -9.871 -4.838 1.00 . C A . 148 NAG O4 1 1 6 7498 3 2 1 NAG O5 O 0.027 -9.290 -8.215 1.00 . C A . 148 NAG O5 1 1 6 7499 3 2 1 NAG O6 O 0.993 -12.347 -6.844 1.00 . C A . 148 NAG O6 1 1 6 7500 3 2 1 NAG O7 O 1.380 -5.171 -5.369 1.00 . C A . 148 NAG O7 1 1 7 7501 1 1 1 HIS C C -2.368 -12.725 20.555 1.00 . A A . 1 HIS C 1 1 7 7502 1 1 1 HIS CA C -3.715 -13.450 20.500 1.00 . A A . 1 HIS CA 1 1 7 7503 1 1 1 HIS CB C -3.491 -14.888 20.030 1.00 . A A . 1 HIS CB 1 1 7 7504 1 1 1 HIS CD2 C -2.023 -16.333 21.526 1.00 . A A . 1 HIS CD2 1 1 7 7505 1 1 1 HIS CE1 C -3.542 -17.098 22.982 1.00 . A A . 1 HIS CE1 1 1 7 7506 1 1 1 HIS CG C -3.214 -15.816 21.178 1.00 . A A . 1 HIS CG 1 1 7 7507 1 1 1 HIS H1 H -5.319 -12.197 20.226 1.00 . A A . 1 HIS H1 1 1 7 7508 1 1 1 HIS H2 H -4.136 -12.097 19.012 1.00 . A A . 1 HIS H2 1 1 7 7509 1 1 1 HIS H3 H -5.186 -13.430 19.066 1.00 . A A . 1 HIS H3 1 1 7 7510 1 1 1 HIS HA H -4.139 -13.454 21.504 1.00 . A A . 1 HIS HA 1 1 7 7511 1 1 1 HIS HB2 H -4.369 -15.238 19.487 1.00 . A A . 1 HIS HB2 1 1 7 7512 1 1 1 HIS HB3 H -2.656 -14.921 19.330 1.00 . A A . 1 HIS HB3 1 1 7 7513 1 1 1 HIS HD2 H -1.090 -16.157 21.024 1.00 . A A . 1 HIS HD2 1 1 7 7514 1 1 1 HIS HE1 H -4.004 -17.596 23.830 1.00 . A A . 1 HIS HE1 1 1 7 7515 1 1 1 HIS HE2 H -1.514 -17.687 23.183 1.00 . A A . 1 HIS HE2 1 1 7 7516 1 1 1 HIS N N -4.656 -12.743 19.639 1.00 . A A . 1 HIS N 1 1 7 7517 1 1 1 HIS ND1 N -4.225 -16.317 22.126 1.00 . A A . 1 HIS ND1 1 1 7 7518 1 1 1 HIS NE2 N -2.231 -17.176 22.710 1.00 . A A . 1 HIS NE2 1 1 7 7519 1 1 1 HIS O O -1.310 -13.310 20.359 1.00 . A A . 1 HIS O 1 1 7 7520 1 1 2 MET C C -2.416 -9.456 22.278 1.00 . A A . 2 MET C 1 1 7 7521 1 1 2 MET CA C -2.327 -10.983 22.208 1.00 . A A . 2 MET CA 1 1 7 7522 1 1 2 MET CB C -0.982 -11.472 22.749 1.00 . A A . 2 MET CB 1 1 7 7523 1 1 2 MET CE C 1.485 -12.837 24.257 1.00 . A A . 2 MET CE 1 1 7 7524 1 1 2 MET CG C -1.099 -11.999 24.180 1.00 . A A . 2 MET CG 1 1 7 7525 1 1 2 MET H H -2.682 -10.754 20.107 1.00 . A A . 2 MET H 1 1 7 7526 1 1 2 MET HA H -3.155 -11.419 22.767 1.00 . A A . 2 MET HA 1 1 7 7527 1 1 2 MET HB2 H -0.592 -12.258 22.103 1.00 . A A . 2 MET HB2 1 1 7 7528 1 1 2 MET HB3 H -0.258 -10.658 22.718 1.00 . A A . 2 MET HB3 1 1 7 7529 1 1 2 MET HE1 H 2.466 -12.860 24.732 1.00 . A A . 2 MET HE1 1 1 7 7530 1 1 2 MET HE2 H 1.606 -12.536 23.217 1.00 . A A . 2 MET HE2 1 1 7 7531 1 1 2 MET HE3 H 1.059 -13.840 24.284 1.00 . A A . 2 MET HE3 1 1 7 7532 1 1 2 MET HG2 H -1.939 -11.525 24.687 1.00 . A A . 2 MET HG2 1 1 7 7533 1 1 2 MET HG3 H -1.289 -13.072 24.171 1.00 . A A . 2 MET HG3 1 1 7 7534 1 1 2 MET N N -2.487 -11.414 20.832 1.00 . A A . 2 MET N 1 1 7 7535 1 1 2 MET O O -3.023 -8.810 21.433 1.00 . A A . 2 MET O 1 1 7 7536 1 1 2 MET SD S 0.406 -11.680 25.116 1.00 . A A . 2 MET SD 1 1 7 7537 1 1 3 GLU C C -3.089 -6.873 23.493 1.00 . A A . 3 GLU C 1 1 7 7538 1 1 3 GLU CA C -1.688 -7.494 23.498 1.00 . A A . 3 GLU CA 1 1 7 7539 1 1 3 GLU CB C -0.831 -6.870 22.393 1.00 . A A . 3 GLU CB 1 1 7 7540 1 1 3 GLU CD C 0.938 -8.585 22.871 1.00 . A A . 3 GLU CD 1 1 7 7541 1 1 3 GLU CG C 0.166 -7.847 21.775 1.00 . A A . 3 GLU CG 1 1 7 7542 1 1 3 GLU H H -1.347 -9.542 24.013 1.00 . A A . 3 GLU H 1 1 7 7543 1 1 3 GLU HA H -1.232 -7.324 24.474 1.00 . A A . 3 GLU HA 1 1 7 7544 1 1 3 GLU HB2 H -1.479 -6.503 21.597 1.00 . A A . 3 GLU HB2 1 1 7 7545 1 1 3 GLU HB3 H -0.289 -6.012 22.798 1.00 . A A . 3 GLU HB3 1 1 7 7546 1 1 3 GLU HG2 H -0.352 -8.569 21.145 1.00 . A A . 3 GLU HG2 1 1 7 7547 1 1 3 GLU HG3 H 0.869 -7.304 21.145 1.00 . A A . 3 GLU HG3 1 1 7 7548 1 1 3 GLU N N -1.772 -8.936 23.340 1.00 . A A . 3 GLU N 1 1 7 7549 1 1 3 GLU O O -4.053 -7.435 22.987 1.00 . A A . 3 GLU O 1 1 7 7550 1 1 3 GLU OE1 O 0.765 -8.246 24.041 1.00 . A A . 3 GLU OE1 1 1 7 7551 1 1 3 GLU OE2 O 1.702 -9.491 22.543 1.00 . A A . 3 GLU OE2 1 1 7 7552 1 1 4 PRO C C -3.696 -4.007 22.340 1.00 . A A . 4 PRO C 1 1 7 7553 1 1 4 PRO CA C -4.055 -4.615 23.699 1.00 . A A . 4 PRO CA 1 1 7 7554 1 1 4 PRO CB C -3.926 -3.537 24.778 1.00 . A A . 4 PRO CB 1 1 7 7555 1 1 4 PRO CD C -2.326 -5.352 25.264 1.00 . A A . 4 PRO CD 1 1 7 7556 1 1 4 PRO CG C -2.812 -3.981 25.737 1.00 . A A . 4 PRO CG 1 1 7 7557 1 1 4 PRO HA H -5.071 -5.007 23.660 1.00 . A A . 4 PRO HA 1 1 7 7558 1 1 4 PRO HB2 H -3.682 -2.574 24.330 1.00 . A A . 4 PRO HB2 1 1 7 7559 1 1 4 PRO HB3 H -4.867 -3.422 25.315 1.00 . A A . 4 PRO HB3 1 1 7 7560 1 1 4 PRO HD2 H -1.273 -5.325 24.985 1.00 . A A . 4 PRO HD2 1 1 7 7561 1 1 4 PRO HD3 H -2.464 -6.111 26.035 1.00 . A A . 4 PRO HD3 1 1 7 7562 1 1 4 PRO HG2 H -1.992 -3.264 25.727 1.00 . A A . 4 PRO HG2 1 1 7 7563 1 1 4 PRO HG3 H -3.189 -4.042 26.757 1.00 . A A . 4 PRO HG3 1 1 7 7564 1 1 4 PRO N N -3.138 -5.670 24.103 1.00 . A A . 4 PRO N 1 1 7 7565 1 1 4 PRO O O -3.858 -2.815 22.105 1.00 . A A . 4 PRO O 1 1 7 7566 1 1 5 VAL C C -4.212 -3.942 19.476 1.00 . A A . 5 VAL C 1 1 7 7567 1 1 5 VAL CA C -2.918 -4.449 20.119 1.00 . A A . 5 VAL CA 1 1 7 7568 1 1 5 VAL CB C -2.318 -5.567 19.255 1.00 . A A . 5 VAL CB 1 1 7 7569 1 1 5 VAL CG1 C -2.822 -6.965 19.624 1.00 . A A . 5 VAL CG1 1 1 7 7570 1 1 5 VAL CG2 C -2.552 -5.310 17.765 1.00 . A A . 5 VAL CG2 1 1 7 7571 1 1 5 VAL H H -3.017 -5.842 21.755 1.00 . A A . 5 VAL H 1 1 7 7572 1 1 5 VAL HA H -2.196 -3.639 20.236 1.00 . A A . 5 VAL HA 1 1 7 7573 1 1 5 VAL HB H -1.243 -5.551 19.420 1.00 . A A . 5 VAL HB 1 1 7 7574 1 1 5 VAL HG11 H -3.612 -6.946 20.374 1.00 . A A . 5 VAL HG11 1 1 7 7575 1 1 5 VAL HG12 H -3.221 -7.469 18.744 1.00 . A A . 5 VAL HG12 1 1 7 7576 1 1 5 VAL HG13 H -2.000 -7.573 20.001 1.00 . A A . 5 VAL HG13 1 1 7 7577 1 1 5 VAL HG21 H -2.789 -4.264 17.574 1.00 . A A . 5 VAL HG21 1 1 7 7578 1 1 5 VAL HG22 H -1.667 -5.568 17.183 1.00 . A A . 5 VAL HG22 1 1 7 7579 1 1 5 VAL HG23 H -3.383 -5.913 17.398 1.00 . A A . 5 VAL HG23 1 1 7 7580 1 1 5 VAL N N -3.200 -4.902 21.468 1.00 . A A . 5 VAL N 1 1 7 7581 1 1 5 VAL O O -5.124 -4.709 19.194 1.00 . A A . 5 VAL O 1 1 7 7582 1 1 6 ASP C C -6.706 -2.686 19.437 1.00 . A A . 6 ASP C 1 1 7 7583 1 1 6 ASP CA C -5.419 -1.895 19.742 1.00 . A A . 6 ASP CA 1 1 7 7584 1 1 6 ASP CB C -5.468 -0.441 19.257 1.00 . A A . 6 ASP CB 1 1 7 7585 1 1 6 ASP CG C -6.851 0.162 19.516 1.00 . A A . 6 ASP CG 1 1 7 7586 1 1 6 ASP H H -3.391 -2.149 19.015 1.00 . A A . 6 ASP H 1 1 7 7587 1 1 6 ASP HA H -5.305 -1.856 20.818 1.00 . A A . 6 ASP HA 1 1 7 7588 1 1 6 ASP HB2 H -4.712 0.167 19.730 1.00 . A A . 6 ASP HB2 1 1 7 7589 1 1 6 ASP HB3 H -5.209 -0.319 18.227 1.00 . A A . 6 ASP HB3 1 1 7 7590 1 1 6 ASP N N -4.239 -2.610 19.273 1.00 . A A . 6 ASP N 1 1 7 7591 1 1 6 ASP O O -7.298 -3.294 20.321 1.00 . A A . 6 ASP O 1 1 7 7592 1 1 6 ASP OD1 O -7.556 -0.340 20.390 1.00 . A A . 6 ASP OD1 1 1 7 7593 1 1 6 ASP OD2 O -7.207 1.126 18.840 1.00 . A A . 6 ASP OD2 1 1 7 7594 1 1 7 PRO C C -5.275 -2.975 16.491 1.00 . A A . 7 PRO C 1 1 7 7595 1 1 7 PRO CA C -6.575 -3.518 17.099 1.00 . A A . 7 PRO CA 1 1 7 7596 1 1 7 PRO CB C -7.644 -3.516 16.002 1.00 . A A . 7 PRO CB 1 1 7 7597 1 1 7 PRO CD C -8.273 -1.877 17.734 1.00 . A A . 7 PRO CD 1 1 7 7598 1 1 7 PRO CG C -8.679 -2.445 16.372 1.00 . A A . 7 PRO CG 1 1 7 7599 1 1 7 PRO HA H -6.415 -4.525 17.483 1.00 . A A . 7 PRO HA 1 1 7 7600 1 1 7 PRO HB2 H -7.198 -3.287 15.035 1.00 . A A . 7 PRO HB2 1 1 7 7601 1 1 7 PRO HB3 H -8.116 -4.496 15.926 1.00 . A A . 7 PRO HB3 1 1 7 7602 1 1 7 PRO HD2 H -8.006 -0.824 17.658 1.00 . A A . 7 PRO HD2 1 1 7 7603 1 1 7 PRO HD3 H -9.075 -1.982 18.465 1.00 . A A . 7 PRO HD3 1 1 7 7604 1 1 7 PRO HG2 H -8.696 -1.657 15.620 1.00 . A A . 7 PRO HG2 1 1 7 7605 1 1 7 PRO HG3 H -9.679 -2.878 16.418 1.00 . A A . 7 PRO HG3 1 1 7 7606 1 1 7 PRO N N -7.117 -2.655 18.147 1.00 . A A . 7 PRO N 1 1 7 7607 1 1 7 PRO O O -4.335 -3.696 16.178 1.00 . A A . 7 PRO O 1 1 7 7608 1 1 8 CYS C C -2.962 -1.002 16.584 1.00 . A A . 8 CYS C 1 1 7 7609 1 1 8 CYS CA C -4.248 -0.863 15.779 1.00 . A A . 8 CYS CA 1 1 7 7610 1 1 8 CYS CB C -4.667 0.604 15.700 1.00 . A A . 8 CYS CB 1 1 7 7611 1 1 8 CYS H H -6.030 -1.161 16.879 1.00 . A A . 8 CYS H 1 1 7 7612 1 1 8 CYS HA H -4.072 -1.265 14.799 1.00 . A A . 8 CYS HA 1 1 7 7613 1 1 8 CYS HB2 H -5.323 0.748 14.838 1.00 . A A . 8 CYS HB2 1 1 7 7614 1 1 8 CYS HB3 H -5.234 0.863 16.596 1.00 . A A . 8 CYS HB3 1 1 7 7615 1 1 8 CYS N N -5.324 -1.641 16.357 1.00 . A A . 8 CYS N 1 1 7 7616 1 1 8 CYS O O -2.081 -1.787 16.258 1.00 . A A . 8 CYS O 1 1 7 7617 1 1 8 CYS SG S -3.262 1.733 15.553 1.00 . A A . 8 CYS SG 1 1 7 7618 1 1 9 PHE C C -1.129 -1.540 18.627 1.00 . A A . 9 PHE C 1 1 7 7619 1 1 9 PHE CA C -1.767 -0.153 18.522 1.00 . A A . 9 PHE CA 1 1 7 7620 1 1 9 PHE CB C -2.217 0.294 19.904 1.00 . A A . 9 PHE CB 1 1 7 7621 1 1 9 PHE CD1 C -0.076 1.430 20.693 1.00 . A A . 9 PHE CD1 1 1 7 7622 1 1 9 PHE CD2 C -0.923 -0.555 21.932 1.00 . A A . 9 PHE CD2 1 1 7 7623 1 1 9 PHE CE1 C 1.038 1.523 21.600 1.00 . A A . 9 PHE CE1 1 1 7 7624 1 1 9 PHE CE2 C 0.189 -0.464 22.841 1.00 . A A . 9 PHE CE2 1 1 7 7625 1 1 9 PHE CG C -1.060 0.391 20.854 1.00 . A A . 9 PHE CG 1 1 7 7626 1 1 9 PHE CZ C 1.169 0.575 22.674 1.00 . A A . 9 PHE CZ 1 1 7 7627 1 1 9 PHE H H -3.673 0.470 17.790 1.00 . A A . 9 PHE H 1 1 7 7628 1 1 9 PHE HA H -1.057 0.553 18.105 1.00 . A A . 9 PHE HA 1 1 7 7629 1 1 9 PHE HB2 H -2.717 1.265 19.846 1.00 . A A . 9 PHE HB2 1 1 7 7630 1 1 9 PHE HB3 H -2.924 -0.449 20.270 1.00 . A A . 9 PHE HB3 1 1 7 7631 1 1 9 PHE HD1 H -0.174 2.142 19.886 1.00 . A A . 9 PHE HD1 1 1 7 7632 1 1 9 PHE HD2 H -1.657 -1.337 22.059 1.00 . A A . 9 PHE HD2 1 1 7 7633 1 1 9 PHE HE1 H 1.773 2.304 21.474 1.00 . A A . 9 PHE HE1 1 1 7 7634 1 1 9 PHE HE2 H 0.288 -1.176 23.647 1.00 . A A . 9 PHE HE2 1 1 7 7635 1 1 9 PHE HZ H 2.004 0.645 23.355 1.00 . A A . 9 PHE HZ 1 1 7 7636 1 1 9 PHE N N -2.920 -0.170 17.639 1.00 . A A . 9 PHE N 1 1 7 7637 1 1 9 PHE O O -1.765 -2.562 18.408 1.00 . A A . 9 PHE O 1 1 7 7638 1 1 10 ARG C C 1.620 -2.480 17.200 1.00 . A A . 10 ARG C 1 1 7 7639 1 1 10 ARG CA C 1.109 -2.526 18.648 1.00 . A A . 10 ARG CA 1 1 7 7640 1 1 10 ARG CB C 0.560 -3.888 18.978 1.00 . A A . 10 ARG CB 1 1 7 7641 1 1 10 ARG CD C 2.651 -5.320 19.226 1.00 . A A . 10 ARG CD 1 1 7 7642 1 1 10 ARG CG C 1.511 -4.580 19.928 1.00 . A A . 10 ARG CG 1 1 7 7643 1 1 10 ARG CZ C 4.227 -7.015 19.863 1.00 . A A . 10 ARG CZ 1 1 7 7644 1 1 10 ARG H H 0.478 -0.718 19.566 1.00 . A A . 10 ARG H 1 1 7 7645 1 1 10 ARG HA H 1.934 -2.369 19.323 1.00 . A A . 10 ARG HA 1 1 7 7646 1 1 10 ARG HB2 H -0.383 -3.767 19.501 1.00 . A A . 10 ARG HB2 1 1 7 7647 1 1 10 ARG HB3 H 0.395 -4.463 18.069 1.00 . A A . 10 ARG HB3 1 1 7 7648 1 1 10 ARG HD2 H 2.380 -5.619 18.214 1.00 . A A . 10 ARG HD2 1 1 7 7649 1 1 10 ARG HD3 H 3.559 -4.719 19.187 1.00 . A A . 10 ARG HD3 1 1 7 7650 1 1 10 ARG HE H 2.290 -7.002 20.508 1.00 . A A . 10 ARG HE 1 1 7 7651 1 1 10 ARG HG2 H 1.879 -3.840 20.627 1.00 . A A . 10 ARG HG2 1 1 7 7652 1 1 10 ARG HG3 H 0.930 -5.231 20.543 1.00 . A A . 10 ARG HG3 1 1 7 7653 1 1 10 ARG HH11 H 5.388 -5.745 18.798 1.00 . A A . 10 ARG HH11 1 1 7 7654 1 1 10 ARG HH12 H 5.193 -7.323 18.111 1.00 . A A . 10 ARG HH12 1 1 7 7655 1 1 10 ARG HH21 H 4.939 -7.487 21.698 1.00 . A A . 10 ARG HH21 1 1 7 7656 1 1 10 ARG HH22 H 4.788 -8.816 20.599 1.00 . A A . 10 ARG HH22 1 1 7 7657 1 1 10 ARG N N 0.162 -1.479 19.003 1.00 . A A . 10 ARG N 1 1 7 7658 1 1 10 ARG NE N 2.975 -6.533 19.953 1.00 . A A . 10 ARG NE 1 1 7 7659 1 1 10 ARG NH1 N 5.000 -6.666 18.839 1.00 . A A . 10 ARG NH1 1 1 7 7660 1 1 10 ARG NH2 N 4.690 -7.841 20.797 1.00 . A A . 10 ARG NH2 1 1 7 7661 1 1 10 ARG O O 2.572 -3.162 16.841 1.00 . A A . 10 ARG O 1 1 7 7662 1 1 11 ALA C C 1.380 -2.846 14.314 1.00 . A A . 11 ALA C 1 1 7 7663 1 1 11 ALA CA C 0.321 -2.163 15.202 1.00 . A A . 11 ALA CA 1 1 7 7664 1 1 11 ALA CB C -0.434 -1.040 14.477 1.00 . A A . 11 ALA CB 1 1 7 7665 1 1 11 ALA H H 0.606 -0.851 16.929 1.00 . A A . 11 ALA H 1 1 7 7666 1 1 11 ALA HA H -0.394 -2.914 15.536 1.00 . A A . 11 ALA HA 1 1 7 7667 1 1 11 ALA HB1 H -1.240 -1.448 13.866 1.00 . A A . 11 ALA HB1 1 1 7 7668 1 1 11 ALA HB2 H -0.881 -0.348 15.191 1.00 . A A . 11 ALA HB2 1 1 7 7669 1 1 11 ALA HB3 H 0.222 -0.463 13.828 1.00 . A A . 11 ALA HB3 1 1 7 7670 1 1 11 ALA N N 0.933 -1.641 16.413 1.00 . A A . 11 ALA N 1 1 7 7671 1 1 11 ALA O O 1.995 -3.832 14.702 1.00 . A A . 11 ALA O 1 1 7 7672 1 1 12 ASN C C 2.677 -0.896 11.447 1.00 . A A . 12 ASN C 1 1 7 7673 1 1 12 ASN CA C 2.634 -1.343 12.912 1.00 . A A . 12 ASN CA 1 1 7 7674 1 1 12 ASN CB C 3.960 -1.993 13.309 1.00 . A A . 12 ASN CB 1 1 7 7675 1 1 12 ASN CG C 4.450 -1.419 14.641 1.00 . A A . 12 ASN CG 1 1 7 7676 1 1 12 ASN H H 0.927 -2.508 12.350 1.00 . A A . 12 ASN H 1 1 7 7677 1 1 12 ASN HA H 2.409 -0.481 13.540 1.00 . A A . 12 ASN HA 1 1 7 7678 1 1 12 ASN HB2 H 3.840 -3.071 13.414 1.00 . A A . 12 ASN HB2 1 1 7 7679 1 1 12 ASN HB3 H 4.718 -1.818 12.546 1.00 . A A . 12 ASN HB3 1 1 7 7680 1 1 12 ASN HD21 H 4.772 0.499 14.024 1.00 . A A . 12 ASN HD21 1 1 7 7681 1 1 12 ASN HD22 H 6.101 -0.259 14.877 1.00 . A A . 12 ASN HD22 1 1 7 7682 1 1 12 ASN N N 1.545 -2.283 13.103 1.00 . A A . 12 ASN N 1 1 7 7683 1 1 12 ASN ND2 N 5.170 -0.292 14.500 1.00 . A A . 12 ASN ND2 1 1 7 7684 1 1 12 ASN O O 3.723 -0.854 10.810 1.00 . A A . 12 ASN O 1 1 7 7685 1 1 12 ASN OD1 O 4.201 -1.961 15.710 1.00 . A A . 12 ASN OD1 1 1 7 7686 1 1 13 CYS C C 2.289 1.619 10.276 1.00 . A A . 13 CYS C 1 1 7 7687 1 1 13 CYS CA C 1.211 0.553 10.131 1.00 . A A . 13 CYS CA 1 1 7 7688 1 1 13 CYS CB C -0.158 1.033 10.576 1.00 . A A . 13 CYS CB 1 1 7 7689 1 1 13 CYS H H 0.562 -0.915 11.200 1.00 . A A . 13 CYS H 1 1 7 7690 1 1 13 CYS HA H 1.188 0.165 9.109 1.00 . A A . 13 CYS HA 1 1 7 7691 1 1 13 CYS HB2 H -0.117 1.369 11.607 1.00 . A A . 13 CYS HB2 1 1 7 7692 1 1 13 CYS HB3 H -0.464 1.870 9.975 1.00 . A A . 13 CYS HB3 1 1 7 7693 1 1 13 CYS N N 1.463 -0.569 10.968 1.00 . A A . 13 CYS N 1 1 7 7694 1 1 13 CYS O O 2.626 2.110 11.346 1.00 . A A . 13 CYS O 1 1 7 7695 1 1 13 CYS SG S -1.384 -0.291 10.455 1.00 . A A . 13 CYS SG 1 1 7 7696 1 1 14 GLU C C 3.656 4.102 8.378 1.00 . A A . 14 GLU C 1 1 7 7697 1 1 14 GLU CA C 3.982 2.696 8.903 1.00 . A A . 14 GLU CA 1 1 7 7698 1 1 14 GLU CB C 4.935 1.978 7.955 1.00 . A A . 14 GLU CB 1 1 7 7699 1 1 14 GLU CD C 6.348 3.003 6.161 1.00 . A A . 14 GLU CD 1 1 7 7700 1 1 14 GLU CG C 6.191 2.801 7.669 1.00 . A A . 14 GLU CG 1 1 7 7701 1 1 14 GLU H H 2.280 1.417 8.352 1.00 . A A . 14 GLU H 1 1 7 7702 1 1 14 GLU HA H 4.435 2.774 9.886 1.00 . A A . 14 GLU HA 1 1 7 7703 1 1 14 GLU HB2 H 5.215 1.015 8.380 1.00 . A A . 14 GLU HB2 1 1 7 7704 1 1 14 GLU HB3 H 4.409 1.767 7.028 1.00 . A A . 14 GLU HB3 1 1 7 7705 1 1 14 GLU HG2 H 6.130 3.776 8.153 1.00 . A A . 14 GLU HG2 1 1 7 7706 1 1 14 GLU HG3 H 7.077 2.296 8.053 1.00 . A A . 14 GLU HG3 1 1 7 7707 1 1 14 GLU N N 2.776 1.906 9.068 1.00 . A A . 14 GLU N 1 1 7 7708 1 1 14 GLU O O 4.284 5.084 8.755 1.00 . A A . 14 GLU O 1 1 7 7709 1 1 14 GLU OE1 O 5.628 3.827 5.601 1.00 . A A . 14 GLU OE1 1 1 7 7710 1 1 14 GLU OE2 O 7.189 2.333 5.563 1.00 . A A . 14 GLU OE2 1 1 7 7711 1 1 15 TYR C C 0.861 4.455 9.091 1.00 . A A . 15 TYR C 1 1 7 7712 1 1 15 TYR CA C 1.505 4.971 7.803 1.00 . A A . 15 TYR CA 1 1 7 7713 1 1 15 TYR CB C 0.538 4.979 6.611 1.00 . A A . 15 TYR CB 1 1 7 7714 1 1 15 TYR CD1 C -1.206 6.785 7.119 1.00 . A A . 15 TYR CD1 1 1 7 7715 1 1 15 TYR CD2 C 0.564 7.231 5.429 1.00 . A A . 15 TYR CD2 1 1 7 7716 1 1 15 TYR CE1 C -1.754 8.097 6.893 1.00 . A A . 15 TYR CE1 1 1 7 7717 1 1 15 TYR CE2 C 0.020 8.543 5.201 1.00 . A A . 15 TYR CE2 1 1 7 7718 1 1 15 TYR CG C -0.045 6.345 6.388 1.00 . A A . 15 TYR CG 1 1 7 7719 1 1 15 TYR CZ C -1.140 8.975 5.933 1.00 . A A . 15 TYR CZ 1 1 7 7720 1 1 15 TYR H H 2.634 3.561 6.674 1.00 . A A . 15 TYR H 1 1 7 7721 1 1 15 TYR HA H 1.895 5.972 7.983 1.00 . A A . 15 TYR HA 1 1 7 7722 1 1 15 TYR HB2 H 1.098 4.713 5.724 1.00 . A A . 15 TYR HB2 1 1 7 7723 1 1 15 TYR HB3 H -0.260 4.235 6.716 1.00 . A A . 15 TYR HB3 1 1 7 7724 1 1 15 TYR HD1 H -1.677 6.131 7.838 1.00 . A A . 15 TYR HD1 1 1 7 7725 1 1 15 TYR HD2 H 1.436 6.907 4.880 1.00 . A A . 15 TYR HD2 1 1 7 7726 1 1 15 TYR HE1 H -2.625 8.421 7.443 1.00 . A A . 15 TYR HE1 1 1 7 7727 1 1 15 TYR HE2 H 0.482 9.203 4.481 1.00 . A A . 15 TYR HE2 1 1 7 7728 1 1 15 TYR HH H -2.175 10.497 6.469 1.00 . A A . 15 TYR HH 1 1 7 7729 1 1 15 TYR N N 2.644 4.136 7.491 1.00 . A A . 15 TYR N 1 1 7 7730 1 1 15 TYR O O 1.531 4.056 10.035 1.00 . A A . 15 TYR O 1 1 7 7731 1 1 15 TYR OH O -1.664 10.233 5.715 1.00 . A A . 15 TYR OH 1 1 7 7732 1 1 16 GLN C C -2.382 3.295 10.066 1.00 . A A . 16 GLN C 1 1 7 7733 1 1 16 GLN CA C -1.182 4.212 10.292 1.00 . A A . 16 GLN CA 1 1 7 7734 1 1 16 GLN CB C -1.589 5.504 10.988 1.00 . A A . 16 GLN CB 1 1 7 7735 1 1 16 GLN CD C -2.155 6.455 13.243 1.00 . A A . 16 GLN CD 1 1 7 7736 1 1 16 GLN CG C -1.550 5.266 12.493 1.00 . A A . 16 GLN CG 1 1 7 7737 1 1 16 GLN H H -0.874 4.798 8.193 1.00 . A A . 16 GLN H 1 1 7 7738 1 1 16 GLN HA H -0.483 3.667 10.914 1.00 . A A . 16 GLN HA 1 1 7 7739 1 1 16 GLN HB2 H -0.910 6.303 10.720 1.00 . A A . 16 GLN HB2 1 1 7 7740 1 1 16 GLN HB3 H -2.593 5.790 10.658 1.00 . A A . 16 GLN HB3 1 1 7 7741 1 1 16 GLN HE21 H -3.950 5.506 13.112 1.00 . A A . 16 GLN HE21 1 1 7 7742 1 1 16 GLN HE22 H -3.969 7.046 13.951 1.00 . A A . 16 GLN HE22 1 1 7 7743 1 1 16 GLN HG2 H -2.100 4.356 12.736 1.00 . A A . 16 GLN HG2 1 1 7 7744 1 1 16 GLN HG3 H -0.519 5.109 12.810 1.00 . A A . 16 GLN HG3 1 1 7 7745 1 1 16 GLN N N -0.477 4.499 9.060 1.00 . A A . 16 GLN N 1 1 7 7746 1 1 16 GLN NE2 N -3.477 6.324 13.455 1.00 . A A . 16 GLN NE2 1 1 7 7747 1 1 16 GLN O O -2.385 2.448 9.188 1.00 . A A . 16 GLN O 1 1 7 7748 1 1 16 GLN OE1 O -1.476 7.411 13.597 1.00 . A A . 16 GLN OE1 1 1 7 7749 1 1 17 CYS C C -5.643 2.614 10.659 1.00 . A A . 17 CYS C 1 1 7 7750 1 1 17 CYS CA C -4.257 2.417 11.281 1.00 . A A . 17 CYS CA 1 1 7 7751 1 1 17 CYS CB C -4.362 2.316 12.803 1.00 . A A . 17 CYS CB 1 1 7 7752 1 1 17 CYS H H -3.279 4.366 11.462 1.00 . A A . 17 CYS H 1 1 7 7753 1 1 17 CYS HA H -3.788 1.523 10.865 1.00 . A A . 17 CYS HA 1 1 7 7754 1 1 17 CYS HB2 H -4.579 3.297 13.225 1.00 . A A . 17 CYS HB2 1 1 7 7755 1 1 17 CYS HB3 H -5.192 1.664 13.073 1.00 . A A . 17 CYS HB3 1 1 7 7756 1 1 17 CYS N N -3.385 3.521 10.932 1.00 . A A . 17 CYS N 1 1 7 7757 1 1 17 CYS O O -6.470 3.387 11.126 1.00 . A A . 17 CYS O 1 1 7 7758 1 1 17 CYS SG S -2.845 1.678 13.558 1.00 . A A . 17 CYS SG 1 1 7 7759 1 1 18 GLN C C -8.289 1.928 9.684 1.00 . A A . 18 GLN C 1 1 7 7760 1 1 18 GLN CA C -7.040 1.910 8.795 1.00 . A A . 18 GLN CA 1 1 7 7761 1 1 18 GLN CB C -7.047 0.731 7.830 1.00 . A A . 18 GLN CB 1 1 7 7762 1 1 18 GLN CD C -8.397 1.229 5.782 1.00 . A A . 18 GLN CD 1 1 7 7763 1 1 18 GLN CG C -8.393 0.513 7.138 1.00 . A A . 18 GLN CG 1 1 7 7764 1 1 18 GLN H H -5.052 1.302 9.226 1.00 . A A . 18 GLN H 1 1 7 7765 1 1 18 GLN HA H -6.992 2.839 8.234 1.00 . A A . 18 GLN HA 1 1 7 7766 1 1 18 GLN HB2 H -6.296 0.934 7.066 1.00 . A A . 18 GLN HB2 1 1 7 7767 1 1 18 GLN HB3 H -6.745 -0.170 8.361 1.00 . A A . 18 GLN HB3 1 1 7 7768 1 1 18 GLN HE21 H -8.078 3.180 6.287 1.00 . A A . 18 GLN HE21 1 1 7 7769 1 1 18 GLN HE22 H -6.829 2.441 5.305 1.00 . A A . 18 GLN HE22 1 1 7 7770 1 1 18 GLN HG2 H -8.566 -0.554 6.988 1.00 . A A . 18 GLN HG2 1 1 7 7771 1 1 18 GLN HG3 H -9.215 0.894 7.740 1.00 . A A . 18 GLN HG3 1 1 7 7772 1 1 18 GLN N N -5.816 1.847 9.570 1.00 . A A . 18 GLN N 1 1 7 7773 1 1 18 GLN NE2 N -7.709 2.388 5.788 1.00 . A A . 18 GLN NE2 1 1 7 7774 1 1 18 GLN O O -9.207 2.711 9.475 1.00 . A A . 18 GLN O 1 1 7 7775 1 1 18 GLN OE1 O -8.980 0.765 4.810 1.00 . A A . 18 GLN OE1 1 1 7 7776 1 1 19 PRO C C -9.387 -0.881 9.483 1.00 . A A . 19 PRO C 1 1 7 7777 1 1 19 PRO CA C -8.324 -0.417 10.488 1.00 . A A . 19 PRO CA 1 1 7 7778 1 1 19 PRO CB C -8.646 -0.993 11.870 1.00 . A A . 19 PRO CB 1 1 7 7779 1 1 19 PRO CD C -8.352 1.443 12.079 1.00 . A A . 19 PRO CD 1 1 7 7780 1 1 19 PRO CG C -8.634 0.168 12.873 1.00 . A A . 19 PRO CG 1 1 7 7781 1 1 19 PRO HA H -7.346 -0.767 10.158 1.00 . A A . 19 PRO HA 1 1 7 7782 1 1 19 PRO HB2 H -9.619 -1.485 11.863 1.00 . A A . 19 PRO HB2 1 1 7 7783 1 1 19 PRO HB3 H -7.903 -1.735 12.150 1.00 . A A . 19 PRO HB3 1 1 7 7784 1 1 19 PRO HD2 H -9.147 2.177 12.208 1.00 . A A . 19 PRO HD2 1 1 7 7785 1 1 19 PRO HD3 H -7.408 1.896 12.379 1.00 . A A . 19 PRO HD3 1 1 7 7786 1 1 19 PRO HG2 H -9.592 0.240 13.387 1.00 . A A . 19 PRO HG2 1 1 7 7787 1 1 19 PRO HG3 H -7.865 0.010 13.629 1.00 . A A . 19 PRO HG3 1 1 7 7788 1 1 19 PRO N N -8.282 1.026 10.689 1.00 . A A . 19 PRO N 1 1 7 7789 1 1 19 PRO O O -10.359 -0.188 9.205 1.00 . A A . 19 PRO O 1 1 7 7790 1 1 20 LEU C C -10.626 -4.062 8.800 1.00 . A A . 20 LEU C 1 1 7 7791 1 1 20 LEU CA C -10.166 -2.748 8.186 1.00 . A A . 20 LEU CA 1 1 7 7792 1 1 20 LEU CB C -9.765 -3.102 6.766 1.00 . A A . 20 LEU CB 1 1 7 7793 1 1 20 LEU CD1 C -11.362 -2.869 4.833 1.00 . A A . 20 LEU CD1 1 1 7 7794 1 1 20 LEU CD2 C -10.885 -5.150 5.791 1.00 . A A . 20 LEU CD2 1 1 7 7795 1 1 20 LEU CG C -11.022 -3.657 6.096 1.00 . A A . 20 LEU CG 1 1 7 7796 1 1 20 LEU H H -8.414 -2.678 9.333 1.00 . A A . 20 LEU H 1 1 7 7797 1 1 20 LEU HA H -11.012 -2.060 8.176 1.00 . A A . 20 LEU HA 1 1 7 7798 1 1 20 LEU HB2 H -9.378 -2.235 6.244 1.00 . A A . 20 LEU HB2 1 1 7 7799 1 1 20 LEU HB3 H -8.983 -3.858 6.749 1.00 . A A . 20 LEU HB3 1 1 7 7800 1 1 20 LEU HD11 H -12.132 -3.379 4.255 1.00 . A A . 20 LEU HD11 1 1 7 7801 1 1 20 LEU HD12 H -11.727 -1.873 5.084 1.00 . A A . 20 LEU HD12 1 1 7 7802 1 1 20 LEU HD13 H -10.481 -2.756 4.201 1.00 . A A . 20 LEU HD13 1 1 7 7803 1 1 20 LEU HD21 H -11.385 -5.405 4.857 1.00 . A A . 20 LEU HD21 1 1 7 7804 1 1 20 LEU HD22 H -9.839 -5.436 5.696 1.00 . A A . 20 LEU HD22 1 1 7 7805 1 1 20 LEU HD23 H -11.333 -5.754 6.580 1.00 . A A . 20 LEU HD23 1 1 7 7806 1 1 20 LEU HG H -11.836 -3.542 6.825 1.00 . A A . 20 LEU HG 1 1 7 7807 1 1 20 LEU N N -9.143 -2.109 8.980 1.00 . A A . 20 LEU N 1 1 7 7808 1 1 20 LEU O O -10.300 -5.160 8.376 1.00 . A A . 20 LEU O 1 1 7 7809 1 1 21 ASN C C -12.575 -5.987 9.262 1.00 . A A . 21 ASN C 1 1 7 7810 1 1 21 ASN CA C -12.474 -4.796 10.226 1.00 . A A . 21 ASN CA 1 1 7 7811 1 1 21 ASN CB C -13.862 -4.181 10.265 1.00 . A A . 21 ASN CB 1 1 7 7812 1 1 21 ASN CG C -14.154 -3.578 11.641 1.00 . A A . 21 ASN CG 1 1 7 7813 1 1 21 ASN H H -11.401 -2.847 9.944 1.00 . A A . 21 ASN H 1 1 7 7814 1 1 21 ASN HA H -12.182 -5.115 11.223 1.00 . A A . 21 ASN HA 1 1 7 7815 1 1 21 ASN HB2 H -13.963 -3.407 9.502 1.00 . A A . 21 ASN HB2 1 1 7 7816 1 1 21 ASN HB3 H -14.574 -4.987 10.063 1.00 . A A . 21 ASN HB3 1 1 7 7817 1 1 21 ASN HD21 H -16.176 -3.679 11.356 1.00 . A A . 21 ASN HD21 1 1 7 7818 1 1 21 ASN N N -11.481 -3.822 9.780 1.00 . A A . 21 ASN N 1 1 7 7819 1 1 21 ASN ND2 N -15.426 -3.159 11.763 1.00 . A A . 21 ASN ND2 1 1 7 7820 1 1 21 ASN O O -13.033 -5.851 8.134 1.00 . A A . 21 ASN O 1 1 7 7821 1 1 21 ASN OD1 O -13.297 -3.502 12.512 1.00 . A A . 21 ASN OD1 1 1 7 7822 1 1 22 GLN C C -11.592 -8.617 11.614 1.00 . A A . 22 GLN C 1 1 7 7823 1 1 22 GLN CA C -12.663 -7.727 10.976 1.00 . A A . 22 GLN CA 1 1 7 7824 1 1 22 GLN CB C -13.894 -8.570 10.636 1.00 . A A . 22 GLN CB 1 1 7 7825 1 1 22 GLN CD C -16.333 -8.961 11.026 1.00 . A A . 22 GLN CD 1 1 7 7826 1 1 22 GLN CG C -15.184 -7.963 11.188 1.00 . A A . 22 GLN CG 1 1 7 7827 1 1 22 GLN H H -11.517 -7.662 9.173 1.00 . A A . 22 GLN H 1 1 7 7828 1 1 22 GLN HA H -12.915 -6.909 11.649 1.00 . A A . 22 GLN HA 1 1 7 7829 1 1 22 GLN HB2 H -13.975 -8.675 9.555 1.00 . A A . 22 GLN HB2 1 1 7 7830 1 1 22 GLN HB3 H -13.766 -9.576 11.036 1.00 . A A . 22 GLN HB3 1 1 7 7831 1 1 22 GLN HE21 H -17.663 -7.891 9.919 1.00 . A A . 22 GLN HE21 1 1 7 7832 1 1 22 GLN HE22 H -18.236 -8.413 11.492 1.00 . A A . 22 GLN HE22 1 1 7 7833 1 1 22 GLN HG2 H -15.074 -7.717 12.244 1.00 . A A . 22 GLN HG2 1 1 7 7834 1 1 22 GLN HG3 H -15.435 -7.045 10.656 1.00 . A A . 22 GLN HG3 1 1 7 7835 1 1 22 GLN N N -12.129 -7.147 9.759 1.00 . A A . 22 GLN N 1 1 7 7836 1 1 22 GLN NE2 N -17.517 -8.368 10.791 1.00 . A A . 22 GLN NE2 1 1 7 7837 1 1 22 GLN O O -11.540 -9.821 11.391 1.00 . A A . 22 GLN O 1 1 7 7838 1 1 22 GLN OE1 O -16.155 -10.171 11.107 1.00 . A A . 22 GLN OE1 1 1 7 7839 1 1 23 THR C C -8.907 -7.496 10.860 1.00 . A A . 23 THR C 1 1 7 7840 1 1 23 THR CA C -9.912 -6.907 11.852 1.00 . A A . 23 THR CA 1 1 7 7841 1 1 23 THR CB C -9.205 -6.141 12.971 1.00 . A A . 23 THR CB 1 1 7 7842 1 1 23 THR CG2 C -10.204 -5.491 13.929 1.00 . A A . 23 THR CG2 1 1 7 7843 1 1 23 THR H H -10.718 -8.145 13.400 1.00 . A A . 23 THR H 1 1 7 7844 1 1 23 THR HA H -10.575 -6.247 11.302 1.00 . A A . 23 THR HA 1 1 7 7845 1 1 23 THR HB H -8.572 -5.365 12.539 1.00 . A A . 23 THR HB 1 1 7 7846 1 1 23 THR HG1 H -8.164 -6.593 14.504 1.00 . A A . 23 THR HG1 1 1 7 7847 1 1 23 THR HG21 H -11.216 -5.846 13.733 1.00 . A A . 23 THR HG21 1 1 7 7848 1 1 23 THR HG22 H -9.960 -5.723 14.966 1.00 . A A . 23 THR HG22 1 1 7 7849 1 1 23 THR HG23 H -10.201 -4.407 13.817 1.00 . A A . 23 THR HG23 1 1 7 7850 1 1 23 THR N N -10.748 -7.948 12.420 1.00 . A A . 23 THR N 1 1 7 7851 1 1 23 THR O O -8.178 -8.439 11.145 1.00 . A A . 23 THR O 1 1 7 7852 1 1 23 THR OG1 O -8.372 -7.020 13.684 1.00 . A A . 23 THR OG1 1 1 7 7853 1 1 24 SER C C -6.511 -6.281 9.863 1.00 . A A . 24 SER C 1 1 7 7854 1 1 24 SER CA C -7.691 -6.612 8.954 1.00 . A A . 24 SER CA 1 1 7 7855 1 1 24 SER CB C -7.870 -5.506 7.944 1.00 . A A . 24 SER CB 1 1 7 7856 1 1 24 SER H H -9.809 -6.514 9.322 1.00 . A A . 24 SER H 1 1 7 7857 1 1 24 SER HA H -7.477 -7.515 8.436 1.00 . A A . 24 SER HA 1 1 7 7858 1 1 24 SER HB2 H -8.606 -5.802 7.203 1.00 . A A . 24 SER HB2 1 1 7 7859 1 1 24 SER HB3 H -8.222 -4.592 8.424 1.00 . A A . 24 SER HB3 1 1 7 7860 1 1 24 SER HG H -6.693 -4.360 6.982 1.00 . A A . 24 SER HG 1 1 7 7861 1 1 24 SER N N -8.937 -6.858 9.674 1.00 . A A . 24 SER N 1 1 7 7862 1 1 24 SER O O -5.373 -6.689 9.665 1.00 . A A . 24 SER O 1 1 7 7863 1 1 24 SER OG O -6.659 -5.259 7.283 1.00 . A A . 24 SER OG 1 1 7 7864 1 1 25 TYR C C -5.293 -3.783 10.143 1.00 . A A . 25 TYR C 1 1 7 7865 1 1 25 TYR CA C -6.582 -4.092 10.887 1.00 . A A . 25 TYR CA 1 1 7 7866 1 1 25 TYR CB C -6.453 -3.566 12.312 1.00 . A A . 25 TYR CB 1 1 7 7867 1 1 25 TYR CD1 C -4.078 -4.251 12.927 1.00 . A A . 25 TYR CD1 1 1 7 7868 1 1 25 TYR CD2 C -5.988 -5.306 14.123 1.00 . A A . 25 TYR CD2 1 1 7 7869 1 1 25 TYR CE1 C -3.154 -5.017 13.722 1.00 . A A . 25 TYR CE1 1 1 7 7870 1 1 25 TYR CE2 C -5.068 -6.076 14.917 1.00 . A A . 25 TYR CE2 1 1 7 7871 1 1 25 TYR CG C -5.497 -4.385 13.130 1.00 . A A . 25 TYR CG 1 1 7 7872 1 1 25 TYR CZ C -3.651 -5.931 14.716 1.00 . A A . 25 TYR CZ 1 1 7 7873 1 1 25 TYR H H -7.796 -5.865 11.151 1.00 . A A . 25 TYR H 1 1 7 7874 1 1 25 TYR HA H -7.410 -3.606 10.362 1.00 . A A . 25 TYR HA 1 1 7 7875 1 1 25 TYR HB2 H -6.087 -2.537 12.285 1.00 . A A . 25 TYR HB2 1 1 7 7876 1 1 25 TYR HB3 H -7.438 -3.562 12.773 1.00 . A A . 25 TYR HB3 1 1 7 7877 1 1 25 TYR HD1 H -3.708 -3.583 12.163 1.00 . A A . 25 TYR HD1 1 1 7 7878 1 1 25 TYR HD2 H -7.052 -5.419 14.267 1.00 . A A . 25 TYR HD2 1 1 7 7879 1 1 25 TYR HE1 H -2.090 -4.904 13.573 1.00 . A A . 25 TYR HE1 1 1 7 7880 1 1 25 TYR HE2 H -5.440 -6.760 15.665 1.00 . A A . 25 TYR HE2 1 1 7 7881 1 1 25 TYR HH H -1.907 -6.641 15.075 1.00 . A A . 25 TYR HH 1 1 7 7882 1 1 25 TYR N N -6.913 -5.506 10.866 1.00 . A A . 25 TYR N 1 1 7 7883 1 1 25 TYR O O -4.271 -4.449 10.252 1.00 . A A . 25 TYR O 1 1 7 7884 1 1 25 TYR OH O -2.766 -6.670 15.474 1.00 . A A . 25 TYR OH 1 1 7 7885 1 1 26 LEU C C -4.058 -1.250 8.113 1.00 . A A . 26 LEU C 1 1 7 7886 1 1 26 LEU CA C -4.688 -2.638 8.158 1.00 . A A . 26 LEU CA 1 1 7 7887 1 1 26 LEU CB C -5.643 -2.927 6.991 1.00 . A A . 26 LEU CB 1 1 7 7888 1 1 26 LEU CD1 C -4.577 -1.656 5.081 1.00 . A A . 26 LEU CD1 1 1 7 7889 1 1 26 LEU CD2 C -7.067 -1.955 5.179 1.00 . A A . 26 LEU CD2 1 1 7 7890 1 1 26 LEU CG C -5.790 -1.790 6.002 1.00 . A A . 26 LEU CG 1 1 7 7891 1 1 26 LEU H H -6.393 -2.337 9.346 1.00 . A A . 26 LEU H 1 1 7 7892 1 1 26 LEU HA H -3.947 -3.438 8.194 1.00 . A A . 26 LEU HA 1 1 7 7893 1 1 26 LEU HB2 H -5.307 -3.816 6.456 1.00 . A A . 26 LEU HB2 1 1 7 7894 1 1 26 LEU HB3 H -6.644 -3.112 7.395 1.00 . A A . 26 LEU HB3 1 1 7 7895 1 1 26 LEU HD11 H -4.869 -1.767 4.037 1.00 . A A . 26 LEU HD11 1 1 7 7896 1 1 26 LEU HD12 H -4.108 -0.678 5.194 1.00 . A A . 26 LEU HD12 1 1 7 7897 1 1 26 LEU HD13 H -3.832 -2.420 5.303 1.00 . A A . 26 LEU HD13 1 1 7 7898 1 1 26 LEU HD21 H -7.708 -1.079 5.268 1.00 . A A . 26 LEU HD21 1 1 7 7899 1 1 26 LEU HD22 H -6.833 -2.095 4.123 1.00 . A A . 26 LEU HD22 1 1 7 7900 1 1 26 LEU HD23 H -7.630 -2.825 5.514 1.00 . A A . 26 LEU HD23 1 1 7 7901 1 1 26 LEU HG H -5.887 -0.914 6.626 1.00 . A A . 26 LEU HG 1 1 7 7902 1 1 26 LEU N N -5.465 -2.705 9.370 1.00 . A A . 26 LEU N 1 1 7 7903 1 1 26 LEU O O -4.477 -0.341 8.820 1.00 . A A . 26 LEU O 1 1 7 7904 1 1 27 CYS C C -2.388 1.009 6.264 1.00 . A A . 27 CYS C 1 1 7 7905 1 1 27 CYS CA C -2.178 0.026 7.424 1.00 . A A . 27 CYS CA 1 1 7 7906 1 1 27 CYS CB C -0.729 -0.402 7.562 1.00 . A A . 27 CYS CB 1 1 7 7907 1 1 27 CYS H H -2.979 -1.744 6.468 1.00 . A A . 27 CYS H 1 1 7 7908 1 1 27 CYS HA H -2.446 0.483 8.375 1.00 . A A . 27 CYS HA 1 1 7 7909 1 1 27 CYS HB2 H -0.386 -0.937 6.683 1.00 . A A . 27 CYS HB2 1 1 7 7910 1 1 27 CYS HB3 H -0.118 0.496 7.682 1.00 . A A . 27 CYS HB3 1 1 7 7911 1 1 27 CYS N N -3.037 -1.131 7.255 1.00 . A A . 27 CYS N 1 1 7 7912 1 1 27 CYS O O -2.358 0.647 5.095 1.00 . A A . 27 CYS O 1 1 7 7913 1 1 27 CYS SG S -0.565 -1.473 9.010 1.00 . A A . 27 CYS SG 1 1 7 7914 1 1 28 VAL C C -3.492 3.329 4.573 1.00 . A A . 28 VAL C 1 1 7 7915 1 1 28 VAL CA C -3.668 3.068 6.077 1.00 . A A . 28 VAL CA 1 1 7 7916 1 1 28 VAL CB C -3.733 4.424 6.770 1.00 . A A . 28 VAL CB 1 1 7 7917 1 1 28 VAL CG1 C -4.607 5.402 5.988 1.00 . A A . 28 VAL CG1 1 1 7 7918 1 1 28 VAL CG2 C -4.228 4.340 8.212 1.00 . A A . 28 VAL CG2 1 1 7 7919 1 1 28 VAL H H -2.049 2.639 7.427 1.00 . A A . 28 VAL H 1 1 7 7920 1 1 28 VAL HA H -4.557 2.472 6.192 1.00 . A A . 28 VAL HA 1 1 7 7921 1 1 28 VAL HB H -2.705 4.785 6.767 1.00 . A A . 28 VAL HB 1 1 7 7922 1 1 28 VAL HG11 H -5.507 4.904 5.628 1.00 . A A . 28 VAL HG11 1 1 7 7923 1 1 28 VAL HG12 H -4.912 6.233 6.623 1.00 . A A . 28 VAL HG12 1 1 7 7924 1 1 28 VAL HG13 H -4.069 5.801 5.129 1.00 . A A . 28 VAL HG13 1 1 7 7925 1 1 28 VAL HG21 H -5.240 4.731 8.295 1.00 . A A . 28 VAL HG21 1 1 7 7926 1 1 28 VAL HG22 H -4.246 3.312 8.569 1.00 . A A . 28 VAL HG22 1 1 7 7927 1 1 28 VAL HG23 H -3.599 4.947 8.864 1.00 . A A . 28 VAL HG23 1 1 7 7928 1 1 28 VAL N N -2.600 2.271 6.679 1.00 . A A . 28 VAL N 1 1 7 7929 1 1 28 VAL O O -4.447 3.536 3.835 1.00 . A A . 28 VAL O 1 1 7 7930 1 1 29 CYS C C -2.372 4.675 2.147 1.00 . A A . 29 CYS C 1 1 7 7931 1 1 29 CYS CA C -1.532 4.213 3.330 1.00 . A A . 29 CYS CA 1 1 7 7932 1 1 29 CYS CB C -0.265 3.558 2.764 1.00 . A A . 29 CYS CB 1 1 7 7933 1 1 29 CYS H H -1.713 2.638 4.770 1.00 . A A . 29 CYS H 1 1 7 7934 1 1 29 CYS HA H -1.308 5.109 3.909 1.00 . A A . 29 CYS HA 1 1 7 7935 1 1 29 CYS HB2 H -0.317 2.493 2.967 1.00 . A A . 29 CYS HB2 1 1 7 7936 1 1 29 CYS HB3 H -0.263 3.636 1.672 1.00 . A A . 29 CYS HB3 1 1 7 7937 1 1 29 CYS N N -2.209 3.286 4.208 1.00 . A A . 29 CYS N 1 1 7 7938 1 1 29 CYS O O -3.500 4.288 1.870 1.00 . A A . 29 CYS O 1 1 7 7939 1 1 29 CYS SG S 1.310 4.213 3.378 1.00 . A A . 29 CYS SG 1 1 7 7940 1 1 30 ALA C C -3.062 6.619 -0.187 1.00 . A A . 30 ALA C 1 1 7 7941 1 1 30 ALA CA C -2.147 6.814 1.025 1.00 . A A . 30 ALA CA 1 1 7 7942 1 1 30 ALA CB C -0.980 7.714 0.621 1.00 . A A . 30 ALA CB 1 1 7 7943 1 1 30 ALA H H -0.697 5.370 1.857 1.00 . A A . 30 ALA H 1 1 7 7944 1 1 30 ALA HA H -2.670 7.266 1.868 1.00 . A A . 30 ALA HA 1 1 7 7945 1 1 30 ALA HB1 H -0.264 7.811 1.437 1.00 . A A . 30 ALA HB1 1 1 7 7946 1 1 30 ALA HB2 H -0.454 7.304 -0.241 1.00 . A A . 30 ALA HB2 1 1 7 7947 1 1 30 ALA HB3 H -1.330 8.713 0.359 1.00 . A A . 30 ALA HB3 1 1 7 7948 1 1 30 ALA N N -1.610 5.546 1.484 1.00 . A A . 30 ALA N 1 1 7 7949 1 1 30 ALA O O -2.754 7.052 -1.290 1.00 . A A . 30 ALA O 1 1 7 7950 1 1 31 GLU C C -4.307 4.905 -2.143 1.00 . A A . 31 GLU C 1 1 7 7951 1 1 31 GLU CA C -4.581 4.772 -0.639 1.00 . A A . 31 GLU CA 1 1 7 7952 1 1 31 GLU CB C -6.065 4.557 -0.344 1.00 . A A . 31 GLU CB 1 1 7 7953 1 1 31 GLU CD C -6.878 6.448 -1.763 1.00 . A A . 31 GLU CD 1 1 7 7954 1 1 31 GLU CG C -6.973 4.942 -1.509 1.00 . A A . 31 GLU CG 1 1 7 7955 1 1 31 GLU H H -4.783 6.113 0.885 1.00 . A A . 31 GLU H 1 1 7 7956 1 1 31 GLU HA H -4.001 3.949 -0.222 1.00 . A A . 31 GLU HA 1 1 7 7957 1 1 31 GLU HB2 H -6.211 3.524 -0.054 1.00 . A A . 31 GLU HB2 1 1 7 7958 1 1 31 GLU HB3 H -6.362 5.136 0.530 1.00 . A A . 31 GLU HB3 1 1 7 7959 1 1 31 GLU HG2 H -6.673 4.411 -2.411 1.00 . A A . 31 GLU HG2 1 1 7 7960 1 1 31 GLU HG3 H -8.006 4.686 -1.281 1.00 . A A . 31 GLU HG3 1 1 7 7961 1 1 31 GLU N N -4.197 5.953 0.093 1.00 . A A . 31 GLU N 1 1 7 7962 1 1 31 GLU O O -4.239 5.990 -2.709 1.00 . A A . 31 GLU O 1 1 7 7963 1 1 31 GLU OE1 O -7.171 7.218 -0.850 1.00 . A A . 31 GLU OE1 1 1 7 7964 1 1 31 GLU OE2 O -6.512 6.833 -2.872 1.00 . A A . 31 GLU OE2 1 1 7 7965 1 1 32 GLY C C -1.774 3.229 -3.263 1.00 . A A . 32 GLY C 1 1 7 7966 1 1 32 GLY CA C -3.194 3.516 -3.794 1.00 . A A . 32 GLY CA 1 1 7 7967 1 1 32 GLY H H -4.770 2.953 -2.444 1.00 . A A . 32 GLY H 1 1 7 7968 1 1 32 GLY HA2 H -3.533 2.661 -4.379 1.00 . A A . 32 GLY HA2 1 1 7 7969 1 1 32 GLY HA3 H -3.195 4.417 -4.410 1.00 . A A . 32 GLY HA3 1 1 7 7970 1 1 32 GLY N N -4.184 3.707 -2.741 1.00 . A A . 32 GLY N 1 1 7 7971 1 1 32 GLY O O -0.788 3.371 -3.975 1.00 . A A . 32 GLY O 1 1 7 7972 1 1 33 PHE C C -0.841 1.432 -0.241 1.00 . A A . 33 PHE C 1 1 7 7973 1 1 33 PHE CA C -0.500 2.438 -1.341 1.00 . A A . 33 PHE CA 1 1 7 7974 1 1 33 PHE CB C 0.138 3.685 -0.724 1.00 . A A . 33 PHE CB 1 1 7 7975 1 1 33 PHE CD1 C 0.143 5.457 -2.560 1.00 . A A . 33 PHE CD1 1 1 7 7976 1 1 33 PHE CD2 C 2.301 4.460 -1.822 1.00 . A A . 33 PHE CD2 1 1 7 7977 1 1 33 PHE CE1 C 0.850 6.314 -3.474 1.00 . A A . 33 PHE CE1 1 1 7 7978 1 1 33 PHE CE2 C 3.011 5.322 -2.729 1.00 . A A . 33 PHE CE2 1 1 7 7979 1 1 33 PHE CG C 0.866 4.534 -1.723 1.00 . A A . 33 PHE CG 1 1 7 7980 1 1 33 PHE CZ C 2.284 6.247 -3.557 1.00 . A A . 33 PHE CZ 1 1 7 7981 1 1 33 PHE H H -2.600 2.708 -1.489 1.00 . A A . 33 PHE H 1 1 7 7982 1 1 33 PHE HA H 0.143 1.969 -2.086 1.00 . A A . 33 PHE HA 1 1 7 7983 1 1 33 PHE HB2 H -0.643 4.294 -0.266 1.00 . A A . 33 PHE HB2 1 1 7 7984 1 1 33 PHE HB3 H 0.854 3.398 0.046 1.00 . A A . 33 PHE HB3 1 1 7 7985 1 1 33 PHE HD1 H -0.934 5.499 -2.503 1.00 . A A . 33 PHE HD1 1 1 7 7986 1 1 33 PHE HD2 H 2.846 3.750 -1.218 1.00 . A A . 33 PHE HD2 1 1 7 7987 1 1 33 PHE HE1 H 0.304 7.008 -4.097 1.00 . A A . 33 PHE HE1 1 1 7 7988 1 1 33 PHE HE2 H 4.089 5.276 -2.788 1.00 . A A . 33 PHE HE2 1 1 7 7989 1 1 33 PHE HZ H 2.816 6.889 -4.244 1.00 . A A . 33 PHE HZ 1 1 7 7990 1 1 33 PHE N N -1.741 2.800 -1.989 1.00 . A A . 33 PHE N 1 1 7 7991 1 1 33 PHE O O -1.071 1.785 0.909 1.00 . A A . 33 PHE O 1 1 7 7992 1 1 34 ALA C C -1.450 -1.206 1.245 1.00 . A A . 34 ALA C 1 1 7 7993 1 1 34 ALA CA C -1.919 -0.694 -0.123 1.00 . A A . 34 ALA CA 1 1 7 7994 1 1 34 ALA CB C -2.223 -1.819 -1.109 1.00 . A A . 34 ALA CB 1 1 7 7995 1 1 34 ALA H H -0.242 -0.178 -1.361 1.00 . A A . 34 ALA H 1 1 7 7996 1 1 34 ALA HA H -2.796 -0.062 0.019 1.00 . A A . 34 ALA HA 1 1 7 7997 1 1 34 ALA HB1 H -2.723 -2.659 -0.627 1.00 . A A . 34 ALA HB1 1 1 7 7998 1 1 34 ALA HB2 H -2.864 -1.464 -1.915 1.00 . A A . 34 ALA HB2 1 1 7 7999 1 1 34 ALA HB3 H -1.296 -2.175 -1.549 1.00 . A A . 34 ALA HB3 1 1 7 8000 1 1 34 ALA N N -0.890 0.163 -0.680 1.00 . A A . 34 ALA N 1 1 7 8001 1 1 34 ALA O O -1.051 -0.431 2.105 1.00 . A A . 34 ALA O 1 1 7 8002 1 1 35 PRO C C -0.010 -3.679 -0.220 1.00 . A A . 35 PRO C 1 1 7 8003 1 1 35 PRO CA C -0.396 -3.450 1.246 1.00 . A A . 35 PRO CA 1 1 7 8004 1 1 35 PRO CB C -0.861 -4.782 1.843 1.00 . A A . 35 PRO CB 1 1 7 8005 1 1 35 PRO CD C -2.740 -3.186 1.900 1.00 . A A . 35 PRO CD 1 1 7 8006 1 1 35 PRO CG C -2.342 -4.628 2.218 1.00 . A A . 35 PRO CG 1 1 7 8007 1 1 35 PRO HA H 0.468 -3.063 1.785 1.00 . A A . 35 PRO HA 1 1 7 8008 1 1 35 PRO HB2 H -0.733 -5.588 1.120 1.00 . A A . 35 PRO HB2 1 1 7 8009 1 1 35 PRO HB3 H -0.268 -5.033 2.722 1.00 . A A . 35 PRO HB3 1 1 7 8010 1 1 35 PRO HD2 H -3.516 -3.148 1.136 1.00 . A A . 35 PRO HD2 1 1 7 8011 1 1 35 PRO HD3 H -3.103 -2.668 2.788 1.00 . A A . 35 PRO HD3 1 1 7 8012 1 1 35 PRO HG2 H -2.955 -5.327 1.650 1.00 . A A . 35 PRO HG2 1 1 7 8013 1 1 35 PRO HG3 H -2.493 -4.842 3.276 1.00 . A A . 35 PRO HG3 1 1 7 8014 1 1 35 PRO N N -1.530 -2.547 1.412 1.00 . A A . 35 PRO N 1 1 7 8015 1 1 35 PRO O O -0.786 -4.199 -1.013 1.00 . A A . 35 PRO O 1 1 7 8016 1 1 36 ILE C C 1.896 -5.637 -0.764 1.00 . A A . 36 ILE C 1 1 7 8017 1 1 36 ILE CA C 2.187 -4.174 -1.165 1.00 . A A . 36 ILE CA 1 1 7 8018 1 1 36 ILE CB C 3.594 -3.719 -0.766 1.00 . A A . 36 ILE CB 1 1 7 8019 1 1 36 ILE CD1 C 5.586 -5.272 -0.425 1.00 . A A . 36 ILE CD1 1 1 7 8020 1 1 36 ILE CG1 C 4.716 -4.524 -1.423 1.00 . A A . 36 ILE CG1 1 1 7 8021 1 1 36 ILE CG2 C 3.720 -3.613 0.753 1.00 . A A . 36 ILE CG2 1 1 7 8022 1 1 36 ILE H H 1.527 -2.329 -0.327 1.00 . A A . 36 ILE H 1 1 7 8023 1 1 36 ILE HA H 2.039 -4.046 -2.233 1.00 . A A . 36 ILE HA 1 1 7 8024 1 1 36 ILE HB H 3.724 -2.713 -1.145 1.00 . A A . 36 ILE HB 1 1 7 8025 1 1 36 ILE HD11 H 5.042 -5.512 0.484 1.00 . A A . 36 ILE HD11 1 1 7 8026 1 1 36 ILE HD12 H 5.931 -6.206 -0.865 1.00 . A A . 36 ILE HD12 1 1 7 8027 1 1 36 ILE HD13 H 6.450 -4.668 -0.156 1.00 . A A . 36 ILE HD13 1 1 7 8028 1 1 36 ILE HG12 H 4.316 -5.227 -2.145 1.00 . A A . 36 ILE HG12 1 1 7 8029 1 1 36 ILE HG13 H 5.347 -3.843 -1.994 1.00 . A A . 36 ILE HG13 1 1 7 8030 1 1 36 ILE HG21 H 4.762 -3.631 1.068 1.00 . A A . 36 ILE HG21 1 1 7 8031 1 1 36 ILE HG22 H 3.284 -2.678 1.103 1.00 . A A . 36 ILE HG22 1 1 7 8032 1 1 36 ILE HG23 H 3.195 -4.430 1.249 1.00 . A A . 36 ILE HG23 1 1 7 8033 1 1 36 ILE N N 1.241 -3.269 -0.521 1.00 . A A . 36 ILE N 1 1 7 8034 1 1 36 ILE O O 1.198 -5.900 0.207 1.00 . A A . 36 ILE O 1 1 7 8035 1 1 37 PRO C C 3.751 -7.518 0.358 1.00 . A A . 37 PRO C 1 1 7 8036 1 1 37 PRO CA C 3.104 -7.756 -1.000 1.00 . A A . 37 PRO CA 1 1 7 8037 1 1 37 PRO CB C 4.141 -8.146 -2.049 1.00 . A A . 37 PRO CB 1 1 7 8038 1 1 37 PRO CD C 2.562 -6.506 -3.007 1.00 . A A . 37 PRO CD 1 1 7 8039 1 1 37 PRO CG C 3.709 -7.463 -3.358 1.00 . A A . 37 PRO CG 1 1 7 8040 1 1 37 PRO HA H 2.362 -8.547 -0.891 1.00 . A A . 37 PRO HA 1 1 7 8041 1 1 37 PRO HB2 H 5.130 -7.807 -1.737 1.00 . A A . 37 PRO HB2 1 1 7 8042 1 1 37 PRO HB3 H 4.191 -9.225 -2.161 1.00 . A A . 37 PRO HB3 1 1 7 8043 1 1 37 PRO HD2 H 2.770 -5.496 -3.353 1.00 . A A . 37 PRO HD2 1 1 7 8044 1 1 37 PRO HD3 H 1.625 -6.835 -3.457 1.00 . A A . 37 PRO HD3 1 1 7 8045 1 1 37 PRO HG2 H 4.544 -6.917 -3.796 1.00 . A A . 37 PRO HG2 1 1 7 8046 1 1 37 PRO HG3 H 3.381 -8.205 -4.086 1.00 . A A . 37 PRO HG3 1 1 7 8047 1 1 37 PRO N N 2.465 -6.579 -1.555 1.00 . A A . 37 PRO N 1 1 7 8048 1 1 37 PRO O O 3.339 -6.656 1.125 1.00 . A A . 37 PRO O 1 1 7 8049 1 1 38 HIS C C 3.911 -8.625 2.906 1.00 . A A . 38 HIS C 1 1 7 8050 1 1 38 HIS CA C 4.684 -9.263 1.747 1.00 . A A . 38 HIS CA 1 1 7 8051 1 1 38 HIS CB C 6.064 -9.795 2.180 1.00 . A A . 38 HIS CB 1 1 7 8052 1 1 38 HIS CD2 C 7.108 -7.469 1.980 1.00 . A A . 38 HIS CD2 1 1 7 8053 1 1 38 HIS CE1 C 9.270 -7.991 1.800 1.00 . A A . 38 HIS CE1 1 1 7 8054 1 1 38 HIS CG C 7.191 -8.810 2.027 1.00 . A A . 38 HIS CG 1 1 7 8055 1 1 38 HIS H H 5.583 -8.361 0.019 1.00 . A A . 38 HIS H 1 1 7 8056 1 1 38 HIS HA H 4.094 -10.098 1.423 1.00 . A A . 38 HIS HA 1 1 7 8057 1 1 38 HIS HB2 H 5.986 -10.064 3.240 1.00 . A A . 38 HIS HB2 1 1 7 8058 1 1 38 HIS HB3 H 6.300 -10.700 1.613 1.00 . A A . 38 HIS HB3 1 1 7 8059 1 1 38 HIS HD1 H 8.977 -10.088 1.887 1.00 . A A . 38 HIS HD1 1 1 7 8060 1 1 38 HIS HD2 H 6.198 -6.904 2.037 1.00 . A A . 38 HIS HD2 1 1 7 8061 1 1 38 HIS HE1 H 10.345 -7.925 1.655 1.00 . A A . 38 HIS HE1 1 1 7 8062 1 1 38 HIS N N 4.779 -8.352 0.614 1.00 . A A . 38 HIS N 1 1 7 8063 1 1 38 HIS ND1 N 8.614 -9.156 1.905 1.00 . A A . 38 HIS ND1 1 1 7 8064 1 1 38 HIS NE2 N 8.465 -6.915 1.837 1.00 . A A . 38 HIS NE2 1 1 7 8065 1 1 38 HIS O O 2.688 -8.624 2.973 1.00 . A A . 38 HIS O 1 1 7 8066 1 1 39 GLU C C 2.979 -7.273 5.245 1.00 . A A . 39 GLU C 1 1 7 8067 1 1 39 GLU CA C 4.339 -7.977 5.170 1.00 . A A . 39 GLU CA 1 1 7 8068 1 1 39 GLU CB C 5.396 -7.198 5.946 1.00 . A A . 39 GLU CB 1 1 7 8069 1 1 39 GLU CD C 6.035 -9.242 7.235 1.00 . A A . 39 GLU CD 1 1 7 8070 1 1 39 GLU CG C 6.553 -8.099 6.359 1.00 . A A . 39 GLU CG 1 1 7 8071 1 1 39 GLU H H 5.676 -8.159 3.429 1.00 . A A . 39 GLU H 1 1 7 8072 1 1 39 GLU HA H 4.272 -9.002 5.528 1.00 . A A . 39 GLU HA 1 1 7 8073 1 1 39 GLU HB2 H 5.775 -6.392 5.315 1.00 . A A . 39 GLU HB2 1 1 7 8074 1 1 39 GLU HB3 H 4.953 -6.760 6.841 1.00 . A A . 39 GLU HB3 1 1 7 8075 1 1 39 GLU HG2 H 7.027 -8.516 5.475 1.00 . A A . 39 GLU HG2 1 1 7 8076 1 1 39 GLU HG3 H 7.307 -7.531 6.901 1.00 . A A . 39 GLU HG3 1 1 7 8077 1 1 39 GLU N N 4.749 -8.093 3.790 1.00 . A A . 39 GLU N 1 1 7 8078 1 1 39 GLU O O 2.710 -6.317 4.528 1.00 . A A . 39 GLU O 1 1 7 8079 1 1 39 GLU OE1 O 5.348 -8.966 8.218 1.00 . A A . 39 GLU OE1 1 1 7 8080 1 1 39 GLU OE2 O 6.322 -10.397 6.922 1.00 . A A . 39 GLU OE2 1 1 7 8081 1 1 40 PRO C C 1.567 -5.889 7.622 1.00 . A A . 40 PRO C 1 1 7 8082 1 1 40 PRO CA C 1.049 -7.033 6.748 1.00 . A A . 40 PRO CA 1 1 7 8083 1 1 40 PRO CB C 0.269 -8.029 7.612 1.00 . A A . 40 PRO CB 1 1 7 8084 1 1 40 PRO CD C 2.191 -9.189 6.587 1.00 . A A . 40 PRO CD 1 1 7 8085 1 1 40 PRO CG C 0.987 -9.382 7.513 1.00 . A A . 40 PRO CG 1 1 7 8086 1 1 40 PRO HA H 0.417 -6.623 5.960 1.00 . A A . 40 PRO HA 1 1 7 8087 1 1 40 PRO HB2 H 0.234 -7.690 8.647 1.00 . A A . 40 PRO HB2 1 1 7 8088 1 1 40 PRO HB3 H -0.759 -8.116 7.260 1.00 . A A . 40 PRO HB3 1 1 7 8089 1 1 40 PRO HD2 H 3.126 -9.375 7.114 1.00 . A A . 40 PRO HD2 1 1 7 8090 1 1 40 PRO HD3 H 2.139 -9.850 5.722 1.00 . A A . 40 PRO HD3 1 1 7 8091 1 1 40 PRO HG2 H 1.314 -9.713 8.498 1.00 . A A . 40 PRO HG2 1 1 7 8092 1 1 40 PRO HG3 H 0.316 -10.143 7.114 1.00 . A A . 40 PRO HG3 1 1 7 8093 1 1 40 PRO N N 2.132 -7.802 6.157 1.00 . A A . 40 PRO N 1 1 7 8094 1 1 40 PRO O O 1.624 -5.984 8.842 1.00 . A A . 40 PRO O 1 1 7 8095 1 1 41 HIS C C 1.821 -2.335 6.449 1.00 . A A . 41 HIS C 1 1 7 8096 1 1 41 HIS CA C 1.580 -3.493 7.434 1.00 . A A . 41 HIS CA 1 1 7 8097 1 1 41 HIS CB C 2.416 -3.169 8.661 1.00 . A A . 41 HIS CB 1 1 7 8098 1 1 41 HIS CD2 C 4.913 -2.649 8.724 1.00 . A A . 41 HIS CD2 1 1 7 8099 1 1 41 HIS CE1 C 5.773 -4.572 7.992 1.00 . A A . 41 HIS CE1 1 1 7 8100 1 1 41 HIS CG C 3.879 -3.476 8.494 1.00 . A A . 41 HIS CG 1 1 7 8101 1 1 41 HIS H H 2.526 -4.912 6.111 1.00 . A A . 41 HIS H 1 1 7 8102 1 1 41 HIS HA H 0.516 -3.525 7.669 1.00 . A A . 41 HIS HA 1 1 7 8103 1 1 41 HIS HB2 H 2.311 -2.095 8.786 1.00 . A A . 41 HIS HB2 1 1 7 8104 1 1 41 HIS HB3 H 2.023 -3.670 9.548 1.00 . A A . 41 HIS HB3 1 1 7 8105 1 1 41 HIS HD1 H 3.909 -5.566 7.808 1.00 . A A . 41 HIS HD1 1 1 7 8106 1 1 41 HIS HD2 H 4.834 -1.641 9.088 1.00 . A A . 41 HIS HD2 1 1 7 8107 1 1 41 HIS HE1 H 6.462 -5.317 7.602 1.00 . A A . 41 HIS HE1 1 1 7 8108 1 1 41 HIS N N 1.940 -4.808 6.914 1.00 . A A . 41 HIS N 1 1 7 8109 1 1 41 HIS ND1 N 4.444 -4.751 8.032 1.00 . A A . 41 HIS ND1 1 1 7 8110 1 1 41 HIS NE2 N 6.165 -3.351 8.395 1.00 . A A . 41 HIS NE2 1 1 7 8111 1 1 41 HIS O O 1.752 -1.169 6.818 1.00 . A A . 41 HIS O 1 1 7 8112 1 1 42 ARG C C 1.843 -1.062 3.415 1.00 . A A . 42 ARG C 1 1 7 8113 1 1 42 ARG CA C 2.805 -1.758 4.355 1.00 . A A . 42 ARG CA 1 1 7 8114 1 1 42 ARG CB C 3.881 -2.411 3.502 1.00 . A A . 42 ARG CB 1 1 7 8115 1 1 42 ARG CD C 5.597 -4.091 4.290 1.00 . A A . 42 ARG CD 1 1 7 8116 1 1 42 ARG CG C 5.152 -2.629 4.310 1.00 . A A . 42 ARG CG 1 1 7 8117 1 1 42 ARG CZ C 7.984 -4.272 4.480 1.00 . A A . 42 ARG CZ 1 1 7 8118 1 1 42 ARG H H 1.921 -3.662 4.985 1.00 . A A . 42 ARG H 1 1 7 8119 1 1 42 ARG HA H 3.241 -1.018 5.025 1.00 . A A . 42 ARG HA 1 1 7 8120 1 1 42 ARG HB2 H 3.505 -3.334 3.065 1.00 . A A . 42 ARG HB2 1 1 7 8121 1 1 42 ARG HB3 H 4.110 -1.756 2.662 1.00 . A A . 42 ARG HB3 1 1 7 8122 1 1 42 ARG HD2 H 4.832 -4.747 4.705 1.00 . A A . 42 ARG HD2 1 1 7 8123 1 1 42 ARG HD3 H 5.839 -4.427 3.281 1.00 . A A . 42 ARG HD3 1 1 7 8124 1 1 42 ARG HE H 6.724 -4.385 6.087 1.00 . A A . 42 ARG HE 1 1 7 8125 1 1 42 ARG HG2 H 5.937 -1.991 3.897 1.00 . A A . 42 ARG HG2 1 1 7 8126 1 1 42 ARG HG3 H 4.960 -2.304 5.337 1.00 . A A . 42 ARG HG3 1 1 7 8127 1 1 42 ARG HH11 H 8.247 -2.773 3.145 1.00 . A A . 42 ARG HH11 1 1 7 8128 1 1 42 ARG HH12 H 8.067 -4.352 2.458 1.00 . A A . 42 ARG HH12 1 1 7 8129 1 1 42 ARG HH21 H 8.992 -5.716 5.479 1.00 . A A . 42 ARG HH21 1 1 7 8130 1 1 42 ARG HH22 H 9.890 -4.270 5.161 1.00 . A A . 42 ARG HH22 1 1 7 8131 1 1 42 ARG N N 2.115 -2.711 5.200 1.00 . A A . 42 ARG N 1 1 7 8132 1 1 42 ARG NE N 6.789 -4.263 5.097 1.00 . A A . 42 ARG NE 1 1 7 8133 1 1 42 ARG NH1 N 8.110 -3.756 3.260 1.00 . A A . 42 ARG NH1 1 1 7 8134 1 1 42 ARG NH2 N 9.043 -4.796 5.090 1.00 . A A . 42 ARG NH2 1 1 7 8135 1 1 42 ARG O O 0.705 -1.460 3.205 1.00 . A A . 42 ARG O 1 1 7 8136 1 1 43 CYS C C 3.424 -0.018 0.654 1.00 . A A . 43 CYS C 1 1 7 8137 1 1 43 CYS CA C 2.226 0.396 1.509 1.00 . A A . 43 CYS CA 1 1 7 8138 1 1 43 CYS CB C 2.042 1.906 1.490 1.00 . A A . 43 CYS CB 1 1 7 8139 1 1 43 CYS H H 2.912 0.646 3.483 1.00 . A A . 43 CYS H 1 1 7 8140 1 1 43 CYS HA H 1.315 -0.092 1.163 1.00 . A A . 43 CYS HA 1 1 7 8141 1 1 43 CYS HB2 H 2.448 2.332 0.573 1.00 . A A . 43 CYS HB2 1 1 7 8142 1 1 43 CYS HB3 H 0.976 2.055 1.497 1.00 . A A . 43 CYS HB3 1 1 7 8143 1 1 43 CYS N N 2.428 0.018 2.884 1.00 . A A . 43 CYS N 1 1 7 8144 1 1 43 CYS O O 4.516 -0.277 1.145 1.00 . A A . 43 CYS O 1 1 7 8145 1 1 43 CYS SG S 2.716 2.788 2.924 1.00 . A A . 43 CYS SG 1 1 7 8146 1 1 44 GLN C C 3.618 0.217 -3.021 1.00 . A A . 44 GLN C 1 1 7 8147 1 1 44 GLN CA C 4.204 0.158 -1.610 1.00 . A A . 44 GLN CA 1 1 7 8148 1 1 44 GLN CB C 5.239 -0.962 -1.509 1.00 . A A . 44 GLN CB 1 1 7 8149 1 1 44 GLN CD C 7.662 -1.427 -1.078 1.00 . A A . 44 GLN CD 1 1 7 8150 1 1 44 GLN CG C 6.665 -0.440 -1.688 1.00 . A A . 44 GLN CG 1 1 7 8151 1 1 44 GLN H H 2.188 -0.153 -0.968 1.00 . A A . 44 GLN H 1 1 7 8152 1 1 44 GLN HA H 4.648 1.123 -1.366 1.00 . A A . 44 GLN HA 1 1 7 8153 1 1 44 GLN HB2 H 5.152 -1.460 -0.544 1.00 . A A . 44 GLN HB2 1 1 7 8154 1 1 44 GLN HB3 H 5.030 -1.713 -2.270 1.00 . A A . 44 GLN HB3 1 1 7 8155 1 1 44 GLN HE21 H 6.891 -2.943 -2.199 1.00 . A A . 44 GLN HE21 1 1 7 8156 1 1 44 GLN HE22 H 7.612 -3.419 -0.672 1.00 . A A . 44 GLN HE22 1 1 7 8157 1 1 44 GLN HG2 H 6.897 -0.311 -2.745 1.00 . A A . 44 GLN HG2 1 1 7 8158 1 1 44 GLN HG3 H 6.785 0.529 -1.202 1.00 . A A . 44 GLN HG3 1 1 7 8159 1 1 44 GLN N N 3.133 -0.054 -0.657 1.00 . A A . 44 GLN N 1 1 7 8160 1 1 44 GLN NE2 N 7.361 -2.712 -1.340 1.00 . A A . 44 GLN NE2 1 1 7 8161 1 1 44 GLN O O 3.246 -0.786 -3.618 1.00 . A A . 44 GLN O 1 1 7 8162 1 1 44 GLN OE1 O 8.625 -1.051 -0.421 1.00 . A A . 44 GLN OE1 1 1 7 8163 1 1 45 MET C C 1.742 0.828 -5.009 1.00 . A A . 45 MET C 1 1 7 8164 1 1 45 MET CA C 2.366 1.945 -4.157 1.00 . A A . 45 MET CA 1 1 7 8165 1 1 45 MET CB C 2.743 3.149 -5.023 1.00 . A A . 45 MET CB 1 1 7 8166 1 1 45 MET CE C 2.559 1.060 -8.441 1.00 . A A . 45 MET CE 1 1 7 8167 1 1 45 MET CG C 3.166 2.735 -6.427 1.00 . A A . 45 MET CG 1 1 7 8168 1 1 45 MET H H 4.319 2.100 -3.293 1.00 . A A . 45 MET H 1 1 7 8169 1 1 45 MET HA H 1.675 2.241 -3.368 1.00 . A A . 45 MET HA 1 1 7 8170 1 1 45 MET HB2 H 1.910 3.851 -5.078 1.00 . A A . 45 MET HB2 1 1 7 8171 1 1 45 MET HB3 H 3.572 3.683 -4.560 1.00 . A A . 45 MET HB3 1 1 7 8172 1 1 45 MET HE1 H 3.621 1.023 -8.198 1.00 . A A . 45 MET HE1 1 1 7 8173 1 1 45 MET HE2 H 2.130 0.073 -8.274 1.00 . A A . 45 MET HE2 1 1 7 8174 1 1 45 MET HE3 H 2.450 1.324 -9.490 1.00 . A A . 45 MET HE3 1 1 7 8175 1 1 45 MET HG2 H 3.702 3.547 -6.918 1.00 . A A . 45 MET HG2 1 1 7 8176 1 1 45 MET HG3 H 3.844 1.883 -6.377 1.00 . A A . 45 MET HG3 1 1 7 8177 1 1 45 MET N N 3.569 1.471 -3.498 1.00 . A A . 45 MET N 1 1 7 8178 1 1 45 MET O O 2.370 0.280 -5.907 1.00 . A A . 45 MET O 1 1 7 8179 1 1 45 MET SD S 1.739 2.288 -7.418 1.00 . A A . 45 MET SD 1 1 7 8180 1 1 46 PHE C C -0.098 -1.419 -6.163 1.00 . A A . 46 PHE C 1 1 7 8181 1 1 46 PHE CA C 0.058 -0.870 -4.726 1.00 . A A . 46 PHE CA 1 1 7 8182 1 1 46 PHE CB C -1.255 -1.050 -3.962 1.00 . A A . 46 PHE CB 1 1 7 8183 1 1 46 PHE CD1 C -0.874 -3.551 -3.633 1.00 . A A . 46 PHE CD1 1 1 7 8184 1 1 46 PHE CD2 C -3.104 -2.758 -4.403 1.00 . A A . 46 PHE CD2 1 1 7 8185 1 1 46 PHE CE1 C -1.345 -4.911 -3.663 1.00 . A A . 46 PHE CE1 1 1 7 8186 1 1 46 PHE CE2 C -3.578 -4.117 -4.433 1.00 . A A . 46 PHE CE2 1 1 7 8187 1 1 46 PHE CG C -1.752 -2.469 -4.002 1.00 . A A . 46 PHE CG 1 1 7 8188 1 1 46 PHE CZ C -2.697 -5.192 -4.063 1.00 . A A . 46 PHE CZ 1 1 7 8189 1 1 46 PHE H H -0.152 1.233 -4.324 1.00 . A A . 46 PHE H 1 1 7 8190 1 1 46 PHE HA H 0.861 -1.416 -4.243 1.00 . A A . 46 PHE HA 1 1 7 8191 1 1 46 PHE HB2 H -1.127 -0.744 -2.924 1.00 . A A . 46 PHE HB2 1 1 7 8192 1 1 46 PHE HB3 H -2.008 -0.398 -4.395 1.00 . A A . 46 PHE HB3 1 1 7 8193 1 1 46 PHE HD1 H 0.142 -3.340 -3.333 1.00 . A A . 46 PHE HD1 1 1 7 8194 1 1 46 PHE HD2 H -3.765 -1.951 -4.682 1.00 . A A . 46 PHE HD2 1 1 7 8195 1 1 46 PHE HE1 H -0.682 -5.717 -3.386 1.00 . A A . 46 PHE HE1 1 1 7 8196 1 1 46 PHE HE2 H -4.594 -4.329 -4.733 1.00 . A A . 46 PHE HE2 1 1 7 8197 1 1 46 PHE HZ H -3.052 -6.212 -4.085 1.00 . A A . 46 PHE HZ 1 1 7 8198 1 1 46 PHE N N 0.471 0.528 -4.667 1.00 . A A . 46 PHE N 1 1 7 8199 1 1 46 PHE O O -0.420 -2.586 -6.351 1.00 . A A . 46 PHE O 1 1 7 8200 1 1 47 CYS C C -1.569 -1.514 -8.623 1.30 . A A . 47 CYS C 1 1 7 8201 1 1 47 CYS CA C -0.909 -0.234 -8.101 0.80 . A A . 47 CYS CA 1 1 7 8202 1 1 47 CYS CB C -0.387 0.576 -9.289 0.60 . A A . 47 CYS CB 1 1 7 8203 1 1 47 CYS H H 1.005 -0.035 -7.041 1.00 . A A . 47 CYS H 1 1 7 8204 1 1 47 CYS HA H -1.642 0.351 -7.549 1.10 . A A . 47 CYS HA 1 1 7 8205 1 1 47 CYS HB2 H -1.225 0.840 -9.935 0.90 . A A . 47 CYS HB2 1 1 7 8206 1 1 47 CYS HB3 H 0.032 1.514 -8.933 0.90 . A A . 47 CYS HB3 1 1 7 8207 1 1 47 CYS N N 0.148 -0.537 -7.144 0.60 . A A . 47 CYS N 1 1 7 8208 1 1 47 CYS O O -1.003 -2.600 -8.592 1.90 . A A . 47 CYS O 1 1 7 8209 1 1 47 CYS SG S 0.855 -0.284 -10.289 1.30 . A A . 47 CYS SG 1 1 7 8210 1 1 48 ASN C C -4.658 -2.867 -9.267 1.90 . A A . 48 ASN C 1 1 7 8211 1 1 48 ASN CA C -3.950 -1.815 -8.409 2.30 . A A . 48 ASN CA 1 1 7 8212 1 1 48 ASN CB C -4.907 -0.667 -8.081 3.00 . A A . 48 ASN CB 1 1 7 8213 1 1 48 ASN CG C -6.037 -1.159 -7.173 3.70 . A A . 48 ASN CG 1 1 7 8214 1 1 48 ASN H H -2.919 -0.777 -9.970 2.00 . A A . 48 ASN H 1 1 7 8215 1 1 48 ASN HA H -3.568 -2.282 -7.502 2.70 . A A . 48 ASN HA 1 1 7 8216 1 1 48 ASN HB2 H -4.377 0.141 -7.578 3.30 . A A . 48 ASN HB2 1 1 7 8217 1 1 48 ASN HB3 H -5.342 -0.260 -8.994 3.20 . A A . 48 ASN HB3 1 1 7 8218 1 1 48 ASN HD21 H -7.317 0.168 -8.059 1.00 . A A . 48 ASN HD21 1 1 7 8219 1 1 48 ASN N N -2.799 -1.296 -9.124 1.70 . A A . 48 ASN N 1 1 7 8220 1 1 48 ASN ND2 N -7.139 -0.391 -7.249 4.10 . A A . 48 ASN ND2 1 1 7 8221 1 1 48 ASN O O -4.694 -4.048 -8.941 2.30 . A A . 48 ASN O 1 1 7 8222 1 1 48 ASN OD1 O -5.915 -2.151 -6.464 4.40 . A A . 48 ASN OD1 1 1 7 8223 1 1 49 GLN C C -6.128 -2.505 -12.644 1.80 . A A . 49 GLN C 1 1 7 8224 1 1 49 GLN CA C -5.627 -3.281 -11.422 2.00 . A A . 49 GLN CA 1 1 7 8225 1 1 49 GLN CB C -6.734 -4.192 -10.891 2.20 . A A . 49 GLN CB 1 1 7 8226 1 1 49 GLN CD C -7.400 -6.501 -10.193 3.40 . A A . 49 GLN CD 1 1 7 8227 1 1 49 GLN CG C -6.278 -5.648 -10.787 2.70 . A A . 49 GLN CG 1 1 7 8228 1 1 49 GLN H H -5.349 -1.371 -10.484 2.50 . A A . 49 GLN H 1 1 7 8229 1 1 49 GLN HA H -4.742 -3.856 -11.696 2.50 . A A . 49 GLN HA 1 1 7 8230 1 1 49 GLN HB2 H -7.058 -3.840 -9.912 2.60 . A A . 49 GLN HB2 1 1 7 8231 1 1 49 GLN HB3 H -7.603 -4.129 -11.546 2.10 . A A . 49 GLN HB3 1 1 7 8232 1 1 49 GLN HE21 H -7.148 -5.848 -8.282 4.10 . A A . 49 GLN HE21 1 1 7 8233 1 1 49 GLN HE22 H -8.809 -5.935 -8.839 4.50 . A A . 49 GLN HE22 1 1 7 8234 1 1 49 GLN HG2 H -6.017 -6.040 -11.770 2.70 . A A . 49 GLN HG2 1 1 7 8235 1 1 49 GLN HG3 H -5.396 -5.730 -10.152 2.80 . A A . 49 GLN HG3 1 1 7 8236 1 1 49 GLN N N -5.214 -2.357 -10.382 2.00 . A A . 49 GLN N 1 1 7 8237 1 1 49 GLN NE2 N -7.823 -6.055 -8.997 4.00 . A A . 49 GLN NE2 1 1 7 8238 1 1 49 GLN O O -7.196 -1.905 -12.634 2.20 . A A . 49 GLN O 1 1 7 8239 1 1 49 GLN OE1 O -7.843 -7.484 -10.775 3.70 . A A . 49 GLN OE1 1 1 7 8240 1 1 50 THR C C -4.134 -3.922 -15.353 1.50 . A A . 50 THR C 1 1 7 8241 1 1 50 THR CA C -5.471 -3.608 -14.677 1.80 . A A . 50 THR CA 1 1 7 8242 1 1 50 THR CB C -6.500 -3.166 -15.719 1.90 . A A . 50 THR CB 1 1 7 8243 1 1 50 THR CG2 C -6.417 -1.666 -16.001 2.30 . A A . 50 THR CG2 1 1 7 8244 1 1 50 THR H H -4.541 -1.896 -13.784 2.00 . A A . 50 THR H 1 1 7 8245 1 1 50 THR HA H -5.816 -4.487 -14.133 2.10 . A A . 50 THR HA 1 1 7 8246 1 1 50 THR HB H -7.501 -3.416 -15.367 2.20 . A A . 50 THR HB 1 1 7 8247 1 1 50 THR HG1 H -5.849 -4.683 -16.676 2.50 . A A . 50 THR HG1 1 1 7 8248 1 1 50 THR HG21 H -6.970 -1.099 -15.252 2.40 . A A . 50 THR HG21 1 1 7 8249 1 1 50 THR HG22 H -6.836 -1.431 -16.979 2.60 . A A . 50 THR HG22 1 1 7 8250 1 1 50 THR HG23 H -5.382 -1.325 -15.987 2.80 . A A . 50 THR HG23 1 1 7 8251 1 1 50 THR N N -5.283 -2.560 -13.690 1.70 . A A . 50 THR N 1 1 7 8252 1 1 50 THR O O -3.968 -3.796 -16.560 2.20 . A A . 50 THR O 1 1 7 8253 1 1 50 THR OG1 O -6.291 -3.878 -16.912 2.20 . A A . 50 THR OG1 1 1 7 8254 1 1 51 ALA C C -1.827 -2.351 -14.907 0.60 . A A . 51 ALA C 1 1 7 8255 1 1 51 ALA CA C -2.360 -3.335 -13.861 0.60 . A A . 51 ALA CA 1 1 7 8256 1 1 51 ALA CB C -1.189 -4.012 -13.149 0.70 . A A . 51 ALA CB 1 1 7 8257 1 1 51 ALA H H -3.250 -5.265 -14.102 0.90 . A A . 51 ALA H 1 1 7 8258 1 1 51 ALA HA H -2.984 -2.814 -13.134 0.70 . A A . 51 ALA HA 1 1 7 8259 1 1 51 ALA HB1 H -1.008 -3.551 -12.177 1.20 . A A . 51 ALA HB1 1 1 7 8260 1 1 51 ALA HB2 H -0.275 -3.924 -13.736 1.00 . A A . 51 ALA HB2 1 1 7 8261 1 1 51 ALA HB3 H -1.389 -5.071 -12.989 1.30 . A A . 51 ALA HB3 1 1 7 8262 1 1 51 ALA N N -3.202 -4.340 -14.479 0.80 . A A . 51 ALA N 1 1 7 8263 1 1 51 ALA O O -2.311 -2.251 -16.028 1.10 . A A . 51 ALA O 1 1 7 8264 1 1 52 CYS C C 0.081 0.590 -14.989 0.80 . A A . 52 CYS C 1 1 7 8265 1 1 52 CYS CA C -0.995 -0.212 -14.238 0.80 . A A . 52 CYS CA 1 1 7 8266 1 1 52 CYS CB C -0.975 0.079 -12.731 0.90 . A A . 52 CYS CB 1 1 7 8267 1 1 52 CYS H H -0.164 -2.103 -13.812 0.90 . A A . 52 CYS H 1 1 7 8268 1 1 52 CYS HA H -1.989 0.018 -14.620 0.80 . A A . 52 CYS HA 1 1 7 8269 1 1 52 CYS HB2 H -0.485 1.031 -12.542 1.00 . A A . 52 CYS HB2 1 1 7 8270 1 1 52 CYS HB3 H -1.995 0.196 -12.370 1.10 . A A . 52 CYS HB3 1 1 7 8271 1 1 52 CYS N N -0.792 -1.635 -14.430 0.70 . A A . 52 CYS N 1 1 7 8272 1 1 52 CYS O O 0.932 1.246 -14.402 1.20 . A A . 52 CYS O 1 1 7 8273 1 1 52 CYS SG S -0.208 -1.238 -11.743 1.00 . A A . 52 CYS SG 1 1 7 8274 1 1 53 PRO C C 2.211 0.764 -17.443 0.80 . A A . 53 PRO C 1 1 7 8275 1 1 53 PRO CA C 0.979 -0.114 -17.191 0.70 . A A . 53 PRO CA 1 1 7 8276 1 1 53 PRO CB C 0.281 -0.292 -18.537 0.90 . A A . 53 PRO CB 1 1 7 8277 1 1 53 PRO CD C -1.203 0.979 -17.033 0.80 . A A . 53 PRO CD 1 1 7 8278 1 1 53 PRO CG C -0.983 0.574 -18.489 0.90 . A A . 53 PRO CG 1 1 7 8279 1 1 53 PRO HA H 1.290 -1.071 -16.773 0.80 . A A . 53 PRO HA 1 1 7 8280 1 1 53 PRO HB2 H 0.932 0.024 -19.352 1.00 . A A . 53 PRO HB2 1 1 7 8281 1 1 53 PRO HB3 H 0.026 -1.339 -18.702 1.10 . A A . 53 PRO HB3 1 1 7 8282 1 1 53 PRO HD2 H -1.292 2.060 -16.927 0.80 . A A . 53 PRO HD2 1 1 7 8283 1 1 53 PRO HD3 H -2.097 0.513 -16.620 0.90 . A A . 53 PRO HD3 1 1 7 8284 1 1 53 PRO HG2 H -0.842 1.464 -19.099 0.90 . A A . 53 PRO HG2 1 1 7 8285 1 1 53 PRO HG3 H -1.841 0.021 -18.863 1.00 . A A . 53 PRO HG3 1 1 7 8286 1 1 53 PRO N N -0.026 0.506 -16.332 0.60 . A A . 53 PRO N 1 1 7 8287 1 1 53 PRO O O 2.858 0.685 -18.481 1.60 . A A . 53 PRO O 1 1 7 8288 1 1 54 ALA C C 2.482 3.510 -17.992 0.90 . A A . 54 ALA C 1 1 7 8289 1 1 54 ALA CA C 3.036 2.919 -16.697 0.80 . A A . 54 ALA CA 1 1 7 8290 1 1 54 ALA CB C 4.557 2.876 -16.824 0.80 . A A . 54 ALA CB 1 1 7 8291 1 1 54 ALA H H 2.330 1.259 -15.503 1.40 . A A . 54 ALA H 1 1 7 8292 1 1 54 ALA HA H 2.725 3.552 -15.866 0.70 . A A . 54 ALA HA 1 1 7 8293 1 1 54 ALA HB1 H 5.021 3.552 -16.105 1.20 . A A . 54 ALA HB1 1 1 7 8294 1 1 54 ALA HB2 H 4.864 3.193 -17.821 1.40 . A A . 54 ALA HB2 1 1 7 8295 1 1 54 ALA HB3 H 4.939 1.871 -16.652 1.30 . A A . 54 ALA HB3 1 1 7 8296 1 1 54 ALA N N 2.487 1.597 -16.429 0.80 . A A . 54 ALA N 1 1 7 8297 1 1 54 ALA O O 1.660 2.929 -18.691 1.50 . A A . 54 ALA O 1 1 7 8298 1 1 55 ASP C C 5.158 5.722 -18.789 1.10 . A A . 55 ASP C 1 1 7 8299 1 1 55 ASP CA C 3.962 4.912 -19.310 1.20 . A A . 55 ASP CA 1 1 7 8300 1 1 55 ASP CB C 3.217 5.557 -20.485 1.40 . A A . 55 ASP CB 1 1 7 8301 1 1 55 ASP CG C 4.075 5.529 -21.752 2.10 . A A . 55 ASP CG 1 1 7 8302 1 1 55 ASP H H 2.750 5.523 -17.703 1.40 . A A . 55 ASP H 1 1 7 8303 1 1 55 ASP HA H 4.330 3.946 -19.608 1.30 . A A . 55 ASP HA 1 1 7 8304 1 1 55 ASP HB2 H 2.294 5.007 -20.664 1.50 . A A . 55 ASP HB2 1 1 7 8305 1 1 55 ASP HB3 H 2.923 6.583 -20.266 1.80 . A A . 55 ASP HB3 1 1 7 8306 1 1 55 ASP N N 3.007 4.724 -18.240 1.00 . A A . 55 ASP N 1 1 7 8307 1 1 55 ASP O O 6.102 5.216 -18.194 1.50 . A A . 55 ASP O 1 1 7 8308 1 1 55 ASP OD1 O 5.293 5.659 -21.641 2.60 . A A . 55 ASP OD1 1 1 7 8309 1 1 55 ASP OD2 O 3.514 5.379 -22.836 2.80 . A A . 55 ASP OD2 1 1 7 8310 1 1 56 CYS C C 6.553 8.279 -17.572 0.80 . A A . 56 CYS C 1 1 7 8311 1 1 56 CYS CA C 5.116 8.031 -18.058 0.80 . A A . 56 CYS CA 1 1 7 8312 1 1 56 CYS CB C 4.155 7.676 -16.934 0.90 . A A . 56 CYS CB 1 1 7 8313 1 1 56 CYS H H 4.306 7.115 -19.770 1.10 . A A . 56 CYS H 1 1 7 8314 1 1 56 CYS HA H 4.772 8.928 -18.559 0.70 . A A . 56 CYS HA 1 1 7 8315 1 1 56 CYS HB2 H 3.282 8.318 -17.065 1.00 . A A . 56 CYS HB2 1 1 7 8316 1 1 56 CYS HB3 H 3.817 6.642 -17.037 0.90 . A A . 56 CYS HB3 1 1 7 8317 1 1 56 CYS N N 5.006 7.014 -19.077 0.90 . A A . 56 CYS N 1 1 7 8318 1 1 56 CYS O O 7.483 7.541 -17.870 1.10 . A A . 56 CYS O 1 1 7 8319 1 1 56 CYS SG S 4.861 7.876 -15.280 1.30 . A A . 56 CYS SG 1 1 7 8320 1 1 57 ASP C C 8.918 9.766 -17.712 0.90 . A A . 57 ASP C 1 1 7 8321 1 1 57 ASP CA C 7.902 10.100 -16.606 1.00 . A A . 57 ASP CA 1 1 7 8322 1 1 57 ASP CB C 8.460 9.751 -15.222 1.10 . A A . 57 ASP CB 1 1 7 8323 1 1 57 ASP CG C 9.959 10.052 -15.132 1.60 . A A . 57 ASP CG 1 1 7 8324 1 1 57 ASP H H 5.832 9.716 -16.317 1.10 . A A . 57 ASP H 1 1 7 8325 1 1 57 ASP HA H 7.663 11.163 -16.637 1.20 . A A . 57 ASP HA 1 1 7 8326 1 1 57 ASP HB2 H 7.945 10.330 -14.455 1.10 . A A . 57 ASP HB2 1 1 7 8327 1 1 57 ASP HB3 H 8.295 8.698 -14.997 1.20 . A A . 57 ASP HB3 1 1 7 8328 1 1 57 ASP N N 6.644 9.388 -16.802 0.80 . A A . 57 ASP N 1 1 7 8329 1 1 57 ASP O O 9.765 8.895 -17.558 1.00 . A A . 57 ASP O 1 1 7 8330 1 1 57 ASP OD1 O 10.377 11.106 -15.609 2.20 . A A . 57 ASP OD1 1 1 7 8331 1 1 57 ASP OD2 O 10.691 9.228 -14.587 2.00 . A A . 57 ASP OD2 1 1 7 8332 1 1 58 PRO C C 7.760 12.783 -18.446 1.20 . A A . 58 PRO C 1 1 7 8333 1 1 58 PRO CA C 8.978 11.953 -18.898 1.20 . A A . 58 PRO CA 1 1 7 8334 1 1 58 PRO CB C 9.230 12.253 -20.378 1.40 . A A . 58 PRO CB 1 1 7 8335 1 1 58 PRO CD C 8.601 9.879 -20.141 1.30 . A A . 58 PRO CD 1 1 7 8336 1 1 58 PRO CG C 8.928 10.968 -21.165 1.50 . A A . 58 PRO CG 1 1 7 8337 1 1 58 PRO HA H 9.842 12.231 -18.294 1.30 . A A . 58 PRO HA 1 1 7 8338 1 1 58 PRO HB2 H 8.588 13.067 -20.717 1.50 . A A . 58 PRO HB2 1 1 7 8339 1 1 58 PRO HB3 H 10.263 12.561 -20.535 1.70 . A A . 58 PRO HB3 1 1 7 8340 1 1 58 PRO HD2 H 7.572 9.535 -20.244 1.30 . A A . 58 PRO HD2 1 1 7 8341 1 1 58 PRO HD3 H 9.266 9.022 -20.243 1.40 . A A . 58 PRO HD3 1 1 7 8342 1 1 58 PRO HG2 H 8.087 11.121 -21.841 1.50 . A A . 58 PRO HG2 1 1 7 8343 1 1 58 PRO HG3 H 9.788 10.678 -21.769 1.70 . A A . 58 PRO HG3 1 1 7 8344 1 1 58 PRO N N 8.788 10.503 -18.842 1.00 . A A . 58 PRO N 1 1 7 8345 1 1 58 PRO O O 7.871 13.939 -18.056 1.50 . A A . 58 PRO O 1 1 7 8346 1 1 59 ASN C C 4.768 13.375 -17.471 1.30 . A A . 59 ASN C 1 1 7 8347 1 1 59 ASN CA C 5.290 12.665 -18.711 1.30 . A A . 59 ASN CA 1 1 7 8348 1 1 59 ASN CB C 4.433 11.428 -18.789 1.50 . A A . 59 ASN CB 1 1 7 8349 1 1 59 ASN CG C 4.592 10.720 -20.136 1.90 . A A . 59 ASN CG 1 1 7 8350 1 1 59 ASN H H 6.518 11.113 -18.415 1.10 . A A . 59 ASN H 1 1 7 8351 1 1 59 ASN HA H 5.291 13.304 -19.581 1.50 . A A . 59 ASN HA 1 1 7 8352 1 1 59 ASN HB2 H 4.748 10.793 -17.948 1.70 . A A . 59 ASN HB2 1 1 7 8353 1 1 59 ASN HB3 H 3.410 11.718 -18.618 1.70 . A A . 59 ASN HB3 1 1 7 8354 1 1 59 ASN HD21 H 3.505 9.006 -19.995 2.10 . A A . 59 ASN HD21 1 1 7 8355 1 1 59 ASN HD22 H 2.853 10.229 -21.070 2.50 . A A . 59 ASN HD22 1 1 7 8356 1 1 59 ASN N N 6.605 12.101 -18.528 1.10 . A A . 59 ASN N 1 1 7 8357 1 1 59 ASN ND2 N 3.557 9.912 -20.427 2.00 . A A . 59 ASN ND2 1 1 7 8358 1 1 59 ASN O O 4.250 14.486 -17.484 1.70 . A A . 59 ASN O 1 1 7 8359 1 1 59 ASN OD1 O 5.572 10.896 -20.849 2.70 . A A . 59 ASN OD1 1 1 7 8360 1 1 60 THR C C 3.152 13.739 -15.220 0.90 . A A . 60 THR C 1 1 7 8361 1 1 60 THR CA C 4.561 13.127 -15.119 1.20 . A A . 60 THR CA 1 1 7 8362 1 1 60 THR CB C 5.648 14.085 -14.623 1.40 . A A . 60 THR CB 1 1 7 8363 1 1 60 THR CG2 C 7.027 13.516 -14.979 1.40 . A A . 60 THR CG2 1 1 7 8364 1 1 60 THR H H 5.878 12.306 -16.683 1.00 . A A . 60 THR H 1 1 7 8365 1 1 60 THR HA H 4.406 12.256 -14.489 1.40 . A A . 60 THR HA 1 1 7 8366 1 1 60 THR HB H 5.568 14.236 -13.547 1.90 . A A . 60 THR HB 1 1 7 8367 1 1 60 THR HG1 H 5.363 15.182 -16.159 2.30 . A A . 60 THR HG1 1 1 7 8368 1 1 60 THR HG21 H 6.946 12.430 -15.070 1.90 . A A . 60 THR HG21 1 1 7 8369 1 1 60 THR HG22 H 7.786 13.753 -14.242 1.80 . A A . 60 THR HG22 1 1 7 8370 1 1 60 THR HG23 H 7.337 13.876 -15.962 1.70 . A A . 60 THR HG23 1 1 7 8371 1 1 60 THR N N 4.974 12.591 -16.406 1.10 . A A . 60 THR N 1 1 7 8372 1 1 60 THR O O 2.833 14.773 -14.646 1.10 . A A . 60 THR O 1 1 7 8373 1 1 60 THR OG1 O 5.488 15.341 -15.232 2.10 . A A . 60 THR OG1 1 1 7 8374 1 1 61 GLN C C 2.092 11.124 -14.435 0.90 . A A . 61 GLN C 1 1 7 8375 1 1 61 GLN CA C 1.395 12.055 -15.432 0.80 . A A . 61 GLN CA 1 1 7 8376 1 1 61 GLN CB C 0.822 11.172 -16.543 1.00 . A A . 61 GLN CB 1 1 7 8377 1 1 61 GLN CD C -1.327 10.695 -17.719 1.90 . A A . 61 GLN CD 1 1 7 8378 1 1 61 GLN CG C -0.666 10.876 -16.351 1.40 . A A . 61 GLN CG 1 1 7 8379 1 1 61 GLN H H 2.771 12.804 -16.904 1.20 . A A . 61 GLN H 1 1 7 8380 1 1 61 GLN HA H 0.625 12.642 -14.931 0.70 . A A . 61 GLN HA 1 1 7 8381 1 1 61 GLN HB2 H 0.986 11.643 -17.512 1.60 . A A . 61 GLN HB2 1 1 7 8382 1 1 61 GLN HB3 H 1.376 10.231 -16.570 1.60 . A A . 61 GLN HB3 1 1 7 8383 1 1 61 GLN HE21 H -1.336 8.688 -17.380 2.80 . A A . 61 GLN HE21 1 1 7 8384 1 1 61 GLN HE22 H -2.326 9.232 -18.721 2.60 . A A . 61 GLN HE22 1 1 7 8385 1 1 61 GLN HG2 H -0.808 9.968 -15.764 1.80 . A A . 61 GLN HG2 1 1 7 8386 1 1 61 GLN HG3 H -1.160 11.693 -15.823 1.90 . A A . 61 GLN HG3 1 1 7 8387 1 1 61 GLN N N 2.353 12.987 -16.010 0.90 . A A . 61 GLN N 1 1 7 8388 1 1 61 GLN NE2 N -1.696 9.424 -17.961 2.40 . A A . 61 GLN NE2 1 1 7 8389 1 1 61 GLN O O 3.133 10.548 -14.721 1.50 . A A . 61 GLN O 1 1 7 8390 1 1 61 GLN OE1 O -1.483 11.633 -18.490 2.40 . A A . 61 GLN OE1 1 1 7 8391 1 1 62 ALA C C 3.347 10.508 -11.841 0.90 . A A . 62 ALA C 1 1 7 8392 1 1 62 ALA CA C 1.956 10.059 -12.291 1.00 . A A . 62 ALA CA 1 1 7 8393 1 1 62 ALA CB C 1.927 8.634 -12.861 1.30 . A A . 62 ALA CB 1 1 7 8394 1 1 62 ALA H H 0.450 11.188 -13.258 1.50 . A A . 62 ALA H 1 1 7 8395 1 1 62 ALA HA H 1.333 10.123 -11.415 1.20 . A A . 62 ALA HA 1 1 7 8396 1 1 62 ALA HB1 H 2.353 8.617 -13.865 1.70 . A A . 62 ALA HB1 1 1 7 8397 1 1 62 ALA HB2 H 0.907 8.254 -12.921 1.60 . A A . 62 ALA HB2 1 1 7 8398 1 1 62 ALA HB3 H 2.512 7.955 -12.240 1.70 . A A . 62 ALA HB3 1 1 7 8399 1 1 62 ALA N N 1.422 10.980 -13.275 1.00 . A A . 62 ALA N 1 1 7 8400 1 1 62 ALA O O 3.529 11.289 -10.914 1.80 . A A . 62 ALA O 1 1 7 8401 1 1 63 SER C C 6.679 9.566 -12.503 0.60 . A A . 63 SER C 1 1 7 8402 1 1 63 SER CA C 5.554 10.514 -12.906 0.50 . A A . 63 SER CA 1 1 7 8403 1 1 63 SER CB C 5.735 11.868 -12.223 0.60 . A A . 63 SER CB 1 1 7 8404 1 1 63 SER H H 3.885 9.086 -12.978 1.20 . A A . 63 SER H 1 1 7 8405 1 1 63 SER HA H 5.553 10.624 -13.991 0.50 . A A . 63 SER HA 1 1 7 8406 1 1 63 SER HB2 H 5.907 11.740 -11.155 1.20 . A A . 63 SER HB2 1 1 7 8407 1 1 63 SER HB3 H 6.598 12.384 -12.645 0.90 . A A . 63 SER HB3 1 1 7 8408 1 1 63 SER HG H 4.166 12.383 -13.177 1.60 . A A . 63 SER HG 1 1 7 8409 1 1 63 SER N N 4.283 9.904 -12.568 0.60 . A A . 63 SER N 1 1 7 8410 1 1 63 SER O O 7.479 9.834 -11.616 1.60 . A A . 63 SER O 1 1 7 8411 1 1 63 SER OG O 4.610 12.691 -12.397 1.30 . A A . 63 SER OG 1 1 7 8412 1 1 64 CYS C C 7.684 7.000 -11.542 0.50 . A A . 64 CYS C 1 1 7 8413 1 1 64 CYS CA C 6.549 7.160 -12.559 0.50 . A A . 64 CYS CA 1 1 7 8414 1 1 64 CYS CB C 6.602 6.034 -13.595 0.50 . A A . 64 CYS CB 1 1 7 8415 1 1 64 CYS H H 6.587 8.494 -14.226 1.40 . A A . 64 CYS H 1 1 7 8416 1 1 64 CYS HA H 5.592 7.167 -12.037 0.60 . A A . 64 CYS HA 1 1 7 8417 1 1 64 CYS HB2 H 7.538 5.490 -13.479 0.70 . A A . 64 CYS HB2 1 1 7 8418 1 1 64 CYS HB3 H 5.806 5.317 -13.408 0.70 . A A . 64 CYS HB3 1 1 7 8419 1 1 64 CYS N N 6.663 8.439 -13.231 0.60 . A A . 64 CYS N 1 1 7 8420 1 1 64 CYS O O 8.821 7.390 -11.777 1.10 . A A . 64 CYS O 1 1 7 8421 1 1 64 CYS SG S 6.460 6.600 -15.311 1.30 . A A . 64 CYS SG 1 1 7 8422 1 1 65 GLU C C 8.693 6.106 -8.333 1.00 . A A . 65 GLU C 1 1 7 8423 1 1 65 GLU CA C 7.704 6.976 -9.121 1.10 . A A . 65 GLU CA 1 1 7 8424 1 1 65 GLU CB C 6.473 7.262 -8.266 1.30 . A A . 65 GLU CB 1 1 7 8425 1 1 65 GLU CD C 7.770 9.268 -7.496 1.90 . A A . 65 GLU CD 1 1 7 8426 1 1 65 GLU CG C 6.781 8.177 -7.081 1.50 . A A . 65 GLU CG 1 1 7 8427 1 1 65 GLU H H 6.704 5.595 -10.435 1.60 . A A . 65 GLU H 1 1 7 8428 1 1 65 GLU HA H 8.239 7.866 -9.383 1.30 . A A . 65 GLU HA 1 1 7 8429 1 1 65 GLU HB2 H 5.688 7.697 -8.880 1.30 . A A . 65 GLU HB2 1 1 7 8430 1 1 65 GLU HB3 H 6.086 6.315 -7.897 1.50 . A A . 65 GLU HB3 1 1 7 8431 1 1 65 GLU HG2 H 5.867 8.645 -6.715 1.70 . A A . 65 GLU HG2 1 1 7 8432 1 1 65 GLU HG3 H 7.208 7.604 -6.258 1.70 . A A . 65 GLU HG3 1 1 7 8433 1 1 65 GLU N N 7.293 6.401 -10.400 1.00 . A A . 65 GLU N 1 1 7 8434 1 1 65 GLU O O 9.549 6.578 -7.595 1.10 . A A . 65 GLU O 1 1 7 8435 1 1 65 GLU OE1 O 7.347 10.236 -8.127 2.40 . A A . 65 GLU OE1 1 1 7 8436 1 1 65 GLU OE2 O 8.952 9.138 -7.183 1.90 . A A . 65 GLU OE2 1 1 7 8437 1 1 66 CYS C C 8.878 3.056 -6.897 0.90 . A A . 66 CYS C 1 1 7 8438 1 1 66 CYS CA C 7.866 3.997 -7.558 1.00 . A A . 66 CYS CA 1 1 7 8439 1 1 66 CYS CB C 6.764 3.203 -8.254 1.20 . A A . 66 CYS CB 1 1 7 8440 1 1 66 CYS H H 8.154 4.655 -9.486 1.10 . A A . 66 CYS H 1 1 7 8441 1 1 66 CYS HA H 7.447 4.705 -6.843 1.10 . A A . 66 CYS HA 1 1 7 8442 1 1 66 CYS HB2 H 7.016 2.143 -8.245 1.20 . A A . 66 CYS HB2 1 1 7 8443 1 1 66 CYS HB3 H 5.857 3.365 -7.698 1.50 . A A . 66 CYS HB3 1 1 7 8444 1 1 66 CYS N N 8.490 4.811 -8.566 1.00 . A A . 66 CYS N 1 1 7 8445 1 1 66 CYS O O 8.868 2.845 -5.690 1.10 . A A . 66 CYS O 1 1 7 8446 1 1 66 CYS SG S 6.414 3.659 -9.973 1.70 . A A . 66 CYS SG 1 1 7 8447 1 1 67 PRO C C 11.718 3.538 -6.641 0.90 . A A . 67 PRO C 1 1 7 8448 1 1 67 PRO CA C 11.168 2.366 -7.441 0.90 . A A . 67 PRO CA 1 1 7 8449 1 1 67 PRO CB C 11.869 2.232 -8.792 0.90 . A A . 67 PRO CB 1 1 7 8450 1 1 67 PRO CD C 9.422 2.039 -9.095 0.80 . A A . 67 PRO CD 1 1 7 8451 1 1 67 PRO CG C 10.768 1.960 -9.829 0.80 . A A . 67 PRO CG 1 1 7 8452 1 1 67 PRO HA H 11.321 1.457 -6.862 1.10 . A A . 67 PRO HA 1 1 7 8453 1 1 67 PRO HB2 H 12.397 3.158 -9.037 0.80 . A A . 67 PRO HB2 1 1 7 8454 1 1 67 PRO HB3 H 12.594 1.414 -8.761 1.00 . A A . 67 PRO HB3 1 1 7 8455 1 1 67 PRO HD2 H 8.725 2.710 -9.595 0.70 . A A . 67 PRO HD2 1 1 7 8456 1 1 67 PRO HD3 H 8.954 1.059 -9.027 0.90 . A A . 67 PRO HD3 1 1 7 8457 1 1 67 PRO HG2 H 10.811 2.702 -10.627 0.80 . A A . 67 PRO HG2 1 1 7 8458 1 1 67 PRO HG3 H 10.905 0.977 -10.280 1.00 . A A . 67 PRO HG3 1 1 7 8459 1 1 67 PRO N N 9.761 2.502 -7.759 0.80 . A A . 67 PRO N 1 1 7 8460 1 1 67 PRO O O 11.262 4.671 -6.736 1.30 . A A . 67 PRO O 1 1 7 8461 1 1 68 GLU C C 11.236 3.128 -3.913 1.10 . A A . 68 GLU C 1 1 7 8462 1 1 68 GLU CA C 12.651 3.427 -4.422 1.20 . A A . 68 GLU CA 1 1 7 8463 1 1 68 GLU CB C 13.015 4.885 -4.126 1.50 . A A . 68 GLU CB 1 1 7 8464 1 1 68 GLU CD C 15.326 4.827 -5.089 2.80 . A A . 68 GLU CD 1 1 7 8465 1 1 68 GLU CG C 13.952 5.493 -5.174 2.10 . A A . 68 GLU CG 1 1 7 8466 1 1 68 GLU H H 13.570 2.806 -6.265 1.60 . A A . 68 GLU H 1 1 7 8467 1 1 68 GLU HA H 13.339 2.730 -3.943 1.30 . A A . 68 GLU HA 1 1 7 8468 1 1 68 GLU HB2 H 12.102 5.478 -4.070 1.90 . A A . 68 GLU HB2 1 1 7 8469 1 1 68 GLU HB3 H 13.481 4.948 -3.143 1.90 . A A . 68 GLU HB3 1 1 7 8470 1 1 68 GLU HG2 H 13.553 5.355 -6.180 2.40 . A A . 68 GLU HG2 1 1 7 8471 1 1 68 GLU HG3 H 14.065 6.564 -5.013 2.50 . A A . 68 GLU HG3 1 1 7 8472 1 1 68 GLU N N 12.734 3.162 -5.847 1.20 . A A . 68 GLU N 1 1 7 8473 1 1 68 GLU O O 10.353 3.978 -3.921 1.20 . A A . 68 GLU O 1 1 7 8474 1 1 68 GLU OE1 O 15.911 4.823 -4.007 3.30 . A A . 68 GLU OE1 1 1 7 8475 1 1 68 GLU OE2 O 15.796 4.318 -6.106 3.40 . A A . 68 GLU OE2 1 1 7 8476 1 1 69 GLY C C 9.517 0.090 -4.114 1.20 . A A . 69 GLY C 1 1 7 8477 1 1 69 GLY CA C 9.742 1.358 -3.281 1.50 . A A . 69 GLY CA 1 1 7 8478 1 1 69 GLY H H 11.885 1.291 -3.279 1.40 . A A . 69 GLY H 1 1 7 8479 1 1 69 GLY HA2 H 9.621 1.143 -2.218 1.70 . A A . 69 GLY HA2 1 1 7 8480 1 1 69 GLY HA3 H 9.050 2.144 -3.589 1.80 . A A . 69 GLY HA3 1 1 7 8481 1 1 69 GLY N N 11.089 1.865 -3.471 1.20 . A A . 69 GLY N 1 1 7 8482 1 1 69 GLY O O 8.924 -0.883 -3.664 1.40 . A A . 69 GLY O 1 1 7 8483 1 1 70 TYR C C 10.223 -2.253 -5.489 0.80 . A A . 70 TYR C 1 1 7 8484 1 1 70 TYR CA C 10.872 -0.909 -5.826 0.80 . A A . 70 TYR CA 1 1 7 8485 1 1 70 TYR CB C 12.250 -0.802 -5.172 0.60 . A A . 70 TYR CB 1 1 7 8486 1 1 70 TYR CD1 C 13.371 -1.280 -7.416 1.30 . A A . 70 TYR CD1 1 1 7 8487 1 1 70 TYR CD2 C 14.293 -2.314 -5.349 1.50 . A A . 70 TYR CD2 1 1 7 8488 1 1 70 TYR CE1 C 14.399 -1.919 -8.195 1.40 . A A . 70 TYR CE1 1 1 7 8489 1 1 70 TYR CE2 C 15.324 -2.951 -6.124 1.70 . A A . 70 TYR CE2 1 1 7 8490 1 1 70 TYR CG C 13.314 -1.474 -5.990 0.70 . A A . 70 TYR CG 1 1 7 8491 1 1 70 TYR CZ C 15.376 -2.752 -7.547 1.10 . A A . 70 TYR CZ 1 1 7 8492 1 1 70 TYR H H 9.991 1.037 -5.859 1.00 . A A . 70 TYR H 1 1 7 8493 1 1 70 TYR HA H 10.925 -0.809 -6.910 0.90 . A A . 70 TYR HA 1 1 7 8494 1 1 70 TYR HB2 H 12.518 0.246 -5.038 0.60 . A A . 70 TYR HB2 1 1 7 8495 1 1 70 TYR HB3 H 12.229 -1.256 -4.181 0.60 . A A . 70 TYR HB3 1 1 7 8496 1 1 70 TYR HD1 H 12.643 -0.651 -7.906 2.10 . A A . 70 TYR HD1 1 1 7 8497 1 1 70 TYR HD2 H 14.253 -2.466 -4.280 2.30 . A A . 70 TYR HD2 1 1 7 8498 1 1 70 TYR HE1 H 14.436 -1.773 -9.265 2.10 . A A . 70 TYR HE1 1 1 7 8499 1 1 70 TYR HE2 H 16.058 -3.575 -5.637 2.50 . A A . 70 TYR HE2 1 1 7 8500 1 1 70 TYR HH H 16.547 -4.220 -7.933 1.50 . A A . 70 TYR HH 1 1 7 8501 1 1 70 TYR N N 10.033 0.176 -5.353 0.90 . A A . 70 TYR N 1 1 7 8502 1 1 70 TYR O O 10.262 -2.727 -4.360 1.10 . A A . 70 TYR O 1 1 7 8503 1 1 70 TYR OH O 16.366 -3.362 -8.292 1.30 . A A . 70 TYR OH 1 1 7 8504 1 1 71 ILE C C 9.860 -3.722 -8.881 0.90 . A A . 71 ILE C 1 1 7 8505 1 1 71 ILE CA C 10.434 -3.640 -7.447 1.00 . A A . 71 ILE CA 1 1 7 8506 1 1 71 ILE CB C 10.577 -5.041 -6.851 1.20 . A A . 71 ILE CB 1 1 7 8507 1 1 71 ILE CD1 C 12.430 -6.551 -6.014 1.80 . A A . 71 ILE CD1 1 1 7 8508 1 1 71 ILE CG1 C 11.967 -5.613 -7.130 1.40 . A A . 71 ILE CG1 1 1 7 8509 1 1 71 ILE CG2 C 9.483 -5.981 -7.360 1.80 . A A . 71 ILE CG2 1 1 7 8510 1 1 71 ILE H H 8.641 -2.732 -6.696 1.10 . A A . 71 ILE H 1 1 7 8511 1 1 71 ILE HA H 11.407 -3.150 -7.493 1.20 . A A . 71 ILE HA 1 1 7 8512 1 1 71 ILE HB H 10.460 -4.948 -5.772 1.70 . A A . 71 ILE HB 1 1 7 8513 1 1 71 ILE HD11 H 12.541 -7.570 -6.384 2.20 . A A . 71 ILE HD11 1 1 7 8514 1 1 71 ILE HD12 H 11.711 -6.565 -5.196 2.30 . A A . 71 ILE HD12 1 1 7 8515 1 1 71 ILE HD13 H 13.392 -6.231 -5.612 2.10 . A A . 71 ILE HD13 1 1 7 8516 1 1 71 ILE HG12 H 11.959 -6.150 -8.078 1.60 . A A . 71 ILE HG12 1 1 7 8517 1 1 71 ILE HG13 H 12.682 -4.798 -7.240 1.70 . A A . 71 ILE HG13 1 1 7 8518 1 1 71 ILE HG21 H 8.512 -5.484 -7.358 2.30 . A A . 71 ILE HG21 1 1 7 8519 1 1 71 ILE HG22 H 9.408 -6.866 -6.728 2.20 . A A . 71 ILE HG22 1 1 7 8520 1 1 71 ILE HG23 H 9.692 -6.310 -8.378 2.20 . A A . 71 ILE HG23 1 1 7 8521 1 1 71 ILE N N 9.625 -2.828 -6.549 0.90 . A A . 71 ILE N 1 1 7 8522 1 1 71 ILE O O 10.497 -4.266 -9.775 0.90 . A A . 71 ILE O 1 1 7 8523 1 1 72 LEU C C 8.522 -3.677 -11.451 0.80 . A A . 72 LEU C 1 1 7 8524 1 1 72 LEU CA C 8.314 -2.625 -10.367 0.80 . A A . 72 LEU CA 1 1 7 8525 1 1 72 LEU CB C 9.055 -1.304 -10.591 0.80 . A A . 72 LEU CB 1 1 7 8526 1 1 72 LEU CD1 C 7.289 0.403 -10.725 0.60 . A A . 72 LEU CD1 1 1 7 8527 1 1 72 LEU CD2 C 9.304 0.605 -12.204 0.70 . A A . 72 LEU CD2 1 1 7 8528 1 1 72 LEU CG C 8.324 -0.353 -11.524 0.70 . A A . 72 LEU CG 1 1 7 8529 1 1 72 LEU H H 8.093 -2.919 -8.261 0.90 . A A . 72 LEU H 1 1 7 8530 1 1 72 LEU HA H 7.252 -2.457 -10.370 0.80 . A A . 72 LEU HA 1 1 7 8531 1 1 72 LEU HB2 H 9.197 -0.821 -9.624 1.00 . A A . 72 LEU HB2 1 1 7 8532 1 1 72 LEU HB3 H 10.042 -1.448 -10.993 1.00 . A A . 72 LEU HB3 1 1 7 8533 1 1 72 LEU HD11 H 6.300 0.160 -11.104 1.10 . A A . 72 LEU HD11 1 1 7 8534 1 1 72 LEU HD12 H 7.472 1.474 -10.793 1.10 . A A . 72 LEU HD12 1 1 7 8535 1 1 72 LEU HD13 H 7.344 0.100 -9.681 1.20 . A A . 72 LEU HD13 1 1 7 8536 1 1 72 LEU HD21 H 9.312 1.574 -11.707 1.40 . A A . 72 LEU HD21 1 1 7 8537 1 1 72 LEU HD22 H 9.037 0.761 -13.250 1.20 . A A . 72 LEU HD22 1 1 7 8538 1 1 72 LEU HD23 H 10.317 0.202 -12.175 1.20 . A A . 72 LEU HD23 1 1 7 8539 1 1 72 LEU HG H 7.812 -0.929 -12.292 0.70 . A A . 72 LEU HG 1 1 7 8540 1 1 72 LEU N N 8.646 -3.159 -9.058 0.80 . A A . 72 LEU N 1 1 7 8541 1 1 72 LEU O O 8.744 -4.851 -11.181 0.90 . A A . 72 LEU O 1 1 7 8542 1 1 73 ASP C C 9.484 -2.700 -14.846 1.20 . A A . 73 ASP C 1 1 7 8543 1 1 73 ASP CA C 9.603 -2.603 -13.324 1.00 . A A . 73 ASP CA 1 1 7 8544 1 1 73 ASP CB C 10.849 -3.310 -12.788 1.50 . A A . 73 ASP CB 1 1 7 8545 1 1 73 ASP CG C 12.008 -3.284 -13.789 2.00 . A A . 73 ASP CG 1 1 7 8546 1 1 73 ASP H H 7.550 -3.190 -13.184 0.80 . A A . 73 ASP H 1 1 7 8547 1 1 73 ASP HA H 9.625 -1.552 -13.050 1.20 . A A . 73 ASP HA 1 1 7 8548 1 1 73 ASP HB2 H 11.147 -2.840 -11.851 1.90 . A A . 73 ASP HB2 1 1 7 8549 1 1 73 ASP HB3 H 10.568 -4.334 -12.539 1.90 . A A . 73 ASP HB3 1 1 7 8550 1 1 73 ASP N N 8.423 -3.175 -12.698 0.90 . A A . 73 ASP N 1 1 7 8551 1 1 73 ASP O O 9.039 -3.691 -15.411 1.70 . A A . 73 ASP O 1 1 7 8552 1 1 73 ASP OD1 O 11.979 -4.062 -14.740 2.30 . A A . 73 ASP OD1 1 1 7 8553 1 1 73 ASP OD2 O 12.925 -2.485 -13.604 2.80 . A A . 73 ASP OD2 1 1 7 8554 1 1 74 ASP C C 8.577 -1.986 -17.443 1.40 . A A . 74 ASP C 1 1 7 8555 1 1 74 ASP CA C 9.918 -1.507 -16.900 1.80 . A A . 74 ASP CA 1 1 7 8556 1 1 74 ASP CB C 11.074 -2.318 -17.486 2.60 . A A . 74 ASP CB 1 1 7 8557 1 1 74 ASP CG C 11.650 -1.605 -18.711 3.20 . A A . 74 ASP CG 1 1 7 8558 1 1 74 ASP H H 10.378 -0.879 -14.910 1.40 . A A . 74 ASP H 1 1 7 8559 1 1 74 ASP HA H 9.981 -0.447 -17.129 2.30 . A A . 74 ASP HA 1 1 7 8560 1 1 74 ASP HB2 H 11.865 -2.452 -16.748 3.00 . A A . 74 ASP HB2 1 1 7 8561 1 1 74 ASP HB3 H 10.731 -3.309 -17.784 3.10 . A A . 74 ASP HB3 1 1 7 8562 1 1 74 ASP N N 9.924 -1.584 -15.453 1.30 . A A . 74 ASP N 1 1 7 8563 1 1 74 ASP O O 8.448 -3.037 -18.058 1.80 . A A . 74 ASP O 1 1 7 8564 1 1 74 ASP OD1 O 11.246 -0.474 -18.977 3.60 . A A . 74 ASP OD1 1 1 7 8565 1 1 74 ASP OD2 O 12.496 -2.189 -19.386 3.70 . A A . 74 ASP OD2 1 1 7 8566 1 1 75 GLY C C 8.233 1.205 -17.548 1.10 . A A . 75 GLY C 1 1 7 8567 1 1 75 GLY CA C 7.384 0.032 -18.012 1.10 . A A . 75 GLY CA 1 1 7 8568 1 1 75 GLY H H 7.141 -1.154 -16.267 1.30 . A A . 75 GLY H 1 1 7 8569 1 1 75 GLY HA2 H 7.612 -0.216 -19.035 1.50 . A A . 75 GLY HA2 1 1 7 8570 1 1 75 GLY HA3 H 6.328 0.292 -17.940 1.30 . A A . 75 GLY HA3 1 1 7 8571 1 1 75 GLY N N 7.596 -1.117 -17.154 1.00 . A A . 75 GLY N 1 1 7 8572 1 1 75 GLY O O 9.364 1.443 -17.954 1.40 . A A . 75 GLY O 1 1 7 8573 1 1 76 PHE C C 7.027 2.293 -14.312 0.80 . A A . 76 PHE C 1 1 7 8574 1 1 76 PHE CA C 8.117 2.282 -15.392 0.90 . A A . 76 PHE CA 1 1 7 8575 1 1 76 PHE CB C 8.765 3.660 -15.497 1.00 . A A . 76 PHE CB 1 1 7 8576 1 1 76 PHE CD1 C 11.202 2.915 -15.329 2.00 . A A . 76 PHE CD1 1 1 7 8577 1 1 76 PHE CD2 C 10.303 4.527 -13.659 1.80 . A A . 76 PHE CD2 1 1 7 8578 1 1 76 PHE CE1 C 12.486 2.956 -14.679 2.70 . A A . 76 PHE CE1 1 1 7 8579 1 1 76 PHE CE2 C 11.585 4.571 -13.008 2.50 . A A . 76 PHE CE2 1 1 7 8580 1 1 76 PHE CG C 10.105 3.699 -14.822 1.20 . A A . 76 PHE CG 1 1 7 8581 1 1 76 PHE CZ C 12.676 3.784 -13.518 2.80 . A A . 76 PHE CZ 1 1 7 8582 1 1 76 PHE H H 6.549 1.749 -16.794 1.00 . A A . 76 PHE H 1 1 7 8583 1 1 76 PHE HA H 8.855 1.516 -15.155 0.80 . A A . 76 PHE HA 1 1 7 8584 1 1 76 PHE HB2 H 8.883 3.938 -16.543 1.60 . A A . 76 PHE HB2 1 1 7 8585 1 1 76 PHE HB3 H 8.114 4.401 -15.035 1.30 . A A . 76 PHE HB3 1 1 7 8586 1 1 76 PHE HD1 H 11.062 2.295 -16.202 2.50 . A A . 76 PHE HD1 1 1 7 8587 1 1 76 PHE HD2 H 9.485 5.117 -13.276 2.30 . A A . 76 PHE HD2 1 1 7 8588 1 1 76 PHE HE1 H 13.306 2.366 -15.061 3.50 . A A . 76 PHE HE1 1 1 7 8589 1 1 76 PHE HE2 H 11.731 5.195 -12.139 3.20 . A A . 76 PHE HE2 1 1 7 8590 1 1 76 PHE HZ H 13.637 3.813 -13.027 3.50 . A A . 76 PHE HZ 1 1 7 8591 1 1 76 PHE N N 7.527 1.907 -16.666 0.90 . A A . 76 PHE N 1 1 7 8592 1 1 76 PHE O O 6.920 3.206 -13.502 0.80 . A A . 76 PHE O 1 1 7 8593 1 1 77 ILE C C 4.745 1.960 -12.603 0.70 . A A . 77 ILE C 1 1 7 8594 1 1 77 ILE CA C 4.843 1.280 -13.967 0.80 . A A . 77 ILE CA 1 1 7 8595 1 1 77 ILE CB C 4.209 -0.126 -13.985 0.90 . A A . 77 ILE CB 1 1 7 8596 1 1 77 ILE CD1 C 3.619 -0.495 -11.531 1.20 . A A . 77 ILE CD1 1 1 7 8597 1 1 77 ILE CG1 C 3.092 -0.338 -12.958 1.10 . A A . 77 ILE CG1 1 1 7 8598 1 1 77 ILE CG2 C 5.253 -1.227 -13.828 0.90 . A A . 77 ILE CG2 1 1 7 8599 1 1 77 ILE H H 6.529 0.451 -14.962 0.80 . A A . 77 ILE H 1 1 7 8600 1 1 77 ILE HA H 4.348 1.890 -14.720 0.80 . A A . 77 ILE HA 1 1 7 8601 1 1 77 ILE HB H 3.762 -0.252 -14.970 0.90 . A A . 77 ILE HB 1 1 7 8602 1 1 77 ILE HD11 H 4.645 -0.856 -11.536 1.50 . A A . 77 ILE HD11 1 1 7 8603 1 1 77 ILE HD12 H 3.017 -1.216 -10.979 1.60 . A A . 77 ILE HD12 1 1 7 8604 1 1 77 ILE HD13 H 3.588 0.447 -10.985 1.70 . A A . 77 ILE HD13 1 1 7 8605 1 1 77 ILE HG12 H 2.357 0.460 -13.005 1.30 . A A . 77 ILE HG12 1 1 7 8606 1 1 77 ILE HG13 H 2.550 -1.246 -13.226 1.10 . A A . 77 ILE HG13 1 1 7 8607 1 1 77 ILE HG21 H 5.991 -0.929 -13.085 1.10 . A A . 77 ILE HG21 1 1 7 8608 1 1 77 ILE HG22 H 5.773 -1.386 -14.773 1.40 . A A . 77 ILE HG22 1 1 7 8609 1 1 77 ILE HG23 H 4.786 -2.157 -13.515 1.40 . A A . 77 ILE HG23 1 1 7 8610 1 1 77 ILE N N 6.234 1.209 -14.381 0.80 . A A . 77 ILE N 1 1 7 8611 1 1 77 ILE O O 5.716 2.081 -11.871 0.80 . A A . 77 ILE O 1 1 7 8612 1 1 78 CYS C C 1.740 3.278 -10.906 0.70 . A A . 78 CYS C 1 1 7 8613 1 1 78 CYS CA C 3.250 3.163 -11.123 0.50 . A A . 78 CYS CA 1 1 7 8614 1 1 78 CYS CB C 3.848 4.563 -11.239 0.40 . A A . 78 CYS CB 1 1 7 8615 1 1 78 CYS H H 2.767 2.032 -12.893 0.50 . A A . 78 CYS H 1 1 7 8616 1 1 78 CYS HA H 3.710 2.620 -10.298 0.60 . A A . 78 CYS HA 1 1 7 8617 1 1 78 CYS HB2 H 4.444 4.630 -12.145 0.70 . A A . 78 CYS HB2 1 1 7 8618 1 1 78 CYS HB3 H 3.049 5.299 -11.328 0.70 . A A . 78 CYS HB3 1 1 7 8619 1 1 78 CYS N N 3.508 2.391 -12.326 0.50 . A A . 78 CYS N 1 1 7 8620 1 1 78 CYS O O 1.221 3.080 -9.815 1.70 . A A . 78 CYS O 1 1 7 8621 1 1 78 CYS SG S 4.881 4.994 -9.817 1.00 . A A . 78 CYS SG 1 1 7 8622 1 1 79 THR C C -0.886 3.767 -13.438 0.90 . A A . 79 THR C 1 1 7 8623 1 1 79 THR CA C -0.366 3.685 -12.002 0.70 . A A . 79 THR CA 1 1 7 8624 1 1 79 THR CB C -0.815 4.912 -11.208 0.90 . A A . 79 THR CB 1 1 7 8625 1 1 79 THR CG2 C -0.573 6.207 -11.982 1.60 . A A . 79 THR CG2 1 1 7 8626 1 1 79 THR H H 1.583 3.819 -12.869 1.30 . A A . 79 THR H 1 1 7 8627 1 1 79 THR HA H -0.714 2.762 -11.537 0.80 . A A . 79 THR HA 1 1 7 8628 1 1 79 THR HB H -0.273 4.948 -10.262 0.70 . A A . 79 THR HB 1 1 7 8629 1 1 79 THR HG1 H -2.374 5.480 -10.268 2.00 . A A . 79 THR HG1 1 1 7 8630 1 1 79 THR HG21 H -0.362 7.033 -11.303 2.00 . A A . 79 THR HG21 1 1 7 8631 1 1 79 THR HG22 H -1.447 6.474 -12.576 2.20 . A A . 79 THR HG22 1 1 7 8632 1 1 79 THR HG23 H 0.275 6.102 -12.660 2.10 . A A . 79 THR HG23 1 1 7 8633 1 1 79 THR N N 1.081 3.621 -12.028 0.70 . A A . 79 THR N 1 1 7 8634 1 1 79 THR O O -0.633 4.722 -14.162 1.50 . A A . 79 THR O 1 1 7 8635 1 1 79 THR OG1 O -2.180 4.798 -10.897 1.70 . A A . 79 THR OG1 1 1 7 8636 1 1 80 ASP C C -3.684 3.883 -13.236 1.10 . A A . 80 ASP C 1 1 7 8637 1 1 80 ASP CA C -2.984 2.955 -14.236 1.20 . A A . 80 ASP CA 1 1 7 8638 1 1 80 ASP CB C -3.712 1.617 -14.359 1.70 . A A . 80 ASP CB 1 1 7 8639 1 1 80 ASP CG C -5.231 1.791 -14.262 2.40 . A A . 80 ASP CG 1 1 7 8640 1 1 80 ASP H H -1.262 1.771 -13.747 0.80 . A A . 80 ASP H 1 1 7 8641 1 1 80 ASP HA H -2.910 3.447 -15.204 1.50 . A A . 80 ASP HA 1 1 7 8642 1 1 80 ASP HB2 H -3.476 1.145 -15.315 1.80 . A A . 80 ASP HB2 1 1 7 8643 1 1 80 ASP HB3 H -3.376 0.962 -13.555 2.10 . A A . 80 ASP HB3 1 1 7 8644 1 1 80 ASP N N -1.626 2.704 -13.794 0.80 . A A . 80 ASP N 1 1 7 8645 1 1 80 ASP O O -4.369 3.442 -12.322 1.90 . A A . 80 ASP O 1 1 7 8646 1 1 80 ASP OD1 O -5.860 2.045 -15.288 2.90 . A A . 80 ASP OD1 1 1 7 8647 1 1 80 ASP OD2 O -5.766 1.669 -13.161 2.90 . A A . 80 ASP OD2 1 1 7 8648 1 1 81 ILE C C -5.585 5.317 -14.706 1.60 . A A . 81 ILE C 1 1 7 8649 1 1 81 ILE CA C -4.596 6.047 -13.792 1.30 . A A . 81 ILE CA 1 1 7 8650 1 1 81 ILE CB C -4.104 7.322 -14.477 1.70 . A A . 81 ILE CB 1 1 7 8651 1 1 81 ILE CD1 C -5.288 8.920 -12.901 3.00 . A A . 81 ILE CD1 1 1 7 8652 1 1 81 ILE CG1 C -5.136 8.443 -14.346 2.50 . A A . 81 ILE CG1 1 1 7 8653 1 1 81 ILE CG2 C -3.777 7.059 -15.947 1.90 . A A . 81 ILE CG2 1 1 7 8654 1 1 81 ILE H H -2.565 5.588 -13.297 1.50 . A A . 81 ILE H 1 1 7 8655 1 1 81 ILE HA H -5.077 6.286 -12.843 1.50 . A A . 81 ILE HA 1 1 7 8656 1 1 81 ILE HB H -3.190 7.643 -13.978 2.20 . A A . 81 ILE HB 1 1 7 8657 1 1 81 ILE HD11 H -6.339 9.061 -12.648 3.20 . A A . 81 ILE HD11 1 1 7 8658 1 1 81 ILE HD12 H -4.776 9.870 -12.750 3.40 . A A . 81 ILE HD12 1 1 7 8659 1 1 81 ILE HD13 H -4.868 8.195 -12.204 3.30 . A A . 81 ILE HD13 1 1 7 8660 1 1 81 ILE HG12 H -4.845 9.283 -14.977 2.70 . A A . 81 ILE HG12 1 1 7 8661 1 1 81 ILE HG13 H -6.100 8.097 -14.718 3.00 . A A . 81 ILE HG13 1 1 7 8662 1 1 81 ILE HG21 H -4.565 7.444 -16.594 2.20 . A A . 81 ILE HG21 1 1 7 8663 1 1 81 ILE HG22 H -3.678 5.990 -16.139 2.30 . A A . 81 ILE HG22 1 1 7 8664 1 1 81 ILE HG23 H -2.842 7.541 -16.232 2.30 . A A . 81 ILE HG23 1 1 7 8665 1 1 81 ILE N N -3.465 5.190 -13.475 1.00 . A A . 81 ILE N 1 1 7 8666 1 1 81 ILE O O -5.243 4.368 -15.402 2.40 . A A . 81 ILE O 1 1 7 8667 1 1 82 ASP C C -8.796 6.590 -15.873 2.70 . A A . 82 ASP C 1 1 7 8668 1 1 82 ASP CA C -7.752 5.482 -15.715 2.60 . A A . 82 ASP CA 1 1 7 8669 1 1 82 ASP CB C -8.428 4.150 -15.392 3.50 . A A . 82 ASP CB 1 1 7 8670 1 1 82 ASP CG C -9.257 3.682 -16.590 3.90 . A A . 82 ASP CG 1 1 7 8671 1 1 82 ASP H H -7.107 6.426 -13.901 2.10 . A A . 82 ASP H 1 1 7 8672 1 1 82 ASP HA H -7.160 5.410 -16.628 3.00 . A A . 82 ASP HA 1 1 7 8673 1 1 82 ASP HB2 H -7.685 3.388 -15.155 3.90 . A A . 82 ASP HB2 1 1 7 8674 1 1 82 ASP HB3 H -9.084 4.255 -14.527 3.90 . A A . 82 ASP HB3 1 1 7 8675 1 1 82 ASP N N -6.828 5.828 -14.652 1.90 . A A . 82 ASP N 1 1 7 8676 1 1 82 ASP O O -8.650 7.506 -16.674 3.30 . A A . 82 ASP O 1 1 7 8677 1 1 82 ASP OD1 O -9.733 4.532 -17.342 4.20 . A A . 82 ASP OD1 1 1 7 8678 1 1 82 ASP OD2 O -9.417 2.474 -16.758 4.50 . A A . 82 ASP OD2 1 1 7 8679 1 1 83 GLU C C -10.008 8.135 -13.310 1.00 . A A . 83 GLU C 1 1 7 8680 1 1 83 GLU CA C -10.573 7.630 -14.640 1.00 . A A . 83 GLU CA 1 1 7 8681 1 1 83 GLU CB C -12.061 7.310 -14.493 1.00 . A A . 83 GLU CB 1 1 7 8682 1 1 83 GLU CD C -14.073 6.725 -15.864 1.00 . A A . 83 GLU CD 1 1 7 8683 1 1 83 GLU CG C -12.580 6.463 -15.656 1.00 . A A . 83 GLU CG 1 1 7 8684 1 1 83 GLU H H -10.143 5.534 -14.751 1.00 . A A . 83 GLU H 1 1 7 8685 1 1 83 GLU HA H -10.407 8.381 -15.412 1.00 . A A . 83 GLU HA 1 1 7 8686 1 1 83 GLU HB2 H -12.230 6.783 -13.555 1.00 . A A . 83 GLU HB2 1 1 7 8687 1 1 83 GLU HB3 H -12.629 8.238 -14.435 1.00 . A A . 83 GLU HB3 1 1 7 8688 1 1 83 GLU HG2 H -12.046 6.704 -16.575 1.00 . A A . 83 GLU HG2 1 1 7 8689 1 1 83 GLU HG3 H -12.432 5.402 -15.454 1.00 . A A . 83 GLU HG3 1 1 7 8690 1 1 83 GLU N N -9.855 6.441 -15.057 1.00 . A A . 83 GLU N 1 1 7 8691 1 1 83 GLU O O -10.082 9.337 -13.059 1.00 . A A . 83 GLU O 1 1 7 8692 1 1 83 GLU OXT O -9.500 7.320 -12.542 1.00 . A A . 83 GLU OXT 1 1 7 8693 1 1 83 GLU OE1 O -14.664 7.433 -15.050 1.00 . A A . 83 GLU OE1 1 1 7 8694 1 1 83 GLU OE2 O -14.628 6.217 -16.837 1.00 . A A . 83 GLU OE2 1 1 7 8695 2 2 1 NAG C1 C -15.681 -1.905 12.444 1.00 . B A . 121 NAG C1 1 1 7 8696 2 2 1 NAG C2 C -15.187 -0.746 11.583 1.00 . B A . 121 NAG C2 1 1 7 8697 2 2 1 NAG C3 C -16.313 0.214 11.218 1.00 . B A . 121 NAG C3 1 1 7 8698 2 2 1 NAG C4 C -17.528 -0.551 10.702 1.00 . B A . 121 NAG C4 1 1 7 8699 2 2 1 NAG C5 C -17.934 -1.689 11.641 1.00 . B A . 121 NAG C5 1 1 7 8700 2 2 1 NAG C6 C -17.999 -3.034 10.914 1.00 . B A . 121 NAG C6 1 1 7 8701 2 2 1 NAG C7 C -13.091 0.417 11.605 1.00 . B A . 121 NAG C7 1 1 7 8702 2 2 1 NAG C8 C -12.386 -0.694 10.823 1.00 . B A . 121 NAG C8 1 1 7 8703 2 2 1 NAG H1 H -15.115 -1.952 13.375 1.00 . B A . 121 NAG H1 1 1 7 8704 2 2 1 NAG H2 H -14.714 -1.133 10.681 1.00 . B A . 121 NAG H2 1 1 7 8705 2 2 1 NAG H3 H -16.593 0.801 12.092 1.00 . B A . 121 NAG H3 1 1 7 8706 2 2 1 NAG H4 H -17.305 -0.958 9.716 1.00 . B A . 121 NAG H4 1 1 7 8707 2 2 1 NAG H5 H -18.929 -1.468 12.026 1.00 . B A . 121 NAG H5 1 1 7 8708 2 2 1 NAG H61 H -17.796 -3.856 11.600 1.00 . B A . 121 NAG H61 1 1 7 8709 2 2 1 NAG H62 H -17.265 -3.077 10.110 1.00 . B A . 121 NAG H62 1 1 7 8710 2 2 1 NAG H81 H -11.327 -0.715 11.079 1.00 . B A . 121 NAG H81 1 1 7 8711 2 2 1 NAG H82 H -12.830 -1.659 11.065 1.00 . B A . 121 NAG H82 1 1 7 8712 2 2 1 NAG H83 H -12.488 -0.516 9.752 1.00 . B A . 121 NAG H83 1 1 7 8713 2 2 1 NAG HN2 H -14.231 0.147 13.283 1.00 . B A . 121 NAG HN2 1 1 7 8714 2 2 1 NAG HO3 H -16.527 1.120 9.553 1.00 . B A . 121 NAG HO3 1 1 7 8715 2 2 1 NAG HO4 H -18.867 0.294 9.639 1.00 . B A . 121 NAG HO4 1 1 7 8716 2 2 1 NAG HO6 H -19.139 -3.665 9.521 1.00 . B A . 121 NAG HO6 1 1 7 8717 2 2 1 NAG N2 N -14.154 -0.023 12.300 1.00 . B A . 121 NAG N2 1 1 7 8718 2 2 1 NAG O3 O -15.868 1.113 10.234 1.00 . B A . 121 NAG O3 1 1 7 8719 2 2 1 NAG O4 O -18.607 0.336 10.550 1.00 . B A . 121 NAG O4 1 1 7 8720 2 2 1 NAG O5 O -17.055 -1.772 12.745 1.00 . B A . 121 NAG O5 1 1 7 8721 2 2 1 NAG O6 O -19.272 -3.235 10.355 1.00 . B A . 121 NAG O6 1 1 7 8722 2 2 1 NAG O7 O -12.698 1.577 11.577 1.00 . B A . 121 NAG O7 1 1 7 8723 3 2 1 NAG C1 C -8.063 -0.391 -6.130 1.00 . C A . 148 NAG C1 1 1 7 8724 3 2 1 NAG C2 C -7.698 0.731 -5.160 1.00 . C A . 148 NAG C2 1 1 7 8725 3 2 1 NAG C3 C -8.894 1.632 -4.855 1.00 . C A . 148 NAG C3 1 1 7 8726 3 2 1 NAG C4 C -10.156 0.815 -4.576 1.00 . C A . 148 NAG C4 1 1 7 8727 3 2 1 NAG C5 C -10.342 -0.320 -5.586 1.00 . C A . 148 NAG C5 1 1 7 8728 3 2 1 NAG C6 C -11.732 -0.285 -6.221 1.00 . C A . 148 NAG C6 1 1 7 8729 3 2 1 NAG C7 C -5.984 -0.398 -3.925 1.00 . C A . 148 NAG C7 1 1 7 8730 3 2 1 NAG C8 C -4.861 0.641 -3.944 1.00 . C A . 148 NAG C8 1 1 7 8731 3 2 1 NAG H1 H -7.976 -1.368 -5.654 1.00 . C A . 148 NAG H1 1 1 7 8732 3 2 1 NAG H2 H -6.873 1.322 -5.559 1.00 . C A . 148 NAG H2 1 1 7 8733 3 2 1 NAG H3 H -8.668 2.258 -3.992 1.00 . C A . 148 NAG H3 1 1 7 8734 3 2 1 NAG H4 H -11.025 1.473 -4.607 1.00 . C A . 148 NAG H4 1 1 7 8735 3 2 1 NAG H5 H -10.202 -1.275 -5.081 1.00 . C A . 148 NAG H5 1 1 7 8736 3 2 1 NAG H61 H -12.500 -0.098 -5.470 1.00 . C A . 148 NAG H61 1 1 7 8737 3 2 1 NAG H62 H -11.961 -1.233 -6.709 1.00 . C A . 148 NAG H62 1 1 7 8738 3 2 1 NAG H81 H -5.055 1.383 -4.719 1.00 . C A . 148 NAG H81 1 1 7 8739 3 2 1 NAG H82 H -4.804 1.144 -2.978 1.00 . C A . 148 NAG H82 1 1 7 8740 3 2 1 NAG H83 H -3.908 0.155 -4.148 1.00 . C A . 148 NAG H83 1 1 7 8741 3 2 1 NAG HN2 H -7.768 0.166 -3.094 1.00 . C A . 148 NAG HN2 1 1 7 8742 3 2 1 NAG HO3 H -9.944 2.933 -5.773 1.00 . C A . 148 NAG HO3 1 1 7 8743 3 2 1 NAG HO4 H -10.430 -0.602 -3.329 1.00 . C A . 148 NAG HO4 1 1 7 8744 3 2 1 NAG HO6 H -12.622 0.607 -7.654 1.00 . C A . 148 NAG HO6 1 1 7 8745 3 2 1 NAG N2 N -7.210 0.153 -3.924 1.00 . C A . 148 NAG N2 1 1 7 8746 3 2 1 NAG O3 O -9.123 2.491 -5.943 1.00 . C A . 148 NAG O3 1 1 7 8747 3 2 1 NAG O4 O -10.087 0.280 -3.279 1.00 . C A . 148 NAG O4 1 1 7 8748 3 2 1 NAG O5 O -9.375 -0.206 -6.603 1.00 . C A . 148 NAG O5 1 1 7 8749 3 2 1 NAG O6 O -11.807 0.733 -7.187 1.00 . C A . 148 NAG O6 1 1 7 8750 3 2 1 NAG O7 O -5.753 -1.601 -3.913 1.00 . C A . 148 NAG O7 1 1 8 8751 1 1 1 HIS C C 5.351 -4.947 26.515 1.00 . A A . 1 HIS C 1 1 8 8752 1 1 1 HIS CA C 6.872 -4.872 26.371 1.00 . A A . 1 HIS CA 1 1 8 8753 1 1 1 HIS CB C 7.458 -6.278 26.507 1.00 . A A . 1 HIS CB 1 1 8 8754 1 1 1 HIS CD2 C 9.986 -6.020 26.681 1.00 . A A . 1 HIS CD2 1 1 8 8755 1 1 1 HIS CE1 C 10.614 -6.707 24.645 1.00 . A A . 1 HIS CE1 1 1 8 8756 1 1 1 HIS CG C 8.872 -6.351 26.004 1.00 . A A . 1 HIS CG 1 1 8 8757 1 1 1 HIS H1 H 6.905 -3.065 27.346 1.00 . A A . 1 HIS H1 1 1 8 8758 1 1 1 HIS H2 H 7.402 -4.383 28.295 1.00 . A A . 1 HIS H2 1 1 8 8759 1 1 1 HIS H3 H 8.436 -3.758 27.101 1.00 . A A . 1 HIS H3 1 1 8 8760 1 1 1 HIS HA H 7.099 -4.472 25.382 1.00 . A A . 1 HIS HA 1 1 8 8761 1 1 1 HIS HB2 H 7.432 -6.587 27.551 1.00 . A A . 1 HIS HB2 1 1 8 8762 1 1 1 HIS HB3 H 6.843 -6.987 25.953 1.00 . A A . 1 HIS HB3 1 1 8 8763 1 1 1 HIS HD2 H 10.023 -5.653 27.690 1.00 . A A . 1 HIS HD2 1 1 8 8764 1 1 1 HIS HE1 H 11.220 -6.972 23.782 1.00 . A A . 1 HIS HE1 1 1 8 8765 1 1 1 HIS HE2 H 12.088 -6.079 26.036 1.00 . A A . 1 HIS HE2 1 1 8 8766 1 1 1 HIS N N 7.445 -3.954 27.348 1.00 . A A . 1 HIS N 1 1 8 8767 1 1 1 HIS ND1 N 9.273 -6.805 24.661 1.00 . A A . 1 HIS ND1 1 1 8 8768 1 1 1 HIS NE2 N 11.133 -6.251 25.794 1.00 . A A . 1 HIS NE2 1 1 8 8769 1 1 1 HIS O O 4.755 -4.347 27.402 1.00 . A A . 1 HIS O 1 1 8 8770 1 1 2 MET C C 2.908 -5.780 24.009 1.00 . A A . 2 MET C 1 1 8 8771 1 1 2 MET CA C 4.199 -5.070 24.420 1.00 . A A . 2 MET CA 1 1 8 8772 1 1 2 MET CB C 5.208 -5.084 23.271 1.00 . A A . 2 MET CB 1 1 8 8773 1 1 2 MET CE C 7.371 -8.299 22.791 1.00 . A A . 2 MET CE 1 1 8 8774 1 1 2 MET CG C 5.366 -6.475 22.656 1.00 . A A . 2 MET CG 1 1 8 8775 1 1 2 MET H H 4.742 -6.717 25.684 1.00 . A A . 2 MET H 1 1 8 8776 1 1 2 MET HA H 3.964 -4.050 24.723 1.00 . A A . 2 MET HA 1 1 8 8777 1 1 2 MET HB2 H 4.890 -4.379 22.503 1.00 . A A . 2 MET HB2 1 1 8 8778 1 1 2 MET HB3 H 6.176 -4.736 23.633 1.00 . A A . 2 MET HB3 1 1 8 8779 1 1 2 MET HE1 H 6.555 -8.994 22.596 1.00 . A A . 2 MET HE1 1 1 8 8780 1 1 2 MET HE2 H 7.474 -8.175 23.869 1.00 . A A . 2 MET HE2 1 1 8 8781 1 1 2 MET HE3 H 8.295 -8.722 22.396 1.00 . A A . 2 MET HE3 1 1 8 8782 1 1 2 MET HG2 H 5.160 -7.244 23.400 1.00 . A A . 2 MET HG2 1 1 8 8783 1 1 2 MET HG3 H 4.651 -6.612 21.844 1.00 . A A . 2 MET HG3 1 1 8 8784 1 1 2 MET N N 4.771 -5.722 25.582 1.00 . A A . 2 MET N 1 1 8 8785 1 1 2 MET O O 2.888 -6.632 23.128 1.00 . A A . 2 MET O 1 1 8 8786 1 1 2 MET SD S 7.031 -6.712 22.013 1.00 . A A . 2 MET SD 1 1 8 8787 1 1 3 GLU C C -0.370 -4.335 24.864 1.00 . A A . 3 GLU C 1 1 8 8788 1 1 3 GLU CA C 0.984 -4.339 24.146 1.00 . A A . 3 GLU CA 1 1 8 8789 1 1 3 GLU CB C 0.786 -4.579 22.648 1.00 . A A . 3 GLU CB 1 1 8 8790 1 1 3 GLU CD C 2.845 -3.993 21.314 1.00 . A A . 3 GLU CD 1 1 8 8791 1 1 3 GLU CG C 1.481 -3.507 21.806 1.00 . A A . 3 GLU CG 1 1 8 8792 1 1 3 GLU H H 1.651 -5.747 25.617 1.00 . A A . 3 GLU H 1 1 8 8793 1 1 3 GLU HA H 1.492 -3.392 24.326 1.00 . A A . 3 GLU HA 1 1 8 8794 1 1 3 GLU HB2 H 1.166 -5.567 22.377 1.00 . A A . 3 GLU HB2 1 1 8 8795 1 1 3 GLU HB3 H -0.284 -4.568 22.424 1.00 . A A . 3 GLU HB3 1 1 8 8796 1 1 3 GLU HG2 H 0.872 -3.252 20.939 1.00 . A A . 3 GLU HG2 1 1 8 8797 1 1 3 GLU HG3 H 1.625 -2.598 22.389 1.00 . A A . 3 GLU HG3 1 1 8 8798 1 1 3 GLU N N 1.836 -5.369 24.710 1.00 . A A . 3 GLU N 1 1 8 8799 1 1 3 GLU O O -0.808 -5.330 25.428 1.00 . A A . 3 GLU O 1 1 8 8800 1 1 3 GLU OE1 O 3.034 -5.202 21.198 1.00 . A A . 3 GLU OE1 1 1 8 8801 1 1 3 GLU OE2 O 3.704 -3.153 21.050 1.00 . A A . 3 GLU OE2 1 1 8 8802 1 1 4 PRO C C -3.062 -3.541 23.479 1.00 . A A . 4 PRO C 1 1 8 8803 1 1 4 PRO CA C -2.453 -3.010 24.777 1.00 . A A . 4 PRO CA 1 1 8 8804 1 1 4 PRO CB C -2.724 -1.508 24.868 1.00 . A A . 4 PRO CB 1 1 8 8805 1 1 4 PRO CD C -0.284 -1.881 24.821 1.00 . A A . 4 PRO CD 1 1 8 8806 1 1 4 PRO CG C -1.365 -0.799 24.822 1.00 . A A . 4 PRO CG 1 1 8 8807 1 1 4 PRO HA H -2.889 -3.540 25.624 1.00 . A A . 4 PRO HA 1 1 8 8808 1 1 4 PRO HB2 H -3.354 -1.183 24.039 1.00 . A A . 4 PRO HB2 1 1 8 8809 1 1 4 PRO HB3 H -3.249 -1.271 25.794 1.00 . A A . 4 PRO HB3 1 1 8 8810 1 1 4 PRO HD2 H 0.353 -1.802 23.941 1.00 . A A . 4 PRO HD2 1 1 8 8811 1 1 4 PRO HD3 H 0.342 -1.818 25.711 1.00 . A A . 4 PRO HD3 1 1 8 8812 1 1 4 PRO HG2 H -1.287 -0.192 23.921 1.00 . A A . 4 PRO HG2 1 1 8 8813 1 1 4 PRO HG3 H -1.247 -0.146 25.685 1.00 . A A . 4 PRO HG3 1 1 8 8814 1 1 4 PRO N N -1.003 -3.142 24.809 1.00 . A A . 4 PRO N 1 1 8 8815 1 1 4 PRO O O -3.898 -2.907 22.847 1.00 . A A . 4 PRO O 1 1 8 8816 1 1 5 VAL C C -4.601 -5.117 21.763 1.00 . A A . 5 VAL C 1 1 8 8817 1 1 5 VAL CA C -3.178 -5.567 22.097 1.00 . A A . 5 VAL CA 1 1 8 8818 1 1 5 VAL CB C -3.089 -7.049 22.459 1.00 . A A . 5 VAL CB 1 1 8 8819 1 1 5 VAL CG1 C -3.010 -7.285 23.970 1.00 . A A . 5 VAL CG1 1 1 8 8820 1 1 5 VAL CG2 C -4.169 -7.944 21.833 1.00 . A A . 5 VAL CG2 1 1 8 8821 1 1 5 VAL H H -1.722 -5.038 23.578 1.00 . A A . 5 VAL H 1 1 8 8822 1 1 5 VAL HA H -2.547 -5.399 21.221 1.00 . A A . 5 VAL HA 1 1 8 8823 1 1 5 VAL HB H -2.143 -7.327 22.007 1.00 . A A . 5 VAL HB 1 1 8 8824 1 1 5 VAL HG11 H -3.456 -6.455 24.517 1.00 . A A . 5 VAL HG11 1 1 8 8825 1 1 5 VAL HG12 H -3.543 -8.194 24.250 1.00 . A A . 5 VAL HG12 1 1 8 8826 1 1 5 VAL HG13 H -1.975 -7.386 24.297 1.00 . A A . 5 VAL HG13 1 1 8 8827 1 1 5 VAL HG21 H -4.890 -7.407 21.220 1.00 . A A . 5 VAL HG21 1 1 8 8828 1 1 5 VAL HG22 H -3.708 -8.702 21.200 1.00 . A A . 5 VAL HG22 1 1 8 8829 1 1 5 VAL HG23 H -4.726 -8.465 22.611 1.00 . A A . 5 VAL HG23 1 1 8 8830 1 1 5 VAL N N -2.569 -4.745 23.137 1.00 . A A . 5 VAL N 1 1 8 8831 1 1 5 VAL O O -5.592 -5.490 22.379 1.00 . A A . 5 VAL O 1 1 8 8832 1 1 6 ASP C C -6.692 -4.944 19.646 1.00 . A A . 6 ASP C 1 1 8 8833 1 1 6 ASP CA C -5.235 -4.518 19.470 1.00 . A A . 6 ASP CA 1 1 8 8834 1 1 6 ASP CB C -4.423 -5.535 18.666 1.00 . A A . 6 ASP CB 1 1 8 8835 1 1 6 ASP CG C -4.925 -6.982 18.797 1.00 . A A . 6 ASP CG 1 1 8 8836 1 1 6 ASP H H -3.734 -3.706 20.753 1.00 . A A . 6 ASP H 1 1 8 8837 1 1 6 ASP HA H -5.231 -3.560 18.948 1.00 . A A . 6 ASP HA 1 1 8 8838 1 1 6 ASP HB2 H -4.386 -5.244 17.621 1.00 . A A . 6 ASP HB2 1 1 8 8839 1 1 6 ASP HB3 H -3.397 -5.510 19.012 1.00 . A A . 6 ASP HB3 1 1 8 8840 1 1 6 ASP N N -4.561 -4.264 20.733 1.00 . A A . 6 ASP N 1 1 8 8841 1 1 6 ASP O O -7.075 -5.606 20.604 1.00 . A A . 6 ASP O 1 1 8 8842 1 1 6 ASP OD1 O -6.094 -7.245 18.519 1.00 . A A . 6 ASP OD1 1 1 8 8843 1 1 6 ASP OD2 O -4.124 -7.840 19.165 1.00 . A A . 6 ASP OD2 1 1 8 8844 1 1 7 PRO C C -6.486 -5.326 16.480 1.00 . A A . 7 PRO C 1 1 8 8845 1 1 7 PRO CA C -7.705 -5.287 17.416 1.00 . A A . 7 PRO CA 1 1 8 8846 1 1 7 PRO CB C -8.862 -4.577 16.705 1.00 . A A . 7 PRO CB 1 1 8 8847 1 1 7 PRO CD C -8.259 -3.294 18.725 1.00 . A A . 7 PRO CD 1 1 8 8848 1 1 7 PRO CG C -9.183 -3.306 17.506 1.00 . A A . 7 PRO CG 1 1 8 8849 1 1 7 PRO HA H -7.984 -6.309 17.675 1.00 . A A . 7 PRO HA 1 1 8 8850 1 1 7 PRO HB2 H -8.588 -4.325 15.681 1.00 . A A . 7 PRO HB2 1 1 8 8851 1 1 7 PRO HB3 H -9.736 -5.227 16.660 1.00 . A A . 7 PRO HB3 1 1 8 8852 1 1 7 PRO HD2 H -7.593 -2.432 18.710 1.00 . A A . 7 PRO HD2 1 1 8 8853 1 1 7 PRO HD3 H -8.827 -3.278 19.655 1.00 . A A . 7 PRO HD3 1 1 8 8854 1 1 7 PRO HG2 H -9.023 -2.418 16.896 1.00 . A A . 7 PRO HG2 1 1 8 8855 1 1 7 PRO HG3 H -10.227 -3.305 17.821 1.00 . A A . 7 PRO HG3 1 1 8 8856 1 1 7 PRO N N -7.485 -4.520 18.637 1.00 . A A . 7 PRO N 1 1 8 8857 1 1 7 PRO O O -5.834 -6.349 16.308 1.00 . A A . 7 PRO O 1 1 8 8858 1 1 8 CYS C C -3.793 -3.993 15.669 1.00 . A A . 8 CYS C 1 1 8 8859 1 1 8 CYS CA C -5.131 -4.035 14.946 1.00 . A A . 8 CYS CA 1 1 8 8860 1 1 8 CYS CB C -5.300 -2.791 14.098 1.00 . A A . 8 CYS CB 1 1 8 8861 1 1 8 CYS H H -6.831 -3.361 16.034 1.00 . A A . 8 CYS H 1 1 8 8862 1 1 8 CYS HA H -5.121 -4.900 14.299 1.00 . A A . 8 CYS HA 1 1 8 8863 1 1 8 CYS HB2 H -6.173 -2.883 13.449 1.00 . A A . 8 CYS HB2 1 1 8 8864 1 1 8 CYS HB3 H -5.442 -1.932 14.754 1.00 . A A . 8 CYS HB3 1 1 8 8865 1 1 8 CYS N N -6.235 -4.148 15.882 1.00 . A A . 8 CYS N 1 1 8 8866 1 1 8 CYS O O -2.853 -4.681 15.295 1.00 . A A . 8 CYS O 1 1 8 8867 1 1 8 CYS SG S -3.829 -2.533 13.090 1.00 . A A . 8 CYS SG 1 1 8 8868 1 1 9 PHE C C -1.605 -4.052 17.427 1.00 . A A . 9 PHE C 1 1 8 8869 1 1 9 PHE CA C -2.517 -2.825 17.358 1.00 . A A . 9 PHE CA 1 1 8 8870 1 1 9 PHE CB C -2.802 -2.351 18.774 1.00 . A A . 9 PHE CB 1 1 8 8871 1 1 9 PHE CD1 C -1.173 -0.411 18.498 1.00 . A A . 9 PHE CD1 1 1 8 8872 1 1 9 PHE CD2 C -1.125 -1.743 20.599 1.00 . A A . 9 PHE CD2 1 1 8 8873 1 1 9 PHE CE1 C -0.108 0.419 18.996 1.00 . A A . 9 PHE CE1 1 1 8 8874 1 1 9 PHE CE2 C -0.063 -0.912 21.102 1.00 . A A . 9 PHE CE2 1 1 8 8875 1 1 9 PHE CG C -1.687 -1.494 19.297 1.00 . A A . 9 PHE CG 1 1 8 8876 1 1 9 PHE CZ C 0.446 0.167 20.299 1.00 . A A . 9 PHE CZ 1 1 8 8877 1 1 9 PHE H H -4.609 -2.664 16.984 1.00 . A A . 9 PHE H 1 1 8 8878 1 1 9 PHE HA H -2.049 -2.036 16.774 1.00 . A A . 9 PHE HA 1 1 8 8879 1 1 9 PHE HB2 H -3.734 -1.781 18.801 1.00 . A A . 9 PHE HB2 1 1 8 8880 1 1 9 PHE HB3 H -2.911 -3.239 19.397 1.00 . A A . 9 PHE HB3 1 1 8 8881 1 1 9 PHE HD1 H -1.586 -0.224 17.518 1.00 . A A . 9 PHE HD1 1 1 8 8882 1 1 9 PHE HD2 H -1.494 -2.563 21.198 1.00 . A A . 9 PHE HD2 1 1 8 8883 1 1 9 PHE HE1 H 0.273 1.229 18.394 1.00 . A A . 9 PHE HE1 1 1 8 8884 1 1 9 PHE HE2 H 0.352 -1.095 22.081 1.00 . A A . 9 PHE HE2 1 1 8 8885 1 1 9 PHE HZ H 1.249 0.785 20.672 1.00 . A A . 9 PHE HZ 1 1 8 8886 1 1 9 PHE N N -3.775 -3.144 16.711 1.00 . A A . 9 PHE N 1 1 8 8887 1 1 9 PHE O O -2.043 -5.195 17.388 1.00 . A A . 9 PHE O 1 1 8 8888 1 1 10 ARG C C 0.680 -5.277 15.799 1.00 . A A . 10 ARG C 1 1 8 8889 1 1 10 ARG CA C 0.635 -4.819 17.278 1.00 . A A . 10 ARG CA 1 1 8 8890 1 1 10 ARG CB C 0.279 -5.991 18.190 1.00 . A A . 10 ARG CB 1 1 8 8891 1 1 10 ARG CD C 1.640 -7.913 19.117 1.00 . A A . 10 ARG CD 1 1 8 8892 1 1 10 ARG CG C 1.456 -6.397 19.067 1.00 . A A . 10 ARG CG 1 1 8 8893 1 1 10 ARG CZ C -0.031 -9.381 20.011 1.00 . A A . 10 ARG CZ 1 1 8 8894 1 1 10 ARG H H -0.002 -2.825 17.800 1.00 . A A . 10 ARG H 1 1 8 8895 1 1 10 ARG HA H 1.592 -4.391 17.542 1.00 . A A . 10 ARG HA 1 1 8 8896 1 1 10 ARG HB2 H -0.542 -5.693 18.851 1.00 . A A . 10 ARG HB2 1 1 8 8897 1 1 10 ARG HB3 H -0.073 -6.832 17.586 1.00 . A A . 10 ARG HB3 1 1 8 8898 1 1 10 ARG HD2 H 1.242 -8.395 18.223 1.00 . A A . 10 ARG HD2 1 1 8 8899 1 1 10 ARG HD3 H 2.687 -8.191 19.233 1.00 . A A . 10 ARG HD3 1 1 8 8900 1 1 10 ARG HE H 1.125 -8.163 21.183 1.00 . A A . 10 ARG HE 1 1 8 8901 1 1 10 ARG HG2 H 2.366 -5.918 18.705 1.00 . A A . 10 ARG HG2 1 1 8 8902 1 1 10 ARG HG3 H 1.272 -6.008 20.069 1.00 . A A . 10 ARG HG3 1 1 8 8903 1 1 10 ARG HH11 H -0.745 -8.507 18.330 1.00 . A A . 10 ARG HH11 1 1 8 8904 1 1 10 ARG HH12 H -1.796 -9.674 19.063 1.00 . A A . 10 ARG HH12 1 1 8 8905 1 1 10 ARG HH21 H 0.681 -10.725 21.347 1.00 . A A . 10 ARG HH21 1 1 8 8906 1 1 10 ARG HH22 H -0.860 -11.111 20.658 1.00 . A A . 10 ARG HH22 1 1 8 8907 1 1 10 ARG N N -0.306 -3.740 17.536 1.00 . A A . 10 ARG N 1 1 8 8908 1 1 10 ARG NE N 0.922 -8.463 20.250 1.00 . A A . 10 ARG NE 1 1 8 8909 1 1 10 ARG NH1 N -0.932 -9.170 19.055 1.00 . A A . 10 ARG NH1 1 1 8 8910 1 1 10 ARG NH2 N -0.074 -10.498 20.731 1.00 . A A . 10 ARG NH2 1 1 8 8911 1 1 10 ARG O O 1.507 -6.092 15.408 1.00 . A A . 10 ARG O 1 1 8 8912 1 1 11 ALA C C 0.443 -5.703 12.843 1.00 . A A . 11 ALA C 1 1 8 8913 1 1 11 ALA CA C -0.715 -5.339 13.797 1.00 . A A . 11 ALA CA 1 1 8 8914 1 1 11 ALA CB C -1.692 -4.396 13.094 1.00 . A A . 11 ALA CB 1 1 8 8915 1 1 11 ALA H H -0.763 -4.005 15.528 1.00 . A A . 11 ALA H 1 1 8 8916 1 1 11 ALA HA H -1.251 -6.238 14.101 1.00 . A A . 11 ALA HA 1 1 8 8917 1 1 11 ALA HB1 H -2.719 -4.762 13.155 1.00 . A A . 11 ALA HB1 1 1 8 8918 1 1 11 ALA HB2 H -1.651 -3.415 13.565 1.00 . A A . 11 ALA HB2 1 1 8 8919 1 1 11 ALA HB3 H -1.455 -4.283 12.038 1.00 . A A . 11 ALA HB3 1 1 8 8920 1 1 11 ALA N N -0.257 -4.704 15.026 1.00 . A A . 11 ALA N 1 1 8 8921 1 1 11 ALA O O 0.275 -6.508 11.934 1.00 . A A . 11 ALA O 1 1 8 8922 1 1 12 ASN C C 1.296 -3.660 11.122 1.00 . A A . 12 ASN C 1 1 8 8923 1 1 12 ASN CA C 1.851 -3.752 12.544 1.00 . A A . 12 ASN CA 1 1 8 8924 1 1 12 ASN CB C 3.354 -3.467 12.533 1.00 . A A . 12 ASN CB 1 1 8 8925 1 1 12 ASN CG C 3.613 -1.986 12.818 1.00 . A A . 12 ASN CG 1 1 8 8926 1 1 12 ASN H H 2.297 -5.516 13.672 1.00 . A A . 12 ASN H 1 1 8 8927 1 1 12 ASN HA H 1.321 -3.051 13.189 1.00 . A A . 12 ASN HA 1 1 8 8928 1 1 12 ASN HB2 H 3.866 -4.068 13.284 1.00 . A A . 12 ASN HB2 1 1 8 8929 1 1 12 ASN HB3 H 3.781 -3.718 11.561 1.00 . A A . 12 ASN HB3 1 1 8 8930 1 1 12 ASN HD21 H 4.509 -1.675 11.018 1.00 . A A . 12 ASN HD21 1 1 8 8931 1 1 12 ASN HD22 H 5.226 -0.824 12.373 1.00 . A A . 12 ASN HD22 1 1 8 8932 1 1 12 ASN N N 1.613 -5.078 13.089 1.00 . A A . 12 ASN N 1 1 8 8933 1 1 12 ASN ND2 N 4.532 -1.446 11.996 1.00 . A A . 12 ASN ND2 1 1 8 8934 1 1 12 ASN O O 1.782 -4.301 10.199 1.00 . A A . 12 ASN O 1 1 8 8935 1 1 12 ASN OD1 O 3.027 -1.386 13.711 1.00 . A A . 12 ASN OD1 1 1 8 8936 1 1 13 CYS C C 1.757 -1.073 10.172 1.00 . A A . 13 CYS C 1 1 8 8937 1 1 13 CYS CA C 0.325 -1.595 10.247 1.00 . A A . 13 CYS CA 1 1 8 8938 1 1 13 CYS CB C -0.611 -0.540 10.839 1.00 . A A . 13 CYS CB 1 1 8 8939 1 1 13 CYS H H -0.640 -3.081 11.389 1.00 . A A . 13 CYS H 1 1 8 8940 1 1 13 CYS HA H -0.001 -1.859 9.240 1.00 . A A . 13 CYS HA 1 1 8 8941 1 1 13 CYS HB2 H -0.221 -0.132 11.779 1.00 . A A . 13 CYS HB2 1 1 8 8942 1 1 13 CYS HB3 H -0.700 0.282 10.128 1.00 . A A . 13 CYS HB3 1 1 8 8943 1 1 13 CYS N N 0.246 -2.822 11.018 1.00 . A A . 13 CYS N 1 1 8 8944 1 1 13 CYS O O 2.327 -0.554 11.125 1.00 . A A . 13 CYS O 1 1 8 8945 1 1 13 CYS SG S -2.262 -1.199 11.145 1.00 . A A . 13 CYS SG 1 1 8 8946 1 1 14 GLU C C 3.083 1.074 8.989 1.00 . A A . 14 GLU C 1 1 8 8947 1 1 14 GLU CA C 3.238 -0.328 8.379 1.00 . A A . 14 GLU CA 1 1 8 8948 1 1 14 GLU CB C 3.057 -0.256 6.864 1.00 . A A . 14 GLU CB 1 1 8 8949 1 1 14 GLU CD C 5.395 0.619 6.713 1.00 . A A . 14 GLU CD 1 1 8 8950 1 1 14 GLU CG C 3.956 0.804 6.228 1.00 . A A . 14 GLU CG 1 1 8 8951 1 1 14 GLU H H 1.945 -2.070 8.457 1.00 . A A . 14 GLU H 1 1 8 8952 1 1 14 GLU HA H 4.224 -0.718 8.612 1.00 . A A . 14 GLU HA 1 1 8 8953 1 1 14 GLU HB2 H 3.260 -1.225 6.409 1.00 . A A . 14 GLU HB2 1 1 8 8954 1 1 14 GLU HB3 H 2.016 -0.028 6.656 1.00 . A A . 14 GLU HB3 1 1 8 8955 1 1 14 GLU HG2 H 3.935 0.723 5.141 1.00 . A A . 14 GLU HG2 1 1 8 8956 1 1 14 GLU HG3 H 3.619 1.806 6.493 1.00 . A A . 14 GLU HG3 1 1 8 8957 1 1 14 GLU N N 2.278 -1.266 8.949 1.00 . A A . 14 GLU N 1 1 8 8958 1 1 14 GLU O O 3.770 1.453 9.929 1.00 . A A . 14 GLU O 1 1 8 8959 1 1 14 GLU OE1 O 6.137 -0.127 6.076 1.00 . A A . 14 GLU OE1 1 1 8 8960 1 1 14 GLU OE2 O 5.756 1.222 7.722 1.00 . A A . 14 GLU OE2 1 1 8 8961 1 1 15 TYR C C 0.629 2.263 10.245 1.00 . A A . 15 TYR C 1 1 8 8962 1 1 15 TYR CA C 1.468 2.867 9.111 1.00 . A A . 15 TYR CA 1 1 8 8963 1 1 15 TYR CB C 0.643 3.699 8.121 1.00 . A A . 15 TYR CB 1 1 8 8964 1 1 15 TYR CD1 C 1.752 5.990 8.031 1.00 . A A . 15 TYR CD1 1 1 8 8965 1 1 15 TYR CD2 C -0.417 5.739 9.225 1.00 . A A . 15 TYR CD2 1 1 8 8966 1 1 15 TYR CE1 C 1.765 7.394 8.344 1.00 . A A . 15 TYR CE1 1 1 8 8967 1 1 15 TYR CE2 C -0.407 7.144 9.540 1.00 . A A . 15 TYR CE2 1 1 8 8968 1 1 15 TYR CG C 0.660 5.158 8.467 1.00 . A A . 15 TYR CG 1 1 8 8969 1 1 15 TYR CZ C 0.685 7.970 9.100 1.00 . A A . 15 TYR CZ 1 1 8 8970 1 1 15 TYR H H 1.874 1.610 7.433 1.00 . A A . 15 TYR H 1 1 8 8971 1 1 15 TYR HA H 2.245 3.484 9.555 1.00 . A A . 15 TYR HA 1 1 8 8972 1 1 15 TYR HB2 H 1.080 3.582 7.138 1.00 . A A . 15 TYR HB2 1 1 8 8973 1 1 15 TYR HB3 H -0.390 3.346 8.054 1.00 . A A . 15 TYR HB3 1 1 8 8974 1 1 15 TYR HD1 H 2.564 5.558 7.466 1.00 . A A . 15 TYR HD1 1 1 8 8975 1 1 15 TYR HD2 H -1.236 5.120 9.559 1.00 . A A . 15 TYR HD2 1 1 8 8976 1 1 15 TYR HE1 H 2.582 8.015 8.007 1.00 . A A . 15 TYR HE1 1 1 8 8977 1 1 15 TYR HE2 H -1.220 7.579 10.102 1.00 . A A . 15 TYR HE2 1 1 8 8978 1 1 15 TYR HH H 1.266 9.468 10.148 1.00 . A A . 15 TYR HH 1 1 8 8979 1 1 15 TYR N N 2.133 1.806 8.379 1.00 . A A . 15 TYR N 1 1 8 8980 1 1 15 TYR O O 1.075 1.396 10.985 1.00 . A A . 15 TYR O 1 1 8 8981 1 1 15 TYR OH O 0.697 9.316 9.404 1.00 . A A . 15 TYR OH 1 1 8 8982 1 1 16 GLN C C -2.692 1.678 10.983 1.00 . A A . 16 GLN C 1 1 8 8983 1 1 16 GLN CA C -1.457 2.455 11.444 1.00 . A A . 16 GLN CA 1 1 8 8984 1 1 16 GLN CB C -1.873 3.750 12.132 1.00 . A A . 16 GLN CB 1 1 8 8985 1 1 16 GLN CD C -2.008 4.927 14.347 1.00 . A A . 16 GLN CD 1 1 8 8986 1 1 16 GLN CG C -1.663 3.616 13.638 1.00 . A A . 16 GLN CG 1 1 8 8987 1 1 16 GLN H H -0.799 3.543 9.701 1.00 . A A . 16 GLN H 1 1 8 8988 1 1 16 GLN HA H -0.867 1.829 12.111 1.00 . A A . 16 GLN HA 1 1 8 8989 1 1 16 GLN HB2 H -1.278 4.564 11.729 1.00 . A A . 16 GLN HB2 1 1 8 8990 1 1 16 GLN HB3 H -2.912 3.993 11.891 1.00 . A A . 16 GLN HB3 1 1 8 8991 1 1 16 GLN HE21 H -0.404 4.748 15.585 1.00 . A A . 16 GLN HE21 1 1 8 8992 1 1 16 GLN HE22 H -0.850 6.390 15.161 1.00 . A A . 16 GLN HE22 1 1 8 8993 1 1 16 GLN HG2 H -2.281 2.809 14.032 1.00 . A A . 16 GLN HG2 1 1 8 8994 1 1 16 GLN HG3 H -0.624 3.353 13.843 1.00 . A A . 16 GLN HG3 1 1 8 8995 1 1 16 GLN N N -0.601 2.791 10.328 1.00 . A A . 16 GLN N 1 1 8 8996 1 1 16 GLN NE2 N -0.997 5.397 15.099 1.00 . A A . 16 GLN NE2 1 1 8 8997 1 1 16 GLN O O -2.706 1.036 9.944 1.00 . A A . 16 GLN O 1 1 8 8998 1 1 16 GLN OE1 O -3.101 5.464 14.220 1.00 . A A . 16 GLN OE1 1 1 8 8999 1 1 17 CYS C C -6.084 1.263 11.415 1.00 . A A . 17 CYS C 1 1 8 9000 1 1 17 CYS CA C -4.720 0.742 11.877 1.00 . A A . 17 CYS CA 1 1 8 9001 1 1 17 CYS CB C -4.818 0.146 13.278 1.00 . A A . 17 CYS CB 1 1 8 9002 1 1 17 CYS H H -3.494 2.447 12.575 1.00 . A A . 17 CYS H 1 1 8 9003 1 1 17 CYS HA H -4.369 -0.034 11.199 1.00 . A A . 17 CYS HA 1 1 8 9004 1 1 17 CYS HB2 H -5.052 0.895 14.030 1.00 . A A . 17 CYS HB2 1 1 8 9005 1 1 17 CYS HB3 H -5.617 -0.597 13.296 1.00 . A A . 17 CYS HB3 1 1 8 9006 1 1 17 CYS N N -3.713 1.791 11.848 1.00 . A A . 17 CYS N 1 1 8 9007 1 1 17 CYS O O -6.730 2.065 12.078 1.00 . A A . 17 CYS O 1 1 8 9008 1 1 17 CYS SG S -3.291 -0.688 13.731 1.00 . A A . 17 CYS SG 1 1 8 9009 1 1 18 GLN C C -7.927 -1.206 10.254 1.00 . A A . 18 GLN C 1 1 8 9010 1 1 18 GLN CA C -7.814 0.298 9.995 1.00 . A A . 18 GLN CA 1 1 8 9011 1 1 18 GLN CB C -8.156 0.566 8.525 1.00 . A A . 18 GLN CB 1 1 8 9012 1 1 18 GLN CD C -6.598 2.393 7.676 1.00 . A A . 18 GLN CD 1 1 8 9013 1 1 18 GLN CG C -6.976 0.907 7.603 1.00 . A A . 18 GLN CG 1 1 8 9014 1 1 18 GLN H H -5.979 0.816 9.366 1.00 . A A . 18 GLN H 1 1 8 9015 1 1 18 GLN HA H -8.465 0.848 10.675 1.00 . A A . 18 GLN HA 1 1 8 9016 1 1 18 GLN HB2 H -8.601 -0.343 8.136 1.00 . A A . 18 GLN HB2 1 1 8 9017 1 1 18 GLN HB3 H -8.878 1.377 8.479 1.00 . A A . 18 GLN HB3 1 1 8 9018 1 1 18 GLN HE21 H -6.512 2.888 9.650 1.00 . A A . 18 GLN HE21 1 1 8 9019 1 1 18 GLN HE22 H -7.842 3.593 8.750 1.00 . A A . 18 GLN HE22 1 1 8 9020 1 1 18 GLN HG2 H -6.113 0.301 7.874 1.00 . A A . 18 GLN HG2 1 1 8 9021 1 1 18 GLN HG3 H -7.224 0.670 6.571 1.00 . A A . 18 GLN HG3 1 1 8 9022 1 1 18 GLN N N -6.467 0.747 10.233 1.00 . A A . 18 GLN N 1 1 8 9023 1 1 18 GLN NE2 N -7.021 3.014 8.793 1.00 . A A . 18 GLN NE2 1 1 8 9024 1 1 18 GLN O O -7.170 -2.009 9.724 1.00 . A A . 18 GLN O 1 1 8 9025 1 1 18 GLN OE1 O -5.966 2.934 6.776 1.00 . A A . 18 GLN OE1 1 1 8 9026 1 1 19 PRO C C -10.852 -2.213 9.616 1.00 . A A . 19 PRO C 1 1 8 9027 1 1 19 PRO CA C -9.927 -2.555 10.788 1.00 . A A . 19 PRO CA 1 1 8 9028 1 1 19 PRO CB C -10.737 -2.715 12.077 1.00 . A A . 19 PRO CB 1 1 8 9029 1 1 19 PRO CD C -9.044 -0.954 12.418 1.00 . A A . 19 PRO CD 1 1 8 9030 1 1 19 PRO CG C -10.146 -1.751 13.114 1.00 . A A . 19 PRO CG 1 1 8 9031 1 1 19 PRO HA H -9.426 -3.485 10.537 1.00 . A A . 19 PRO HA 1 1 8 9032 1 1 19 PRO HB2 H -11.787 -2.484 11.898 1.00 . A A . 19 PRO HB2 1 1 8 9033 1 1 19 PRO HB3 H -10.676 -3.738 12.443 1.00 . A A . 19 PRO HB3 1 1 8 9034 1 1 19 PRO HD2 H -9.302 0.102 12.344 1.00 . A A . 19 PRO HD2 1 1 8 9035 1 1 19 PRO HD3 H -8.094 -1.046 12.945 1.00 . A A . 19 PRO HD3 1 1 8 9036 1 1 19 PRO HG2 H -10.914 -1.084 13.501 1.00 . A A . 19 PRO HG2 1 1 8 9037 1 1 19 PRO HG3 H -9.729 -2.311 13.951 1.00 . A A . 19 PRO HG3 1 1 8 9038 1 1 19 PRO N N -8.933 -1.533 11.091 1.00 . A A . 19 PRO N 1 1 8 9039 1 1 19 PRO O O -11.938 -1.671 9.780 1.00 . A A . 19 PRO O 1 1 8 9040 1 1 20 LEU C C -12.488 -3.699 7.902 1.00 . A A . 20 LEU C 1 1 8 9041 1 1 20 LEU CA C -11.140 -3.197 7.379 1.00 . A A . 20 LEU CA 1 1 8 9042 1 1 20 LEU CB C -10.349 -4.325 6.731 1.00 . A A . 20 LEU CB 1 1 8 9043 1 1 20 LEU CD1 C -12.115 -4.273 4.926 1.00 . A A . 20 LEU CD1 1 1 8 9044 1 1 20 LEU CD2 C -10.554 -6.234 5.090 1.00 . A A . 20 LEU CD2 1 1 8 9045 1 1 20 LEU CG C -11.283 -5.146 5.868 1.00 . A A . 20 LEU CG 1 1 8 9046 1 1 20 LEU H H -9.341 -2.582 8.332 1.00 . A A . 20 LEU H 1 1 8 9047 1 1 20 LEU HA H -11.347 -2.464 6.615 1.00 . A A . 20 LEU HA 1 1 8 9048 1 1 20 LEU HB2 H -9.539 -3.932 6.122 1.00 . A A . 20 LEU HB2 1 1 8 9049 1 1 20 LEU HB3 H -9.898 -4.953 7.499 1.00 . A A . 20 LEU HB3 1 1 8 9050 1 1 20 LEU HD11 H -12.619 -3.471 5.463 1.00 . A A . 20 LEU HD11 1 1 8 9051 1 1 20 LEU HD12 H -11.485 -3.819 4.161 1.00 . A A . 20 LEU HD12 1 1 8 9052 1 1 20 LEU HD13 H -12.877 -4.867 4.422 1.00 . A A . 20 LEU HD13 1 1 8 9053 1 1 20 LEU HD21 H -9.527 -5.932 4.884 1.00 . A A . 20 LEU HD21 1 1 8 9054 1 1 20 LEU HD22 H -10.557 -7.166 5.654 1.00 . A A . 20 LEU HD22 1 1 8 9055 1 1 20 LEU HD23 H -11.045 -6.420 4.135 1.00 . A A . 20 LEU HD23 1 1 8 9056 1 1 20 LEU HG H -11.930 -5.600 6.603 1.00 . A A . 20 LEU HG 1 1 8 9057 1 1 20 LEU N N -10.333 -2.590 8.430 1.00 . A A . 20 LEU N 1 1 8 9058 1 1 20 LEU O O -13.554 -3.363 7.400 1.00 . A A . 20 LEU O 1 1 8 9059 1 1 21 ASN C C -14.171 -6.065 8.499 1.00 . A A . 21 ASN C 1 1 8 9060 1 1 21 ASN CA C -13.516 -5.142 9.524 1.00 . A A . 21 ASN CA 1 1 8 9061 1 1 21 ASN CB C -14.522 -4.099 9.991 1.00 . A A . 21 ASN CB 1 1 8 9062 1 1 21 ASN CG C -14.219 -3.554 11.382 1.00 . A A . 21 ASN CG 1 1 8 9063 1 1 21 ASN H H -11.492 -4.399 9.441 1.00 . A A . 21 ASN H 1 1 8 9064 1 1 21 ASN HA H -13.174 -5.783 10.326 1.00 . A A . 21 ASN HA 1 1 8 9065 1 1 21 ASN HB2 H -14.529 -3.255 9.309 1.00 . A A . 21 ASN HB2 1 1 8 9066 1 1 21 ASN HB3 H -15.513 -4.551 10.007 1.00 . A A . 21 ASN HB3 1 1 8 9067 1 1 21 ASN HD21 H -16.020 -2.790 11.916 1.00 . A A . 21 ASN HD21 1 1 8 9068 1 1 21 ASN N N -12.339 -4.531 8.940 1.00 . A A . 21 ASN N 1 1 8 9069 1 1 21 ASN ND2 N -15.068 -2.567 11.714 1.00 . A A . 21 ASN ND2 1 1 8 9070 1 1 21 ASN O O -14.294 -5.752 7.321 1.00 . A A . 21 ASN O 1 1 8 9071 1 1 21 ASN OD1 O -13.317 -3.993 12.085 1.00 . A A . 21 ASN OD1 1 1 8 9072 1 1 22 GLN C C -12.578 -8.681 8.808 1.00 . A A . 22 GLN C 1 1 8 9073 1 1 22 GLN CA C -14.077 -8.476 8.512 1.00 . A A . 22 GLN CA 1 1 8 9074 1 1 22 GLN CB C -14.305 -8.504 7.000 1.00 . A A . 22 GLN CB 1 1 8 9075 1 1 22 GLN CD C -13.529 -9.845 5.034 1.00 . A A . 22 GLN CD 1 1 8 9076 1 1 22 GLN CG C -14.161 -9.914 6.426 1.00 . A A . 22 GLN CG 1 1 8 9077 1 1 22 GLN H H -15.219 -7.220 9.817 1.00 . A A . 22 GLN H 1 1 8 9078 1 1 22 GLN HA H -14.646 -9.266 9.003 1.00 . A A . 22 GLN HA 1 1 8 9079 1 1 22 GLN HB2 H -15.298 -8.115 6.772 1.00 . A A . 22 GLN HB2 1 1 8 9080 1 1 22 GLN HB3 H -13.593 -7.838 6.513 1.00 . A A . 22 GLN HB3 1 1 8 9081 1 1 22 GLN HE21 H -13.922 -11.785 4.565 1.00 . A A . 22 GLN HE21 1 1 8 9082 1 1 22 GLN HE22 H -12.323 -11.213 4.130 1.00 . A A . 22 GLN HE22 1 1 8 9083 1 1 22 GLN HG2 H -13.533 -10.529 7.070 1.00 . A A . 22 GLN HG2 1 1 8 9084 1 1 22 GLN HG3 H -15.134 -10.399 6.349 1.00 . A A . 22 GLN HG3 1 1 8 9085 1 1 22 GLN N N -14.581 -7.223 9.047 1.00 . A A . 22 GLN N 1 1 8 9086 1 1 22 GLN NE2 N -13.231 -11.056 4.531 1.00 . A A . 22 GLN NE2 1 1 8 9087 1 1 22 GLN O O -11.903 -9.433 8.115 1.00 . A A . 22 GLN O 1 1 8 9088 1 1 22 GLN OE1 O -13.329 -8.778 4.467 1.00 . A A . 22 GLN OE1 1 1 8 9089 1 1 23 THR C C -9.816 -8.255 9.028 1.00 . A A . 23 THR C 1 1 8 9090 1 1 23 THR CA C -10.827 -7.303 9.660 1.00 . A A . 23 THR CA 1 1 8 9091 1 1 23 THR CB C -10.277 -6.757 10.976 1.00 . A A . 23 THR CB 1 1 8 9092 1 1 23 THR CG2 C -11.361 -6.076 11.809 1.00 . A A . 23 THR CG2 1 1 8 9093 1 1 23 THR H H -12.576 -7.951 10.731 1.00 . A A . 23 THR H 1 1 8 9094 1 1 23 THR HA H -11.024 -6.495 8.957 1.00 . A A . 23 THR HA 1 1 8 9095 1 1 23 THR HB H -9.483 -6.039 10.759 1.00 . A A . 23 THR HB 1 1 8 9096 1 1 23 THR HG1 H -10.166 -7.847 12.538 1.00 . A A . 23 THR HG1 1 1 8 9097 1 1 23 THR HG21 H -11.623 -5.115 11.371 1.00 . A A . 23 THR HG21 1 1 8 9098 1 1 23 THR HG22 H -12.263 -6.687 11.852 1.00 . A A . 23 THR HG22 1 1 8 9099 1 1 23 THR HG23 H -11.019 -5.903 12.829 1.00 . A A . 23 THR HG23 1 1 8 9100 1 1 23 THR N N -12.091 -7.987 9.858 1.00 . A A . 23 THR N 1 1 8 9101 1 1 23 THR O O -9.405 -9.256 9.602 1.00 . A A . 23 THR O 1 1 8 9102 1 1 23 THR OG1 O -9.701 -7.805 11.713 1.00 . A A . 23 THR OG1 1 1 8 9103 1 1 24 SER C C -7.169 -7.061 8.457 1.00 . A A . 24 SER C 1 1 8 9104 1 1 24 SER CA C -8.039 -7.841 7.459 1.00 . A A . 24 SER CA 1 1 8 9105 1 1 24 SER CB C -7.882 -7.248 6.068 1.00 . A A . 24 SER CB 1 1 8 9106 1 1 24 SER H H -10.139 -7.455 7.189 1.00 . A A . 24 SER H 1 1 8 9107 1 1 24 SER HA H -7.733 -8.869 7.506 1.00 . A A . 24 SER HA 1 1 8 9108 1 1 24 SER HB2 H -8.654 -7.631 5.401 1.00 . A A . 24 SER HB2 1 1 8 9109 1 1 24 SER HB3 H -7.991 -6.169 6.134 1.00 . A A . 24 SER HB3 1 1 8 9110 1 1 24 SER HG H -6.229 -6.714 5.282 1.00 . A A . 24 SER HG 1 1 8 9111 1 1 24 SER N N -9.455 -7.854 7.800 1.00 . A A . 24 SER N 1 1 8 9112 1 1 24 SER O O -5.997 -7.348 8.671 1.00 . A A . 24 SER O 1 1 8 9113 1 1 24 SER OG O -6.622 -7.543 5.522 1.00 . A A . 24 SER OG 1 1 8 9114 1 1 25 TYR C C -6.017 -4.512 8.509 1.00 . A A . 25 TYR C 1 1 8 9115 1 1 25 TYR CA C -7.290 -4.757 9.307 1.00 . A A . 25 TYR CA 1 1 8 9116 1 1 25 TYR CB C -7.006 -4.569 10.796 1.00 . A A . 25 TYR CB 1 1 8 9117 1 1 25 TYR CD1 C -4.709 -5.600 11.206 1.00 . A A . 25 TYR CD1 1 1 8 9118 1 1 25 TYR CD2 C -6.736 -6.801 12.005 1.00 . A A . 25 TYR CD2 1 1 8 9119 1 1 25 TYR CE1 C -3.878 -6.663 11.709 1.00 . A A . 25 TYR CE1 1 1 8 9120 1 1 25 TYR CE2 C -5.909 -7.866 12.508 1.00 . A A . 25 TYR CE2 1 1 8 9121 1 1 25 TYR CG C -6.140 -5.668 11.345 1.00 . A A . 25 TYR CG 1 1 8 9122 1 1 25 TYR CZ C -4.480 -7.797 12.357 1.00 . A A . 25 TYR CZ 1 1 8 9123 1 1 25 TYR H H -8.818 -6.314 9.047 1.00 . A A . 25 TYR H 1 1 8 9124 1 1 25 TYR HA H -8.057 -4.054 8.965 1.00 . A A . 25 TYR HA 1 1 8 9125 1 1 25 TYR HB2 H -6.533 -3.607 11.011 1.00 . A A . 25 TYR HB2 1 1 8 9126 1 1 25 TYR HB3 H -7.965 -4.563 11.294 1.00 . A A . 25 TYR HB3 1 1 8 9127 1 1 25 TYR HD1 H -4.255 -4.748 10.722 1.00 . A A . 25 TYR HD1 1 1 8 9128 1 1 25 TYR HD2 H -7.808 -6.850 12.123 1.00 . A A . 25 TYR HD2 1 1 8 9129 1 1 25 TYR HE1 H -2.805 -6.608 11.600 1.00 . A A . 25 TYR HE1 1 1 8 9130 1 1 25 TYR HE2 H -6.361 -8.716 12.999 1.00 . A A . 25 TYR HE2 1 1 8 9131 1 1 25 TYR HH H -2.794 -8.692 12.538 1.00 . A A . 25 TYR HH 1 1 8 9132 1 1 25 TYR N N -7.850 -6.072 9.041 1.00 . A A . 25 TYR N 1 1 8 9133 1 1 25 TYR O O -5.034 -5.240 8.560 1.00 . A A . 25 TYR O 1 1 8 9134 1 1 25 TYR OH O -3.686 -8.822 12.831 1.00 . A A . 25 TYR OH 1 1 8 9135 1 1 26 LEU C C -4.443 -2.281 6.296 1.00 . A A . 26 LEU C 1 1 8 9136 1 1 26 LEU CA C -5.561 -3.344 6.450 1.00 . A A . 26 LEU CA 1 1 8 9137 1 1 26 LEU CB C -6.731 -3.134 5.508 1.00 . A A . 26 LEU CB 1 1 8 9138 1 1 26 LEU CD1 C -7.259 -1.238 3.982 1.00 . A A . 26 LEU CD1 1 1 8 9139 1 1 26 LEU CD2 C -8.493 -1.538 6.118 1.00 . A A . 26 LEU CD2 1 1 8 9140 1 1 26 LEU CG C -7.158 -1.681 5.421 1.00 . A A . 26 LEU CG 1 1 8 9141 1 1 26 LEU H H -6.934 -2.817 7.984 1.00 . A A . 26 LEU H 1 1 8 9142 1 1 26 LEU HA H -5.148 -4.318 6.287 1.00 . A A . 26 LEU HA 1 1 8 9143 1 1 26 LEU HB2 H -6.516 -3.543 4.519 1.00 . A A . 26 LEU HB2 1 1 8 9144 1 1 26 LEU HB3 H -7.581 -3.675 5.938 1.00 . A A . 26 LEU HB3 1 1 8 9145 1 1 26 LEU HD11 H -8.203 -0.720 3.829 1.00 . A A . 26 LEU HD11 1 1 8 9146 1 1 26 LEU HD12 H -6.433 -0.568 3.752 1.00 . A A . 26 LEU HD12 1 1 8 9147 1 1 26 LEU HD13 H -7.214 -2.107 3.329 1.00 . A A . 26 LEU HD13 1 1 8 9148 1 1 26 LEU HD21 H -9.255 -2.060 5.548 1.00 . A A . 26 LEU HD21 1 1 8 9149 1 1 26 LEU HD22 H -8.424 -2.004 7.102 1.00 . A A . 26 LEU HD22 1 1 8 9150 1 1 26 LEU HD23 H -8.777 -0.493 6.190 1.00 . A A . 26 LEU HD23 1 1 8 9151 1 1 26 LEU HG H -6.445 -1.034 5.917 1.00 . A A . 26 LEU HG 1 1 8 9152 1 1 26 LEU N N -6.148 -3.402 7.778 1.00 . A A . 26 LEU N 1 1 8 9153 1 1 26 LEU O O -3.599 -2.324 5.409 1.00 . A A . 26 LEU O 1 1 8 9154 1 1 27 CYS C C -3.091 0.579 6.786 1.00 . A A . 27 CYS C 1 1 8 9155 1 1 27 CYS CA C -3.484 -0.530 7.766 1.00 . A A . 27 CYS CA 1 1 8 9156 1 1 27 CYS CB C -2.324 -1.450 8.105 1.00 . A A . 27 CYS CB 1 1 8 9157 1 1 27 CYS H H -5.297 -1.595 7.837 1.00 . A A . 27 CYS H 1 1 8 9158 1 1 27 CYS HA H -3.956 -0.099 8.643 1.00 . A A . 27 CYS HA 1 1 8 9159 1 1 27 CYS HB2 H -2.256 -2.131 7.261 1.00 . A A . 27 CYS HB2 1 1 8 9160 1 1 27 CYS HB3 H -1.392 -0.888 8.197 1.00 . A A . 27 CYS HB3 1 1 8 9161 1 1 27 CYS N N -4.541 -1.346 7.248 1.00 . A A . 27 CYS N 1 1 8 9162 1 1 27 CYS O O -3.075 0.403 5.574 1.00 . A A . 27 CYS O 1 1 8 9163 1 1 27 CYS SG S -2.580 -2.467 9.583 1.00 . A A . 27 CYS SG 1 1 8 9164 1 1 28 VAL C C -1.623 3.335 6.013 1.00 . A A . 28 VAL C 1 1 8 9165 1 1 28 VAL CA C -2.938 2.983 6.696 1.00 . A A . 28 VAL CA 1 1 8 9166 1 1 28 VAL CB C -3.310 4.141 7.630 1.00 . A A . 28 VAL CB 1 1 8 9167 1 1 28 VAL CG1 C -4.312 5.075 6.950 1.00 . A A . 28 VAL CG1 1 1 8 9168 1 1 28 VAL CG2 C -3.835 3.683 8.993 1.00 . A A . 28 VAL CG2 1 1 8 9169 1 1 28 VAL H H -2.479 1.724 8.363 1.00 . A A . 28 VAL H 1 1 8 9170 1 1 28 VAL HA H -3.716 2.822 5.951 1.00 . A A . 28 VAL HA 1 1 8 9171 1 1 28 VAL HB H -2.399 4.714 7.808 1.00 . A A . 28 VAL HB 1 1 8 9172 1 1 28 VAL HG11 H -4.358 4.881 5.879 1.00 . A A . 28 VAL HG11 1 1 8 9173 1 1 28 VAL HG12 H -5.313 4.941 7.361 1.00 . A A . 28 VAL HG12 1 1 8 9174 1 1 28 VAL HG13 H -4.028 6.118 7.091 1.00 . A A . 28 VAL HG13 1 1 8 9175 1 1 28 VAL HG21 H -3.027 3.681 9.723 1.00 . A A . 28 VAL HG21 1 1 8 9176 1 1 28 VAL HG22 H -4.600 4.369 9.357 1.00 . A A . 28 VAL HG22 1 1 8 9177 1 1 28 VAL HG23 H -4.277 2.688 8.958 1.00 . A A . 28 VAL HG23 1 1 8 9178 1 1 28 VAL N N -2.778 1.731 7.411 1.00 . A A . 28 VAL N 1 1 8 9179 1 1 28 VAL O O -0.649 2.593 6.052 1.00 . A A . 28 VAL O 1 1 8 9180 1 1 29 CYS C C -0.426 6.574 5.051 1.00 . A A . 29 CYS C 1 1 8 9181 1 1 29 CYS CA C -0.401 5.048 4.970 1.00 . A A . 29 CYS CA 1 1 8 9182 1 1 29 CYS CB C -0.198 4.552 3.542 1.00 . A A . 29 CYS CB 1 1 8 9183 1 1 29 CYS H H -2.401 4.584 4.714 1.00 . A A . 29 CYS H 1 1 8 9184 1 1 29 CYS HA H 0.377 4.573 5.566 1.00 . A A . 29 CYS HA 1 1 8 9185 1 1 29 CYS HB2 H -1.089 4.790 2.959 1.00 . A A . 29 CYS HB2 1 1 8 9186 1 1 29 CYS HB3 H 0.646 5.042 3.057 1.00 . A A . 29 CYS HB3 1 1 8 9187 1 1 29 CYS N N -1.674 4.519 5.382 1.00 . A A . 29 CYS N 1 1 8 9188 1 1 29 CYS O O -1.109 7.180 5.867 1.00 . A A . 29 CYS O 1 1 8 9189 1 1 29 CYS SG S 0.057 2.753 3.578 1.00 . A A . 29 CYS SG 1 1 8 9190 1 1 30 ALA C C -0.914 9.145 3.424 1.00 . A A . 30 ALA C 1 1 8 9191 1 1 30 ALA CA C 0.399 8.579 3.984 1.00 . A A . 30 ALA CA 1 1 8 9192 1 1 30 ALA CB C 1.506 8.941 3.003 1.00 . A A . 30 ALA CB 1 1 8 9193 1 1 30 ALA H H 1.150 6.534 3.944 1.00 . A A . 30 ALA H 1 1 8 9194 1 1 30 ALA HA H 0.648 8.997 4.959 1.00 . A A . 30 ALA HA 1 1 8 9195 1 1 30 ALA HB1 H 1.599 10.024 2.924 1.00 . A A . 30 ALA HB1 1 1 8 9196 1 1 30 ALA HB2 H 2.460 8.533 3.333 1.00 . A A . 30 ALA HB2 1 1 8 9197 1 1 30 ALA HB3 H 1.278 8.543 2.015 1.00 . A A . 30 ALA HB3 1 1 8 9198 1 1 30 ALA N N 0.377 7.132 4.134 1.00 . A A . 30 ALA N 1 1 8 9199 1 1 30 ALA O O -0.928 10.177 2.764 1.00 . A A . 30 ALA O 1 1 8 9200 1 1 31 GLU C C -2.628 8.201 1.365 1.00 . A A . 31 GLU C 1 1 8 9201 1 1 31 GLU CA C -2.635 7.561 2.759 1.00 . A A . 31 GLU CA 1 1 8 9202 1 1 31 GLU CB C -4.049 7.251 3.266 1.00 . A A . 31 GLU CB 1 1 8 9203 1 1 31 GLU CD C -5.402 6.441 1.312 1.00 . A A . 31 GLU CD 1 1 8 9204 1 1 31 GLU CG C -5.173 7.596 2.289 1.00 . A A . 31 GLU CG 1 1 8 9205 1 1 31 GLU H H -2.295 8.366 4.685 1.00 . A A . 31 GLU H 1 1 8 9206 1 1 31 GLU HA H -2.039 6.649 2.733 1.00 . A A . 31 GLU HA 1 1 8 9207 1 1 31 GLU HB2 H -4.097 6.198 3.535 1.00 . A A . 31 GLU HB2 1 1 8 9208 1 1 31 GLU HB3 H -4.229 7.793 4.194 1.00 . A A . 31 GLU HB3 1 1 8 9209 1 1 31 GLU HG2 H -6.095 7.765 2.846 1.00 . A A . 31 GLU HG2 1 1 8 9210 1 1 31 GLU HG3 H -4.963 8.511 1.737 1.00 . A A . 31 GLU HG3 1 1 8 9211 1 1 31 GLU N N -2.000 8.424 3.735 1.00 . A A . 31 GLU N 1 1 8 9212 1 1 31 GLU O O -2.455 9.402 1.201 1.00 . A A . 31 GLU O 1 1 8 9213 1 1 31 GLU OE1 O -4.806 5.382 1.504 1.00 . A A . 31 GLU OE1 1 1 8 9214 1 1 31 GLU OE2 O -6.173 6.614 0.369 1.00 . A A . 31 GLU OE2 1 1 8 9215 1 1 32 GLY C C -1.887 5.671 -1.171 1.00 . A A . 32 GLY C 1 1 8 9216 1 1 32 GLY CA C -1.810 7.102 -0.626 1.00 . A A . 32 GLY CA 1 1 8 9217 1 1 32 GLY H H -3.688 6.783 0.349 1.00 . A A . 32 GLY H 1 1 8 9218 1 1 32 GLY HA2 H -1.974 7.828 -1.424 1.00 . A A . 32 GLY HA2 1 1 8 9219 1 1 32 GLY HA3 H -0.846 7.275 -0.147 1.00 . A A . 32 GLY HA3 1 1 8 9220 1 1 32 GLY N N -2.838 7.308 0.379 1.00 . A A . 32 GLY N 1 1 8 9221 1 1 32 GLY O O -1.872 5.423 -2.370 1.00 . A A . 32 GLY O 1 1 8 9222 1 1 33 PHE C C -1.674 2.719 0.980 1.00 . A A . 33 PHE C 1 1 8 9223 1 1 33 PHE CA C -0.996 3.719 0.015 1.00 . A A . 33 PHE CA 1 1 8 9224 1 1 33 PHE CB C 0.278 4.394 0.555 1.00 . A A . 33 PHE CB 1 1 8 9225 1 1 33 PHE CD1 C 1.234 4.926 -1.767 1.00 . A A . 33 PHE CD1 1 1 8 9226 1 1 33 PHE CD2 C 2.718 3.897 -0.061 1.00 . A A . 33 PHE CD2 1 1 8 9227 1 1 33 PHE CE1 C 2.334 4.983 -2.692 1.00 . A A . 33 PHE CE1 1 1 8 9228 1 1 33 PHE CE2 C 3.810 3.915 -0.998 1.00 . A A . 33 PHE CE2 1 1 8 9229 1 1 33 PHE CG C 1.419 4.404 -0.437 1.00 . A A . 33 PHE CG 1 1 8 9230 1 1 33 PHE CZ C 3.621 4.475 -2.308 1.00 . A A . 33 PHE CZ 1 1 8 9231 1 1 33 PHE H H -2.591 4.936 0.584 1.00 . A A . 33 PHE H 1 1 8 9232 1 1 33 PHE HA H -0.768 3.199 -0.912 1.00 . A A . 33 PHE HA 1 1 8 9233 1 1 33 PHE HB2 H 0.046 5.426 0.843 1.00 . A A . 33 PHE HB2 1 1 8 9234 1 1 33 PHE HB3 H 0.612 3.880 1.452 1.00 . A A . 33 PHE HB3 1 1 8 9235 1 1 33 PHE HD1 H 0.260 5.232 -2.099 1.00 . A A . 33 PHE HD1 1 1 8 9236 1 1 33 PHE HD2 H 2.899 3.505 0.928 1.00 . A A . 33 PHE HD2 1 1 8 9237 1 1 33 PHE HE1 H 2.185 5.382 -3.686 1.00 . A A . 33 PHE HE1 1 1 8 9238 1 1 33 PHE HE2 H 4.763 3.480 -0.734 1.00 . A A . 33 PHE HE2 1 1 8 9239 1 1 33 PHE HZ H 4.446 4.510 -3.003 1.00 . A A . 33 PHE HZ 1 1 8 9240 1 1 33 PHE N N -1.980 4.764 -0.186 1.00 . A A . 33 PHE N 1 1 8 9241 1 1 33 PHE O O -2.012 3.059 2.105 1.00 . A A . 33 PHE O 1 1 8 9242 1 1 34 ALA C C -2.465 -0.845 1.157 1.00 . A A . 34 ALA C 1 1 8 9243 1 1 34 ALA CA C -2.837 0.657 1.256 1.00 . A A . 34 ALA CA 1 1 8 9244 1 1 34 ALA CB C -4.280 1.004 0.893 1.00 . A A . 34 ALA CB 1 1 8 9245 1 1 34 ALA H H -1.511 1.172 -0.378 1.00 . A A . 34 ALA H 1 1 8 9246 1 1 34 ALA HA H -2.669 0.955 2.287 1.00 . A A . 34 ALA HA 1 1 8 9247 1 1 34 ALA HB1 H -4.388 2.081 0.769 1.00 . A A . 34 ALA HB1 1 1 8 9248 1 1 34 ALA HB2 H -4.582 0.540 -0.041 1.00 . A A . 34 ALA HB2 1 1 8 9249 1 1 34 ALA HB3 H -4.968 0.697 1.681 1.00 . A A . 34 ALA HB3 1 1 8 9250 1 1 34 ALA N N -1.926 1.491 0.474 1.00 . A A . 34 ALA N 1 1 8 9251 1 1 34 ALA O O -1.302 -1.205 1.267 1.00 . A A . 34 ALA O 1 1 8 9252 1 1 35 PRO C C -2.580 -3.087 -0.929 1.00 . A A . 35 PRO C 1 1 8 9253 1 1 35 PRO CA C -3.110 -3.079 0.507 1.00 . A A . 35 PRO CA 1 1 8 9254 1 1 35 PRO CB C -4.377 -3.922 0.664 1.00 . A A . 35 PRO CB 1 1 8 9255 1 1 35 PRO CD C -4.830 -1.632 1.457 1.00 . A A . 35 PRO CD 1 1 8 9256 1 1 35 PRO CG C -5.388 -3.058 1.429 1.00 . A A . 35 PRO CG 1 1 8 9257 1 1 35 PRO HA H -2.326 -3.476 1.152 1.00 . A A . 35 PRO HA 1 1 8 9258 1 1 35 PRO HB2 H -4.775 -4.207 -0.310 1.00 . A A . 35 PRO HB2 1 1 8 9259 1 1 35 PRO HB3 H -4.161 -4.837 1.215 1.00 . A A . 35 PRO HB3 1 1 8 9260 1 1 35 PRO HD2 H -5.439 -1.021 0.795 1.00 . A A . 35 PRO HD2 1 1 8 9261 1 1 35 PRO HD3 H -4.845 -1.207 2.460 1.00 . A A . 35 PRO HD3 1 1 8 9262 1 1 35 PRO HG2 H -6.361 -3.080 0.938 1.00 . A A . 35 PRO HG2 1 1 8 9263 1 1 35 PRO HG3 H -5.521 -3.435 2.443 1.00 . A A . 35 PRO HG3 1 1 8 9264 1 1 35 PRO N N -3.458 -1.746 0.972 1.00 . A A . 35 PRO N 1 1 8 9265 1 1 35 PRO O O -3.330 -3.132 -1.897 1.00 . A A . 35 PRO O 1 1 8 9266 1 1 36 ILE C C -1.207 -5.384 -1.740 1.00 . A A . 36 ILE C 1 1 8 9267 1 1 36 ILE CA C -0.514 -4.010 -1.802 1.00 . A A . 36 ILE CA 1 1 8 9268 1 1 36 ILE CB C 0.924 -4.044 -1.300 1.00 . A A . 36 ILE CB 1 1 8 9269 1 1 36 ILE CD1 C 2.703 -5.846 -1.231 1.00 . A A . 36 ILE CD1 1 1 8 9270 1 1 36 ILE CG1 C 1.805 -4.993 -2.114 1.00 . A A . 36 ILE CG1 1 1 8 9271 1 1 36 ILE CG2 C 0.971 -4.336 0.195 1.00 . A A . 36 ILE CG2 1 1 8 9272 1 1 36 ILE H H -0.712 -2.311 -0.532 1.00 . A A . 36 ILE H 1 1 8 9273 1 1 36 ILE HA H -0.488 -3.634 -2.816 1.00 . A A . 36 ILE HA 1 1 8 9274 1 1 36 ILE HB H 1.322 -3.040 -1.441 1.00 . A A . 36 ILE HB 1 1 8 9275 1 1 36 ILE HD11 H 2.156 -6.258 -0.385 1.00 . A A . 36 ILE HD11 1 1 8 9276 1 1 36 ILE HD12 H 3.105 -6.675 -1.809 1.00 . A A . 36 ILE HD12 1 1 8 9277 1 1 36 ILE HD13 H 3.526 -5.246 -0.848 1.00 . A A . 36 ILE HD13 1 1 8 9278 1 1 36 ILE HG12 H 1.204 -5.654 -2.731 1.00 . A A . 36 ILE HG12 1 1 8 9279 1 1 36 ILE HG13 H 2.420 -4.412 -2.801 1.00 . A A . 36 ILE HG13 1 1 8 9280 1 1 36 ILE HG21 H 2.003 -4.458 0.524 1.00 . A A . 36 ILE HG21 1 1 8 9281 1 1 36 ILE HG22 H 0.530 -3.516 0.764 1.00 . A A . 36 ILE HG22 1 1 8 9282 1 1 36 ILE HG23 H 0.426 -5.249 0.434 1.00 . A A . 36 ILE HG23 1 1 8 9283 1 1 36 ILE N N -1.232 -3.038 -0.990 1.00 . A A . 36 ILE N 1 1 8 9284 1 1 36 ILE O O -1.810 -5.746 -0.737 1.00 . A A . 36 ILE O 1 1 8 9285 1 1 37 PRO C C -0.298 -8.151 -1.679 1.00 . A A . 37 PRO C 1 1 8 9286 1 1 37 PRO CA C -1.135 -7.586 -2.818 1.00 . A A . 37 PRO CA 1 1 8 9287 1 1 37 PRO CB C -0.549 -8.039 -4.153 1.00 . A A . 37 PRO CB 1 1 8 9288 1 1 37 PRO CD C -0.827 -5.592 -4.191 1.00 . A A . 37 PRO CD 1 1 8 9289 1 1 37 PRO CG C -0.561 -6.813 -5.077 1.00 . A A . 37 PRO CG 1 1 8 9290 1 1 37 PRO HA H -2.165 -7.923 -2.710 1.00 . A A . 37 PRO HA 1 1 8 9291 1 1 37 PRO HB2 H 0.475 -8.383 -4.005 1.00 . A A . 37 PRO HB2 1 1 8 9292 1 1 37 PRO HB3 H -1.115 -8.872 -4.564 1.00 . A A . 37 PRO HB3 1 1 8 9293 1 1 37 PRO HD2 H 0.050 -4.947 -4.184 1.00 . A A . 37 PRO HD2 1 1 8 9294 1 1 37 PRO HD3 H -1.685 -5.018 -4.541 1.00 . A A . 37 PRO HD3 1 1 8 9295 1 1 37 PRO HG2 H 0.394 -6.713 -5.593 1.00 . A A . 37 PRO HG2 1 1 8 9296 1 1 37 PRO HG3 H -1.338 -6.912 -5.836 1.00 . A A . 37 PRO HG3 1 1 8 9297 1 1 37 PRO N N -1.092 -6.134 -2.863 1.00 . A A . 37 PRO N 1 1 8 9298 1 1 37 PRO O O 0.672 -7.550 -1.238 1.00 . A A . 37 PRO O 1 1 8 9299 1 1 38 HIS C C -0.230 -8.527 1.068 1.00 . A A . 38 HIS C 1 1 8 9300 1 1 38 HIS CA C -0.536 -9.733 0.163 1.00 . A A . 38 HIS CA 1 1 8 9301 1 1 38 HIS CB C 0.457 -10.905 0.287 1.00 . A A . 38 HIS CB 1 1 8 9302 1 1 38 HIS CD2 C 2.372 -9.834 -1.058 1.00 . A A . 38 HIS CD2 1 1 8 9303 1 1 38 HIS CE1 C 4.134 -10.612 0.062 1.00 . A A . 38 HIS CE1 1 1 8 9304 1 1 38 HIS CG C 1.888 -10.597 -0.063 1.00 . A A . 38 HIS CG 1 1 8 9305 1 1 38 HIS H H -1.195 -9.971 -1.860 1.00 . A A . 38 HIS H 1 1 8 9306 1 1 38 HIS HA H -1.485 -10.104 0.516 1.00 . A A . 38 HIS HA 1 1 8 9307 1 1 38 HIS HB2 H 0.434 -11.217 1.338 1.00 . A A . 38 HIS HB2 1 1 8 9308 1 1 38 HIS HB3 H 0.113 -11.743 -0.326 1.00 . A A . 38 HIS HB3 1 1 8 9309 1 1 38 HIS HD1 H 2.999 -11.709 1.475 1.00 . A A . 38 HIS HD1 1 1 8 9310 1 1 38 HIS HD2 H 1.784 -9.309 -1.780 1.00 . A A . 38 HIS HD2 1 1 8 9311 1 1 38 HIS HE1 H 5.149 -10.799 0.403 1.00 . A A . 38 HIS HE1 1 1 8 9312 1 1 38 HIS N N -0.732 -9.346 -1.230 1.00 . A A . 38 HIS N 1 1 8 9313 1 1 38 HIS ND1 N 3.051 -11.111 0.675 1.00 . A A . 38 HIS ND1 1 1 8 9314 1 1 38 HIS NE2 N 3.843 -9.836 -0.994 1.00 . A A . 38 HIS NE2 1 1 8 9315 1 1 38 HIS O O -0.854 -7.475 1.002 1.00 . A A . 38 HIS O 1 1 8 9316 1 1 39 GLU C C -0.041 -7.174 3.544 1.00 . A A . 39 GLU C 1 1 8 9317 1 1 39 GLU CA C 0.699 -8.493 3.310 1.00 . A A . 39 GLU CA 1 1 8 9318 1 1 39 GLU CB C 2.111 -8.432 3.904 1.00 . A A . 39 GLU CB 1 1 8 9319 1 1 39 GLU CD C 4.584 -8.651 3.565 1.00 . A A . 39 GLU CD 1 1 8 9320 1 1 39 GLU CG C 3.251 -8.345 2.879 1.00 . A A . 39 GLU CG 1 1 8 9321 1 1 39 GLU H H 1.426 -9.458 1.576 1.00 . A A . 39 GLU H 1 1 8 9322 1 1 39 GLU HA H 0.148 -9.332 3.734 1.00 . A A . 39 GLU HA 1 1 8 9323 1 1 39 GLU HB2 H 2.177 -7.559 4.552 1.00 . A A . 39 GLU HB2 1 1 8 9324 1 1 39 GLU HB3 H 2.249 -9.327 4.512 1.00 . A A . 39 GLU HB3 1 1 8 9325 1 1 39 GLU HG2 H 3.108 -9.045 2.057 1.00 . A A . 39 GLU HG2 1 1 8 9326 1 1 39 GLU HG3 H 3.298 -7.350 2.444 1.00 . A A . 39 GLU HG3 1 1 8 9327 1 1 39 GLU N N 0.773 -8.787 1.904 1.00 . A A . 39 GLU N 1 1 8 9328 1 1 39 GLU O O 0.537 -6.095 3.493 1.00 . A A . 39 GLU O 1 1 8 9329 1 1 39 GLU OE1 O 4.577 -9.351 4.576 1.00 . A A . 39 GLU OE1 1 1 8 9330 1 1 39 GLU OE2 O 5.615 -8.186 3.082 1.00 . A A . 39 GLU OE2 1 1 8 9331 1 1 40 PRO C C -1.836 -5.688 5.597 1.00 . A A . 40 PRO C 1 1 8 9332 1 1 40 PRO CA C -2.194 -6.197 4.199 1.00 . A A . 40 PRO CA 1 1 8 9333 1 1 40 PRO CB C -3.626 -6.740 4.204 1.00 . A A . 40 PRO CB 1 1 8 9334 1 1 40 PRO CD C -2.068 -8.584 3.694 1.00 . A A . 40 PRO CD 1 1 8 9335 1 1 40 PRO CG C -3.544 -8.247 3.921 1.00 . A A . 40 PRO CG 1 1 8 9336 1 1 40 PRO HA H -2.084 -5.387 3.477 1.00 . A A . 40 PRO HA 1 1 8 9337 1 1 40 PRO HB2 H -4.100 -6.556 5.168 1.00 . A A . 40 PRO HB2 1 1 8 9338 1 1 40 PRO HB3 H -4.226 -6.244 3.441 1.00 . A A . 40 PRO HB3 1 1 8 9339 1 1 40 PRO HD2 H -1.708 -9.283 4.448 1.00 . A A . 40 PRO HD2 1 1 8 9340 1 1 40 PRO HD3 H -1.907 -9.019 2.708 1.00 . A A . 40 PRO HD3 1 1 8 9341 1 1 40 PRO HG2 H -3.939 -8.815 4.764 1.00 . A A . 40 PRO HG2 1 1 8 9342 1 1 40 PRO HG3 H -4.136 -8.506 3.043 1.00 . A A . 40 PRO HG3 1 1 8 9343 1 1 40 PRO N N -1.359 -7.320 3.808 1.00 . A A . 40 PRO N 1 1 8 9344 1 1 40 PRO O O -2.681 -5.585 6.478 1.00 . A A . 40 PRO O 1 1 8 9345 1 1 41 HIS C C 0.327 -3.002 5.844 1.00 . A A . 41 HIS C 1 1 8 9346 1 1 41 HIS CA C -0.196 -4.239 6.595 1.00 . A A . 41 HIS CA 1 1 8 9347 1 1 41 HIS CB C 0.856 -4.655 7.616 1.00 . A A . 41 HIS CB 1 1 8 9348 1 1 41 HIS CD2 C 3.134 -4.342 6.517 1.00 . A A . 41 HIS CD2 1 1 8 9349 1 1 41 HIS CE1 C 3.687 -6.452 6.048 1.00 . A A . 41 HIS CE1 1 1 8 9350 1 1 41 HIS CG C 2.124 -5.114 6.952 1.00 . A A . 41 HIS CG 1 1 8 9351 1 1 41 HIS H H 0.178 -5.953 5.330 1.00 . A A . 41 HIS H 1 1 8 9352 1 1 41 HIS HA H -1.126 -3.937 7.061 1.00 . A A . 41 HIS HA 1 1 8 9353 1 1 41 HIS HB2 H 1.080 -3.784 8.229 1.00 . A A . 41 HIS HB2 1 1 8 9354 1 1 41 HIS HB3 H 0.470 -5.446 8.263 1.00 . A A . 41 HIS HB3 1 1 8 9355 1 1 41 HIS HD1 H 1.921 -7.301 6.856 1.00 . A A . 41 HIS HD1 1 1 8 9356 1 1 41 HIS HD2 H 3.173 -3.270 6.567 1.00 . A A . 41 HIS HD2 1 1 8 9357 1 1 41 HIS HE1 H 4.122 -7.299 5.523 1.00 . A A . 41 HIS HE1 1 1 8 9358 1 1 41 HIS N N -0.533 -5.378 5.741 1.00 . A A . 41 HIS N 1 1 8 9359 1 1 41 HIS ND1 N 2.488 -6.504 6.651 1.00 . A A . 41 HIS ND1 1 1 8 9360 1 1 41 HIS NE2 N 4.180 -5.207 5.947 1.00 . A A . 41 HIS NE2 1 1 8 9361 1 1 41 HIS O O 0.417 -1.909 6.390 1.00 . A A . 41 HIS O 1 1 8 9362 1 1 42 ARG C C 0.697 -1.218 3.247 1.00 . A A . 42 ARG C 1 1 8 9363 1 1 42 ARG CA C 1.527 -2.339 3.858 1.00 . A A . 42 ARG CA 1 1 8 9364 1 1 42 ARG CB C 2.272 -3.086 2.757 1.00 . A A . 42 ARG CB 1 1 8 9365 1 1 42 ARG CD C 3.721 -5.133 3.069 1.00 . A A . 42 ARG CD 1 1 8 9366 1 1 42 ARG CG C 3.606 -3.625 3.268 1.00 . A A . 42 ARG CG 1 1 8 9367 1 1 42 ARG CZ C 6.066 -5.135 2.572 1.00 . A A . 42 ARG CZ 1 1 8 9368 1 1 42 ARG H H 0.295 -4.127 4.269 1.00 . A A . 42 ARG H 1 1 8 9369 1 1 42 ARG HA H 2.220 -1.923 4.589 1.00 . A A . 42 ARG HA 1 1 8 9370 1 1 42 ARG HB2 H 1.634 -3.890 2.391 1.00 . A A . 42 ARG HB2 1 1 8 9371 1 1 42 ARG HB3 H 2.454 -2.432 1.904 1.00 . A A . 42 ARG HB3 1 1 8 9372 1 1 42 ARG HD2 H 3.052 -5.682 3.732 1.00 . A A . 42 ARG HD2 1 1 8 9373 1 1 42 ARG HD3 H 3.510 -5.414 2.037 1.00 . A A . 42 ARG HD3 1 1 8 9374 1 1 42 ARG HE H 5.255 -6.196 4.124 1.00 . A A . 42 ARG HE 1 1 8 9375 1 1 42 ARG HG2 H 4.428 -3.133 2.741 1.00 . A A . 42 ARG HG2 1 1 8 9376 1 1 42 ARG HG3 H 3.698 -3.376 4.328 1.00 . A A . 42 ARG HG3 1 1 8 9377 1 1 42 ARG HH11 H 5.266 -5.088 0.714 1.00 . A A . 42 ARG HH11 1 1 8 9378 1 1 42 ARG HH12 H 6.801 -5.880 0.839 1.00 . A A . 42 ARG HH12 1 1 8 9379 1 1 42 ARG HH21 H 6.930 -3.903 3.927 1.00 . A A . 42 ARG HH21 1 1 8 9380 1 1 42 ARG HH22 H 7.974 -4.465 2.664 1.00 . A A . 42 ARG HH22 1 1 8 9381 1 1 42 ARG N N 0.662 -3.253 4.578 1.00 . A A . 42 ARG N 1 1 8 9382 1 1 42 ARG NE N 5.070 -5.576 3.362 1.00 . A A . 42 ARG NE 1 1 8 9383 1 1 42 ARG NH1 N 6.042 -5.389 1.267 1.00 . A A . 42 ARG NH1 1 1 8 9384 1 1 42 ARG NH2 N 7.073 -4.444 3.098 1.00 . A A . 42 ARG NH2 1 1 8 9385 1 1 42 ARG O O -0.507 -1.116 3.449 1.00 . A A . 42 ARG O 1 1 8 9386 1 1 43 CYS C C 0.881 -0.427 0.096 1.00 . A A . 43 CYS C 1 1 8 9387 1 1 43 CYS CA C 0.813 0.325 1.420 1.00 . A A . 43 CYS CA 1 1 8 9388 1 1 43 CYS CB C 1.614 1.589 1.287 1.00 . A A . 43 CYS CB 1 1 8 9389 1 1 43 CYS H H 2.306 0.034 2.710 1.00 . A A . 43 CYS H 1 1 8 9390 1 1 43 CYS HA H -0.188 0.539 1.733 1.00 . A A . 43 CYS HA 1 1 8 9391 1 1 43 CYS HB2 H 2.542 1.454 0.742 1.00 . A A . 43 CYS HB2 1 1 8 9392 1 1 43 CYS HB3 H 1.008 2.175 0.644 1.00 . A A . 43 CYS HB3 1 1 8 9393 1 1 43 CYS N N 1.432 -0.387 2.488 1.00 . A A . 43 CYS N 1 1 8 9394 1 1 43 CYS O O -0.080 -0.679 -0.621 1.00 . A A . 43 CYS O 1 1 8 9395 1 1 43 CYS SG S 1.935 2.445 2.855 1.00 . A A . 43 CYS SG 1 1 8 9396 1 1 44 GLN C C 1.725 -0.429 -2.563 1.00 . A A . 44 GLN C 1 1 8 9397 1 1 44 GLN CA C 2.753 -0.733 -1.467 1.00 . A A . 44 GLN CA 1 1 8 9398 1 1 44 GLN CB C 3.444 -2.076 -1.704 1.00 . A A . 44 GLN CB 1 1 8 9399 1 1 44 GLN CD C 5.645 -2.734 -0.708 1.00 . A A . 44 GLN CD 1 1 8 9400 1 1 44 GLN CG C 4.962 -1.914 -1.805 1.00 . A A . 44 GLN CG 1 1 8 9401 1 1 44 GLN H H 2.639 -0.444 0.698 1.00 . A A . 44 GLN H 1 1 8 9402 1 1 44 GLN HA H 3.495 0.063 -1.469 1.00 . A A . 44 GLN HA 1 1 8 9403 1 1 44 GLN HB2 H 3.211 -2.759 -0.887 1.00 . A A . 44 GLN HB2 1 1 8 9404 1 1 44 GLN HB3 H 3.060 -2.531 -2.617 1.00 . A A . 44 GLN HB3 1 1 8 9405 1 1 44 GLN HE21 H 5.172 -1.384 0.738 1.00 . A A . 44 GLN HE21 1 1 8 9406 1 1 44 GLN HE22 H 5.114 -3.068 1.228 1.00 . A A . 44 GLN HE22 1 1 8 9407 1 1 44 GLN HG2 H 5.321 -2.252 -2.778 1.00 . A A . 44 GLN HG2 1 1 8 9408 1 1 44 GLN HG3 H 5.244 -0.866 -1.690 1.00 . A A . 44 GLN HG3 1 1 8 9409 1 1 44 GLN N N 2.161 -0.696 -0.139 1.00 . A A . 44 GLN N 1 1 8 9410 1 1 44 GLN NE2 N 5.278 -2.362 0.531 1.00 . A A . 44 GLN NE2 1 1 8 9411 1 1 44 GLN O O 0.791 -1.182 -2.810 1.00 . A A . 44 GLN O 1 1 8 9412 1 1 44 GLN OE1 O 6.438 -3.630 -0.969 1.00 . A A . 44 GLN OE1 1 1 8 9413 1 1 45 MET C C -0.398 1.215 -3.557 1.00 . A A . 45 MET C 1 1 8 9414 1 1 45 MET CA C 0.988 1.784 -3.241 1.00 . A A . 45 MET CA 1 1 8 9415 1 1 45 MET CB C 1.368 2.776 -4.340 1.00 . A A . 45 MET CB 1 1 8 9416 1 1 45 MET CE C 0.937 0.311 -7.562 1.00 . A A . 45 MET CE 1 1 8 9417 1 1 45 MET CG C 1.076 2.235 -5.734 1.00 . A A . 45 MET CG 1 1 8 9418 1 1 45 MET H H 2.929 0.929 -3.469 1.00 . A A . 45 MET H 1 1 8 9419 1 1 45 MET HA H 0.986 2.271 -2.260 1.00 . A A . 45 MET HA 1 1 8 9420 1 1 45 MET HB2 H 0.798 3.695 -4.210 1.00 . A A . 45 MET HB2 1 1 8 9421 1 1 45 MET HB3 H 2.426 3.024 -4.270 1.00 . A A . 45 MET HB3 1 1 8 9422 1 1 45 MET HE1 H 0.005 -0.243 -7.442 1.00 . A A . 45 MET HE1 1 1 8 9423 1 1 45 MET HE2 H 0.722 1.278 -8.022 1.00 . A A . 45 MET HE2 1 1 8 9424 1 1 45 MET HE3 H 1.608 -0.245 -8.213 1.00 . A A . 45 MET HE3 1 1 8 9425 1 1 45 MET HG2 H 0.001 2.217 -5.902 1.00 . A A . 45 MET HG2 1 1 8 9426 1 1 45 MET HG3 H 1.518 2.880 -6.494 1.00 . A A . 45 MET HG3 1 1 8 9427 1 1 45 MET N N 1.989 0.731 -3.192 1.00 . A A . 45 MET N 1 1 8 9428 1 1 45 MET O O -0.551 0.154 -4.149 1.00 . A A . 45 MET O 1 1 8 9429 1 1 45 MET SD S 1.703 0.570 -5.961 1.00 . A A . 45 MET SD 1 1 8 9430 1 1 46 PHE C C -3.360 1.391 -4.513 1.00 . A A . 46 PHE C 1 1 8 9431 1 1 46 PHE CA C -2.742 1.525 -3.101 1.00 . A A . 46 PHE CA 1 1 8 9432 1 1 46 PHE CB C -3.518 2.441 -2.116 1.00 . A A . 46 PHE CB 1 1 8 9433 1 1 46 PHE CD1 C -4.818 4.235 -3.389 1.00 . A A . 46 PHE CD1 1 1 8 9434 1 1 46 PHE CD2 C -6.068 2.389 -2.283 1.00 . A A . 46 PHE CD2 1 1 8 9435 1 1 46 PHE CE1 C -6.060 4.814 -3.831 1.00 . A A . 46 PHE CE1 1 1 8 9436 1 1 46 PHE CE2 C -7.312 2.965 -2.723 1.00 . A A . 46 PHE CE2 1 1 8 9437 1 1 46 PHE CG C -4.817 3.024 -2.608 1.00 . A A . 46 PHE CG 1 1 8 9438 1 1 46 PHE CZ C -7.306 4.179 -3.496 1.00 . A A . 46 PHE CZ 1 1 8 9439 1 1 46 PHE H H -1.252 2.822 -2.563 1.00 . A A . 46 PHE H 1 1 8 9440 1 1 46 PHE HA H -2.610 0.523 -2.704 1.00 . A A . 46 PHE HA 1 1 8 9441 1 1 46 PHE HB2 H -3.723 1.888 -1.204 1.00 . A A . 46 PHE HB2 1 1 8 9442 1 1 46 PHE HB3 H -2.887 3.276 -1.811 1.00 . A A . 46 PHE HB3 1 1 8 9443 1 1 46 PHE HD1 H -3.883 4.713 -3.640 1.00 . A A . 46 PHE HD1 1 1 8 9444 1 1 46 PHE HD2 H -6.075 1.479 -1.702 1.00 . A A . 46 PHE HD2 1 1 8 9445 1 1 46 PHE HE1 H -6.055 5.724 -4.412 1.00 . A A . 46 PHE HE1 1 1 8 9446 1 1 46 PHE HE2 H -8.248 2.489 -2.471 1.00 . A A . 46 PHE HE2 1 1 8 9447 1 1 46 PHE HZ H -8.239 4.613 -3.826 1.00 . A A . 46 PHE HZ 1 1 8 9448 1 1 46 PHE N N -1.389 2.014 -3.124 1.00 . A A . 46 PHE N 1 1 8 9449 1 1 46 PHE O O -4.572 1.293 -4.655 1.00 . A A . 46 PHE O 1 1 8 9450 1 1 47 CYS C C -3.832 3.063 -6.704 1.30 . A A . 47 CYS C 1 1 8 9451 1 1 47 CYS CA C -2.418 2.569 -6.375 0.80 . A A . 47 CYS CA 1 1 8 9452 1 1 47 CYS CB C -1.655 2.300 -7.667 0.60 . A A . 47 CYS CB 1 1 8 9453 1 1 47 CYS H H -1.864 0.606 -5.646 1.00 . A A . 47 CYS H 1 1 8 9454 1 1 47 CYS HA H -1.882 3.317 -5.796 1.10 . A A . 47 CYS HA 1 1 8 9455 1 1 47 CYS HB2 H -1.229 1.299 -7.653 0.90 . A A . 47 CYS HB2 1 1 8 9456 1 1 47 CYS HB3 H -2.332 2.347 -8.519 0.90 . A A . 47 CYS HB3 1 1 8 9457 1 1 47 CYS N N -2.480 1.385 -5.535 0.60 . A A . 47 CYS N 1 1 8 9458 1 1 47 CYS O O -4.139 4.246 -6.628 1.90 . A A . 47 CYS O 1 1 8 9459 1 1 47 CYS SG S -0.340 3.523 -7.896 1.30 . A A . 47 CYS SG 1 1 8 9460 1 1 48 ASN C C -6.653 3.477 -6.998 1.90 . A A . 48 ASN C 1 1 8 9461 1 1 48 ASN CA C -5.904 2.372 -7.748 2.30 . A A . 48 ASN CA 1 1 8 9462 1 1 48 ASN CB C -6.806 1.133 -7.908 3.00 . A A . 48 ASN CB 1 1 8 9463 1 1 48 ASN CG C -6.445 -0.023 -6.961 3.70 . A A . 48 ASN CG 1 1 8 9464 1 1 48 ASN H H -4.427 1.115 -6.845 2.00 . A A . 48 ASN H 1 1 8 9465 1 1 48 ASN HA H -5.616 2.753 -8.728 2.70 . A A . 48 ASN HA 1 1 8 9466 1 1 48 ASN HB2 H -7.846 1.408 -7.731 3.30 . A A . 48 ASN HB2 1 1 8 9467 1 1 48 ASN HB3 H -6.748 0.764 -8.931 3.20 . A A . 48 ASN HB3 1 1 8 9468 1 1 48 ASN HD21 H -7.713 0.727 -5.536 1.00 . A A . 48 ASN HD21 1 1 8 9469 1 1 48 ASN N N -4.658 2.063 -7.064 1.70 . A A . 48 ASN N 1 1 8 9470 1 1 48 ASN ND2 N -7.223 -0.081 -5.865 4.10 . A A . 48 ASN ND2 1 1 8 9471 1 1 48 ASN O O -7.347 3.237 -6.017 2.30 . A A . 48 ASN O 1 1 8 9472 1 1 48 ASN OD1 O -5.531 -0.799 -7.211 4.40 . A A . 48 ASN OD1 1 1 8 9473 1 1 49 GLN C C -5.778 4.873 -9.866 1.80 . A A . 49 GLN C 1 1 8 9474 1 1 49 GLN CA C -6.942 4.954 -8.876 2.00 . A A . 49 GLN CA 1 1 8 9475 1 1 49 GLN CB C -7.594 6.337 -8.941 2.20 . A A . 49 GLN CB 1 1 8 9476 1 1 49 GLN CD C -7.631 7.347 -6.652 3.40 . A A . 49 GLN CD 1 1 8 9477 1 1 49 GLN CG C -6.915 7.339 -8.005 2.70 . A A . 49 GLN CG 1 1 8 9478 1 1 49 GLN H H -6.008 5.418 -7.004 2.50 . A A . 49 GLN H 1 1 8 9479 1 1 49 GLN HA H -7.663 4.168 -9.100 2.50 . A A . 49 GLN HA 1 1 8 9480 1 1 49 GLN HB2 H -7.555 6.711 -9.963 2.60 . A A . 49 GLN HB2 1 1 8 9481 1 1 49 GLN HB3 H -8.650 6.254 -8.682 2.10 . A A . 49 GLN HB3 1 1 8 9482 1 1 49 GLN HE21 H -6.939 9.222 -6.271 4.10 . A A . 49 GLN HE21 1 1 8 9483 1 1 49 GLN HE22 H -7.257 8.230 -4.859 4.50 . A A . 49 GLN HE22 1 1 8 9484 1 1 49 GLN HG2 H -5.869 7.074 -7.852 2.70 . A A . 49 GLN HG2 1 1 8 9485 1 1 49 GLN HG3 H -6.943 8.343 -8.429 2.80 . A A . 49 GLN HG3 1 1 8 9486 1 1 49 GLN N N -6.463 4.699 -7.530 2.00 . A A . 49 GLN N 1 1 8 9487 1 1 49 GLN NE2 N -7.241 8.358 -5.856 4.00 . A A . 49 GLN NE2 1 1 8 9488 1 1 49 GLN O O -5.590 3.885 -10.565 2.20 . A A . 49 GLN O 1 1 8 9489 1 1 49 GLN OE1 O -8.468 6.502 -6.358 3.70 . A A . 49 GLN OE1 1 1 8 9490 1 1 50 THR C C -3.439 7.464 -11.008 1.50 . A A . 50 THR C 1 1 8 9491 1 1 50 THR CA C -4.663 6.557 -11.160 1.80 . A A . 50 THR CA 1 1 8 9492 1 1 50 THR CB C -5.845 7.358 -11.711 1.90 . A A . 50 THR CB 1 1 8 9493 1 1 50 THR CG2 C -6.163 8.573 -10.838 2.30 . A A . 50 THR CG2 1 1 8 9494 1 1 50 THR H H -4.711 6.401 -9.021 2.00 . A A . 50 THR H 1 1 8 9495 1 1 50 THR HA H -4.415 5.723 -11.816 2.10 . A A . 50 THR HA 1 1 8 9496 1 1 50 THR HB H -6.721 6.714 -11.773 2.20 . A A . 50 THR HB 1 1 8 9497 1 1 50 THR HG1 H -6.224 8.421 -13.249 2.50 . A A . 50 THR HG1 1 1 8 9498 1 1 50 THR HG21 H -7.226 8.613 -10.599 2.40 . A A . 50 THR HG21 1 1 8 9499 1 1 50 THR HG22 H -5.897 9.498 -11.348 2.60 . A A . 50 THR HG22 1 1 8 9500 1 1 50 THR HG23 H -5.607 8.533 -9.902 2.80 . A A . 50 THR HG23 1 1 8 9501 1 1 50 THR N N -5.017 5.982 -9.875 1.70 . A A . 50 THR N 1 1 8 9502 1 1 50 THR O O -2.728 7.438 -10.011 2.20 . A A . 50 THR O 1 1 8 9503 1 1 50 THR OG1 O -5.558 7.787 -13.018 2.20 . A A . 50 THR OG1 1 1 8 9504 1 1 51 ALA C C -0.843 7.836 -12.062 0.60 . A A . 51 ALA C 1 1 8 9505 1 1 51 ALA CA C -2.098 8.029 -12.917 0.60 . A A . 51 ALA CA 1 1 8 9506 1 1 51 ALA CB C -1.907 9.211 -13.862 0.70 . A A . 51 ALA CB 1 1 8 9507 1 1 51 ALA H H -4.009 8.836 -12.393 0.90 . A A . 51 ALA H 1 1 8 9508 1 1 51 ALA HA H -2.308 7.125 -13.488 0.70 . A A . 51 ALA HA 1 1 8 9509 1 1 51 ALA HB1 H -1.191 8.963 -14.645 1.20 . A A . 51 ALA HB1 1 1 8 9510 1 1 51 ALA HB2 H -1.534 10.082 -13.323 1.00 . A A . 51 ALA HB2 1 1 8 9511 1 1 51 ALA HB3 H -2.850 9.480 -14.336 1.30 . A A . 51 ALA HB3 1 1 8 9512 1 1 51 ALA N N -3.256 8.261 -12.075 0.80 . A A . 51 ALA N 1 1 8 9513 1 1 51 ALA O O -0.358 8.747 -11.402 1.10 . A A . 51 ALA O 1 1 8 9514 1 1 52 CYS C C 1.972 6.033 -11.468 0.80 . A A . 52 CYS C 1 1 8 9515 1 1 52 CYS CA C 0.491 6.131 -11.050 0.80 . A A . 52 CYS CA 1 1 8 9516 1 1 52 CYS CB C -0.002 4.772 -10.594 0.90 . A A . 52 CYS CB 1 1 8 9517 1 1 52 CYS H H -0.758 5.934 -12.776 0.90 . A A . 52 CYS H 1 1 8 9518 1 1 52 CYS HA H 0.374 6.854 -10.242 0.80 . A A . 52 CYS HA 1 1 8 9519 1 1 52 CYS HB2 H -0.492 4.286 -11.439 1.00 . A A . 52 CYS HB2 1 1 8 9520 1 1 52 CYS HB3 H 0.865 4.188 -10.293 1.10 . A A . 52 CYS HB3 1 1 8 9521 1 1 52 CYS N N -0.360 6.585 -12.129 0.70 . A A . 52 CYS N 1 1 8 9522 1 1 52 CYS O O 2.861 6.428 -10.725 1.20 . A A . 52 CYS O 1 1 8 9523 1 1 52 CYS SG S -1.160 4.848 -9.208 1.00 . A A . 52 CYS SG 1 1 8 9524 1 1 53 PRO C C 4.164 4.036 -13.008 0.80 . A A . 53 PRO C 1 1 8 9525 1 1 53 PRO CA C 2.639 4.119 -12.931 0.70 . A A . 53 PRO CA 1 1 8 9526 1 1 53 PRO CB C 2.141 3.822 -14.334 0.90 . A A . 53 PRO CB 1 1 8 9527 1 1 53 PRO CD C 2.041 6.250 -13.921 0.80 . A A . 53 PRO CD 1 1 8 9528 1 1 53 PRO CG C 2.072 5.185 -15.015 0.90 . A A . 53 PRO CG 1 1 8 9529 1 1 53 PRO HA H 2.278 3.395 -12.191 0.80 . A A . 53 PRO HA 1 1 8 9530 1 1 53 PRO HB2 H 2.829 3.161 -14.859 1.00 . A A . 53 PRO HB2 1 1 8 9531 1 1 53 PRO HB3 H 1.154 3.361 -14.315 1.10 . A A . 53 PRO HB3 1 1 8 9532 1 1 53 PRO HD2 H 2.866 6.954 -14.030 0.80 . A A . 53 PRO HD2 1 1 8 9533 1 1 53 PRO HD3 H 1.110 6.812 -13.942 0.90 . A A . 53 PRO HD3 1 1 8 9534 1 1 53 PRO HG2 H 2.957 5.311 -15.629 0.90 . A A . 53 PRO HG2 1 1 8 9535 1 1 53 PRO HG3 H 1.188 5.241 -15.636 1.00 . A A . 53 PRO HG3 1 1 8 9536 1 1 53 PRO N N 2.194 5.492 -12.692 0.60 . A A . 53 PRO N 1 1 8 9537 1 1 53 PRO O O 4.817 4.503 -13.933 1.60 . A A . 53 PRO O 1 1 8 9538 1 1 54 ALA C C 6.976 3.041 -12.861 0.90 . A A . 54 ALA C 1 1 8 9539 1 1 54 ALA CA C 5.814 2.542 -11.982 0.80 . A A . 54 ALA CA 1 1 8 9540 1 1 54 ALA CB C 5.352 1.195 -12.472 0.80 . A A . 54 ALA CB 1 1 8 9541 1 1 54 ALA H H 3.927 3.224 -11.271 1.40 . A A . 54 ALA H 1 1 8 9542 1 1 54 ALA HA H 6.155 2.470 -10.949 0.70 . A A . 54 ALA HA 1 1 8 9543 1 1 54 ALA HB1 H 5.351 1.207 -13.558 1.20 . A A . 54 ALA HB1 1 1 8 9544 1 1 54 ALA HB2 H 4.332 1.024 -12.145 1.40 . A A . 54 ALA HB2 1 1 8 9545 1 1 54 ALA HB3 H 5.991 0.408 -12.072 1.30 . A A . 54 ALA HB3 1 1 8 9546 1 1 54 ALA N N 4.642 3.396 -11.941 0.80 . A A . 54 ALA N 1 1 8 9547 1 1 54 ALA O O 6.848 3.381 -14.031 1.50 . A A . 54 ALA O 1 1 8 9548 1 1 55 ASP C C 9.413 3.904 -13.990 1.10 . A A . 55 ASP C 1 1 8 9549 1 1 55 ASP CA C 9.459 3.192 -12.657 1.20 . A A . 55 ASP CA 1 1 8 9550 1 1 55 ASP CB C 10.130 1.845 -12.776 1.40 . A A . 55 ASP CB 1 1 8 9551 1 1 55 ASP CG C 11.480 1.989 -13.483 2.10 . A A . 55 ASP CG 1 1 8 9552 1 1 55 ASP H H 7.972 2.854 -11.185 1.40 . A A . 55 ASP H 1 1 8 9553 1 1 55 ASP HA H 9.987 3.819 -11.938 1.30 . A A . 55 ASP HA 1 1 8 9554 1 1 55 ASP HB2 H 10.273 1.379 -11.802 1.50 . A A . 55 ASP HB2 1 1 8 9555 1 1 55 ASP HB3 H 9.455 1.234 -13.354 1.80 . A A . 55 ASP HB3 1 1 8 9556 1 1 55 ASP N N 8.113 3.033 -12.145 1.00 . A A . 55 ASP N 1 1 8 9557 1 1 55 ASP O O 9.645 3.373 -15.069 1.50 . A A . 55 ASP O 1 1 8 9558 1 1 55 ASP OD1 O 11.994 3.106 -13.541 2.60 . A A . 55 ASP OD1 1 1 8 9559 1 1 55 ASP OD2 O 12.001 0.984 -13.963 2.80 . A A . 55 ASP OD2 1 1 8 9560 1 1 56 CYS C C 10.010 6.023 -15.843 0.80 . A A . 56 CYS C 1 1 8 9561 1 1 56 CYS CA C 8.923 6.157 -14.777 0.80 . A A . 56 CYS CA 1 1 8 9562 1 1 56 CYS CB C 9.024 7.490 -14.045 0.90 . A A . 56 CYS CB 1 1 8 9563 1 1 56 CYS H H 8.796 5.445 -12.845 1.10 . A A . 56 CYS H 1 1 8 9564 1 1 56 CYS HA H 7.938 6.027 -15.224 0.70 . A A . 56 CYS HA 1 1 8 9565 1 1 56 CYS HB2 H 9.873 7.990 -14.485 0.90 . A A . 56 CYS HB2 1 1 8 9566 1 1 56 CYS HB3 H 8.121 8.068 -14.230 1.00 . A A . 56 CYS HB3 1 1 8 9567 1 1 56 CYS N N 9.073 5.167 -13.760 0.90 . A A . 56 CYS N 1 1 8 9568 1 1 56 CYS O O 10.908 5.194 -15.762 1.10 . A A . 56 CYS O 1 1 8 9569 1 1 56 CYS SG S 9.364 7.483 -12.257 1.30 . A A . 56 CYS SG 1 1 8 9570 1 1 57 ASP C C 12.016 8.025 -16.748 0.90 . A A . 57 ASP C 1 1 8 9571 1 1 57 ASP CA C 11.024 7.256 -17.626 1.00 . A A . 57 ASP CA 1 1 8 9572 1 1 57 ASP CB C 10.610 8.106 -18.826 1.10 . A A . 57 ASP CB 1 1 8 9573 1 1 57 ASP CG C 11.675 8.010 -19.921 1.60 . A A . 57 ASP CG 1 1 8 9574 1 1 57 ASP H H 8.968 7.333 -17.020 1.10 . A A . 57 ASP H 1 1 8 9575 1 1 57 ASP HA H 11.456 6.313 -17.950 1.20 . A A . 57 ASP HA 1 1 8 9576 1 1 57 ASP HB2 H 9.656 7.767 -19.229 1.10 . A A . 57 ASP HB2 1 1 8 9577 1 1 57 ASP HB3 H 10.496 9.150 -18.533 1.20 . A A . 57 ASP HB3 1 1 8 9578 1 1 57 ASP N N 9.856 6.909 -16.842 0.80 . A A . 57 ASP N 1 1 8 9579 1 1 57 ASP O O 11.733 9.115 -16.267 1.00 . A A . 57 ASP O 1 1 8 9580 1 1 57 ASP OD1 O 11.952 6.901 -20.376 2.00 . A A . 57 ASP OD1 1 1 8 9581 1 1 57 ASP OD2 O 12.216 9.046 -20.307 2.20 . A A . 57 ASP OD2 1 1 8 9582 1 1 58 PRO C C 14.277 9.180 -15.225 1.20 . A A . 58 PRO C 1 1 8 9583 1 1 58 PRO CA C 14.045 7.679 -15.414 1.20 . A A . 58 PRO CA 1 1 8 9584 1 1 58 PRO CB C 15.373 6.974 -15.704 1.40 . A A . 58 PRO CB 1 1 8 9585 1 1 58 PRO CD C 13.783 6.476 -17.526 1.30 . A A . 58 PRO CD 1 1 8 9586 1 1 58 PRO CG C 15.216 6.238 -17.042 1.50 . A A . 58 PRO CG 1 1 8 9587 1 1 58 PRO HA H 13.582 7.274 -14.514 1.30 . A A . 58 PRO HA 1 1 8 9588 1 1 58 PRO HB2 H 16.185 7.698 -15.759 1.50 . A A . 58 PRO HB2 1 1 8 9589 1 1 58 PRO HB3 H 15.614 6.270 -14.907 1.70 . A A . 58 PRO HB3 1 1 8 9590 1 1 58 PRO HD2 H 13.762 6.913 -18.524 1.30 . A A . 58 PRO HD2 1 1 8 9591 1 1 58 PRO HD3 H 13.229 5.538 -17.538 1.40 . A A . 58 PRO HD3 1 1 8 9592 1 1 58 PRO HG2 H 15.932 6.615 -17.772 1.50 . A A . 58 PRO HG2 1 1 8 9593 1 1 58 PRO HG3 H 15.405 5.172 -16.917 1.70 . A A . 58 PRO HG3 1 1 8 9594 1 1 58 PRO N N 13.200 7.398 -16.563 1.00 . A A . 58 PRO N 1 1 8 9595 1 1 58 PRO O O 14.321 9.691 -14.113 1.50 . A A . 58 PRO O 1 1 8 9596 1 1 59 ASN C C 14.578 12.247 -16.135 1.30 . A A . 59 ASN C 1 1 8 9597 1 1 59 ASN CA C 15.338 10.967 -16.419 1.30 . A A . 59 ASN CA 1 1 8 9598 1 1 59 ASN CB C 16.001 11.049 -17.792 1.50 . A A . 59 ASN CB 1 1 8 9599 1 1 59 ASN CG C 16.864 12.308 -17.872 1.90 . A A . 59 ASN CG 1 1 8 9600 1 1 59 ASN H H 13.894 9.609 -17.200 1.10 . A A . 59 ASN H 1 1 8 9601 1 1 59 ASN HA H 16.046 10.809 -15.632 1.50 . A A . 59 ASN HA 1 1 8 9602 1 1 59 ASN HB2 H 16.626 10.172 -17.978 1.70 . A A . 59 ASN HB2 1 1 8 9603 1 1 59 ASN HB3 H 15.233 11.114 -18.566 1.70 . A A . 59 ASN HB3 1 1 8 9604 1 1 59 ASN HD21 H 15.135 13.346 -18.026 2.10 . A A . 59 ASN HD21 1 1 8 9605 1 1 59 ASN HD22 H 16.591 14.267 -18.373 2.50 . A A . 59 ASN HD22 1 1 8 9606 1 1 59 ASN N N 14.424 9.844 -16.386 1.10 . A A . 59 ASN N 1 1 8 9607 1 1 59 ASN ND2 N 16.135 13.411 -18.113 2.00 . A A . 59 ASN ND2 1 1 8 9608 1 1 59 ASN O O 14.818 13.000 -15.198 1.70 . A A . 59 ASN O 1 1 8 9609 1 1 59 ASN OD1 O 18.080 12.277 -17.725 2.70 . A A . 59 ASN OD1 1 1 8 9610 1 1 60 THR C C 11.607 13.747 -16.599 0.90 . A A . 60 THR C 1 1 8 9611 1 1 60 THR CA C 12.991 13.665 -17.270 1.20 . A A . 60 THR CA 1 1 8 9612 1 1 60 THR CB C 12.876 13.951 -18.753 1.40 . A A . 60 THR CB 1 1 8 9613 1 1 60 THR CG2 C 12.152 12.796 -19.402 1.40 . A A . 60 THR CG2 1 1 8 9614 1 1 60 THR H H 13.597 11.545 -17.602 1.00 . A A . 60 THR H 1 1 8 9615 1 1 60 THR HA H 13.654 14.395 -16.847 1.40 . A A . 60 THR HA 1 1 8 9616 1 1 60 THR HB H 13.866 14.069 -19.192 1.90 . A A . 60 THR HB 1 1 8 9617 1 1 60 THR HG1 H 12.659 15.830 -18.517 2.30 . A A . 60 THR HG1 1 1 8 9618 1 1 60 THR HG21 H 12.687 11.873 -19.181 1.90 . A A . 60 THR HG21 1 1 8 9619 1 1 60 THR HG22 H 12.097 12.942 -20.477 1.80 . A A . 60 THR HG22 1 1 8 9620 1 1 60 THR HG23 H 11.149 12.723 -18.984 1.70 . A A . 60 THR HG23 1 1 8 9621 1 1 60 THR N N 13.639 12.382 -17.062 1.10 . A A . 60 THR N 1 1 8 9622 1 1 60 THR O O 10.759 14.535 -16.999 1.10 . A A . 60 THR O 1 1 8 9623 1 1 60 THR OG1 O 12.171 15.148 -18.960 2.10 . A A . 60 THR OG1 1 1 8 9624 1 1 61 GLN C C 10.128 11.797 -13.820 0.90 . A A . 61 GLN C 1 1 8 9625 1 1 61 GLN CA C 10.168 12.928 -14.848 0.80 . A A . 61 GLN CA 1 1 8 9626 1 1 61 GLN CB C 8.999 12.781 -15.822 1.00 . A A . 61 GLN CB 1 1 8 9627 1 1 61 GLN CD C 6.644 13.459 -16.335 1.90 . A A . 61 GLN CD 1 1 8 9628 1 1 61 GLN CG C 7.890 13.783 -15.508 1.40 . A A . 61 GLN CG 1 1 8 9629 1 1 61 GLN H H 12.170 12.290 -15.285 1.20 . A A . 61 GLN H 1 1 8 9630 1 1 61 GLN HA H 10.126 13.887 -14.330 0.70 . A A . 61 GLN HA 1 1 8 9631 1 1 61 GLN HB2 H 9.345 12.919 -16.846 1.60 . A A . 61 GLN HB2 1 1 8 9632 1 1 61 GLN HB3 H 8.601 11.767 -15.763 1.60 . A A . 61 GLN HB3 1 1 8 9633 1 1 61 GLN HE21 H 6.994 13.852 -18.301 2.80 . A A . 61 GLN HE21 1 1 8 9634 1 1 61 GLN HE22 H 6.059 15.063 -17.443 2.60 . A A . 61 GLN HE22 1 1 8 9635 1 1 61 GLN HG2 H 7.634 13.750 -14.449 1.80 . A A . 61 GLN HG2 1 1 8 9636 1 1 61 GLN HG3 H 8.216 14.797 -15.737 1.90 . A A . 61 GLN HG3 1 1 8 9637 1 1 61 GLN N N 11.431 12.903 -15.562 0.90 . A A . 61 GLN N 1 1 8 9638 1 1 61 GLN NE2 N 6.558 14.190 -17.461 2.40 . A A . 61 GLN NE2 1 1 8 9639 1 1 61 GLN O O 10.448 10.649 -14.104 1.50 . A A . 61 GLN O 1 1 8 9640 1 1 61 GLN OE1 O 5.831 12.615 -15.978 2.40 . A A . 61 GLN OE1 1 1 8 9641 1 1 62 ALA C C 7.425 11.485 -13.172 0.90 . A A . 62 ALA C 1 1 8 9642 1 1 62 ALA CA C 8.460 11.715 -12.064 1.00 . A A . 62 ALA CA 1 1 8 9643 1 1 62 ALA CB C 7.919 12.718 -11.044 1.30 . A A . 62 ALA CB 1 1 8 9644 1 1 62 ALA H H 10.302 12.801 -12.054 1.50 . A A . 62 ALA H 1 1 8 9645 1 1 62 ALA HA H 8.691 10.765 -11.585 1.20 . A A . 62 ALA HA 1 1 8 9646 1 1 62 ALA HB1 H 7.533 12.207 -10.162 1.70 . A A . 62 ALA HB1 1 1 8 9647 1 1 62 ALA HB2 H 7.110 13.310 -11.471 1.60 . A A . 62 ALA HB2 1 1 8 9648 1 1 62 ALA HB3 H 8.703 13.402 -10.719 1.70 . A A . 62 ALA HB3 1 1 8 9649 1 1 62 ALA N N 9.714 12.211 -12.608 1.00 . A A . 62 ALA N 1 1 8 9650 1 1 62 ALA O O 6.503 12.268 -13.367 1.80 . A A . 62 ALA O 1 1 8 9651 1 1 63 SER C C 5.811 8.678 -14.210 0.60 . A A . 63 SER C 1 1 8 9652 1 1 63 SER CA C 6.586 9.893 -14.766 0.50 . A A . 63 SER CA 1 1 8 9653 1 1 63 SER CB C 7.203 9.529 -16.118 0.60 . A A . 63 SER CB 1 1 8 9654 1 1 63 SER H H 8.494 9.846 -13.776 1.20 . A A . 63 SER H 1 1 8 9655 1 1 63 SER HA H 5.893 10.727 -14.862 0.50 . A A . 63 SER HA 1 1 8 9656 1 1 63 SER HB2 H 8.292 9.524 -16.063 1.20 . A A . 63 SER HB2 1 1 8 9657 1 1 63 SER HB3 H 6.883 8.536 -16.437 0.90 . A A . 63 SER HB3 1 1 8 9658 1 1 63 SER HG H 6.025 10.114 -17.499 1.60 . A A . 63 SER HG 1 1 8 9659 1 1 63 SER N N 7.639 10.356 -13.872 0.60 . A A . 63 SER N 1 1 8 9660 1 1 63 SER O O 5.135 7.970 -14.947 1.60 . A A . 63 SER O 1 1 8 9661 1 1 63 SER OG O 6.818 10.452 -17.105 1.30 . A A . 63 SER OG 1 1 8 9662 1 1 64 CYS C C 5.224 7.420 -10.813 0.50 . A A . 64 CYS C 1 1 8 9663 1 1 64 CYS CA C 5.496 7.227 -12.310 0.50 . A A . 64 CYS CA 1 1 8 9664 1 1 64 CYS CB C 6.576 6.164 -12.496 0.50 . A A . 64 CYS CB 1 1 8 9665 1 1 64 CYS H H 6.412 9.158 -12.324 1.40 . A A . 64 CYS H 1 1 8 9666 1 1 64 CYS HA H 4.575 6.957 -12.827 0.60 . A A . 64 CYS HA 1 1 8 9667 1 1 64 CYS HB2 H 6.141 5.186 -12.324 0.70 . A A . 64 CYS HB2 1 1 8 9668 1 1 64 CYS HB3 H 6.949 6.149 -13.517 0.70 . A A . 64 CYS HB3 1 1 8 9669 1 1 64 CYS N N 5.946 8.477 -12.885 0.60 . A A . 64 CYS N 1 1 8 9670 1 1 64 CYS O O 4.969 8.522 -10.342 1.10 . A A . 64 CYS O 1 1 8 9671 1 1 64 CYS SG S 7.927 6.375 -11.313 1.30 . A A . 64 CYS SG 1 1 8 9672 1 1 65 GLU C C 6.376 5.159 -8.218 1.00 . A A . 65 GLU C 1 1 8 9673 1 1 65 GLU CA C 5.558 6.353 -8.678 1.10 . A A . 65 GLU CA 1 1 8 9674 1 1 65 GLU CB C 4.230 6.403 -7.927 1.30 . A A . 65 GLU CB 1 1 8 9675 1 1 65 GLU CD C 5.730 6.677 -5.944 1.90 . A A . 65 GLU CD 1 1 8 9676 1 1 65 GLU CG C 4.376 7.051 -6.551 1.50 . A A . 65 GLU CG 1 1 8 9677 1 1 65 GLU H H 5.120 5.396 -10.538 1.60 . A A . 65 GLU H 1 1 8 9678 1 1 65 GLU HA H 6.144 7.231 -8.527 1.30 . A A . 65 GLU HA 1 1 8 9679 1 1 65 GLU HB2 H 3.501 6.950 -8.524 1.50 . A A . 65 GLU HB2 1 1 8 9680 1 1 65 GLU HB3 H 3.843 5.390 -7.817 1.30 . A A . 65 GLU HB3 1 1 8 9681 1 1 65 GLU HG2 H 4.309 8.136 -6.628 1.70 . A A . 65 GLU HG2 1 1 8 9682 1 1 65 GLU HG3 H 3.583 6.716 -5.882 1.70 . A A . 65 GLU HG3 1 1 8 9683 1 1 65 GLU N N 5.302 6.277 -10.104 1.00 . A A . 65 GLU N 1 1 8 9684 1 1 65 GLU O O 7.460 5.234 -7.652 1.10 . A A . 65 GLU O 1 1 8 9685 1 1 65 GLU OE1 O 5.907 5.519 -5.569 2.40 . A A . 65 GLU OE1 1 1 8 9686 1 1 65 GLU OE2 O 6.593 7.550 -5.851 1.90 . A A . 65 GLU OE2 1 1 8 9687 1 1 66 CYS C C 7.064 2.132 -7.959 0.90 . A A . 66 CYS C 1 1 8 9688 1 1 66 CYS CA C 5.713 2.851 -7.789 1.00 . A A . 66 CYS CA 1 1 8 9689 1 1 66 CYS CB C 4.493 2.063 -8.290 1.20 . A A . 66 CYS CB 1 1 8 9690 1 1 66 CYS H H 4.902 4.249 -9.102 1.10 . A A . 66 CYS H 1 1 8 9691 1 1 66 CYS HA H 5.591 3.136 -6.745 1.10 . A A . 66 CYS HA 1 1 8 9692 1 1 66 CYS HB2 H 4.790 1.196 -8.875 1.20 . A A . 66 CYS HB2 1 1 8 9693 1 1 66 CYS HB3 H 3.982 1.719 -7.406 1.50 . A A . 66 CYS HB3 1 1 8 9694 1 1 66 CYS N N 5.701 4.067 -8.542 1.00 . A A . 66 CYS N 1 1 8 9695 1 1 66 CYS O O 8.126 2.741 -7.924 1.10 . A A . 66 CYS O 1 1 8 9696 1 1 66 CYS SG S 3.248 2.990 -9.247 1.70 . A A . 66 CYS SG 1 1 8 9697 1 1 67 PRO C C 7.528 -0.187 -5.922 0.90 . A A . 67 PRO C 1 1 8 9698 1 1 67 PRO CA C 6.547 -0.115 -7.091 0.90 . A A . 67 PRO CA 1 1 8 9699 1 1 67 PRO CB C 6.443 -1.485 -7.765 0.90 . A A . 67 PRO CB 1 1 8 9700 1 1 67 PRO CD C 7.051 0.197 -9.460 0.80 . A A . 67 PRO CD 1 1 8 9701 1 1 67 PRO CG C 6.721 -1.282 -9.260 0.80 . A A . 67 PRO CG 1 1 8 9702 1 1 67 PRO HA H 5.574 0.193 -6.709 1.10 . A A . 67 PRO HA 1 1 8 9703 1 1 67 PRO HB2 H 7.175 -2.173 -7.337 0.80 . A A . 67 PRO HB2 1 1 8 9704 1 1 67 PRO HB3 H 5.442 -1.899 -7.627 1.00 . A A . 67 PRO HB3 1 1 8 9705 1 1 67 PRO HD2 H 8.043 0.347 -9.877 0.70 . A A . 67 PRO HD2 1 1 8 9706 1 1 67 PRO HD3 H 6.327 0.665 -10.126 0.90 . A A . 67 PRO HD3 1 1 8 9707 1 1 67 PRO HG2 H 7.534 -1.921 -9.602 0.80 . A A . 67 PRO HG2 1 1 8 9708 1 1 67 PRO HG3 H 5.839 -1.543 -9.840 1.00 . A A . 67 PRO HG3 1 1 8 9709 1 1 67 PRO N N 6.956 0.800 -8.143 0.80 . A A . 67 PRO N 1 1 8 9710 1 1 67 PRO O O 8.485 0.570 -5.820 1.30 . A A . 67 PRO O 1 1 8 9711 1 1 68 GLU C C 9.594 -1.652 -4.757 1.10 . A A . 68 GLU C 1 1 8 9712 1 1 68 GLU CA C 8.196 -1.728 -4.152 1.20 . A A . 68 GLU CA 1 1 8 9713 1 1 68 GLU CB C 7.806 -3.169 -3.801 1.50 . A A . 68 GLU CB 1 1 8 9714 1 1 68 GLU CD C 5.667 -3.794 -4.960 2.80 . A A . 68 GLU CD 1 1 8 9715 1 1 68 GLU CG C 7.192 -3.920 -4.985 2.10 . A A . 68 GLU CG 1 1 8 9716 1 1 68 GLU H H 6.260 -1.489 -5.026 1.60 . A A . 68 GLU H 1 1 8 9717 1 1 68 GLU HA H 8.197 -1.141 -3.255 1.30 . A A . 68 GLU HA 1 1 8 9718 1 1 68 GLU HB2 H 8.684 -3.709 -3.447 1.90 . A A . 68 GLU HB2 1 1 8 9719 1 1 68 GLU HB3 H 7.096 -3.160 -2.974 1.90 . A A . 68 GLU HB3 1 1 8 9720 1 1 68 GLU HG2 H 7.561 -3.524 -5.930 2.40 . A A . 68 GLU HG2 1 1 8 9721 1 1 68 GLU HG3 H 7.456 -4.977 -4.947 2.50 . A A . 68 GLU HG3 1 1 8 9722 1 1 68 GLU N N 7.204 -1.162 -5.051 1.20 . A A . 68 GLU N 1 1 8 9723 1 1 68 GLU O O 10.422 -0.799 -4.460 1.20 . A A . 68 GLU O 1 1 8 9724 1 1 68 GLU OE1 O 5.061 -4.165 -3.957 3.30 . A A . 68 GLU OE1 1 1 8 9725 1 1 68 GLU OE2 O 5.099 -3.327 -5.945 3.40 . A A . 68 GLU OE2 1 1 8 9726 1 1 69 GLY C C 9.473 -2.262 -8.015 1.20 . A A . 69 GLY C 1 1 8 9727 1 1 69 GLY CA C 10.463 -2.440 -6.863 1.50 . A A . 69 GLY CA 1 1 8 9728 1 1 69 GLY H H 9.056 -3.339 -5.431 1.40 . A A . 69 GLY H 1 1 8 9729 1 1 69 GLY HA2 H 11.083 -1.552 -6.739 1.70 . A A . 69 GLY HA2 1 1 8 9730 1 1 69 GLY HA3 H 11.086 -3.319 -7.029 1.80 . A A . 69 GLY HA3 1 1 8 9731 1 1 69 GLY N N 9.739 -2.642 -5.627 1.20 . A A . 69 GLY N 1 1 8 9732 1 1 69 GLY O O 8.865 -3.212 -8.493 1.40 . A A . 69 GLY O 1 1 8 9733 1 1 70 TYR C C 11.539 -1.300 -9.602 0.80 . A A . 70 TYR C 1 1 8 9734 1 1 70 TYR CA C 10.451 -0.312 -9.131 0.80 . A A . 70 TYR CA 1 1 8 9735 1 1 70 TYR CB C 11.049 0.772 -8.227 0.60 . A A . 70 TYR CB 1 1 8 9736 1 1 70 TYR CD1 C 12.062 2.354 -9.956 1.50 . A A . 70 TYR CD1 1 1 8 9737 1 1 70 TYR CD2 C 13.561 1.189 -8.347 1.30 . A A . 70 TYR CD2 1 1 8 9738 1 1 70 TYR CE1 C 13.201 3.008 -10.546 1.70 . A A . 70 TYR CE1 1 1 8 9739 1 1 70 TYR CE2 C 14.702 1.841 -8.934 1.40 . A A . 70 TYR CE2 1 1 8 9740 1 1 70 TYR CG C 12.237 1.444 -8.853 0.70 . A A . 70 TYR CG 1 1 8 9741 1 1 70 TYR CZ C 14.520 2.751 -10.034 1.10 . A A . 70 TYR CZ 1 1 8 9742 1 1 70 TYR H H 8.476 -0.525 -8.244 1.00 . A A . 70 TYR H 1 1 8 9743 1 1 70 TYR HA H 10.010 0.145 -10.016 0.90 . A A . 70 TYR HA 1 1 8 9744 1 1 70 TYR HB2 H 10.295 1.530 -8.011 0.60 . A A . 70 TYR HB2 1 1 8 9745 1 1 70 TYR HB3 H 11.352 0.347 -7.271 0.60 . A A . 70 TYR HB3 1 1 8 9746 1 1 70 TYR HD1 H 11.072 2.549 -10.341 2.30 . A A . 70 TYR HD1 1 1 8 9747 1 1 70 TYR HD2 H 13.699 0.506 -7.523 2.10 . A A . 70 TYR HD2 1 1 8 9748 1 1 70 TYR HE1 H 13.065 3.691 -11.371 2.50 . A A . 70 TYR HE1 1 1 8 9749 1 1 70 TYR HE2 H 15.692 1.649 -8.549 2.10 . A A . 70 TYR HE2 1 1 8 9750 1 1 70 TYR HH H 16.407 2.934 -10.328 1.50 . A A . 70 TYR HH 1 1 8 9751 1 1 70 TYR N N 9.354 -0.983 -8.425 0.90 . A A . 70 TYR N 1 1 8 9752 1 1 70 TYR O O 11.893 -2.248 -8.912 1.10 . A A . 70 TYR O 1 1 8 9753 1 1 70 TYR OH O 15.613 3.378 -10.598 1.30 . A A . 70 TYR OH 1 1 8 9754 1 1 71 ILE C C 11.173 -3.160 -11.664 0.90 . A A . 71 ILE C 1 1 8 9755 1 1 71 ILE CA C 12.263 -2.077 -11.778 1.00 . A A . 71 ILE CA 1 1 8 9756 1 1 71 ILE CB C 13.663 -2.641 -11.530 1.20 . A A . 71 ILE CB 1 1 8 9757 1 1 71 ILE CD1 C 16.109 -1.996 -11.412 1.80 . A A . 71 ILE CD1 1 1 8 9758 1 1 71 ILE CG1 C 14.736 -1.657 -11.995 1.40 . A A . 71 ILE CG1 1 1 8 9759 1 1 71 ILE CG2 C 13.866 -4.007 -12.187 1.80 . A A . 71 ILE CG2 1 1 8 9760 1 1 71 ILE H H 12.395 -0.093 -11.010 1.10 . A A . 71 ILE H 1 1 8 9761 1 1 71 ILE HA H 12.202 -1.617 -12.765 1.20 . A A . 71 ILE HA 1 1 8 9762 1 1 71 ILE HB H 13.768 -2.751 -10.452 1.70 . A A . 71 ILE HB 1 1 8 9763 1 1 71 ILE HD11 H 16.105 -2.989 -10.961 2.20 . A A . 71 ILE HD11 1 1 8 9764 1 1 71 ILE HD12 H 16.393 -1.278 -10.643 2.30 . A A . 71 ILE HD12 1 1 8 9765 1 1 71 ILE HD13 H 16.876 -1.982 -12.187 2.10 . A A . 71 ILE HD13 1 1 8 9766 1 1 71 ILE HG12 H 14.790 -1.664 -13.084 1.60 . A A . 71 ILE HG12 1 1 8 9767 1 1 71 ILE HG13 H 14.456 -0.645 -11.703 1.70 . A A . 71 ILE HG13 1 1 8 9768 1 1 71 ILE HG21 H 14.920 -4.178 -12.408 2.30 . A A . 71 ILE HG21 1 1 8 9769 1 1 71 ILE HG22 H 13.311 -4.075 -13.123 2.20 . A A . 71 ILE HG22 1 1 8 9770 1 1 71 ILE HG23 H 13.525 -4.809 -11.533 2.20 . A A . 71 ILE HG23 1 1 8 9771 1 1 71 ILE N N 12.041 -1.007 -10.818 0.90 . A A . 71 ILE N 1 1 8 9772 1 1 71 ILE O O 11.424 -4.354 -11.770 0.90 . A A . 71 ILE O 1 1 8 9773 1 1 72 LEU C C 9.188 -3.540 -13.607 0.80 . A A . 72 LEU C 1 1 8 9774 1 1 72 LEU CA C 9.019 -2.465 -12.535 0.80 . A A . 72 LEU CA 1 1 8 9775 1 1 72 LEU CB C 9.231 -1.067 -13.093 0.80 . A A . 72 LEU CB 1 1 8 9776 1 1 72 LEU CD1 C 7.250 -0.003 -14.050 0.70 . A A . 72 LEU CD1 1 1 8 9777 1 1 72 LEU CD2 C 9.275 0.096 -15.375 0.60 . A A . 72 LEU CD2 1 1 8 9778 1 1 72 LEU CG C 8.492 -0.780 -14.400 0.70 . A A . 72 LEU CG 1 1 8 9779 1 1 72 LEU H H 9.735 -2.238 -10.556 0.90 . A A . 72 LEU H 1 1 8 9780 1 1 72 LEU HA H 8.024 -2.544 -12.105 0.80 . A A . 72 LEU HA 1 1 8 9781 1 1 72 LEU HB2 H 8.880 -0.363 -12.339 1.00 . A A . 72 LEU HB2 1 1 8 9782 1 1 72 LEU HB3 H 10.288 -0.878 -13.205 1.00 . A A . 72 LEU HB3 1 1 8 9783 1 1 72 LEU HD11 H 6.874 0.534 -14.920 1.40 . A A . 72 LEU HD11 1 1 8 9784 1 1 72 LEU HD12 H 7.504 0.743 -13.295 1.20 . A A . 72 LEU HD12 1 1 8 9785 1 1 72 LEU HD13 H 6.473 -0.661 -13.666 1.20 . A A . 72 LEU HD13 1 1 8 9786 1 1 72 LEU HD21 H 10.343 0.080 -15.174 1.10 . A A . 72 LEU HD21 1 1 8 9787 1 1 72 LEU HD22 H 8.940 1.132 -15.275 1.10 . A A . 72 LEU HD22 1 1 8 9788 1 1 72 LEU HD23 H 9.082 -0.199 -16.404 1.20 . A A . 72 LEU HD23 1 1 8 9789 1 1 72 LEU HG H 8.214 -1.713 -14.888 0.70 . A A . 72 LEU HG 1 1 8 9790 1 1 72 LEU N N 9.948 -2.653 -11.438 0.80 . A A . 72 LEU N 1 1 8 9791 1 1 72 LEU O O 10.286 -3.966 -13.943 0.90 . A A . 72 LEU O 1 1 8 9792 1 1 73 ASP C C 6.459 -5.548 -15.042 1.20 . A A . 73 ASP C 1 1 8 9793 1 1 73 ASP CA C 7.918 -5.208 -14.793 1.00 . A A . 73 ASP CA 1 1 8 9794 1 1 73 ASP CB C 8.583 -6.297 -13.952 1.50 . A A . 73 ASP CB 1 1 8 9795 1 1 73 ASP CG C 8.921 -7.501 -14.832 2.00 . A A . 73 ASP CG 1 1 8 9796 1 1 73 ASP H H 7.196 -3.357 -14.009 0.80 . A A . 73 ASP H 1 1 8 9797 1 1 73 ASP HA H 8.407 -5.079 -15.739 1.20 . A A . 73 ASP HA 1 1 8 9798 1 1 73 ASP HB2 H 9.500 -5.926 -13.493 1.90 . A A . 73 ASP HB2 1 1 8 9799 1 1 73 ASP HB3 H 7.919 -6.620 -13.150 1.90 . A A . 73 ASP HB3 1 1 8 9800 1 1 73 ASP N N 8.005 -3.935 -14.110 0.90 . A A . 73 ASP N 1 1 8 9801 1 1 73 ASP O O 5.987 -5.763 -16.151 1.70 . A A . 73 ASP O 1 1 8 9802 1 1 73 ASP OD1 O 8.446 -7.551 -15.966 2.80 . A A . 73 ASP OD1 1 1 8 9803 1 1 73 ASP OD2 O 9.656 -8.375 -14.375 2.30 . A A . 73 ASP OD2 1 1 8 9804 1 1 74 ASP C C 3.403 -5.528 -14.506 1.40 . A A . 74 ASP C 1 1 8 9805 1 1 74 ASP CA C 4.543 -6.273 -13.782 1.80 . A A . 74 ASP CA 1 1 8 9806 1 1 74 ASP CB C 4.173 -6.440 -12.308 2.60 . A A . 74 ASP CB 1 1 8 9807 1 1 74 ASP CG C 3.409 -7.752 -12.115 3.20 . A A . 74 ASP CG 1 1 8 9808 1 1 74 ASP H H 6.552 -5.568 -13.181 1.40 . A A . 74 ASP H 1 1 8 9809 1 1 74 ASP HA H 4.694 -7.253 -14.228 2.30 . A A . 74 ASP HA 1 1 8 9810 1 1 74 ASP HB2 H 5.067 -6.456 -11.685 3.00 . A A . 74 ASP HB2 1 1 8 9811 1 1 74 ASP HB3 H 3.547 -5.614 -11.972 3.10 . A A . 74 ASP HB3 1 1 8 9812 1 1 74 ASP N N 5.830 -5.595 -13.868 1.30 . A A . 74 ASP N 1 1 8 9813 1 1 74 ASP O O 2.230 -5.818 -14.299 1.80 . A A . 74 ASP O 1 1 8 9814 1 1 74 ASP OD1 O 2.871 -8.266 -13.094 3.60 . A A . 74 ASP OD1 1 1 8 9815 1 1 74 ASP OD2 O 3.362 -8.244 -10.989 3.70 . A A . 74 ASP OD2 1 1 8 9816 1 1 75 GLY C C 3.555 -2.448 -16.545 1.10 . A A . 75 GLY C 1 1 8 9817 1 1 75 GLY CA C 3.076 -3.313 -15.388 1.10 . A A . 75 GLY CA 1 1 8 9818 1 1 75 GLY H H 4.656 -4.680 -15.858 1.30 . A A . 75 GLY H 1 1 8 9819 1 1 75 GLY HA2 H 2.022 -3.514 -15.478 1.50 . A A . 75 GLY HA2 1 1 8 9820 1 1 75 GLY HA3 H 3.269 -2.806 -14.438 1.30 . A A . 75 GLY HA3 1 1 8 9821 1 1 75 GLY N N 3.802 -4.566 -15.356 1.00 . A A . 75 GLY N 1 1 8 9822 1 1 75 GLY O O 3.137 -2.529 -17.693 1.40 . A A . 75 GLY O 1 1 8 9823 1 1 76 PHE C C 3.319 0.340 -15.224 0.80 . A A . 76 PHE C 1 1 8 9824 1 1 76 PHE CA C 4.316 -0.192 -16.270 0.90 . A A . 76 PHE CA 1 1 8 9825 1 1 76 PHE CB C 3.827 0.117 -17.687 1.00 . A A . 76 PHE CB 1 1 8 9826 1 1 76 PHE CD1 C 6.125 -0.497 -18.611 1.80 . A A . 76 PHE CD1 1 1 8 9827 1 1 76 PHE CD2 C 4.088 -1.155 -19.879 2.00 . A A . 76 PHE CD2 1 1 8 9828 1 1 76 PHE CE1 C 6.951 -1.107 -19.619 2.50 . A A . 76 PHE CE1 1 1 8 9829 1 1 76 PHE CE2 C 4.910 -1.766 -20.889 2.70 . A A . 76 PHE CE2 1 1 8 9830 1 1 76 PHE CG C 4.690 -0.518 -18.738 1.20 . A A . 76 PHE CG 1 1 8 9831 1 1 76 PHE CZ C 6.343 -1.740 -20.759 2.80 . A A . 76 PHE CZ 1 1 8 9832 1 1 76 PHE H H 4.750 -1.973 -15.179 1.00 . A A . 76 PHE H 1 1 8 9833 1 1 76 PHE HA H 5.292 0.258 -16.094 0.80 . A A . 76 PHE HA 1 1 8 9834 1 1 76 PHE HB2 H 2.802 -0.231 -17.811 1.60 . A A . 76 PHE HB2 1 1 8 9835 1 1 76 PHE HB3 H 3.825 1.195 -17.844 1.30 . A A . 76 PHE HB3 1 1 8 9836 1 1 76 PHE HD1 H 6.584 -0.026 -17.754 2.30 . A A . 76 PHE HD1 1 1 8 9837 1 1 76 PHE HD2 H 3.012 -1.179 -19.973 2.50 . A A . 76 PHE HD2 1 1 8 9838 1 1 76 PHE HE1 H 8.027 -1.090 -19.521 3.20 . A A . 76 PHE HE1 1 1 8 9839 1 1 76 PHE HE2 H 4.452 -2.242 -21.743 3.50 . A A . 76 PHE HE2 1 1 8 9840 1 1 76 PHE HZ H 6.961 -2.197 -21.517 3.50 . A A . 76 PHE HZ 1 1 8 9841 1 1 76 PHE N N 4.483 -1.622 -16.072 0.90 . A A . 76 PHE N 1 1 8 9842 1 1 76 PHE O O 2.446 1.149 -15.514 0.80 . A A . 76 PHE O 1 1 8 9843 1 1 77 ILE C C 1.422 0.442 -12.990 0.70 . A A . 77 ILE C 1 1 8 9844 1 1 77 ILE CA C 2.342 -0.735 -13.348 0.80 . A A . 77 ILE CA 1 1 8 9845 1 1 77 ILE CB C 2.750 -1.643 -12.165 0.90 . A A . 77 ILE CB 1 1 8 9846 1 1 77 ILE CD1 C 2.288 -2.446 -9.809 1.20 . A A . 77 ILE CD1 1 1 8 9847 1 1 77 ILE CG1 C 1.798 -1.599 -10.983 1.10 . A A . 77 ILE CG1 1 1 8 9848 1 1 77 ILE CG2 C 4.144 -1.374 -11.628 0.90 . A A . 77 ILE CG2 1 1 8 9849 1 1 77 ILE H H 4.391 -0.644 -13.863 0.80 . A A . 77 ILE H 1 1 8 9850 1 1 77 ILE HA H 1.905 -1.397 -14.093 0.80 . A A . 77 ILE HA 1 1 8 9851 1 1 77 ILE HB H 2.739 -2.670 -12.529 0.90 . A A . 77 ILE HB 1 1 8 9852 1 1 77 ILE HD11 H 3.074 -1.928 -9.260 1.50 . A A . 77 ILE HD11 1 1 8 9853 1 1 77 ILE HD12 H 2.689 -3.398 -10.155 1.60 . A A . 77 ILE HD12 1 1 8 9854 1 1 77 ILE HD13 H 1.473 -2.653 -9.115 1.70 . A A . 77 ILE HD13 1 1 8 9855 1 1 77 ILE HG12 H 1.716 -0.556 -10.676 1.10 . A A . 77 ILE HG12 1 1 8 9856 1 1 77 ILE HG13 H 0.813 -1.937 -11.307 1.30 . A A . 77 ILE HG13 1 1 8 9857 1 1 77 ILE HG21 H 4.453 -2.247 -11.063 1.10 . A A . 77 ILE HG21 1 1 8 9858 1 1 77 ILE HG22 H 4.116 -0.525 -10.946 1.40 . A A . 77 ILE HG22 1 1 8 9859 1 1 77 ILE HG23 H 4.884 -1.206 -12.406 1.40 . A A . 77 ILE HG23 1 1 8 9860 1 1 77 ILE N N 3.510 -0.195 -14.000 0.80 . A A . 77 ILE N 1 1 8 9861 1 1 77 ILE O O 1.745 1.595 -13.238 0.80 . A A . 77 ILE O 1 1 8 9862 1 1 78 CYS C C -1.560 1.337 -11.336 0.70 . A A . 78 CYS C 1 1 8 9863 1 1 78 CYS CA C -0.154 0.747 -11.172 0.50 . A A . 78 CYS CA 1 1 8 9864 1 1 78 CYS CB C 0.774 1.902 -10.769 0.40 . A A . 78 CYS CB 1 1 8 9865 1 1 78 CYS H H 0.013 -0.867 -12.571 0.50 . A A . 78 CYS H 1 1 8 9866 1 1 78 CYS HA H -0.178 -0.016 -10.395 0.60 . A A . 78 CYS HA 1 1 8 9867 1 1 78 CYS HB2 H 0.606 2.660 -11.524 0.70 . A A . 78 CYS HB2 1 1 8 9868 1 1 78 CYS HB3 H 0.415 2.310 -9.829 0.70 . A A . 78 CYS HB3 1 1 8 9869 1 1 78 CYS N N 0.270 0.082 -12.404 0.50 . A A . 78 CYS N 1 1 8 9870 1 1 78 CYS O O -1.854 2.422 -10.847 1.70 . A A . 78 CYS O 1 1 8 9871 1 1 78 CYS SG S 2.573 1.627 -10.612 1.00 . A A . 78 CYS SG 1 1 8 9872 1 1 79 THR C C -3.280 2.480 -13.290 0.90 . A A . 79 THR C 1 1 8 9873 1 1 79 THR CA C -2.775 1.030 -13.370 0.70 . A A . 79 THR CA 1 1 8 9874 1 1 79 THR CB C -3.812 0.070 -13.968 0.90 . A A . 79 THR CB 1 1 8 9875 1 1 79 THR CG2 C -5.202 0.688 -14.129 1.60 . A A . 79 THR CG2 1 1 8 9876 1 1 79 THR H H -2.777 -0.276 -11.663 1.30 . A A . 79 THR H 1 1 8 9877 1 1 79 THR HA H -1.858 1.011 -13.958 0.80 . A A . 79 THR HA 1 1 8 9878 1 1 79 THR HB H -3.889 -0.809 -13.327 0.70 . A A . 79 THR HB 1 1 8 9879 1 1 79 THR HG1 H -3.976 -0.054 -15.864 2.00 . A A . 79 THR HG1 1 1 8 9880 1 1 79 THR HG21 H -5.153 1.619 -14.693 2.00 . A A . 79 THR HG21 1 1 8 9881 1 1 79 THR HG22 H -5.646 0.905 -13.158 2.20 . A A . 79 THR HG22 1 1 8 9882 1 1 79 THR HG23 H -5.868 0.007 -14.660 2.10 . A A . 79 THR HG23 1 1 8 9883 1 1 79 THR N N -2.403 0.568 -12.047 0.70 . A A . 79 THR N 1 1 8 9884 1 1 79 THR O O -4.427 2.757 -12.960 1.50 . A A . 79 THR O 1 1 8 9885 1 1 79 THR OG1 O -3.359 -0.377 -15.220 1.70 . A A . 79 THR OG1 1 1 8 9886 1 1 80 ASP C C -3.161 3.407 -15.927 1.10 . A A . 80 ASP C 1 1 8 9887 1 1 80 ASP CA C -2.401 4.156 -14.826 1.20 . A A . 80 ASP CA 1 1 8 9888 1 1 80 ASP CB C -0.996 4.489 -15.302 1.70 . A A . 80 ASP CB 1 1 8 9889 1 1 80 ASP CG C -1.075 5.700 -16.237 2.40 . A A . 80 ASP CG 1 1 8 9890 1 1 80 ASP H H -1.602 3.599 -12.943 0.80 . A A . 80 ASP H 1 1 8 9891 1 1 80 ASP HA H -2.904 5.088 -14.586 1.50 . A A . 80 ASP HA 1 1 8 9892 1 1 80 ASP HB2 H -0.362 4.730 -14.444 2.10 . A A . 80 ASP HB2 1 1 8 9893 1 1 80 ASP HB3 H -0.555 3.648 -15.840 1.80 . A A . 80 ASP HB3 1 1 8 9894 1 1 80 ASP N N -2.329 3.385 -13.596 0.80 . A A . 80 ASP N 1 1 8 9895 1 1 80 ASP O O -3.422 2.214 -15.836 1.90 . A A . 80 ASP O 1 1 8 9896 1 1 80 ASP OD1 O -1.520 6.758 -15.794 2.90 . A A . 80 ASP OD1 1 1 8 9897 1 1 80 ASP OD2 O -0.691 5.570 -17.398 2.90 . A A . 80 ASP OD2 1 1 8 9898 1 1 81 ILE C C -5.861 3.695 -16.769 1.60 . A A . 81 ILE C 1 1 8 9899 1 1 81 ILE CA C -4.806 4.760 -17.089 1.30 . A A . 81 ILE CA 1 1 8 9900 1 1 81 ILE CB C -5.025 5.308 -18.506 1.70 . A A . 81 ILE CB 1 1 8 9901 1 1 81 ILE CD1 C -3.215 7.061 -18.299 3.00 . A A . 81 ILE CD1 1 1 8 9902 1 1 81 ILE CG1 C -3.731 5.866 -19.100 2.50 . A A . 81 ILE CG1 1 1 8 9903 1 1 81 ILE CG2 C -6.105 6.391 -18.530 1.90 . A A . 81 ILE CG2 1 1 8 9904 1 1 81 ILE H H -2.732 4.550 -17.550 1.50 . A A . 81 ILE H 1 1 8 9905 1 1 81 ILE HA H -4.862 5.573 -16.366 1.50 . A A . 81 ILE HA 1 1 8 9906 1 1 81 ILE HB H -5.361 4.486 -19.138 2.20 . A A . 81 ILE HB 1 1 8 9907 1 1 81 ILE HD11 H -3.662 7.990 -18.653 3.20 . A A . 81 ILE HD11 1 1 8 9908 1 1 81 ILE HD12 H -2.134 7.152 -18.388 3.40 . A A . 81 ILE HD12 1 1 8 9909 1 1 81 ILE HD13 H -3.460 6.957 -17.242 3.30 . A A . 81 ILE HD13 1 1 8 9910 1 1 81 ILE HG12 H -2.973 5.084 -19.126 2.70 . A A . 81 ILE HG12 1 1 8 9911 1 1 81 ILE HG13 H -3.905 6.167 -20.133 3.00 . A A . 81 ILE HG13 1 1 8 9912 1 1 81 ILE HG21 H -7.059 6.016 -18.162 2.20 . A A . 81 ILE HG21 1 1 8 9913 1 1 81 ILE HG22 H -6.262 6.751 -19.547 2.30 . A A . 81 ILE HG22 1 1 8 9914 1 1 81 ILE HG23 H -5.815 7.244 -17.914 2.30 . A A . 81 ILE HG23 1 1 8 9915 1 1 81 ILE N N -3.469 4.199 -16.974 1.00 . A A . 81 ILE N 1 1 8 9916 1 1 81 ILE O O -5.572 2.511 -16.649 2.40 . A A . 81 ILE O 1 1 8 9917 1 1 82 ASP C C -8.156 3.989 -18.841 2.70 . A A . 82 ASP C 1 1 8 9918 1 1 82 ASP CA C -8.177 3.552 -17.369 2.60 . A A . 82 ASP CA 1 1 8 9919 1 1 82 ASP CB C -9.526 3.866 -16.712 3.50 . A A . 82 ASP CB 1 1 8 9920 1 1 82 ASP CG C -9.603 5.330 -16.263 3.90 . A A . 82 ASP CG 1 1 8 9921 1 1 82 ASP H H -7.278 5.007 -16.080 2.10 . A A . 82 ASP H 1 1 8 9922 1 1 82 ASP HA H -7.970 2.482 -17.316 3.00 . A A . 82 ASP HA 1 1 8 9923 1 1 82 ASP HB2 H -10.341 3.675 -17.409 3.90 . A A . 82 ASP HB2 1 1 8 9924 1 1 82 ASP HB3 H -9.680 3.225 -15.844 3.90 . A A . 82 ASP HB3 1 1 8 9925 1 1 82 ASP N N -7.101 4.202 -16.646 1.90 . A A . 82 ASP N 1 1 8 9926 1 1 82 ASP O O -7.429 3.441 -19.661 3.30 . A A . 82 ASP O 1 1 8 9927 1 1 82 ASP OD1 O -8.841 6.148 -16.776 4.20 . A A . 82 ASP OD1 1 1 8 9928 1 1 82 ASP OD2 O -10.428 5.634 -15.403 4.50 . A A . 82 ASP OD2 1 1 8 9929 1 1 83 GLU C C -8.677 6.821 -20.711 1.00 . A A . 83 GLU C 1 1 8 9930 1 1 83 GLU CA C -9.169 5.387 -20.508 1.00 . A A . 83 GLU CA 1 1 8 9931 1 1 83 GLU CB C -10.644 5.276 -20.898 1.00 . A A . 83 GLU CB 1 1 8 9932 1 1 83 GLU CD C -11.276 3.110 -21.982 1.00 . A A . 83 GLU CD 1 1 8 9933 1 1 83 GLU CG C -10.832 4.553 -22.232 1.00 . A A . 83 GLU CG 1 1 8 9934 1 1 83 GLU H H -9.487 5.479 -18.390 1.00 . A A . 83 GLU H 1 1 8 9935 1 1 83 GLU HA H -8.553 4.708 -21.097 1.00 . A A . 83 GLU HA 1 1 8 9936 1 1 83 GLU HB2 H -11.190 4.748 -20.116 1.00 . A A . 83 GLU HB2 1 1 8 9937 1 1 83 GLU HB3 H -11.080 6.274 -20.960 1.00 . A A . 83 GLU HB3 1 1 8 9938 1 1 83 GLU HG2 H -11.587 5.055 -22.838 1.00 . A A . 83 GLU HG2 1 1 8 9939 1 1 83 GLU HG3 H -9.902 4.544 -22.801 1.00 . A A . 83 GLU HG3 1 1 8 9940 1 1 83 GLU N N -8.996 5.002 -19.120 1.00 . A A . 83 GLU N 1 1 8 9941 1 1 83 GLU O O -9.129 7.706 -19.986 1.00 . A A . 83 GLU O 1 1 8 9942 1 1 83 GLU OXT O -7.848 7.037 -21.595 1.00 . A A . 83 GLU OXT 1 1 8 9943 1 1 83 GLU OE1 O -12.456 2.899 -21.709 1.00 . A A . 83 GLU OE1 1 1 8 9944 1 1 83 GLU OE2 O -10.437 2.215 -22.065 1.00 . A A . 83 GLU OE2 1 1 8 9945 2 2 1 NAG C1 C -14.647 -1.184 11.579 1.00 . B A . 121 NAG C1 1 1 8 9946 2 2 1 NAG C2 C -15.342 -0.547 10.375 1.00 . B A . 121 NAG C2 1 1 8 9947 2 2 1 NAG C3 C -16.758 -0.096 10.721 1.00 . B A . 121 NAG C3 1 1 8 9948 2 2 1 NAG C4 C -17.278 -0.782 11.985 1.00 . B A . 121 NAG C4 1 1 8 9949 2 2 1 NAG C5 C -16.317 -0.648 13.174 1.00 . B A . 121 NAG C5 1 1 8 9950 2 2 1 NAG C6 C -16.371 -1.884 14.073 1.00 . B A . 121 NAG C6 1 1 8 9951 2 2 1 NAG C7 C -13.366 0.417 9.397 1.00 . B A . 121 NAG C7 1 1 8 9952 2 2 1 NAG C8 C -13.387 -0.452 8.137 1.00 . B A . 121 NAG C8 1 1 8 9953 2 2 1 NAG H1 H -13.564 -1.195 11.452 1.00 . B A . 121 NAG H1 1 1 8 9954 2 2 1 NAG H2 H -15.361 -1.240 9.534 1.00 . B A . 121 NAG H2 1 1 8 9955 2 2 1 NAG H3 H -16.769 0.984 10.862 1.00 . B A . 121 NAG H3 1 1 8 9956 2 2 1 NAG H4 H -17.443 -1.839 11.777 1.00 . B A . 121 NAG H4 1 1 8 9957 2 2 1 NAG H5 H -16.608 0.223 13.761 1.00 . B A . 121 NAG H5 1 1 8 9958 2 2 1 NAG H61 H -15.389 -2.102 14.493 1.00 . B A . 121 NAG H61 1 1 8 9959 2 2 1 NAG H62 H -16.699 -2.759 13.511 1.00 . B A . 121 NAG H62 1 1 8 9960 2 2 1 NAG H81 H -13.755 -1.450 8.376 1.00 . B A . 121 NAG H81 1 1 8 9961 2 2 1 NAG H82 H -14.036 -0.003 7.385 1.00 . B A . 121 NAG H82 1 1 8 9962 2 2 1 NAG H83 H -12.378 -0.542 7.734 1.00 . B A . 121 NAG H83 1 1 8 9963 2 2 1 NAG HN2 H -14.956 1.531 10.029 1.00 . B A . 121 NAG HN2 1 1 8 9964 2 2 1 NAG HO3 H -18.250 -1.012 9.963 1.00 . B A . 121 NAG HO3 1 1 8 9965 2 2 1 NAG HO4 H -19.106 -0.400 11.602 1.00 . B A . 121 NAG HO4 1 1 8 9966 2 2 1 NAG HO6 H -18.076 -2.118 14.895 1.00 . B A . 121 NAG HO6 1 1 8 9967 2 2 1 NAG N2 N -14.584 0.608 9.932 1.00 . B A . 121 NAG N2 1 1 8 9968 2 2 1 NAG O3 O -17.616 -0.382 9.646 1.00 . B A . 121 NAG O3 1 1 8 9969 2 2 1 NAG O4 O -18.523 -0.230 12.330 1.00 . B A . 121 NAG O4 1 1 8 9970 2 2 1 NAG O5 O -14.987 -0.462 12.740 1.00 . B A . 121 NAG O5 1 1 8 9971 2 2 1 NAG O6 O -17.267 -1.686 15.136 1.00 . B A . 121 NAG O6 1 1 8 9972 2 2 1 NAG O7 O -12.323 0.878 9.845 1.00 . B A . 121 NAG O7 1 1 8 9973 3 2 1 NAG C1 C -7.341 -1.358 -5.185 1.00 . C A . 148 NAG C1 1 1 8 9974 3 2 1 NAG C2 C -7.130 -1.169 -3.682 1.00 . C A . 148 NAG C2 1 1 8 9975 3 2 1 NAG C3 C -8.380 -1.527 -2.878 1.00 . C A . 148 NAG C3 1 1 8 9976 3 2 1 NAG C4 C -8.931 -2.896 -3.279 1.00 . C A . 148 NAG C4 1 1 8 9977 3 2 1 NAG C5 C -8.807 -3.138 -4.784 1.00 . C A . 148 NAG C5 1 1 8 9978 3 2 1 NAG C6 C -10.057 -3.808 -5.356 1.00 . C A . 148 NAG C6 1 1 8 9979 3 2 1 NAG C7 C -4.788 -1.509 -3.260 1.00 . C A . 148 NAG C7 1 1 8 9980 3 2 1 NAG C8 C -4.424 -0.747 -1.982 1.00 . C A . 148 NAG C8 1 1 8 9981 3 2 1 NAG H1 H -6.574 -2.006 -5.609 1.00 . C A . 148 NAG H1 1 1 8 9982 3 2 1 NAG H2 H -6.824 -0.145 -3.467 1.00 . C A . 148 NAG H2 1 1 8 9983 3 2 1 NAG H3 H -8.142 -1.528 -1.815 1.00 . C A . 148 NAG H3 1 1 8 9984 3 2 1 NAG H4 H -9.978 -2.967 -2.985 1.00 . C A . 148 NAG H4 1 1 8 9985 3 2 1 NAG H5 H -7.940 -3.771 -4.976 1.00 . C A . 148 NAG H5 1 1 8 9986 3 2 1 NAG H61 H -10.318 -3.380 -6.324 1.00 . C A . 148 NAG H61 1 1 8 9987 3 2 1 NAG H62 H -10.908 -3.676 -4.688 1.00 . C A . 148 NAG H62 1 1 8 9988 3 2 1 NAG H81 H -5.086 -1.021 -1.165 1.00 . C A . 148 NAG H81 1 1 8 9989 3 2 1 NAG H82 H -3.397 -0.963 -1.681 1.00 . C A . 148 NAG H82 1 1 8 9990 3 2 1 NAG H83 H -4.514 0.326 -2.153 1.00 . C A . 148 NAG H83 1 1 8 9991 3 2 1 NAG HN2 H -6.202 -2.949 -2.929 1.00 . C A . 148 NAG HN2 1 1 8 9992 3 2 1 NAG HO3 H -10.159 -1.007 -3.330 1.00 . C A . 148 NAG HO3 1 1 8 9993 3 2 1 NAG HO4 H -8.684 -4.020 -1.758 1.00 . C A . 148 NAG HO4 1 1 8 9994 3 2 1 NAG HO6 H -9.841 -5.343 -6.466 1.00 . C A . 148 NAG HO6 1 1 8 9995 3 2 1 NAG N2 N -6.035 -2.013 -3.240 1.00 . C A . 148 NAG N2 1 1 8 9996 3 2 1 NAG O3 O -9.367 -0.548 -3.082 1.00 . C A . 148 NAG O3 1 1 8 9997 3 2 1 NAG O4 O -8.237 -3.901 -2.585 1.00 . C A . 148 NAG O4 1 1 8 9998 3 2 1 NAG O5 O -8.613 -1.905 -5.433 1.00 . C A . 148 NAG O5 1 1 8 9999 3 2 1 NAG O6 O -9.846 -5.185 -5.531 1.00 . C A . 148 NAG O6 1 1 8 10000 3 2 1 NAG O7 O -3.998 -1.626 -4.188 1.00 . C A . 148 NAG O7 1 1 9 10001 1 1 1 HIS C C 1.627 -2.300 27.355 1.00 . A A . 1 HIS C 1 1 9 10002 1 1 1 HIS CA C 1.238 -3.770 27.168 1.00 . A A . 1 HIS CA 1 1 9 10003 1 1 1 HIS CB C 2.214 -4.435 26.195 1.00 . A A . 1 HIS CB 1 1 9 10004 1 1 1 HIS CD2 C 1.209 -6.661 26.914 1.00 . A A . 1 HIS CD2 1 1 9 10005 1 1 1 HIS CE1 C 2.470 -8.085 25.733 1.00 . A A . 1 HIS CE1 1 1 9 10006 1 1 1 HIS CG C 2.088 -5.932 26.204 1.00 . A A . 1 HIS CG 1 1 9 10007 1 1 1 HIS H1 H -0.396 -4.897 26.641 1.00 . A A . 1 HIS H1 1 1 9 10008 1 1 1 HIS H2 H -0.774 -3.419 27.386 1.00 . A A . 1 HIS H2 1 1 9 10009 1 1 1 HIS H3 H -0.236 -3.445 25.775 1.00 . A A . 1 HIS H3 1 1 9 10010 1 1 1 HIS HA H 1.297 -4.261 28.139 1.00 . A A . 1 HIS HA 1 1 9 10011 1 1 1 HIS HB2 H 2.034 -4.066 25.185 1.00 . A A . 1 HIS HB2 1 1 9 10012 1 1 1 HIS HB3 H 3.236 -4.159 26.453 1.00 . A A . 1 HIS HB3 1 1 9 10013 1 1 1 HIS HD2 H 0.463 -6.272 27.582 1.00 . A A . 1 HIS HD2 1 1 9 10014 1 1 1 HIS HE1 H 2.887 -8.997 25.315 1.00 . A A . 1 HIS HE1 1 1 9 10015 1 1 1 HIS HE2 H 0.953 -8.844 27.007 1.00 . A A . 1 HIS HE2 1 1 9 10016 1 1 1 HIS N N -0.141 -3.891 26.710 1.00 . A A . 1 HIS N 1 1 9 10017 1 1 1 HIS ND1 N 2.924 -6.858 25.422 1.00 . A A . 1 HIS ND1 1 1 9 10018 1 1 1 HIS NE2 N 1.455 -8.076 26.609 1.00 . A A . 1 HIS NE2 1 1 9 10019 1 1 1 HIS O O 1.542 -1.742 28.443 1.00 . A A . 1 HIS O 1 1 9 10020 1 1 2 MET C C 1.992 0.584 25.289 1.00 . A A . 2 MET C 1 1 9 10021 1 1 2 MET CA C 2.630 -0.387 26.301 1.00 . A A . 2 MET CA 1 1 9 10022 1 1 2 MET CB C 4.129 -0.477 26.020 1.00 . A A . 2 MET CB 1 1 9 10023 1 1 2 MET CE C 7.150 -2.221 25.552 1.00 . A A . 2 MET CE 1 1 9 10024 1 1 2 MET CG C 4.778 -1.654 26.750 1.00 . A A . 2 MET CG 1 1 9 10025 1 1 2 MET H H 2.019 -2.209 25.350 1.00 . A A . 2 MET H 1 1 9 10026 1 1 2 MET HA H 2.441 -0.029 27.313 1.00 . A A . 2 MET HA 1 1 9 10027 1 1 2 MET HB2 H 4.279 -0.585 24.945 1.00 . A A . 2 MET HB2 1 1 9 10028 1 1 2 MET HB3 H 4.615 0.453 26.314 1.00 . A A . 2 MET HB3 1 1 9 10029 1 1 2 MET HE1 H 8.109 -1.803 25.247 1.00 . A A . 2 MET HE1 1 1 9 10030 1 1 2 MET HE2 H 6.444 -2.116 24.728 1.00 . A A . 2 MET HE2 1 1 9 10031 1 1 2 MET HE3 H 7.283 -3.282 25.765 1.00 . A A . 2 MET HE3 1 1 9 10032 1 1 2 MET HG2 H 4.297 -1.808 27.715 1.00 . A A . 2 MET HG2 1 1 9 10033 1 1 2 MET HG3 H 4.649 -2.571 26.175 1.00 . A A . 2 MET HG3 1 1 9 10034 1 1 2 MET N N 2.060 -1.720 26.222 1.00 . A A . 2 MET N 1 1 9 10035 1 1 2 MET O O 2.595 1.585 24.919 1.00 . A A . 2 MET O 1 1 9 10036 1 1 2 MET SD S 6.535 -1.365 27.011 1.00 . A A . 2 MET SD 1 1 9 10037 1 1 3 GLU C C -0.917 1.313 23.437 1.00 . A A . 3 GLU C 1 1 9 10038 1 1 3 GLU CA C 0.420 0.564 23.485 1.00 . A A . 3 GLU CA 1 1 9 10039 1 1 3 GLU CB C 0.343 -0.717 22.650 1.00 . A A . 3 GLU CB 1 1 9 10040 1 1 3 GLU CD C 2.709 -1.352 23.216 1.00 . A A . 3 GLU CD 1 1 9 10041 1 1 3 GLU CG C 1.255 -1.826 23.176 1.00 . A A . 3 GLU CG 1 1 9 10042 1 1 3 GLU H H 0.103 -0.199 25.469 1.00 . A A . 3 GLU H 1 1 9 10043 1 1 3 GLU HA H 1.209 1.217 23.112 1.00 . A A . 3 GLU HA 1 1 9 10044 1 1 3 GLU HB2 H -0.688 -1.073 22.642 1.00 . A A . 3 GLU HB2 1 1 9 10045 1 1 3 GLU HB3 H 0.616 -0.496 21.617 1.00 . A A . 3 GLU HB3 1 1 9 10046 1 1 3 GLU HG2 H 0.948 -2.126 24.176 1.00 . A A . 3 GLU HG2 1 1 9 10047 1 1 3 GLU HG3 H 1.196 -2.705 22.537 1.00 . A A . 3 GLU HG3 1 1 9 10048 1 1 3 GLU N N 0.759 0.249 24.861 1.00 . A A . 3 GLU N 1 1 9 10049 1 1 3 GLU O O -1.729 1.253 24.353 1.00 . A A . 3 GLU O 1 1 9 10050 1 1 3 GLU OE1 O 2.954 -0.179 22.939 1.00 . A A . 3 GLU OE1 1 1 9 10051 1 1 3 GLU OE2 O 3.581 -2.165 23.520 1.00 . A A . 3 GLU OE2 1 1 9 10052 1 1 4 PRO C C -3.382 1.427 21.505 1.00 . A A . 4 PRO C 1 1 9 10053 1 1 4 PRO CA C -2.391 2.538 21.879 1.00 . A A . 4 PRO CA 1 1 9 10054 1 1 4 PRO CB C -2.103 3.369 20.631 1.00 . A A . 4 PRO CB 1 1 9 10055 1 1 4 PRO CD C -0.002 2.316 21.390 1.00 . A A . 4 PRO CD 1 1 9 10056 1 1 4 PRO CG C -0.638 3.118 20.258 1.00 . A A . 4 PRO CG 1 1 9 10057 1 1 4 PRO HA H -2.820 3.153 22.670 1.00 . A A . 4 PRO HA 1 1 9 10058 1 1 4 PRO HB2 H -2.762 3.076 19.814 1.00 . A A . 4 PRO HB2 1 1 9 10059 1 1 4 PRO HB3 H -2.272 4.428 20.828 1.00 . A A . 4 PRO HB3 1 1 9 10060 1 1 4 PRO HD2 H 0.431 1.388 21.017 1.00 . A A . 4 PRO HD2 1 1 9 10061 1 1 4 PRO HD3 H 0.773 2.886 21.902 1.00 . A A . 4 PRO HD3 1 1 9 10062 1 1 4 PRO HG2 H -0.586 2.549 19.331 1.00 . A A . 4 PRO HG2 1 1 9 10063 1 1 4 PRO HG3 H -0.113 4.060 20.121 1.00 . A A . 4 PRO HG3 1 1 9 10064 1 1 4 PRO N N -1.091 2.025 22.302 1.00 . A A . 4 PRO N 1 1 9 10065 1 1 4 PRO O O -4.225 1.576 20.629 1.00 . A A . 4 PRO O 1 1 9 10066 1 1 5 VAL C C -4.642 -1.207 20.940 1.00 . A A . 5 VAL C 1 1 9 10067 1 1 5 VAL CA C -3.266 -0.982 21.589 1.00 . A A . 5 VAL CA 1 1 9 10068 1 1 5 VAL CB C -2.981 -2.067 22.638 1.00 . A A . 5 VAL CB 1 1 9 10069 1 1 5 VAL CG1 C -4.266 -2.635 23.248 1.00 . A A . 5 VAL CG1 1 1 9 10070 1 1 5 VAL CG2 C -2.118 -3.184 22.052 1.00 . A A . 5 VAL CG2 1 1 9 10071 1 1 5 VAL H H -2.787 0.429 23.132 1.00 . A A . 5 VAL H 1 1 9 10072 1 1 5 VAL HA H -2.487 -0.960 20.819 1.00 . A A . 5 VAL HA 1 1 9 10073 1 1 5 VAL HB H -2.423 -1.604 23.451 1.00 . A A . 5 VAL HB 1 1 9 10074 1 1 5 VAL HG11 H -4.587 -3.532 22.717 1.00 . A A . 5 VAL HG11 1 1 9 10075 1 1 5 VAL HG12 H -4.116 -2.900 24.295 1.00 . A A . 5 VAL HG12 1 1 9 10076 1 1 5 VAL HG13 H -5.075 -1.907 23.199 1.00 . A A . 5 VAL HG13 1 1 9 10077 1 1 5 VAL HG21 H -1.565 -2.832 21.181 1.00 . A A . 5 VAL HG21 1 1 9 10078 1 1 5 VAL HG22 H -1.398 -3.545 22.787 1.00 . A A . 5 VAL HG22 1 1 9 10079 1 1 5 VAL HG23 H -2.736 -4.027 21.745 1.00 . A A . 5 VAL HG23 1 1 9 10080 1 1 5 VAL N N -3.208 0.314 22.235 1.00 . A A . 5 VAL N 1 1 9 10081 1 1 5 VAL O O -5.507 -0.340 20.913 1.00 . A A . 5 VAL O 1 1 9 10082 1 1 6 ASP C C -7.042 -2.216 19.530 1.00 . A A . 6 ASP C 1 1 9 10083 1 1 6 ASP CA C -5.598 -2.648 19.261 1.00 . A A . 6 ASP CA 1 1 9 10084 1 1 6 ASP CB C -5.487 -4.122 18.824 1.00 . A A . 6 ASP CB 1 1 9 10085 1 1 6 ASP CG C -6.658 -4.972 19.333 1.00 . A A . 6 ASP CG 1 1 9 10086 1 1 6 ASP H H -3.980 -3.060 20.572 1.00 . A A . 6 ASP H 1 1 9 10087 1 1 6 ASP HA H -5.184 -2.004 18.492 1.00 . A A . 6 ASP HA 1 1 9 10088 1 1 6 ASP HB2 H -5.429 -4.208 17.741 1.00 . A A . 6 ASP HB2 1 1 9 10089 1 1 6 ASP HB3 H -4.564 -4.564 19.197 1.00 . A A . 6 ASP HB3 1 1 9 10090 1 1 6 ASP N N -4.755 -2.447 20.427 1.00 . A A . 6 ASP N 1 1 9 10091 1 1 6 ASP O O -7.536 -2.270 20.650 1.00 . A A . 6 ASP O 1 1 9 10092 1 1 6 ASP OD1 O -6.945 -4.919 20.528 1.00 . A A . 6 ASP OD1 1 1 9 10093 1 1 6 ASP OD2 O -7.266 -5.675 18.528 1.00 . A A . 6 ASP OD2 1 1 9 10094 1 1 7 PRO C C -6.719 -2.770 16.338 1.00 . A A . 7 PRO C 1 1 9 10095 1 1 7 PRO CA C -7.940 -2.616 17.255 1.00 . A A . 7 PRO CA 1 1 9 10096 1 1 7 PRO CB C -9.035 -1.884 16.474 1.00 . A A . 7 PRO CB 1 1 9 10097 1 1 7 PRO CD C -8.329 -0.476 18.372 1.00 . A A . 7 PRO CD 1 1 9 10098 1 1 7 PRO CG C -9.235 -0.515 17.139 1.00 . A A . 7 PRO CG 1 1 9 10099 1 1 7 PRO HA H -8.278 -3.602 17.573 1.00 . A A . 7 PRO HA 1 1 9 10100 1 1 7 PRO HB2 H -8.742 -1.763 15.431 1.00 . A A . 7 PRO HB2 1 1 9 10101 1 1 7 PRO HB3 H -9.962 -2.456 16.491 1.00 . A A . 7 PRO HB3 1 1 9 10102 1 1 7 PRO HD2 H -7.573 0.306 18.286 1.00 . A A . 7 PRO HD2 1 1 9 10103 1 1 7 PRO HD3 H -8.904 -0.306 19.283 1.00 . A A . 7 PRO HD3 1 1 9 10104 1 1 7 PRO HG2 H -8.974 0.286 16.448 1.00 . A A . 7 PRO HG2 1 1 9 10105 1 1 7 PRO HG3 H -10.277 -0.378 17.426 1.00 . A A . 7 PRO HG3 1 1 9 10106 1 1 7 PRO N N -7.691 -1.781 18.425 1.00 . A A . 7 PRO N 1 1 9 10107 1 1 7 PRO O O -6.404 -3.848 15.852 1.00 . A A . 7 PRO O 1 1 9 10108 1 1 8 CYS C C -3.649 -1.531 16.171 1.00 . A A . 8 CYS C 1 1 9 10109 1 1 8 CYS CA C -4.890 -1.526 15.303 1.00 . A A . 8 CYS CA 1 1 9 10110 1 1 8 CYS CB C -4.974 -0.254 14.502 1.00 . A A . 8 CYS CB 1 1 9 10111 1 1 8 CYS H H -6.400 -0.780 16.568 1.00 . A A . 8 CYS H 1 1 9 10112 1 1 8 CYS HA H -4.883 -2.410 14.669 1.00 . A A . 8 CYS HA 1 1 9 10113 1 1 8 CYS HB2 H -5.630 -0.479 13.667 1.00 . A A . 8 CYS HB2 1 1 9 10114 1 1 8 CYS HB3 H -5.440 0.508 15.125 1.00 . A A . 8 CYS HB3 1 1 9 10115 1 1 8 CYS N N -6.071 -1.610 16.139 1.00 . A A . 8 CYS N 1 1 9 10116 1 1 8 CYS O O -2.819 -0.630 16.209 1.00 . A A . 8 CYS O 1 1 9 10117 1 1 8 CYS SG S -3.383 0.351 13.895 1.00 . A A . 8 CYS SG 1 1 9 10118 1 1 9 PHE C C -1.692 -1.911 18.116 1.00 . A A . 9 PHE C 1 1 9 10119 1 1 9 PHE CA C -2.686 -3.048 17.871 1.00 . A A . 9 PHE CA 1 1 9 10120 1 1 9 PHE CB C -2.107 -4.395 17.456 1.00 . A A . 9 PHE CB 1 1 9 10121 1 1 9 PHE CD1 C -1.686 -5.300 19.803 1.00 . A A . 9 PHE CD1 1 1 9 10122 1 1 9 PHE CD2 C 0.190 -5.252 18.169 1.00 . A A . 9 PHE CD2 1 1 9 10123 1 1 9 PHE CE1 C -0.814 -5.881 20.790 1.00 . A A . 9 PHE CE1 1 1 9 10124 1 1 9 PHE CE2 C 1.064 -5.833 19.152 1.00 . A A . 9 PHE CE2 1 1 9 10125 1 1 9 PHE CG C -1.191 -4.991 18.487 1.00 . A A . 9 PHE CG 1 1 9 10126 1 1 9 PHE CZ C 0.561 -6.149 20.462 1.00 . A A . 9 PHE CZ 1 1 9 10127 1 1 9 PHE H H -4.488 -3.154 16.602 1.00 . A A . 9 PHE H 1 1 9 10128 1 1 9 PHE HA H -3.211 -3.180 18.804 1.00 . A A . 9 PHE HA 1 1 9 10129 1 1 9 PHE HB2 H -2.934 -5.098 17.309 1.00 . A A . 9 PHE HB2 1 1 9 10130 1 1 9 PHE HB3 H -1.609 -4.263 16.498 1.00 . A A . 9 PHE HB3 1 1 9 10131 1 1 9 PHE HD1 H -2.712 -5.078 20.054 1.00 . A A . 9 PHE HD1 1 1 9 10132 1 1 9 PHE HD2 H 0.575 -4.985 17.195 1.00 . A A . 9 PHE HD2 1 1 9 10133 1 1 9 PHE HE1 H -1.191 -6.115 21.774 1.00 . A A . 9 PHE HE1 1 1 9 10134 1 1 9 PHE HE2 H 2.098 -6.030 18.906 1.00 . A A . 9 PHE HE2 1 1 9 10135 1 1 9 PHE HZ H 1.217 -6.587 21.200 1.00 . A A . 9 PHE HZ 1 1 9 10136 1 1 9 PHE N N -3.654 -2.671 16.857 1.00 . A A . 9 PHE N 1 1 9 10137 1 1 9 PHE O O -2.078 -0.785 18.407 1.00 . A A . 9 PHE O 1 1 9 10138 1 1 10 ARG C C 0.958 -1.457 16.048 1.00 . A A . 10 ARG C 1 1 9 10139 1 1 10 ARG CA C 0.531 -1.248 17.516 1.00 . A A . 10 ARG CA 1 1 9 10140 1 1 10 ARG CB C 1.723 -1.214 18.451 1.00 . A A . 10 ARG CB 1 1 9 10141 1 1 10 ARG CD C 2.927 1.023 18.602 1.00 . A A . 10 ARG CD 1 1 9 10142 1 1 10 ARG CG C 1.804 0.137 19.143 1.00 . A A . 10 ARG CG 1 1 9 10143 1 1 10 ARG CZ C 4.426 2.734 19.361 1.00 . A A . 10 ARG CZ 1 1 9 10144 1 1 10 ARG H H -0.147 -3.162 18.313 1.00 . A A . 10 ARG H 1 1 9 10145 1 1 10 ARG HA H 0.003 -0.311 17.654 1.00 . A A . 10 ARG HA 1 1 9 10146 1 1 10 ARG HB2 H 1.576 -1.981 19.220 1.00 . A A . 10 ARG HB2 1 1 9 10147 1 1 10 ARG HB3 H 2.638 -1.479 17.916 1.00 . A A . 10 ARG HB3 1 1 9 10148 1 1 10 ARG HD2 H 3.733 0.434 18.163 1.00 . A A . 10 ARG HD2 1 1 9 10149 1 1 10 ARG HD3 H 2.561 1.731 17.859 1.00 . A A . 10 ARG HD3 1 1 9 10150 1 1 10 ARG HE H 3.237 1.650 20.628 1.00 . A A . 10 ARG HE 1 1 9 10151 1 1 10 ARG HG2 H 0.846 0.650 19.109 1.00 . A A . 10 ARG HG2 1 1 9 10152 1 1 10 ARG HG3 H 1.931 -0.063 20.191 1.00 . A A . 10 ARG HG3 1 1 9 10153 1 1 10 ARG HH11 H 3.709 4.625 19.445 1.00 . A A . 10 ARG HH11 1 1 9 10154 1 1 10 ARG HH12 H 4.083 4.045 17.857 1.00 . A A . 10 ARG HH12 1 1 9 10155 1 1 10 ARG HH21 H 6.190 1.805 19.011 1.00 . A A . 10 ARG HH21 1 1 9 10156 1 1 10 ARG HH22 H 6.217 2.996 20.269 1.00 . A A . 10 ARG HH22 1 1 9 10157 1 1 10 ARG N N -0.409 -2.258 17.987 1.00 . A A . 10 ARG N 1 1 9 10158 1 1 10 ARG NE N 3.509 1.802 19.678 1.00 . A A . 10 ARG NE 1 1 9 10159 1 1 10 ARG NH1 N 4.040 3.898 18.845 1.00 . A A . 10 ARG NH1 1 1 9 10160 1 1 10 ARG NH2 N 5.718 2.492 19.564 1.00 . A A . 10 ARG NH2 1 1 9 10161 1 1 10 ARG O O 2.018 -1.015 15.622 1.00 . A A . 10 ARG O 1 1 9 10162 1 1 11 ALA C C 1.072 -1.255 13.260 1.00 . A A . 11 ALA C 1 1 9 10163 1 1 11 ALA CA C -0.015 -2.141 13.875 1.00 . A A . 11 ALA CA 1 1 9 10164 1 1 11 ALA CB C -1.400 -1.650 13.453 1.00 . A A . 11 ALA CB 1 1 9 10165 1 1 11 ALA H H -0.583 -2.694 15.876 1.00 . A A . 11 ALA H 1 1 9 10166 1 1 11 ALA HA H 0.143 -3.169 13.549 1.00 . A A . 11 ALA HA 1 1 9 10167 1 1 11 ALA HB1 H -2.087 -1.648 14.299 1.00 . A A . 11 ALA HB1 1 1 9 10168 1 1 11 ALA HB2 H -1.346 -0.636 13.058 1.00 . A A . 11 ALA HB2 1 1 9 10169 1 1 11 ALA HB3 H -1.824 -2.291 12.680 1.00 . A A . 11 ALA HB3 1 1 9 10170 1 1 11 ALA N N 0.063 -2.164 15.328 1.00 . A A . 11 ALA N 1 1 9 10171 1 1 11 ALA O O 1.051 -0.035 13.363 1.00 . A A . 11 ALA O 1 1 9 10172 1 1 12 ASN C C 2.328 -2.037 10.200 1.00 . A A . 12 ASN C 1 1 9 10173 1 1 12 ASN CA C 2.704 -1.336 11.503 1.00 . A A . 12 ASN CA 1 1 9 10174 1 1 12 ASN CB C 4.215 -1.405 11.726 1.00 . A A . 12 ASN CB 1 1 9 10175 1 1 12 ASN CG C 4.867 -0.074 11.347 1.00 . A A . 12 ASN CG 1 1 9 10176 1 1 12 ASN H H 2.238 -2.897 12.896 1.00 . A A . 12 ASN H 1 1 9 10177 1 1 12 ASN HA H 2.344 -0.309 11.459 1.00 . A A . 12 ASN HA 1 1 9 10178 1 1 12 ASN HB2 H 4.438 -1.623 12.771 1.00 . A A . 12 ASN HB2 1 1 9 10179 1 1 12 ASN HB3 H 4.654 -2.199 11.121 1.00 . A A . 12 ASN HB3 1 1 9 10180 1 1 12 ASN HD21 H 6.834 -0.390 10.924 1.00 . A A . 12 ASN HD21 1 1 9 10181 1 1 12 ASN HD22 H 6.502 0.323 12.491 1.00 . A A . 12 ASN HD22 1 1 9 10182 1 1 12 ASN N N 2.017 -1.963 12.615 1.00 . A A . 12 ASN N 1 1 9 10183 1 1 12 ASN ND2 N 6.186 -0.044 11.610 1.00 . A A . 12 ASN ND2 1 1 9 10184 1 1 12 ASN O O 3.091 -2.807 9.629 1.00 . A A . 12 ASN O 1 1 9 10185 1 1 12 ASN OD1 O 4.225 0.846 10.856 1.00 . A A . 12 ASN OD1 1 1 9 10186 1 1 13 CYS C C 2.117 0.117 8.456 1.00 . A A . 13 CYS C 1 1 9 10187 1 1 13 CYS CA C 0.851 -0.682 8.774 1.00 . A A . 13 CYS CA 1 1 9 10188 1 1 13 CYS CB C -0.265 0.245 9.255 1.00 . A A . 13 CYS CB 1 1 9 10189 1 1 13 CYS H H 0.308 -2.167 10.186 1.00 . A A . 13 CYS H 1 1 9 10190 1 1 13 CYS HA H 0.536 -1.217 7.875 1.00 . A A . 13 CYS HA 1 1 9 10191 1 1 13 CYS HB2 H 0.040 0.775 10.161 1.00 . A A . 13 CYS HB2 1 1 9 10192 1 1 13 CYS HB3 H -0.484 0.991 8.487 1.00 . A A . 13 CYS HB3 1 1 9 10193 1 1 13 CYS N N 1.092 -1.706 9.780 1.00 . A A . 13 CYS N 1 1 9 10194 1 1 13 CYS O O 2.573 0.963 9.216 1.00 . A A . 13 CYS O 1 1 9 10195 1 1 13 CYS SG S -1.771 -0.693 9.603 1.00 . A A . 13 CYS SG 1 1 9 10196 1 1 14 GLU C C 3.050 2.113 6.727 1.00 . A A . 14 GLU C 1 1 9 10197 1 1 14 GLU CA C 3.559 0.672 6.613 1.00 . A A . 14 GLU CA 1 1 9 10198 1 1 14 GLU CB C 3.720 0.280 5.148 1.00 . A A . 14 GLU CB 1 1 9 10199 1 1 14 GLU CD C 5.239 0.850 3.240 1.00 . A A . 14 GLU CD 1 1 9 10200 1 1 14 GLU CG C 4.310 1.418 4.315 1.00 . A A . 14 GLU CG 1 1 9 10201 1 1 14 GLU H H 2.411 -1.143 6.912 1.00 . A A . 14 GLU H 1 1 9 10202 1 1 14 GLU HA H 4.511 0.582 7.131 1.00 . A A . 14 GLU HA 1 1 9 10203 1 1 14 GLU HB2 H 4.357 -0.600 5.071 1.00 . A A . 14 GLU HB2 1 1 9 10204 1 1 14 GLU HB3 H 2.748 -0.003 4.751 1.00 . A A . 14 GLU HB3 1 1 9 10205 1 1 14 GLU HG2 H 3.520 1.993 3.833 1.00 . A A . 14 GLU HG2 1 1 9 10206 1 1 14 GLU HG3 H 4.878 2.101 4.947 1.00 . A A . 14 GLU HG3 1 1 9 10207 1 1 14 GLU N N 2.645 -0.241 7.276 1.00 . A A . 14 GLU N 1 1 9 10208 1 1 14 GLU O O 3.551 2.913 7.509 1.00 . A A . 14 GLU O 1 1 9 10209 1 1 14 GLU OE1 O 5.195 -0.357 3.005 1.00 . A A . 14 GLU OE1 1 1 9 10210 1 1 14 GLU OE2 O 5.995 1.620 2.650 1.00 . A A . 14 GLU OE2 1 1 9 10211 1 1 15 TYR C C 0.412 3.049 7.584 1.00 . A A . 15 TYR C 1 1 9 10212 1 1 15 TYR CA C 1.110 3.444 6.279 1.00 . A A . 15 TYR CA 1 1 9 10213 1 1 15 TYR CB C 0.123 3.706 5.130 1.00 . A A . 15 TYR CB 1 1 9 10214 1 1 15 TYR CD1 C 0.620 6.213 5.221 1.00 . A A . 15 TYR CD1 1 1 9 10215 1 1 15 TYR CD2 C -1.718 5.452 4.849 1.00 . A A . 15 TYR CD2 1 1 9 10216 1 1 15 TYR CE1 C 0.189 7.583 5.138 1.00 . A A . 15 TYR CE1 1 1 9 10217 1 1 15 TYR CE2 C -2.153 6.821 4.765 1.00 . A A . 15 TYR CE2 1 1 9 10218 1 1 15 TYR CG C -0.330 5.139 5.074 1.00 . A A . 15 TYR CG 1 1 9 10219 1 1 15 TYR CZ C -1.198 7.886 4.911 1.00 . A A . 15 TYR CZ 1 1 9 10220 1 1 15 TYR H H 1.886 1.869 5.055 1.00 . A A . 15 TYR H 1 1 9 10221 1 1 15 TYR HA H 1.723 4.321 6.474 1.00 . A A . 15 TYR HA 1 1 9 10222 1 1 15 TYR HB2 H 0.610 3.482 4.190 1.00 . A A . 15 TYR HB2 1 1 9 10223 1 1 15 TYR HB3 H -0.750 3.049 5.212 1.00 . A A . 15 TYR HB3 1 1 9 10224 1 1 15 TYR HD1 H 1.663 5.992 5.393 1.00 . A A . 15 TYR HD1 1 1 9 10225 1 1 15 TYR HD2 H -2.438 4.658 4.735 1.00 . A A . 15 TYR HD2 1 1 9 10226 1 1 15 TYR HE1 H 0.908 8.383 5.242 1.00 . A A . 15 TYR HE1 1 1 9 10227 1 1 15 TYR HE2 H -3.195 7.046 4.588 1.00 . A A . 15 TYR HE2 1 1 9 10228 1 1 15 TYR HH H -2.465 9.287 5.237 1.00 . A A . 15 TYR HH 1 1 9 10229 1 1 15 TYR N N 2.026 2.387 5.899 1.00 . A A . 15 TYR N 1 1 9 10230 1 1 15 TYR O O 1.022 2.537 8.514 1.00 . A A . 15 TYR O 1 1 9 10231 1 1 15 TYR OH O -1.612 9.200 4.833 1.00 . A A . 15 TYR OH 1 1 9 10232 1 1 16 GLN C C -2.683 1.992 8.640 1.00 . A A . 16 GLN C 1 1 9 10233 1 1 16 GLN CA C -1.644 3.099 8.813 1.00 . A A . 16 GLN CA 1 1 9 10234 1 1 16 GLN CB C -2.269 4.404 9.320 1.00 . A A . 16 GLN CB 1 1 9 10235 1 1 16 GLN CD C -3.307 5.356 11.397 1.00 . A A . 16 GLN CD 1 1 9 10236 1 1 16 GLN CG C -2.162 4.505 10.842 1.00 . A A . 16 GLN CG 1 1 9 10237 1 1 16 GLN H H -1.238 3.732 6.735 1.00 . A A . 16 GLN H 1 1 9 10238 1 1 16 GLN HA H -0.932 2.730 9.539 1.00 . A A . 16 GLN HA 1 1 9 10239 1 1 16 GLN HB2 H -1.762 5.246 8.868 1.00 . A A . 16 GLN HB2 1 1 9 10240 1 1 16 GLN HB3 H -3.322 4.446 9.021 1.00 . A A . 16 GLN HB3 1 1 9 10241 1 1 16 GLN HE21 H -3.902 6.181 9.636 1.00 . A A . 16 GLN HE21 1 1 9 10242 1 1 16 GLN HE22 H -3.646 7.315 10.949 1.00 . A A . 16 GLN HE22 1 1 9 10243 1 1 16 GLN HG2 H -2.205 3.513 11.293 1.00 . A A . 16 GLN HG2 1 1 9 10244 1 1 16 GLN HG3 H -1.211 4.955 11.130 1.00 . A A . 16 GLN HG3 1 1 9 10245 1 1 16 GLN N N -0.899 3.329 7.588 1.00 . A A . 16 GLN N 1 1 9 10246 1 1 16 GLN NE2 N -3.648 6.376 10.589 1.00 . A A . 16 GLN NE2 1 1 9 10247 1 1 16 GLN O O -2.543 1.075 7.839 1.00 . A A . 16 GLN O 1 1 9 10248 1 1 16 GLN OE1 O -3.837 5.104 12.473 1.00 . A A . 16 GLN OE1 1 1 9 10249 1 1 17 CYS C C -5.986 1.286 9.153 1.00 . A A . 17 CYS C 1 1 9 10250 1 1 17 CYS CA C -4.605 1.044 9.764 1.00 . A A . 17 CYS CA 1 1 9 10251 1 1 17 CYS CB C -4.731 0.879 11.275 1.00 . A A . 17 CYS CB 1 1 9 10252 1 1 17 CYS H H -3.642 2.996 10.020 1.00 . A A . 17 CYS H 1 1 9 10253 1 1 17 CYS HA H -4.137 0.156 9.340 1.00 . A A . 17 CYS HA 1 1 9 10254 1 1 17 CYS HB2 H -4.673 1.851 11.765 1.00 . A A . 17 CYS HB2 1 1 9 10255 1 1 17 CYS HB3 H -5.703 0.454 11.524 1.00 . A A . 17 CYS HB3 1 1 9 10256 1 1 17 CYS N N -3.724 2.158 9.473 1.00 . A A . 17 CYS N 1 1 9 10257 1 1 17 CYS O O -6.512 2.392 9.153 1.00 . A A . 17 CYS O 1 1 9 10258 1 1 17 CYS SG S -3.434 -0.192 11.935 1.00 . A A . 17 CYS SG 1 1 9 10259 1 1 18 GLN C C -7.749 -1.087 10.304 1.00 . A A . 18 GLN C 1 1 9 10260 1 1 18 GLN CA C -7.861 -0.208 9.064 1.00 . A A . 18 GLN CA 1 1 9 10261 1 1 18 GLN CB C -8.556 -0.977 7.948 1.00 . A A . 18 GLN CB 1 1 9 10262 1 1 18 GLN CD C -10.407 0.713 7.770 1.00 . A A . 18 GLN CD 1 1 9 10263 1 1 18 GLN CG C -10.069 -0.768 7.977 1.00 . A A . 18 GLN CG 1 1 9 10264 1 1 18 GLN H H -6.015 -0.394 7.991 1.00 . A A . 18 GLN H 1 1 9 10265 1 1 18 GLN HA H -8.399 0.710 9.294 1.00 . A A . 18 GLN HA 1 1 9 10266 1 1 18 GLN HB2 H -8.164 -0.645 6.984 1.00 . A A . 18 GLN HB2 1 1 9 10267 1 1 18 GLN HB3 H -8.332 -2.038 8.061 1.00 . A A . 18 GLN HB3 1 1 9 10268 1 1 18 GLN HE21 H -9.007 0.846 6.291 1.00 . A A . 18 GLN HE21 1 1 9 10269 1 1 18 GLN HE22 H -9.415 2.355 7.082 1.00 . A A . 18 GLN HE22 1 1 9 10270 1 1 18 GLN HG2 H -10.551 -1.358 7.198 1.00 . A A . 18 GLN HG2 1 1 9 10271 1 1 18 GLN HG3 H -10.474 -1.092 8.937 1.00 . A A . 18 GLN HG3 1 1 9 10272 1 1 18 GLN N N -6.529 0.170 8.637 1.00 . A A . 18 GLN N 1 1 9 10273 1 1 18 GLN NE2 N -9.532 1.362 6.976 1.00 . A A . 18 GLN NE2 1 1 9 10274 1 1 18 GLN O O -6.775 -1.805 10.491 1.00 . A A . 18 GLN O 1 1 9 10275 1 1 18 GLN OE1 O -11.388 1.223 8.295 1.00 . A A . 18 GLN OE1 1 1 9 10276 1 1 19 PRO C C -10.535 -2.735 10.698 1.00 . A A . 19 PRO C 1 1 9 10277 1 1 19 PRO CA C -9.512 -2.132 11.672 1.00 . A A . 19 PRO CA 1 1 9 10278 1 1 19 PRO CB C -10.255 -1.614 12.906 1.00 . A A . 19 PRO CB 1 1 9 10279 1 1 19 PRO CD C -9.154 0.281 11.774 1.00 . A A . 19 PRO CD 1 1 9 10280 1 1 19 PRO CG C -10.006 -0.102 12.984 1.00 . A A . 19 PRO CG 1 1 9 10281 1 1 19 PRO HA H -8.796 -2.903 11.952 1.00 . A A . 19 PRO HA 1 1 9 10282 1 1 19 PRO HB2 H -11.322 -1.821 12.823 1.00 . A A . 19 PRO HB2 1 1 9 10283 1 1 19 PRO HB3 H -9.893 -2.109 13.807 1.00 . A A . 19 PRO HB3 1 1 9 10284 1 1 19 PRO HD2 H -9.713 0.898 11.071 1.00 . A A . 19 PRO HD2 1 1 9 10285 1 1 19 PRO HD3 H -8.256 0.820 12.074 1.00 . A A . 19 PRO HD3 1 1 9 10286 1 1 19 PRO HG2 H -10.949 0.441 12.978 1.00 . A A . 19 PRO HG2 1 1 9 10287 1 1 19 PRO HG3 H -9.481 0.142 13.908 1.00 . A A . 19 PRO HG3 1 1 9 10288 1 1 19 PRO N N -8.793 -0.979 11.151 1.00 . A A . 19 PRO N 1 1 9 10289 1 1 19 PRO O O -11.621 -2.204 10.496 1.00 . A A . 19 PRO O 1 1 9 10290 1 1 20 LEU C C -11.802 -5.708 10.216 1.00 . A A . 20 LEU C 1 1 9 10291 1 1 20 LEU CA C -10.425 -5.192 10.688 1.00 . A A . 20 LEU CA 1 1 9 10292 1 1 20 LEU CB C -10.320 -5.166 12.227 1.00 . A A . 20 LEU CB 1 1 9 10293 1 1 20 LEU CD1 C -11.170 -6.194 14.366 1.00 . A A . 20 LEU CD1 1 1 9 10294 1 1 20 LEU CD2 C -12.722 -4.843 12.909 1.00 . A A . 20 LEU CD2 1 1 9 10295 1 1 20 LEU CG C -11.519 -5.787 12.935 1.00 . A A . 20 LEU CG 1 1 9 10296 1 1 20 LEU H H -9.571 -3.813 9.277 1.00 . A A . 20 LEU H 1 1 9 10297 1 1 20 LEU HA H -9.678 -5.869 10.295 1.00 . A A . 20 LEU HA 1 1 9 10298 1 1 20 LEU HB2 H -9.425 -5.700 12.543 1.00 . A A . 20 LEU HB2 1 1 9 10299 1 1 20 LEU HB3 H -10.202 -4.155 12.596 1.00 . A A . 20 LEU HB3 1 1 9 10300 1 1 20 LEU HD11 H -11.890 -5.781 15.072 1.00 . A A . 20 LEU HD11 1 1 9 10301 1 1 20 LEU HD12 H -11.177 -7.279 14.473 1.00 . A A . 20 LEU HD12 1 1 9 10302 1 1 20 LEU HD13 H -10.180 -5.832 14.644 1.00 . A A . 20 LEU HD13 1 1 9 10303 1 1 20 LEU HD21 H -12.451 -3.882 12.472 1.00 . A A . 20 LEU HD21 1 1 9 10304 1 1 20 LEU HD22 H -13.535 -5.265 12.319 1.00 . A A . 20 LEU HD22 1 1 9 10305 1 1 20 LEU HD23 H -13.094 -4.661 13.917 1.00 . A A . 20 LEU HD23 1 1 9 10306 1 1 20 LEU HG H -11.767 -6.680 12.371 1.00 . A A . 20 LEU HG 1 1 9 10307 1 1 20 LEU N N -10.114 -3.873 10.112 1.00 . A A . 20 LEU N 1 1 9 10308 1 1 20 LEU O O -12.059 -6.883 9.995 1.00 . A A . 20 LEU O 1 1 9 10309 1 1 21 ASN C C -14.082 -6.014 8.628 1.00 . A A . 21 ASN C 1 1 9 10310 1 1 21 ASN CA C -13.577 -4.613 9.035 1.00 . A A . 21 ASN CA 1 1 9 10311 1 1 21 ASN CB C -12.886 -3.877 7.887 1.00 . A A . 21 ASN CB 1 1 9 10312 1 1 21 ASN CG C -13.935 -3.378 6.889 1.00 . A A . 21 ASN CG 1 1 9 10313 1 1 21 ASN H H -12.198 -4.040 10.733 1.00 . A A . 21 ASN H 1 1 9 10314 1 1 21 ASN HA H -14.422 -4.028 9.375 1.00 . A A . 21 ASN HA 1 1 9 10315 1 1 21 ASN HB2 H -12.312 -3.026 8.264 1.00 . A A . 21 ASN HB2 1 1 9 10316 1 1 21 ASN HB3 H -12.214 -4.564 7.375 1.00 . A A . 21 ASN HB3 1 1 9 10317 1 1 21 ASN HD21 H -12.409 -2.846 5.633 1.00 . A A . 21 ASN HD21 1 1 9 10318 1 1 21 ASN N N -12.670 -4.713 10.166 1.00 . A A . 21 ASN N 1 1 9 10319 1 1 21 ASN ND2 N -13.395 -2.807 5.798 1.00 . A A . 21 ASN ND2 1 1 9 10320 1 1 21 ASN O O -14.667 -6.733 9.429 1.00 . A A . 21 ASN O 1 1 9 10321 1 1 21 ASN OD1 O -15.136 -3.501 7.097 1.00 . A A . 21 ASN OD1 1 1 9 10322 1 1 22 GLN C C -12.197 -8.129 7.761 1.00 . A A . 22 GLN C 1 1 9 10323 1 1 22 GLN CA C -13.495 -7.738 7.054 1.00 . A A . 22 GLN CA 1 1 9 10324 1 1 22 GLN CB C -13.330 -7.919 5.546 1.00 . A A . 22 GLN CB 1 1 9 10325 1 1 22 GLN CD C -15.577 -8.967 5.173 1.00 . A A . 22 GLN CD 1 1 9 10326 1 1 22 GLN CG C -14.065 -9.157 5.031 1.00 . A A . 22 GLN CG 1 1 9 10327 1 1 22 GLN H H -13.858 -5.669 6.623 1.00 . A A . 22 GLN H 1 1 9 10328 1 1 22 GLN HA H -14.317 -8.343 7.438 1.00 . A A . 22 GLN HA 1 1 9 10329 1 1 22 GLN HB2 H -13.699 -7.032 5.033 1.00 . A A . 22 GLN HB2 1 1 9 10330 1 1 22 GLN HB3 H -12.269 -7.999 5.309 1.00 . A A . 22 GLN HB3 1 1 9 10331 1 1 22 GLN HE21 H -15.938 -10.899 4.647 1.00 . A A . 22 GLN HE21 1 1 9 10332 1 1 22 GLN HE22 H -17.052 -10.214 5.816 1.00 . A A . 22 GLN HE22 1 1 9 10333 1 1 22 GLN HG2 H -13.829 -9.336 3.982 1.00 . A A . 22 GLN HG2 1 1 9 10334 1 1 22 GLN HG3 H -13.766 -10.042 5.594 1.00 . A A . 22 GLN HG3 1 1 9 10335 1 1 22 GLN N N -13.822 -6.355 7.350 1.00 . A A . 22 GLN N 1 1 9 10336 1 1 22 GLN NE2 N -16.249 -10.131 5.216 1.00 . A A . 22 GLN NE2 1 1 9 10337 1 1 22 GLN O O -12.086 -9.183 8.375 1.00 . A A . 22 GLN O 1 1 9 10338 1 1 22 GLN OE1 O -16.087 -7.855 5.236 1.00 . A A . 22 GLN OE1 1 1 9 10339 1 1 23 THR C C -9.246 -8.487 8.516 1.00 . A A . 23 THR C 1 1 9 10340 1 1 23 THR CA C -9.870 -7.681 7.362 1.00 . A A . 23 THR CA 1 1 9 10341 1 1 23 THR CB C -8.967 -6.499 7.025 1.00 . A A . 23 THR CB 1 1 9 10342 1 1 23 THR CG2 C -7.847 -6.893 6.061 1.00 . A A . 23 THR CG2 1 1 9 10343 1 1 23 THR H H -11.444 -6.237 7.762 1.00 . A A . 23 THR H 1 1 9 10344 1 1 23 THR HA H -9.987 -8.365 6.540 1.00 . A A . 23 THR HA 1 1 9 10345 1 1 23 THR HB H -8.538 -6.123 7.955 1.00 . A A . 23 THR HB 1 1 9 10346 1 1 23 THR HG1 H -10.071 -5.792 5.641 1.00 . A A . 23 THR HG1 1 1 9 10347 1 1 23 THR HG21 H -8.036 -7.874 5.626 1.00 . A A . 23 THR HG21 1 1 9 10348 1 1 23 THR HG22 H -7.766 -6.173 5.247 1.00 . A A . 23 THR HG22 1 1 9 10349 1 1 23 THR HG23 H -6.887 -6.932 6.576 1.00 . A A . 23 THR HG23 1 1 9 10350 1 1 23 THR N N -11.227 -7.206 7.628 1.00 . A A . 23 THR N 1 1 9 10351 1 1 23 THR O O -8.384 -9.338 8.336 1.00 . A A . 23 THR O 1 1 9 10352 1 1 23 THR OG1 O -9.732 -5.464 6.463 1.00 . A A . 23 THR OG1 1 1 9 10353 1 1 24 SER C C -7.637 -7.439 10.673 1.00 . A A . 24 SER C 1 1 9 10354 1 1 24 SER CA C -9.007 -8.069 10.914 1.00 . A A . 24 SER CA 1 1 9 10355 1 1 24 SER CB C -8.957 -9.431 11.579 1.00 . A A . 24 SER CB 1 1 9 10356 1 1 24 SER H H -10.587 -7.602 9.580 1.00 . A A . 24 SER H 1 1 9 10357 1 1 24 SER HA H -9.588 -7.407 11.553 1.00 . A A . 24 SER HA 1 1 9 10358 1 1 24 SER HB2 H -8.726 -9.330 12.639 1.00 . A A . 24 SER HB2 1 1 9 10359 1 1 24 SER HB3 H -9.946 -9.874 11.494 1.00 . A A . 24 SER HB3 1 1 9 10360 1 1 24 SER HG H -8.501 -11.007 10.605 1.00 . A A . 24 SER HG 1 1 9 10361 1 1 24 SER N N -9.761 -8.135 9.693 1.00 . A A . 24 SER N 1 1 9 10362 1 1 24 SER O O -6.881 -7.785 9.774 1.00 . A A . 24 SER O 1 1 9 10363 1 1 24 SER OG O -8.015 -10.282 10.976 1.00 . A A . 24 SER OG 1 1 9 10364 1 1 25 TYR C C -5.989 -5.002 10.228 1.00 . A A . 25 TYR C 1 1 9 10365 1 1 25 TYR CA C -7.176 -5.110 11.170 1.00 . A A . 25 TYR CA 1 1 9 10366 1 1 25 TYR CB C -6.927 -4.240 12.403 1.00 . A A . 25 TYR CB 1 1 9 10367 1 1 25 TYR CD1 C -5.793 -5.783 14.089 1.00 . A A . 25 TYR CD1 1 1 9 10368 1 1 25 TYR CD2 C -4.420 -4.109 12.862 1.00 . A A . 25 TYR CD2 1 1 9 10369 1 1 25 TYR CE1 C -4.618 -6.243 14.781 1.00 . A A . 25 TYR CE1 1 1 9 10370 1 1 25 TYR CE2 C -3.242 -4.568 13.552 1.00 . A A . 25 TYR CE2 1 1 9 10371 1 1 25 TYR CG C -5.700 -4.712 13.129 1.00 . A A . 25 TYR CG 1 1 9 10372 1 1 25 TYR CZ C -3.343 -5.634 14.511 1.00 . A A . 25 TYR CZ 1 1 9 10373 1 1 25 TYR H H -7.807 -6.675 12.478 1.00 . A A . 25 TYR H 1 1 9 10374 1 1 25 TYR HA H -8.060 -4.788 10.615 1.00 . A A . 25 TYR HA 1 1 9 10375 1 1 25 TYR HB2 H -6.815 -3.183 12.136 1.00 . A A . 25 TYR HB2 1 1 9 10376 1 1 25 TYR HB3 H -7.787 -4.316 13.069 1.00 . A A . 25 TYR HB3 1 1 9 10377 1 1 25 TYR HD1 H -6.749 -6.243 14.290 1.00 . A A . 25 TYR HD1 1 1 9 10378 1 1 25 TYR HD2 H -4.342 -3.308 12.141 1.00 . A A . 25 TYR HD2 1 1 9 10379 1 1 25 TYR HE1 H -4.694 -7.043 15.502 1.00 . A A . 25 TYR HE1 1 1 9 10380 1 1 25 TYR HE2 H -2.285 -4.112 13.350 1.00 . A A . 25 TYR HE2 1 1 9 10381 1 1 25 TYR HH H -1.588 -6.405 14.547 1.00 . A A . 25 TYR HH 1 1 9 10382 1 1 25 TYR N N -7.416 -6.480 11.582 1.00 . A A . 25 TYR N 1 1 9 10383 1 1 25 TYR O O -5.008 -5.734 10.278 1.00 . A A . 25 TYR O 1 1 9 10384 1 1 25 TYR OH O -2.216 -6.074 15.175 1.00 . A A . 25 TYR OH 1 1 9 10385 1 1 26 LEU C C -4.741 -2.783 7.921 1.00 . A A . 26 LEU C 1 1 9 10386 1 1 26 LEU CA C -5.593 -4.044 8.064 1.00 . A A . 26 LEU CA 1 1 9 10387 1 1 26 LEU CB C -6.728 -4.154 7.035 1.00 . A A . 26 LEU CB 1 1 9 10388 1 1 26 LEU CD1 C -6.048 -2.838 4.988 1.00 . A A . 26 LEU CD1 1 1 9 10389 1 1 26 LEU CD2 C -8.425 -2.810 5.766 1.00 . A A . 26 LEU CD2 1 1 9 10390 1 1 26 LEU CG C -6.963 -2.888 6.212 1.00 . A A . 26 LEU CG 1 1 9 10391 1 1 26 LEU H H -7.068 -3.509 9.485 1.00 . A A . 26 LEU H 1 1 9 10392 1 1 26 LEU HA H -4.992 -4.953 8.028 1.00 . A A . 26 LEU HA 1 1 9 10393 1 1 26 LEU HB2 H -6.516 -4.985 6.359 1.00 . A A . 26 LEU HB2 1 1 9 10394 1 1 26 LEU HB3 H -7.655 -4.394 7.570 1.00 . A A . 26 LEU HB3 1 1 9 10395 1 1 26 LEU HD11 H -6.627 -2.895 4.066 1.00 . A A . 26 LEU HD11 1 1 9 10396 1 1 26 LEU HD12 H -5.476 -1.910 4.969 1.00 . A A . 26 LEU HD12 1 1 9 10397 1 1 26 LEU HD13 H -5.341 -3.667 4.994 1.00 . A A . 26 LEU HD13 1 1 9 10398 1 1 26 LEU HD21 H -9.101 -3.106 6.568 1.00 . A A . 26 LEU HD21 1 1 9 10399 1 1 26 LEU HD22 H -8.688 -1.800 5.452 1.00 . A A . 26 LEU HD22 1 1 9 10400 1 1 26 LEU HD23 H -8.603 -3.475 4.921 1.00 . A A . 26 LEU HD23 1 1 9 10401 1 1 26 LEU HG H -6.746 -2.034 6.853 1.00 . A A . 26 LEU HG 1 1 9 10402 1 1 26 LEU N N -6.205 -3.999 9.370 1.00 . A A . 26 LEU N 1 1 9 10403 1 1 26 LEU O O -4.736 -1.926 8.797 1.00 . A A . 26 LEU O 1 1 9 10404 1 1 27 CYS C C -3.342 -0.862 5.315 1.00 . A A . 27 CYS C 1 1 9 10405 1 1 27 CYS CA C -3.136 -1.561 6.662 1.00 . A A . 27 CYS CA 1 1 9 10406 1 1 27 CYS CB C -1.688 -1.981 6.887 1.00 . A A . 27 CYS CB 1 1 9 10407 1 1 27 CYS H H -4.158 -3.357 6.043 1.00 . A A . 27 CYS H 1 1 9 10408 1 1 27 CYS HA H -3.409 -0.863 7.447 1.00 . A A . 27 CYS HA 1 1 9 10409 1 1 27 CYS HB2 H -1.448 -2.834 6.254 1.00 . A A . 27 CYS HB2 1 1 9 10410 1 1 27 CYS HB3 H -1.018 -1.156 6.628 1.00 . A A . 27 CYS HB3 1 1 9 10411 1 1 27 CYS N N -4.024 -2.703 6.788 1.00 . A A . 27 CYS N 1 1 9 10412 1 1 27 CYS O O -3.481 -1.480 4.267 1.00 . A A . 27 CYS O 1 1 9 10413 1 1 27 CYS SG S -1.407 -2.442 8.614 1.00 . A A . 27 CYS SG 1 1 9 10414 1 1 28 VAL C C -3.966 1.603 3.267 1.00 . A A . 28 VAL C 1 1 9 10415 1 1 28 VAL CA C -4.319 1.298 4.728 1.00 . A A . 28 VAL CA 1 1 9 10416 1 1 28 VAL CB C -4.406 2.646 5.415 1.00 . A A . 28 VAL CB 1 1 9 10417 1 1 28 VAL CG1 C -5.329 3.578 4.639 1.00 . A A . 28 VAL CG1 1 1 9 10418 1 1 28 VAL CG2 C -4.818 2.526 6.877 1.00 . A A . 28 VAL CG2 1 1 9 10419 1 1 28 VAL H H -2.725 0.907 6.099 1.00 . A A . 28 VAL H 1 1 9 10420 1 1 28 VAL HA H -5.235 0.730 4.731 1.00 . A A . 28 VAL HA 1 1 9 10421 1 1 28 VAL HB H -3.392 3.042 5.374 1.00 . A A . 28 VAL HB 1 1 9 10422 1 1 28 VAL HG11 H -4.760 4.174 3.927 1.00 . A A . 28 VAL HG11 1 1 9 10423 1 1 28 VAL HG12 H -6.066 2.999 4.082 1.00 . A A . 28 VAL HG12 1 1 9 10424 1 1 28 VAL HG13 H -5.856 4.251 5.314 1.00 . A A . 28 VAL HG13 1 1 9 10425 1 1 28 VAL HG21 H -4.314 3.285 7.477 1.00 . A A . 28 VAL HG21 1 1 9 10426 1 1 28 VAL HG22 H -5.889 2.665 7.004 1.00 . A A . 28 VAL HG22 1 1 9 10427 1 1 28 VAL HG23 H -4.563 1.536 7.251 1.00 . A A . 28 VAL HG23 1 1 9 10428 1 1 28 VAL N N -3.346 0.477 5.445 1.00 . A A . 28 VAL N 1 1 9 10429 1 1 28 VAL O O -4.817 1.886 2.434 1.00 . A A . 28 VAL O 1 1 9 10430 1 1 29 CYS C C -2.462 2.981 1.088 1.00 . A A . 29 CYS C 1 1 9 10431 1 1 29 CYS CA C -1.804 2.421 2.340 1.00 . A A . 29 CYS CA 1 1 9 10432 1 1 29 CYS CB C -0.558 1.646 1.916 1.00 . A A . 29 CYS CB 1 1 9 10433 1 1 29 CYS H H -2.262 0.793 3.611 1.00 . A A . 29 CYS H 1 1 9 10434 1 1 29 CYS HA H -1.586 3.247 3.017 1.00 . A A . 29 CYS HA 1 1 9 10435 1 1 29 CYS HB2 H -0.957 0.712 1.537 1.00 . A A . 29 CYS HB2 1 1 9 10436 1 1 29 CYS HB3 H -0.040 2.143 1.093 1.00 . A A . 29 CYS HB3 1 1 9 10437 1 1 29 CYS N N -2.655 1.506 3.054 1.00 . A A . 29 CYS N 1 1 9 10438 1 1 29 CYS O O -3.559 2.653 0.655 1.00 . A A . 29 CYS O 1 1 9 10439 1 1 29 CYS SG S 0.633 1.269 3.235 1.00 . A A . 29 CYS SG 1 1 9 10440 1 1 30 ALA C C -2.872 4.753 -1.345 1.00 . A A . 30 ALA C 1 1 9 10441 1 1 30 ALA CA C -2.092 5.073 -0.064 1.00 . A A . 30 ALA CA 1 1 9 10442 1 1 30 ALA CB C -0.899 5.964 -0.406 1.00 . A A . 30 ALA CB 1 1 9 10443 1 1 30 ALA H H -0.760 3.743 1.084 1.00 . A A . 30 ALA H 1 1 9 10444 1 1 30 ALA HA H -2.725 5.575 0.669 1.00 . A A . 30 ALA HA 1 1 9 10445 1 1 30 ALA HB1 H -0.022 5.364 -0.647 1.00 . A A . 30 ALA HB1 1 1 9 10446 1 1 30 ALA HB2 H -1.119 6.600 -1.264 1.00 . A A . 30 ALA HB2 1 1 9 10447 1 1 30 ALA HB3 H -0.645 6.609 0.435 1.00 . A A . 30 ALA HB3 1 1 9 10448 1 1 30 ALA N N -1.607 3.858 0.567 1.00 . A A . 30 ALA N 1 1 9 10449 1 1 30 ALA O O -2.345 4.829 -2.447 1.00 . A A . 30 ALA O 1 1 9 10450 1 1 31 GLU C C -4.282 3.196 -3.278 1.00 . A A . 31 GLU C 1 1 9 10451 1 1 31 GLU CA C -4.755 3.293 -1.823 1.00 . A A . 31 GLU CA 1 1 9 10452 1 1 31 GLU CB C -6.268 3.466 -1.788 1.00 . A A . 31 GLU CB 1 1 9 10453 1 1 31 GLU CD C -8.340 2.246 -2.485 1.00 . A A . 31 GLU CD 1 1 9 10454 1 1 31 GLU CG C -6.988 2.121 -1.780 1.00 . A A . 31 GLU CG 1 1 9 10455 1 1 31 GLU H H -4.698 4.850 -0.408 1.00 . A A . 31 GLU H 1 1 9 10456 1 1 31 GLU HA H -4.475 2.392 -1.280 1.00 . A A . 31 GLU HA 1 1 9 10457 1 1 31 GLU HB2 H -6.546 4.030 -0.900 1.00 . A A . 31 GLU HB2 1 1 9 10458 1 1 31 GLU HB3 H -6.576 4.059 -2.646 1.00 . A A . 31 GLU HB3 1 1 9 10459 1 1 31 GLU HG2 H -6.385 1.368 -2.289 1.00 . A A . 31 GLU HG2 1 1 9 10460 1 1 31 GLU HG3 H -7.147 1.787 -0.755 1.00 . A A . 31 GLU HG3 1 1 9 10461 1 1 31 GLU N N -4.154 4.411 -1.122 1.00 . A A . 31 GLU N 1 1 9 10462 1 1 31 GLU O O -3.981 4.179 -3.943 1.00 . A A . 31 GLU O 1 1 9 10463 1 1 31 GLU OE1 O -9.149 3.069 -2.060 1.00 . A A . 31 GLU OE1 1 1 9 10464 1 1 31 GLU OE2 O -8.568 1.521 -3.452 1.00 . A A . 31 GLU OE2 1 1 9 10465 1 1 32 GLY C C -1.857 1.837 -4.130 1.00 . A A . 32 GLY C 1 1 9 10466 1 1 32 GLY CA C -3.250 1.472 -4.636 1.00 . A A . 32 GLY CA 1 1 9 10467 1 1 32 GLY H H -4.987 1.297 -3.396 1.00 . A A . 32 GLY H 1 1 9 10468 1 1 32 GLY HA2 H -3.335 0.388 -4.678 1.00 . A A . 32 GLY HA2 1 1 9 10469 1 1 32 GLY HA3 H -3.446 1.915 -5.613 1.00 . A A . 32 GLY HA3 1 1 9 10470 1 1 32 GLY N N -4.278 1.925 -3.716 1.00 . A A . 32 GLY N 1 1 9 10471 1 1 32 GLY O O -1.002 2.328 -4.856 1.00 . A A . 32 GLY O 1 1 9 10472 1 1 33 PHE C C -1.524 -0.439 -1.466 1.00 . A A . 33 PHE C 1 1 9 10473 1 1 33 PHE CA C -0.794 0.508 -2.421 1.00 . A A . 33 PHE CA 1 1 9 10474 1 1 33 PHE CB C 0.432 1.055 -1.718 1.00 . A A . 33 PHE CB 1 1 9 10475 1 1 33 PHE CD1 C 0.353 3.528 -2.370 1.00 . A A . 33 PHE CD1 1 1 9 10476 1 1 33 PHE CD2 C 2.402 2.197 -2.837 1.00 . A A . 33 PHE CD2 1 1 9 10477 1 1 33 PHE CE1 C 0.997 4.705 -2.890 1.00 . A A . 33 PHE CE1 1 1 9 10478 1 1 33 PHE CE2 C 3.057 3.376 -3.336 1.00 . A A . 33 PHE CE2 1 1 9 10479 1 1 33 PHE CG C 1.056 2.272 -2.333 1.00 . A A . 33 PHE CG 1 1 9 10480 1 1 33 PHE CZ C 2.351 4.629 -3.369 1.00 . A A . 33 PHE CZ 1 1 9 10481 1 1 33 PHE H H -2.384 1.870 -2.174 1.00 . A A . 33 PHE H 1 1 9 10482 1 1 33 PHE HA H -0.459 -0.025 -3.297 1.00 . A A . 33 PHE HA 1 1 9 10483 1 1 33 PHE HB2 H 0.179 1.292 -0.689 1.00 . A A . 33 PHE HB2 1 1 9 10484 1 1 33 PHE HB3 H 1.167 0.250 -1.758 1.00 . A A . 33 PHE HB3 1 1 9 10485 1 1 33 PHE HD1 H -0.655 3.579 -1.990 1.00 . A A . 33 PHE HD1 1 1 9 10486 1 1 33 PHE HD2 H 2.918 1.248 -2.847 1.00 . A A . 33 PHE HD2 1 1 9 10487 1 1 33 PHE HE1 H 0.464 5.644 -2.920 1.00 . A A . 33 PHE HE1 1 1 9 10488 1 1 33 PHE HE2 H 4.079 3.321 -3.678 1.00 . A A . 33 PHE HE2 1 1 9 10489 1 1 33 PHE HZ H 2.839 5.507 -3.760 1.00 . A A . 33 PHE HZ 1 1 9 10490 1 1 33 PHE N N -1.709 1.548 -2.829 1.00 . A A . 33 PHE N 1 1 9 10491 1 1 33 PHE O O -1.697 -0.149 -0.290 1.00 . A A . 33 PHE O 1 1 9 10492 1 1 34 ALA C C -2.936 -3.811 -1.649 1.00 . A A . 34 ALA C 1 1 9 10493 1 1 34 ALA CA C -2.925 -2.331 -1.267 1.00 . A A . 34 ALA CA 1 1 9 10494 1 1 34 ALA CB C -4.317 -1.725 -1.417 1.00 . A A . 34 ALA CB 1 1 9 10495 1 1 34 ALA H H -1.559 -1.875 -2.912 1.00 . A A . 34 ALA H 1 1 9 10496 1 1 34 ALA HA H -2.609 -2.250 -0.231 1.00 . A A . 34 ALA HA 1 1 9 10497 1 1 34 ALA HB1 H -4.587 -1.153 -0.529 1.00 . A A . 34 ALA HB1 1 1 9 10498 1 1 34 ALA HB2 H -4.360 -1.058 -2.278 1.00 . A A . 34 ALA HB2 1 1 9 10499 1 1 34 ALA HB3 H -5.061 -2.511 -1.547 1.00 . A A . 34 ALA HB3 1 1 9 10500 1 1 34 ALA N N -1.947 -1.579 -2.037 1.00 . A A . 34 ALA N 1 1 9 10501 1 1 34 ALA O O -3.398 -4.218 -2.707 1.00 . A A . 34 ALA O 1 1 9 10502 1 1 35 PRO C C -0.403 -5.509 -1.824 1.00 . A A . 35 PRO C 1 1 9 10503 1 1 35 PRO CA C -0.990 -4.861 -0.568 1.00 . A A . 35 PRO CA 1 1 9 10504 1 1 35 PRO CB C -0.859 -5.795 0.641 1.00 . A A . 35 PRO CB 1 1 9 10505 1 1 35 PRO CD C -3.236 -5.207 0.342 1.00 . A A . 35 PRO CD 1 1 9 10506 1 1 35 PRO CG C -2.271 -6.026 1.201 1.00 . A A . 35 PRO CG 1 1 9 10507 1 1 35 PRO HA H -0.466 -3.923 -0.389 1.00 . A A . 35 PRO HA 1 1 9 10508 1 1 35 PRO HB2 H -0.411 -6.744 0.354 1.00 . A A . 35 PRO HB2 1 1 9 10509 1 1 35 PRO HB3 H -0.217 -5.352 1.401 1.00 . A A . 35 PRO HB3 1 1 9 10510 1 1 35 PRO HD2 H -4.003 -5.829 -0.118 1.00 . A A . 35 PRO HD2 1 1 9 10511 1 1 35 PRO HD3 H -3.727 -4.433 0.931 1.00 . A A . 35 PRO HD3 1 1 9 10512 1 1 35 PRO HG2 H -2.529 -7.084 1.161 1.00 . A A . 35 PRO HG2 1 1 9 10513 1 1 35 PRO HG3 H -2.326 -5.713 2.244 1.00 . A A . 35 PRO HG3 1 1 9 10514 1 1 35 PRO N N -2.414 -4.596 -0.686 1.00 . A A . 35 PRO N 1 1 9 10515 1 1 35 PRO O O -1.081 -6.190 -2.584 1.00 . A A . 35 PRO O 1 1 9 10516 1 1 36 ILE C C 1.346 -7.668 -2.119 1.00 . A A . 36 ILE C 1 1 9 10517 1 1 36 ILE CA C 1.824 -6.251 -2.508 1.00 . A A . 36 ILE CA 1 1 9 10518 1 1 36 ILE CB C 3.218 -5.895 -1.975 1.00 . A A . 36 ILE CB 1 1 9 10519 1 1 36 ILE CD1 C 5.028 -7.537 -1.316 1.00 . A A . 36 ILE CD1 1 1 9 10520 1 1 36 ILE CG1 C 4.338 -6.814 -2.462 1.00 . A A . 36 ILE CG1 1 1 9 10521 1 1 36 ILE CG2 C 3.206 -5.719 -0.459 1.00 . A A . 36 ILE CG2 1 1 9 10522 1 1 36 ILE H H 1.259 -4.337 -1.730 1.00 . A A . 36 ILE H 1 1 9 10523 1 1 36 ILE HA H 1.820 -6.138 -3.589 1.00 . A A . 36 ILE HA 1 1 9 10524 1 1 36 ILE HB H 3.467 -4.919 -2.380 1.00 . A A . 36 ILE HB 1 1 9 10525 1 1 36 ILE HD11 H 5.458 -8.474 -1.667 1.00 . A A . 36 ILE HD11 1 1 9 10526 1 1 36 ILE HD12 H 5.819 -6.918 -0.897 1.00 . A A . 36 ILE HD12 1 1 9 10527 1 1 36 ILE HD13 H 4.321 -7.766 -0.525 1.00 . A A . 36 ILE HD13 1 1 9 10528 1 1 36 ILE HG12 H 3.971 -7.543 -3.174 1.00 . A A . 36 ILE HG12 1 1 9 10529 1 1 36 ILE HG13 H 5.074 -6.216 -2.999 1.00 . A A . 36 ILE HG13 1 1 9 10530 1 1 36 ILE HG21 H 4.211 -5.537 -0.074 1.00 . A A . 36 ILE HG21 1 1 9 10531 1 1 36 ILE HG22 H 2.575 -4.875 -0.182 1.00 . A A . 36 ILE HG22 1 1 9 10532 1 1 36 ILE HG23 H 2.811 -6.599 0.045 1.00 . A A . 36 ILE HG23 1 1 9 10533 1 1 36 ILE N N 0.910 -5.244 -1.979 1.00 . A A . 36 ILE N 1 1 9 10534 1 1 36 ILE O O 0.488 -7.839 -1.263 1.00 . A A . 36 ILE O 1 1 9 10535 1 1 37 PRO C C 2.820 -9.617 -0.637 1.00 . A A . 37 PRO C 1 1 9 10536 1 1 37 PRO CA C 2.409 -9.876 -2.090 1.00 . A A . 37 PRO CA 1 1 9 10537 1 1 37 PRO CB C 3.565 -10.362 -2.962 1.00 . A A . 37 PRO CB 1 1 9 10538 1 1 37 PRO CD C 2.231 -8.692 -4.207 1.00 . A A . 37 PRO CD 1 1 9 10539 1 1 37 PRO CG C 3.350 -9.732 -4.353 1.00 . A A . 37 PRO CG 1 1 9 10540 1 1 37 PRO HA H 1.611 -10.619 -2.090 1.00 . A A . 37 PRO HA 1 1 9 10541 1 1 37 PRO HB2 H 4.516 -10.042 -2.536 1.00 . A A . 37 PRO HB2 1 1 9 10542 1 1 37 PRO HB3 H 3.580 -11.448 -3.019 1.00 . A A . 37 PRO HB3 1 1 9 10543 1 1 37 PRO HD2 H 2.552 -7.709 -4.551 1.00 . A A . 37 PRO HD2 1 1 9 10544 1 1 37 PRO HD3 H 1.342 -8.983 -4.768 1.00 . A A . 37 PRO HD3 1 1 9 10545 1 1 37 PRO HG2 H 4.267 -9.262 -4.710 1.00 . A A . 37 PRO HG2 1 1 9 10546 1 1 37 PRO HG3 H 3.068 -10.496 -5.077 1.00 . A A . 37 PRO HG3 1 1 9 10547 1 1 37 PRO N N 1.939 -8.688 -2.781 1.00 . A A . 37 PRO N 1 1 9 10548 1 1 37 PRO O O 2.340 -8.691 0.002 1.00 . A A . 37 PRO O 1 1 9 10549 1 1 38 HIS C C 2.776 -10.061 2.115 1.00 . A A . 38 HIS C 1 1 9 10550 1 1 38 HIS CA C 3.575 -11.012 1.206 1.00 . A A . 38 HIS CA 1 1 9 10551 1 1 38 HIS CB C 4.939 -11.424 1.781 1.00 . A A . 38 HIS CB 1 1 9 10552 1 1 38 HIS CD2 C 5.871 -9.106 1.244 1.00 . A A . 38 HIS CD2 1 1 9 10553 1 1 38 HIS CE1 C 8.064 -9.522 1.271 1.00 . A A . 38 HIS CE1 1 1 9 10554 1 1 38 HIS CG C 6.019 -10.411 1.528 1.00 . A A . 38 HIS CG 1 1 9 10555 1 1 38 HIS H H 4.506 -10.765 -0.711 1.00 . A A . 38 HIS H 1 1 9 10556 1 1 38 HIS HA H 2.979 -11.904 1.135 1.00 . A A . 38 HIS HA 1 1 9 10557 1 1 38 HIS HB2 H 4.824 -11.554 2.863 1.00 . A A . 38 HIS HB2 1 1 9 10558 1 1 38 HIS HB3 H 5.242 -12.382 1.350 1.00 . A A . 38 HIS HB3 1 1 9 10559 1 1 38 HIS HD1 H 7.871 -11.541 1.874 1.00 . A A . 38 HIS HD1 1 1 9 10560 1 1 38 HIS HD2 H 4.931 -8.591 1.172 1.00 . A A . 38 HIS HD2 1 1 9 10561 1 1 38 HIS HE1 H 9.145 -9.396 1.271 1.00 . A A . 38 HIS HE1 1 1 9 10562 1 1 38 HIS N N 3.726 -10.489 -0.149 1.00 . A A . 38 HIS N 1 1 9 10563 1 1 38 HIS ND1 N 7.461 -10.686 1.556 1.00 . A A . 38 HIS ND1 1 1 9 10564 1 1 38 HIS NE2 N 7.205 -8.511 1.057 1.00 . A A . 38 HIS NE2 1 1 9 10565 1 1 38 HIS O O 1.599 -9.790 1.907 1.00 . A A . 38 HIS O 1 1 9 10566 1 1 39 GLU C C 1.509 -8.777 4.260 1.00 . A A . 39 GLU C 1 1 9 10567 1 1 39 GLU CA C 2.893 -9.419 4.427 1.00 . A A . 39 GLU CA 1 1 9 10568 1 1 39 GLU CB C 3.784 -8.543 5.302 1.00 . A A . 39 GLU CB 1 1 9 10569 1 1 39 GLU CD C 5.255 -10.251 6.382 1.00 . A A . 39 GLU CD 1 1 9 10570 1 1 39 GLU CG C 5.206 -9.088 5.389 1.00 . A A . 39 GLU CG 1 1 9 10571 1 1 39 GLU H H 4.478 -9.756 2.953 1.00 . A A . 39 GLU H 1 1 9 10572 1 1 39 GLU HA H 2.818 -10.419 4.844 1.00 . A A . 39 GLU HA 1 1 9 10573 1 1 39 GLU HB2 H 3.802 -7.540 4.876 1.00 . A A . 39 GLU HB2 1 1 9 10574 1 1 39 GLU HB3 H 3.365 -8.487 6.309 1.00 . A A . 39 GLU HB3 1 1 9 10575 1 1 39 GLU HG2 H 5.529 -9.442 4.412 1.00 . A A . 39 GLU HG2 1 1 9 10576 1 1 39 GLU HG3 H 5.901 -8.313 5.711 1.00 . A A . 39 GLU HG3 1 1 9 10577 1 1 39 GLU N N 3.509 -9.600 3.129 1.00 . A A . 39 GLU N 1 1 9 10578 1 1 39 GLU O O 1.311 -7.883 3.446 1.00 . A A . 39 GLU O 1 1 9 10579 1 1 39 GLU OE1 O 4.675 -10.128 7.459 1.00 . A A . 39 GLU OE1 1 1 9 10580 1 1 39 GLU OE2 O 5.873 -11.267 6.066 1.00 . A A . 39 GLU OE2 1 1 9 10581 1 1 40 PRO C C -0.497 -7.359 6.231 1.00 . A A . 40 PRO C 1 1 9 10582 1 1 40 PRO CA C -0.691 -8.588 5.342 1.00 . A A . 40 PRO CA 1 1 9 10583 1 1 40 PRO CB C -1.578 -9.606 6.064 1.00 . A A . 40 PRO CB 1 1 9 10584 1 1 40 PRO CD C 0.638 -10.615 5.661 1.00 . A A . 40 PRO CD 1 1 9 10585 1 1 40 PRO CG C -0.729 -10.864 6.302 1.00 . A A . 40 PRO CG 1 1 9 10586 1 1 40 PRO HA H -1.139 -8.272 4.400 1.00 . A A . 40 PRO HA 1 1 9 10587 1 1 40 PRO HB2 H -1.933 -9.200 7.011 1.00 . A A . 40 PRO HB2 1 1 9 10588 1 1 40 PRO HB3 H -2.452 -9.845 5.459 1.00 . A A . 40 PRO HB3 1 1 9 10589 1 1 40 PRO HD2 H 1.436 -10.643 6.403 1.00 . A A . 40 PRO HD2 1 1 9 10590 1 1 40 PRO HD3 H 0.855 -11.353 4.889 1.00 . A A . 40 PRO HD3 1 1 9 10591 1 1 40 PRO HG2 H -0.620 -11.054 7.370 1.00 . A A . 40 PRO HG2 1 1 9 10592 1 1 40 PRO HG3 H -1.207 -11.738 5.859 1.00 . A A . 40 PRO HG3 1 1 9 10593 1 1 40 PRO N N 0.555 -9.289 5.071 1.00 . A A . 40 PRO N 1 1 9 10594 1 1 40 PRO O O -1.058 -7.249 7.314 1.00 . A A . 40 PRO O 1 1 9 10595 1 1 41 HIS C C 0.007 -4.409 4.271 1.00 . A A . 41 HIS C 1 1 9 10596 1 1 41 HIS CA C -0.090 -5.051 5.659 1.00 . A A . 41 HIS CA 1 1 9 10597 1 1 41 HIS CB C 0.728 -4.245 6.663 1.00 . A A . 41 HIS CB 1 1 9 10598 1 1 41 HIS CD2 C 3.172 -3.577 6.335 1.00 . A A . 41 HIS CD2 1 1 9 10599 1 1 41 HIS CE1 C 4.183 -5.554 6.551 1.00 . A A . 41 HIS CE1 1 1 9 10600 1 1 41 HIS CG C 2.207 -4.488 6.551 1.00 . A A . 41 HIS CG 1 1 9 10601 1 1 41 HIS H H 1.252 -6.731 5.413 1.00 . A A . 41 HIS H 1 1 9 10602 1 1 41 HIS HA H -1.138 -5.071 5.913 1.00 . A A . 41 HIS HA 1 1 9 10603 1 1 41 HIS HB2 H 0.525 -3.179 6.539 1.00 . A A . 41 HIS HB2 1 1 9 10604 1 1 41 HIS HB3 H 0.409 -4.539 7.658 1.00 . A A . 41 HIS HB3 1 1 9 10605 1 1 41 HIS HD1 H 2.396 -6.661 6.831 1.00 . A A . 41 HIS HD1 1 1 9 10606 1 1 41 HIS HD2 H 3.011 -2.526 6.180 1.00 . A A . 41 HIS HD2 1 1 9 10607 1 1 41 HIS HE1 H 4.939 -6.332 6.624 1.00 . A A . 41 HIS HE1 1 1 9 10608 1 1 41 HIS N N 0.336 -6.448 5.697 1.00 . A A . 41 HIS N 1 1 9 10609 1 1 41 HIS ND1 N 2.869 -5.793 6.676 1.00 . A A . 41 HIS ND1 1 1 9 10610 1 1 41 HIS NE2 N 4.477 -4.258 6.346 1.00 . A A . 41 HIS NE2 1 1 9 10611 1 1 41 HIS O O -0.760 -3.531 3.896 1.00 . A A . 41 HIS O 1 1 9 10612 1 1 42 ARG C C 1.335 -3.105 1.951 1.00 . A A . 42 ARG C 1 1 9 10613 1 1 42 ARG CA C 1.977 -4.023 2.972 1.00 . A A . 42 ARG CA 1 1 9 10614 1 1 42 ARG CB C 3.086 -4.775 2.258 1.00 . A A . 42 ARG CB 1 1 9 10615 1 1 42 ARG CD C 4.885 -6.430 2.859 1.00 . A A . 42 ARG CD 1 1 9 10616 1 1 42 ARG CG C 4.237 -5.090 3.201 1.00 . A A . 42 ARG CG 1 1 9 10617 1 1 42 ARG CZ C 7.199 -5.974 2.404 1.00 . A A . 42 ARG CZ 1 1 9 10618 1 1 42 ARG H H 1.146 -5.862 3.861 1.00 . A A . 42 ARG H 1 1 9 10619 1 1 42 ARG HA H 2.378 -3.425 3.792 1.00 . A A . 42 ARG HA 1 1 9 10620 1 1 42 ARG HB2 H 2.676 -5.679 1.815 1.00 . A A . 42 ARG HB2 1 1 9 10621 1 1 42 ARG HB3 H 3.464 -4.162 1.440 1.00 . A A . 42 ARG HB3 1 1 9 10622 1 1 42 ARG HD2 H 5.312 -6.913 3.735 1.00 . A A . 42 ARG HD2 1 1 9 10623 1 1 42 ARG HD3 H 4.178 -7.113 2.387 1.00 . A A . 42 ARG HD3 1 1 9 10624 1 1 42 ARG HE H 5.804 -6.262 0.933 1.00 . A A . 42 ARG HE 1 1 9 10625 1 1 42 ARG HG2 H 4.989 -4.299 3.125 1.00 . A A . 42 ARG HG2 1 1 9 10626 1 1 42 ARG HG3 H 3.846 -5.088 4.221 1.00 . A A . 42 ARG HG3 1 1 9 10627 1 1 42 ARG HH11 H 7.405 -7.703 3.436 1.00 . A A . 42 ARG HH11 1 1 9 10628 1 1 42 ARG HH12 H 8.398 -6.392 3.980 1.00 . A A . 42 ARG HH12 1 1 9 10629 1 1 42 ARG HH21 H 7.451 -4.207 1.446 1.00 . A A . 42 ARG HH21 1 1 9 10630 1 1 42 ARG HH22 H 8.898 -4.927 2.069 1.00 . A A . 42 ARG HH22 1 1 9 10631 1 1 42 ARG N N 1.007 -4.924 3.560 1.00 . A A . 42 ARG N 1 1 9 10632 1 1 42 ARG NE N 5.968 -6.221 1.918 1.00 . A A . 42 ARG NE 1 1 9 10633 1 1 42 ARG NH1 N 7.709 -6.754 3.352 1.00 . A A . 42 ARG NH1 1 1 9 10634 1 1 42 ARG NH2 N 7.908 -4.950 1.933 1.00 . A A . 42 ARG NH2 1 1 9 10635 1 1 42 ARG O O 0.188 -3.239 1.545 1.00 . A A . 42 ARG O 1 1 9 10636 1 1 43 CYS C C 3.317 -1.596 -0.507 1.00 . A A . 43 CYS C 1 1 9 10637 1 1 43 CYS CA C 2.049 -1.467 0.341 1.00 . A A . 43 CYS CA 1 1 9 10638 1 1 43 CYS CB C 1.733 -0.019 0.681 1.00 . A A . 43 CYS CB 1 1 9 10639 1 1 43 CYS H H 2.639 -1.685 2.360 1.00 . A A . 43 CYS H 1 1 9 10640 1 1 43 CYS HA H 1.183 -1.902 -0.158 1.00 . A A . 43 CYS HA 1 1 9 10641 1 1 43 CYS HB2 H 2.071 0.661 -0.099 1.00 . A A . 43 CYS HB2 1 1 9 10642 1 1 43 CYS HB3 H 0.658 0.006 0.716 1.00 . A A . 43 CYS HB3 1 1 9 10643 1 1 43 CYS N N 2.202 -2.148 1.600 1.00 . A A . 43 CYS N 1 1 9 10644 1 1 43 CYS O O 4.420 -1.285 -0.073 1.00 . A A . 43 CYS O 1 1 9 10645 1 1 43 CYS SG S 2.319 0.570 2.290 1.00 . A A . 43 CYS SG 1 1 9 10646 1 1 44 GLN C C 3.574 -2.168 -4.132 1.00 . A A . 44 GLN C 1 1 9 10647 1 1 44 GLN CA C 4.148 -2.019 -2.721 1.00 . A A . 44 GLN CA 1 1 9 10648 1 1 44 GLN CB C 5.151 -3.139 -2.459 1.00 . A A . 44 GLN CB 1 1 9 10649 1 1 44 GLN CD C 7.580 -3.556 -2.885 1.00 . A A . 44 GLN CD 1 1 9 10650 1 1 44 GLN CG C 6.567 -2.606 -2.245 1.00 . A A . 44 GLN CG 1 1 9 10651 1 1 44 GLN H H 2.185 -2.461 -1.970 1.00 . A A . 44 GLN H 1 1 9 10652 1 1 44 GLN HA H 4.613 -1.038 -2.618 1.00 . A A . 44 GLN HA 1 1 9 10653 1 1 44 GLN HB2 H 4.841 -3.714 -1.586 1.00 . A A . 44 GLN HB2 1 1 9 10654 1 1 44 GLN HB3 H 5.142 -3.821 -3.308 1.00 . A A . 44 GLN HB3 1 1 9 10655 1 1 44 GLN HE21 H 7.555 -4.999 -1.449 1.00 . A A . 44 GLN HE21 1 1 9 10656 1 1 44 GLN HE22 H 7.314 -5.564 -3.091 1.00 . A A . 44 GLN HE22 1 1 9 10657 1 1 44 GLN HG2 H 6.677 -1.617 -2.690 1.00 . A A . 44 GLN HG2 1 1 9 10658 1 1 44 GLN HG3 H 6.787 -2.519 -1.180 1.00 . A A . 44 GLN HG3 1 1 9 10659 1 1 44 GLN N N 3.079 -2.075 -1.741 1.00 . A A . 44 GLN N 1 1 9 10660 1 1 44 GLN NE2 N 7.474 -4.819 -2.435 1.00 . A A . 44 GLN NE2 1 1 9 10661 1 1 44 GLN O O 3.503 -3.255 -4.691 1.00 . A A . 44 GLN O 1 1 9 10662 1 1 44 GLN OE1 O 8.390 -3.172 -3.721 1.00 . A A . 44 GLN OE1 1 1 9 10663 1 1 45 MET C C 0.820 -1.762 -4.315 1.00 . A A . 45 MET C 1 1 9 10664 1 1 45 MET CA C 1.765 -0.708 -4.920 1.00 . A A . 45 MET CA 1 1 9 10665 1 1 45 MET CB C 1.516 -0.614 -6.428 1.00 . A A . 45 MET CB 1 1 9 10666 1 1 45 MET CE C 2.829 2.115 -9.263 1.00 . A A . 45 MET CE 1 1 9 10667 1 1 45 MET CG C 2.481 0.296 -7.194 1.00 . A A . 45 MET CG 1 1 9 10668 1 1 45 MET H H 3.878 -0.327 -4.883 1.00 . A A . 45 MET H 1 1 9 10669 1 1 45 MET HA H 1.545 0.239 -4.428 1.00 . A A . 45 MET HA 1 1 9 10670 1 1 45 MET HB2 H 1.566 -1.614 -6.857 1.00 . A A . 45 MET HB2 1 1 9 10671 1 1 45 MET HB3 H 0.500 -0.254 -6.574 1.00 . A A . 45 MET HB3 1 1 9 10672 1 1 45 MET HE1 H 2.488 1.938 -10.282 1.00 . A A . 45 MET HE1 1 1 9 10673 1 1 45 MET HE2 H 3.032 3.178 -9.136 1.00 . A A . 45 MET HE2 1 1 9 10674 1 1 45 MET HE3 H 3.771 1.593 -9.131 1.00 . A A . 45 MET HE3 1 1 9 10675 1 1 45 MET HG2 H 3.210 0.752 -6.525 1.00 . A A . 45 MET HG2 1 1 9 10676 1 1 45 MET HG3 H 3.028 -0.305 -7.918 1.00 . A A . 45 MET HG3 1 1 9 10677 1 1 45 MET N N 3.173 -0.998 -4.661 1.00 . A A . 45 MET N 1 1 9 10678 1 1 45 MET O O 1.157 -2.495 -3.393 1.00 . A A . 45 MET O 1 1 9 10679 1 1 45 MET SD S 1.575 1.586 -8.075 1.00 . A A . 45 MET SD 1 1 9 10680 1 1 46 PHE C C -1.395 -2.764 -6.914 1.00 . A A . 46 PHE C 1 1 9 10681 1 1 46 PHE CA C -0.826 -3.011 -5.507 1.00 . A A . 46 PHE CA 1 1 9 10682 1 1 46 PHE CB C -1.890 -3.638 -4.620 1.00 . A A . 46 PHE CB 1 1 9 10683 1 1 46 PHE CD1 C -1.510 -6.083 -5.253 1.00 . A A . 46 PHE CD1 1 1 9 10684 1 1 46 PHE CD2 C -3.765 -5.078 -5.570 1.00 . A A . 46 PHE CD2 1 1 9 10685 1 1 46 PHE CE1 C -1.999 -7.341 -5.752 1.00 . A A . 46 PHE CE1 1 1 9 10686 1 1 46 PHE CE2 C -4.257 -6.334 -6.071 1.00 . A A . 46 PHE CE2 1 1 9 10687 1 1 46 PHE CG C -2.391 -4.947 -5.157 1.00 . A A . 46 PHE CG 1 1 9 10688 1 1 46 PHE CZ C -3.373 -7.465 -6.163 1.00 . A A . 46 PHE CZ 1 1 9 10689 1 1 46 PHE H H -1.043 -1.021 -4.710 1.00 . A A . 46 PHE H 1 1 9 10690 1 1 46 PHE HA H 0.047 -3.662 -5.545 1.00 . A A . 46 PHE HA 1 1 9 10691 1 1 46 PHE HB2 H -1.491 -3.790 -3.618 1.00 . A A . 46 PHE HB2 1 1 9 10692 1 1 46 PHE HB3 H -2.725 -2.949 -4.535 1.00 . A A . 46 PHE HB3 1 1 9 10693 1 1 46 PHE HD1 H -0.478 -5.991 -4.948 1.00 . A A . 46 PHE HD1 1 1 9 10694 1 1 46 PHE HD2 H -4.430 -4.230 -5.502 1.00 . A A . 46 PHE HD2 1 1 9 10695 1 1 46 PHE HE1 H -1.338 -8.192 -5.816 1.00 . A A . 46 PHE HE1 1 1 9 10696 1 1 46 PHE HE2 H -5.289 -6.428 -6.376 1.00 . A A . 46 PHE HE2 1 1 9 10697 1 1 46 PHE HZ H -3.740 -8.407 -6.542 1.00 . A A . 46 PHE HZ 1 1 9 10698 1 1 46 PHE N N -0.399 -1.770 -4.887 1.00 . A A . 46 PHE N 1 1 9 10699 1 1 46 PHE O O -2.474 -3.234 -7.252 1.00 . A A . 46 PHE O 1 1 9 10700 1 1 47 CYS C C -2.624 -0.698 -8.329 1.30 . A A . 47 CYS C 1 1 9 10701 1 1 47 CYS CA C -1.116 -0.922 -8.534 0.80 . A A . 47 CYS CA 1 1 9 10702 1 1 47 CYS CB C -0.781 -1.174 -10.008 0.60 . A A . 47 CYS CB 1 1 9 10703 1 1 47 CYS H H 0.378 -2.221 -7.742 1.00 . A A . 47 CYS H 1 1 9 10704 1 1 47 CYS HA H -0.593 -0.022 -8.208 1.10 . A A . 47 CYS HA 1 1 9 10705 1 1 47 CYS HB2 H -0.020 -1.950 -10.085 0.90 . A A . 47 CYS HB2 1 1 9 10706 1 1 47 CYS HB3 H -1.654 -1.541 -10.548 0.90 . A A . 47 CYS HB3 1 1 9 10707 1 1 47 CYS N N -0.600 -2.015 -7.709 0.60 . A A . 47 CYS N 1 1 9 10708 1 1 47 CYS O O -3.049 0.232 -7.654 1.90 . A A . 47 CYS O 1 1 9 10709 1 1 47 CYS SG S -0.171 0.310 -10.849 1.30 . A A . 47 CYS SG 1 1 9 10710 1 1 48 ASN C C -5.397 -0.235 -9.240 1.90 . A A . 48 ASN C 1 1 9 10711 1 1 48 ASN CA C -4.830 -1.567 -8.746 2.30 . A A . 48 ASN CA 1 1 9 10712 1 1 48 ASN CB C -5.151 -1.757 -7.264 3.00 . A A . 48 ASN CB 1 1 9 10713 1 1 48 ASN CG C -6.409 -2.616 -7.117 3.70 . A A . 48 ASN CG 1 1 9 10714 1 1 48 ASN H H -2.983 -2.296 -9.551 2.00 . A A . 48 ASN H 1 1 9 10715 1 1 48 ASN HA H -5.249 -2.376 -9.344 2.70 . A A . 48 ASN HA 1 1 9 10716 1 1 48 ASN HB2 H -4.326 -2.248 -6.749 3.30 . A A . 48 ASN HB2 1 1 9 10717 1 1 48 ASN HB3 H -5.321 -0.796 -6.780 3.20 . A A . 48 ASN HB3 1 1 9 10718 1 1 48 ASN HD21 H -7.466 -0.939 -6.611 1.00 . A A . 48 ASN HD21 1 1 9 10719 1 1 48 ASN N N -3.395 -1.606 -8.955 1.70 . A A . 48 ASN N 1 1 9 10720 1 1 48 ASN ND2 N -7.452 -1.939 -6.606 4.10 . A A . 48 ASN ND2 1 1 9 10721 1 1 48 ASN O O -4.689 0.624 -9.754 2.30 . A A . 48 ASN O 1 1 9 10722 1 1 48 ASN OD1 O -6.428 -3.797 -7.444 4.40 . A A . 48 ASN OD1 1 1 9 10723 1 1 49 GLN C C -7.134 0.551 -11.349 1.80 . A A . 49 GLN C 1 1 9 10724 1 1 49 GLN CA C -7.476 0.786 -9.876 2.00 . A A . 49 GLN CA 1 1 9 10725 1 1 49 GLN CB C -7.148 2.225 -9.476 2.20 . A A . 49 GLN CB 1 1 9 10726 1 1 49 GLN CD C -9.157 3.183 -8.325 3.40 . A A . 49 GLN CD 1 1 9 10727 1 1 49 GLN CG C -8.355 3.151 -9.628 2.70 . A A . 49 GLN CG 1 1 9 10728 1 1 49 GLN H H -7.176 -0.672 -8.334 2.50 . A A . 49 GLN H 1 1 9 10729 1 1 49 GLN HA H -8.530 0.564 -9.708 2.50 . A A . 49 GLN HA 1 1 9 10730 1 1 49 GLN HB2 H -6.798 2.244 -8.444 2.60 . A A . 49 GLN HB2 1 1 9 10731 1 1 49 GLN HB3 H -6.326 2.594 -10.090 2.10 . A A . 49 GLN HB3 1 1 9 10732 1 1 49 GLN HE21 H -7.947 3.804 -6.810 4.10 . A A . 49 GLN HE21 1 1 9 10733 1 1 49 GLN HE22 H -9.078 5.001 -7.413 4.50 . A A . 49 GLN HE22 1 1 9 10734 1 1 49 GLN HG2 H -8.033 4.164 -9.870 2.70 . A A . 49 GLN HG2 1 1 9 10735 1 1 49 GLN HG3 H -9.003 2.807 -10.433 2.80 . A A . 49 GLN HG3 1 1 9 10736 1 1 49 GLN N N -6.724 -0.133 -9.044 2.00 . A A . 49 GLN N 1 1 9 10737 1 1 49 GLN NE2 N -8.685 4.076 -7.437 4.00 . A A . 49 GLN NE2 1 1 9 10738 1 1 49 GLN O O -6.070 0.052 -11.695 2.20 . A A . 49 GLN O 1 1 9 10739 1 1 49 GLN OE1 O -10.127 2.457 -8.144 3.70 . A A . 49 GLN OE1 1 1 9 10740 1 1 50 THR C C -7.519 3.046 -13.280 1.50 . A A . 50 THR C 1 1 9 10741 1 1 50 THR CA C -7.733 1.540 -13.455 1.80 . A A . 50 THR CA 1 1 9 10742 1 1 50 THR CB C -8.821 1.277 -14.498 1.90 . A A . 50 THR CB 1 1 9 10743 1 1 50 THR CG2 C -8.424 0.156 -15.460 2.30 . A A . 50 THR CG2 1 1 9 10744 1 1 50 THR H H -9.074 0.808 -11.951 2.00 . A A . 50 THR H 1 1 9 10745 1 1 50 THR HA H -6.792 1.074 -13.747 2.10 . A A . 50 THR HA 1 1 9 10746 1 1 50 THR HB H -9.009 2.188 -15.065 2.20 . A A . 50 THR HB 1 1 9 10747 1 1 50 THR HG1 H -10.006 1.363 -13.007 2.50 . A A . 50 THR HG1 1 1 9 10748 1 1 50 THR HG21 H -8.312 0.534 -16.476 2.40 . A A . 50 THR HG21 1 1 9 10749 1 1 50 THR HG22 H -9.180 -0.628 -15.475 2.60 . A A . 50 THR HG22 1 1 9 10750 1 1 50 THR HG23 H -7.477 -0.293 -15.160 2.80 . A A . 50 THR HG23 1 1 9 10751 1 1 50 THR N N -8.111 0.945 -12.187 1.70 . A A . 50 THR N 1 1 9 10752 1 1 50 THR O O -7.905 3.643 -12.282 2.20 . A A . 50 THR O 1 1 9 10753 1 1 50 THR OG1 O -10.021 0.934 -13.852 2.20 . A A . 50 THR OG1 1 1 9 10754 1 1 51 ALA C C -4.702 2.784 -13.492 0.60 . A A . 51 ALA C 1 1 9 10755 1 1 51 ALA CA C -5.574 3.097 -14.714 0.60 . A A . 51 ALA CA 1 1 9 10756 1 1 51 ALA CB C -4.857 4.123 -15.589 0.70 . A A . 51 ALA CB 1 1 9 10757 1 1 51 ALA H H -7.360 4.265 -14.901 0.90 . A A . 51 ALA H 1 1 9 10758 1 1 51 ALA HA H -5.763 2.186 -15.281 0.70 . A A . 51 ALA HA 1 1 9 10759 1 1 51 ALA HB1 H -4.082 4.638 -15.022 1.20 . A A . 51 ALA HB1 1 1 9 10760 1 1 51 ALA HB2 H -5.551 4.873 -15.966 1.00 . A A . 51 ALA HB2 1 1 9 10761 1 1 51 ALA HB3 H -4.388 3.635 -16.443 1.30 . A A . 51 ALA HB3 1 1 9 10762 1 1 51 ALA N N -6.875 3.612 -14.318 0.80 . A A . 51 ALA N 1 1 9 10763 1 1 51 ALA O O -5.165 2.688 -12.363 1.10 . A A . 51 ALA O 1 1 9 10764 1 1 52 CYS C C -1.962 4.625 -13.877 0.80 . A A . 52 CYS C 1 1 9 10765 1 1 52 CYS CA C -2.438 3.419 -13.055 0.80 . A A . 52 CYS CA 1 1 9 10766 1 1 52 CYS CB C -1.284 2.530 -12.602 0.90 . A A . 52 CYS CB 1 1 9 10767 1 1 52 CYS H H -3.103 1.878 -14.388 0.90 . A A . 52 CYS H 1 1 9 10768 1 1 52 CYS HA H -2.959 3.767 -12.169 0.80 . A A . 52 CYS HA 1 1 9 10769 1 1 52 CYS HB2 H -0.748 2.159 -13.469 1.00 . A A . 52 CYS HB2 1 1 9 10770 1 1 52 CYS HB3 H -0.576 3.107 -12.008 1.10 . A A . 52 CYS HB3 1 1 9 10771 1 1 52 CYS N N -3.401 2.633 -13.803 0.70 . A A . 52 CYS N 1 1 9 10772 1 1 52 CYS O O -2.169 5.775 -13.506 1.20 . A A . 52 CYS O 1 1 9 10773 1 1 52 CYS SG S -1.874 1.123 -11.625 1.00 . A A . 52 CYS SG 1 1 9 10774 1 1 53 PRO C C 0.711 5.711 -14.723 0.80 . A A . 53 PRO C 1 1 9 10775 1 1 53 PRO CA C 0.133 4.356 -15.141 0.70 . A A . 53 PRO CA 1 1 9 10776 1 1 53 PRO CB C 0.429 4.107 -16.623 0.90 . A A . 53 PRO CB 1 1 9 10777 1 1 53 PRO CD C -2.006 3.968 -16.253 0.80 . A A . 53 PRO CD 1 1 9 10778 1 1 53 PRO CG C -0.919 3.897 -17.328 0.90 . A A . 53 PRO CG 1 1 9 10779 1 1 53 PRO HA H 0.578 3.576 -14.524 0.80 . A A . 53 PRO HA 1 1 9 10780 1 1 53 PRO HB2 H 0.959 4.957 -17.052 1.00 . A A . 53 PRO HB2 1 1 9 10781 1 1 53 PRO HB3 H 1.067 3.232 -16.743 1.10 . A A . 53 PRO HB3 1 1 9 10782 1 1 53 PRO HD2 H -2.737 4.741 -16.489 0.80 . A A . 53 PRO HD2 1 1 9 10783 1 1 53 PRO HD3 H -2.519 3.012 -16.150 0.90 . A A . 53 PRO HD3 1 1 9 10784 1 1 53 PRO HG2 H -1.079 4.673 -18.077 0.90 . A A . 53 PRO HG2 1 1 9 10785 1 1 53 PRO HG3 H -0.944 2.937 -17.844 1.00 . A A . 53 PRO HG3 1 1 9 10786 1 1 53 PRO N N -1.314 4.302 -15.019 0.60 . A A . 53 PRO N 1 1 9 10787 1 1 53 PRO O O 0.007 6.626 -14.312 1.60 . A A . 53 PRO O 1 1 9 10788 1 1 54 ALA C C 2.150 8.166 -15.409 0.90 . A A . 54 ALA C 1 1 9 10789 1 1 54 ALA CA C 2.799 6.975 -14.687 0.80 . A A . 54 ALA CA 1 1 9 10790 1 1 54 ALA CB C 4.210 6.741 -15.226 0.80 . A A . 54 ALA CB 1 1 9 10791 1 1 54 ALA H H 2.542 4.874 -14.872 1.40 . A A . 54 ALA H 1 1 9 10792 1 1 54 ALA HA H 2.847 7.176 -13.621 0.70 . A A . 54 ALA HA 1 1 9 10793 1 1 54 ALA HB1 H 4.954 7.220 -14.589 1.20 . A A . 54 ALA HB1 1 1 9 10794 1 1 54 ALA HB2 H 4.313 7.151 -16.231 1.40 . A A . 54 ALA HB2 1 1 9 10795 1 1 54 ALA HB3 H 4.436 5.676 -15.272 1.30 . A A . 54 ALA HB3 1 1 9 10796 1 1 54 ALA N N 2.049 5.743 -14.851 0.80 . A A . 54 ALA N 1 1 9 10797 1 1 54 ALA O O 0.968 8.186 -15.730 1.50 . A A . 54 ALA O 1 1 9 10798 1 1 55 ASP C C 1.717 10.791 -14.406 1.10 . A A . 55 ASP C 1 1 9 10799 1 1 55 ASP CA C 2.697 10.552 -15.561 1.20 . A A . 55 ASP CA 1 1 9 10800 1 1 55 ASP CB C 2.175 10.968 -16.933 1.40 . A A . 55 ASP CB 1 1 9 10801 1 1 55 ASP CG C 1.330 12.243 -16.873 2.10 . A A . 55 ASP CG 1 1 9 10802 1 1 55 ASP H H 3.978 8.892 -15.860 1.40 . A A . 55 ASP H 1 1 9 10803 1 1 55 ASP HA H 3.627 11.068 -15.328 1.30 . A A . 55 ASP HA 1 1 9 10804 1 1 55 ASP HB2 H 3.012 11.138 -17.609 1.80 . A A . 55 ASP HB2 1 1 9 10805 1 1 55 ASP HB3 H 1.597 10.145 -17.347 1.50 . A A . 55 ASP HB3 1 1 9 10806 1 1 55 ASP N N 3.043 9.147 -15.643 1.00 . A A . 55 ASP N 1 1 9 10807 1 1 55 ASP O O 0.714 11.485 -14.515 1.50 . A A . 55 ASP O 1 1 9 10808 1 1 55 ASP OD1 O 1.908 13.326 -16.789 2.80 . A A . 55 ASP OD1 1 1 9 10809 1 1 55 ASP OD2 O 0.105 12.138 -16.914 2.60 . A A . 55 ASP OD2 1 1 9 10810 1 1 56 CYS C C 2.168 12.169 -11.899 0.80 . A A . 56 CYS C 1 1 9 10811 1 1 56 CYS CA C 1.822 10.683 -11.984 0.80 . A A . 56 CYS CA 1 1 9 10812 1 1 56 CYS CB C 2.686 9.901 -11.006 0.90 . A A . 56 CYS CB 1 1 9 10813 1 1 56 CYS H H 2.448 9.219 -13.245 1.10 . A A . 56 CYS H 1 1 9 10814 1 1 56 CYS HA H 0.771 10.492 -11.771 0.70 . A A . 56 CYS HA 1 1 9 10815 1 1 56 CYS HB2 H 3.471 10.570 -10.665 1.00 . A A . 56 CYS HB2 1 1 9 10816 1 1 56 CYS HB3 H 2.055 9.612 -10.172 0.90 . A A . 56 CYS HB3 1 1 9 10817 1 1 56 CYS N N 2.101 10.154 -13.285 0.90 . A A . 56 CYS N 1 1 9 10818 1 1 56 CYS O O 2.555 12.810 -12.868 1.10 . A A . 56 CYS O 1 1 9 10819 1 1 56 CYS SG S 3.473 8.395 -11.639 1.30 . A A . 56 CYS SG 1 1 9 10820 1 1 57 ASP C C 4.158 13.174 -9.614 0.90 . A A . 57 ASP C 1 1 9 10821 1 1 57 ASP CA C 2.808 13.703 -10.113 1.00 . A A . 57 ASP CA 1 1 9 10822 1 1 57 ASP CB C 1.954 14.245 -8.976 1.10 . A A . 57 ASP CB 1 1 9 10823 1 1 57 ASP CG C 2.152 13.446 -7.684 1.60 . A A . 57 ASP CG 1 1 9 10824 1 1 57 ASP H H 1.215 12.494 -10.060 1.10 . A A . 57 ASP H 1 1 9 10825 1 1 57 ASP HA H 2.959 14.438 -10.903 1.20 . A A . 57 ASP HA 1 1 9 10826 1 1 57 ASP HB2 H 2.190 15.278 -8.817 1.20 . A A . 57 ASP HB2 1 1 9 10827 1 1 57 ASP HB3 H 0.899 14.205 -9.248 1.10 . A A . 57 ASP HB3 1 1 9 10828 1 1 57 ASP N N 1.997 12.653 -10.657 0.80 . A A . 57 ASP N 1 1 9 10829 1 1 57 ASP O O 4.326 12.003 -9.298 1.00 . A A . 57 ASP O 1 1 9 10830 1 1 57 ASP OD1 O 3.211 13.571 -7.072 2.20 . A A . 57 ASP OD1 1 1 9 10831 1 1 57 ASP OD2 O 1.243 12.710 -7.305 2.00 . A A . 57 ASP OD2 1 1 9 10832 1 1 58 PRO C C 5.786 14.167 -7.158 1.20 . A A . 58 PRO C 1 1 9 10833 1 1 58 PRO CA C 6.226 14.071 -8.624 1.20 . A A . 58 PRO CA 1 1 9 10834 1 1 58 PRO CB C 7.116 15.263 -8.988 1.40 . A A . 58 PRO CB 1 1 9 10835 1 1 58 PRO CD C 5.152 15.246 -10.484 1.30 . A A . 58 PRO CD 1 1 9 10836 1 1 58 PRO CG C 6.449 15.991 -10.165 1.50 . A A . 58 PRO CG 1 1 9 10837 1 1 58 PRO HA H 6.766 13.135 -8.764 1.30 . A A . 58 PRO HA 1 1 9 10838 1 1 58 PRO HB2 H 7.227 15.935 -8.137 1.50 . A A . 58 PRO HB2 1 1 9 10839 1 1 58 PRO HB3 H 8.111 14.919 -9.268 1.70 . A A . 58 PRO HB3 1 1 9 10840 1 1 58 PRO HD2 H 4.280 15.883 -10.334 1.30 . A A . 58 PRO HD2 1 1 9 10841 1 1 58 PRO HD3 H 5.143 14.880 -11.511 1.40 . A A . 58 PRO HD3 1 1 9 10842 1 1 58 PRO HG2 H 6.242 17.029 -9.907 1.50 . A A . 58 PRO HG2 1 1 9 10843 1 1 58 PRO HG3 H 7.108 15.993 -11.034 1.70 . A A . 58 PRO HG3 1 1 9 10844 1 1 58 PRO N N 5.114 14.125 -9.561 1.00 . A A . 58 PRO N 1 1 9 10845 1 1 58 PRO O O 6.013 13.265 -6.361 1.50 . A A . 58 PRO O 1 1 9 10846 1 1 59 ASN C C 4.415 15.525 -4.471 1.30 . A A . 59 ASN C 1 1 9 10847 1 1 59 ASN CA C 5.417 15.929 -5.562 1.30 . A A . 59 ASN CA 1 1 9 10848 1 1 59 ASN CB C 5.437 17.448 -5.708 1.50 . A A . 59 ASN CB 1 1 9 10849 1 1 59 ASN CG C 5.497 18.107 -4.328 1.90 . A A . 59 ASN CG 1 1 9 10850 1 1 59 ASN H H 4.509 15.733 -7.501 1.10 . A A . 59 ASN H 1 1 9 10851 1 1 59 ASN HA H 6.370 15.526 -5.269 1.50 . A A . 59 ASN HA 1 1 9 10852 1 1 59 ASN HB2 H 6.305 17.755 -6.292 1.70 . A A . 59 ASN HB2 1 1 9 10853 1 1 59 ASN HB3 H 4.531 17.790 -6.216 1.70 . A A . 59 ASN HB3 1 1 9 10854 1 1 59 ASN HD21 H 3.516 17.705 -4.159 2.10 . A A . 59 ASN HD21 1 1 9 10855 1 1 59 ASN HD22 H 4.175 18.752 -2.915 2.50 . A A . 59 ASN HD22 1 1 9 10856 1 1 59 ASN N N 5.150 15.314 -6.858 1.10 . A A . 59 ASN N 1 1 9 10857 1 1 59 ASN ND2 N 4.288 18.199 -3.747 2.00 . A A . 59 ASN ND2 1 1 9 10858 1 1 59 ASN O O 4.725 15.453 -3.288 1.70 . A A . 59 ASN O 1 1 9 10859 1 1 59 ASN OD1 O 6.549 18.496 -3.837 2.70 . A A . 59 ASN OD1 1 1 9 10860 1 1 60 THR C C 1.659 14.086 -3.498 0.90 . A A . 60 THR C 1 1 9 10861 1 1 60 THR CA C 2.008 15.413 -4.157 1.20 . A A . 60 THR CA 1 1 9 10862 1 1 60 THR CB C 0.815 15.942 -4.967 1.40 . A A . 60 THR CB 1 1 9 10863 1 1 60 THR CG2 C 1.201 16.460 -6.355 1.40 . A A . 60 THR CG2 1 1 9 10864 1 1 60 THR H H 3.289 15.098 -5.952 1.00 . A A . 60 THR H 1 1 9 10865 1 1 60 THR HA H 2.272 16.095 -3.377 1.40 . A A . 60 THR HA 1 1 9 10866 1 1 60 THR HB H 0.340 16.750 -4.409 1.90 . A A . 60 THR HB 1 1 9 10867 1 1 60 THR HG1 H -0.841 15.282 -5.648 2.30 . A A . 60 THR HG1 1 1 9 10868 1 1 60 THR HG21 H 1.392 15.629 -7.034 1.90 . A A . 60 THR HG21 1 1 9 10869 1 1 60 THR HG22 H 2.103 17.071 -6.304 1.80 . A A . 60 THR HG22 1 1 9 10870 1 1 60 THR HG23 H 0.403 17.067 -6.782 1.70 . A A . 60 THR HG23 1 1 9 10871 1 1 60 THR N N 3.206 15.276 -4.973 1.10 . A A . 60 THR N 1 1 9 10872 1 1 60 THR O O 1.489 13.943 -2.294 1.10 . A A . 60 THR O 1 1 9 10873 1 1 60 THR OG1 O -0.147 14.927 -5.110 2.10 . A A . 60 THR OG1 1 1 9 10874 1 1 61 GLN C C 3.073 11.257 -4.192 0.90 . A A . 61 GLN C 1 1 9 10875 1 1 61 GLN CA C 1.627 11.744 -4.094 0.80 . A A . 61 GLN CA 1 1 9 10876 1 1 61 GLN CB C 0.727 10.934 -5.031 1.00 . A A . 61 GLN CB 1 1 9 10877 1 1 61 GLN CD C -1.068 9.184 -4.952 1.90 . A A . 61 GLN CD 1 1 9 10878 1 1 61 GLN CG C 0.290 9.615 -4.392 1.40 . A A . 61 GLN CG 1 1 9 10879 1 1 61 GLN H H 1.679 13.594 -5.325 1.20 . A A . 61 GLN H 1 1 9 10880 1 1 61 GLN HA H 1.288 11.665 -3.061 0.70 . A A . 61 GLN HA 1 1 9 10881 1 1 61 GLN HB2 H -0.149 11.521 -5.303 1.60 . A A . 61 GLN HB2 1 1 9 10882 1 1 61 GLN HB3 H 1.257 10.726 -5.959 1.60 . A A . 61 GLN HB3 1 1 9 10883 1 1 61 GLN HE21 H -0.616 7.295 -5.557 2.60 . A A . 61 GLN HE21 1 1 9 10884 1 1 61 GLN HE22 H -1.264 8.350 -6.800 2.80 . A A . 61 GLN HE22 1 1 9 10885 1 1 61 GLN HG2 H 1.019 8.832 -4.595 1.80 . A A . 61 GLN HG2 1 1 9 10886 1 1 61 GLN HG3 H 0.209 9.720 -3.310 1.90 . A A . 61 GLN HG3 1 1 9 10887 1 1 61 GLN N N 1.571 13.151 -4.437 0.90 . A A . 61 GLN N 1 1 9 10888 1 1 61 GLN NE2 N -0.974 8.188 -5.851 2.40 . A A . 61 GLN NE2 1 1 9 10889 1 1 61 GLN O O 3.945 11.920 -4.741 1.50 . A A . 61 GLN O 1 1 9 10890 1 1 61 GLN OE1 O -2.113 9.711 -4.592 2.40 . A A . 61 GLN OE1 1 1 9 10891 1 1 62 ALA C C 4.275 9.263 -5.725 0.90 . A A . 62 ALA C 1 1 9 10892 1 1 62 ALA CA C 4.177 9.085 -4.201 1.00 . A A . 62 ALA CA 1 1 9 10893 1 1 62 ALA CB C 3.720 7.686 -3.766 1.30 . A A . 62 ALA CB 1 1 9 10894 1 1 62 ALA H H 2.775 9.801 -2.786 1.50 . A A . 62 ALA H 1 1 9 10895 1 1 62 ALA HA H 5.158 9.266 -3.783 1.20 . A A . 62 ALA HA 1 1 9 10896 1 1 62 ALA HB1 H 3.574 7.641 -2.687 1.70 . A A . 62 ALA HB1 1 1 9 10897 1 1 62 ALA HB2 H 4.455 6.929 -4.041 1.60 . A A . 62 ALA HB2 1 1 9 10898 1 1 62 ALA HB3 H 2.775 7.433 -4.245 1.70 . A A . 62 ALA HB3 1 1 9 10899 1 1 62 ALA N N 3.259 10.051 -3.623 1.00 . A A . 62 ALA N 1 1 9 10900 1 1 62 ALA O O 4.845 10.219 -6.237 1.80 . A A . 62 ALA O 1 1 9 10901 1 1 63 SER C C 3.174 7.684 -8.751 0.60 . A A . 63 SER C 1 1 9 10902 1 1 63 SER CA C 2.778 8.497 -7.515 0.50 . A A . 63 SER CA 1 1 9 10903 1 1 63 SER CB C 2.637 9.981 -7.879 0.60 . A A . 63 SER CB 1 1 9 10904 1 1 63 SER H H 3.755 7.415 -5.875 1.20 . A A . 63 SER H 1 1 9 10905 1 1 63 SER HA H 1.844 8.088 -7.184 0.50 . A A . 63 SER HA 1 1 9 10906 1 1 63 SER HB2 H 2.902 10.661 -7.071 1.20 . A A . 63 SER HB2 1 1 9 10907 1 1 63 SER HB3 H 3.282 10.217 -8.722 0.90 . A A . 63 SER HB3 1 1 9 10908 1 1 63 SER HG H 1.096 9.680 -8.965 1.60 . A A . 63 SER HG 1 1 9 10909 1 1 63 SER N N 3.679 8.268 -6.388 0.60 . A A . 63 SER N 1 1 9 10910 1 1 63 SER O O 2.353 7.141 -9.480 1.60 . A A . 63 SER O 1 1 9 10911 1 1 63 SER OG O 1.313 10.268 -8.254 1.30 . A A . 63 SER OG 1 1 9 10912 1 1 64 CYS C C 5.794 5.613 -8.975 0.50 . A A . 64 CYS C 1 1 9 10913 1 1 64 CYS CA C 5.112 6.697 -9.801 0.50 . A A . 64 CYS CA 1 1 9 10914 1 1 64 CYS CB C 6.141 7.378 -10.704 0.50 . A A . 64 CYS CB 1 1 9 10915 1 1 64 CYS H H 4.913 8.161 -8.151 1.40 . A A . 64 CYS H 1 1 9 10916 1 1 64 CYS HA H 4.303 6.259 -10.385 0.60 . A A . 64 CYS HA 1 1 9 10917 1 1 64 CYS HB2 H 7.008 7.678 -10.115 0.70 . A A . 64 CYS HB2 1 1 9 10918 1 1 64 CYS HB3 H 6.508 6.670 -11.449 0.70 . A A . 64 CYS HB3 1 1 9 10919 1 1 64 CYS N N 4.497 7.658 -8.904 0.60 . A A . 64 CYS N 1 1 9 10920 1 1 64 CYS O O 7.013 5.529 -8.895 1.10 . A A . 64 CYS O 1 1 9 10921 1 1 64 CYS SG S 5.465 8.827 -11.549 1.30 . A A . 64 CYS SG 1 1 9 10922 1 1 65 GLU C C 6.317 4.102 -6.527 1.00 . A A . 65 GLU C 1 1 9 10923 1 1 65 GLU CA C 4.971 4.648 -6.937 1.10 . A A . 65 GLU CA 1 1 9 10924 1 1 65 GLU CB C 3.846 3.678 -6.631 1.30 . A A . 65 GLU CB 1 1 9 10925 1 1 65 GLU CD C 1.420 3.576 -5.957 1.90 . A A . 65 GLU CD 1 1 9 10926 1 1 65 GLU CG C 2.483 4.364 -6.720 1.50 . A A . 65 GLU CG 1 1 9 10927 1 1 65 GLU H H 4.266 4.157 -8.741 1.60 . A A . 65 GLU H 1 1 9 10928 1 1 65 GLU HA H 4.822 5.602 -6.491 1.30 . A A . 65 GLU HA 1 1 9 10929 1 1 65 GLU HB2 H 3.898 2.833 -7.313 1.30 . A A . 65 GLU HB2 1 1 9 10930 1 1 65 GLU HB3 H 4.014 3.251 -5.665 1.50 . A A . 65 GLU HB3 1 1 9 10931 1 1 65 GLU HG2 H 2.540 5.367 -6.298 1.70 . A A . 65 GLU HG2 1 1 9 10932 1 1 65 GLU HG3 H 2.173 4.463 -7.761 1.70 . A A . 65 GLU HG3 1 1 9 10933 1 1 65 GLU N N 4.923 4.801 -8.356 1.00 . A A . 65 GLU N 1 1 9 10934 1 1 65 GLU O O 7.134 4.690 -5.829 1.10 . A A . 65 GLU O 1 1 9 10935 1 1 65 GLU OE1 O 1.694 2.444 -5.561 2.40 . A A . 65 GLU OE1 1 1 9 10936 1 1 65 GLU OE2 O 0.327 4.108 -5.767 1.90 . A A . 65 GLU OE2 1 1 9 10937 1 1 66 CYS C C 8.794 2.615 -7.469 0.90 . A A . 66 CYS C 1 1 9 10938 1 1 66 CYS CA C 7.502 2.008 -6.905 1.00 . A A . 66 CYS CA 1 1 9 10939 1 1 66 CYS CB C 7.077 0.766 -7.678 1.20 . A A . 66 CYS CB 1 1 9 10940 1 1 66 CYS H H 5.609 2.556 -7.523 1.10 . A A . 66 CYS H 1 1 9 10941 1 1 66 CYS HA H 7.569 1.825 -5.836 1.10 . A A . 66 CYS HA 1 1 9 10942 1 1 66 CYS HB2 H 7.453 0.808 -8.703 1.20 . A A . 66 CYS HB2 1 1 9 10943 1 1 66 CYS HB3 H 7.527 -0.065 -7.180 1.50 . A A . 66 CYS HB3 1 1 9 10944 1 1 66 CYS N N 6.414 2.900 -7.067 1.00 . A A . 66 CYS N 1 1 9 10945 1 1 66 CYS O O 9.046 3.812 -7.403 1.10 . A A . 66 CYS O 1 1 9 10946 1 1 66 CYS SG S 5.307 0.430 -7.719 1.70 . A A . 66 CYS SG 1 1 9 10947 1 1 67 PRO C C 11.571 1.065 -6.723 0.90 . A A . 67 PRO C 1 1 9 10948 1 1 67 PRO CA C 10.201 0.631 -7.247 0.90 . A A . 67 PRO CA 1 1 9 10949 1 1 67 PRO CB C 10.305 -0.562 -8.205 0.90 . A A . 67 PRO CB 1 1 9 10950 1 1 67 PRO CD C 9.586 1.420 -9.459 0.80 . A A . 67 PRO CD 1 1 9 10951 1 1 67 PRO CG C 9.710 -0.103 -9.551 0.80 . A A . 67 PRO CG 1 1 9 10952 1 1 67 PRO HA H 9.559 0.388 -6.401 1.10 . A A . 67 PRO HA 1 1 9 10953 1 1 67 PRO HB2 H 11.350 -0.858 -8.316 1.00 . A A . 67 PRO HB2 1 1 9 10954 1 1 67 PRO HB3 H 9.740 -1.412 -7.813 0.80 . A A . 67 PRO HB3 1 1 9 10955 1 1 67 PRO HD2 H 10.438 1.918 -9.923 0.70 . A A . 67 PRO HD2 1 1 9 10956 1 1 67 PRO HD3 H 8.672 1.792 -9.920 0.90 . A A . 67 PRO HD3 1 1 9 10957 1 1 67 PRO HG2 H 10.336 -0.395 -10.393 0.80 . A A . 67 PRO HG2 1 1 9 10958 1 1 67 PRO HG3 H 8.730 -0.555 -9.704 1.00 . A A . 67 PRO HG3 1 1 9 10959 1 1 67 PRO N N 9.585 1.683 -8.032 0.80 . A A . 67 PRO N 1 1 9 10960 1 1 67 PRO O O 11.978 2.211 -6.873 1.30 . A A . 67 PRO O 1 1 9 10961 1 1 68 GLU C C 14.395 0.395 -7.209 1.10 . A A . 68 GLU C 1 1 9 10962 1 1 68 GLU CA C 13.661 0.189 -5.878 1.20 . A A . 68 GLU CA 1 1 9 10963 1 1 68 GLU CB C 14.166 -1.098 -5.224 1.50 . A A . 68 GLU CB 1 1 9 10964 1 1 68 GLU CD C 13.708 -2.937 -3.586 2.80 . A A . 68 GLU CD 1 1 9 10965 1 1 68 GLU CG C 13.205 -1.605 -4.148 2.10 . A A . 68 GLU CG 1 1 9 10966 1 1 68 GLU H H 11.684 -0.515 -5.482 1.60 . A A . 68 GLU H 1 1 9 10967 1 1 68 GLU HA H 13.827 1.027 -5.202 1.30 . A A . 68 GLU HA 1 1 9 10968 1 1 68 GLU HB2 H 14.300 -1.866 -5.985 1.90 . A A . 68 GLU HB2 1 1 9 10969 1 1 68 GLU HB3 H 15.147 -0.922 -4.783 1.90 . A A . 68 GLU HB3 1 1 9 10970 1 1 68 GLU HG2 H 13.126 -0.885 -3.333 2.40 . A A . 68 GLU HG2 1 1 9 10971 1 1 68 GLU HG3 H 12.207 -1.750 -4.561 2.50 . A A . 68 GLU HG3 1 1 9 10972 1 1 68 GLU N N 12.223 0.084 -6.072 1.20 . A A . 68 GLU N 1 1 9 10973 1 1 68 GLU O O 15.025 -0.514 -7.736 1.20 . A A . 68 GLU O 1 1 9 10974 1 1 68 GLU OE1 O 14.622 -2.919 -2.763 3.30 . A A . 68 GLU OE1 1 1 9 10975 1 1 68 GLU OE2 O 13.179 -3.976 -3.977 3.40 . A A . 68 GLU OE2 1 1 9 10976 1 1 69 GLY C C 12.934 1.827 -9.742 1.20 . A A . 69 GLY C 1 1 9 10977 1 1 69 GLY CA C 14.341 1.825 -9.142 1.50 . A A . 69 GLY CA 1 1 9 10978 1 1 69 GLY H H 14.155 2.421 -7.094 1.40 . A A . 69 GLY H 1 1 9 10979 1 1 69 GLY HA2 H 14.818 2.786 -9.328 1.80 . A A . 69 GLY HA2 1 1 9 10980 1 1 69 GLY HA3 H 14.943 1.016 -9.558 1.70 . A A . 69 GLY HA3 1 1 9 10981 1 1 69 GLY N N 14.287 1.640 -7.704 1.20 . A A . 69 GLY N 1 1 9 10982 1 1 69 GLY O O 12.374 2.863 -10.077 1.40 . A A . 69 GLY O 1 1 9 10983 1 1 70 TYR C C 14.056 0.041 -11.619 0.80 . A A . 70 TYR C 1 1 9 10984 1 1 70 TYR CA C 13.261 -0.462 -10.393 0.80 . A A . 70 TYR CA 1 1 9 10985 1 1 70 TYR CB C 12.430 -1.705 -10.744 0.60 . A A . 70 TYR CB 1 1 9 10986 1 1 70 TYR CD1 C 14.674 -2.958 -10.553 1.50 . A A . 70 TYR CD1 1 1 9 10987 1 1 70 TYR CD2 C 12.598 -4.217 -11.093 1.30 . A A . 70 TYR CD2 1 1 9 10988 1 1 70 TYR CE1 C 15.430 -4.181 -10.599 1.70 . A A . 70 TYR CE1 1 1 9 10989 1 1 70 TYR CE2 C 13.351 -5.442 -11.141 1.40 . A A . 70 TYR CE2 1 1 9 10990 1 1 70 TYR CG C 13.251 -2.967 -10.796 0.70 . A A . 70 TYR CG 1 1 9 10991 1 1 70 TYR CZ C 14.768 -5.423 -10.893 1.10 . A A . 70 TYR CZ 1 1 9 10992 1 1 70 TYR H H 11.542 0.427 -9.379 1.00 . A A . 70 TYR H 1 1 9 10993 1 1 70 TYR HA H 13.946 -0.707 -9.586 0.90 . A A . 70 TYR HA 1 1 9 10994 1 1 70 TYR HB2 H 11.636 -1.851 -10.013 0.60 . A A . 70 TYR HB2 1 1 9 10995 1 1 70 TYR HB3 H 11.945 -1.565 -11.710 0.60 . A A . 70 TYR HB3 1 1 9 10996 1 1 70 TYR HD1 H 15.193 -2.034 -10.350 2.30 . A A . 70 TYR HD1 1 1 9 10997 1 1 70 TYR HD2 H 11.534 -4.233 -11.281 2.10 . A A . 70 TYR HD2 1 1 9 10998 1 1 70 TYR HE1 H 16.494 -4.166 -10.413 2.50 . A A . 70 TYR HE1 1 1 9 10999 1 1 70 TYR HE2 H 12.854 -6.374 -11.363 2.10 . A A . 70 TYR HE2 1 1 9 11000 1 1 70 TYR HH H 15.446 -6.967 -11.807 1.50 . A A . 70 TYR HH 1 1 9 11001 1 1 70 TYR N N 12.410 0.594 -9.853 0.90 . A A . 70 TYR N 1 1 9 11002 1 1 70 TYR O O 14.461 1.195 -11.691 1.10 . A A . 70 TYR O 1 1 9 11003 1 1 70 TYR OH O 15.493 -6.596 -10.936 1.30 . A A . 70 TYR OH 1 1 9 11004 1 1 71 ILE C C 13.067 -0.903 -14.746 0.90 . A A . 71 ILE C 1 1 9 11005 1 1 71 ILE CA C 14.327 -0.478 -13.965 1.00 . A A . 71 ILE CA 1 1 9 11006 1 1 71 ILE CB C 15.562 -1.092 -14.625 1.20 . A A . 71 ILE CB 1 1 9 11007 1 1 71 ILE CD1 C 16.975 0.277 -13.025 1.80 . A A . 71 ILE CD1 1 1 9 11008 1 1 71 ILE CG1 C 16.754 -1.093 -13.667 1.40 . A A . 71 ILE CG1 1 1 9 11009 1 1 71 ILE CG2 C 15.902 -0.355 -15.921 1.80 . A A . 71 ILE CG2 1 1 9 11010 1 1 71 ILE H H 14.341 -1.863 -12.339 1.10 . A A . 71 ILE H 1 1 9 11011 1 1 71 ILE HA H 14.405 0.608 -13.963 1.20 . A A . 71 ILE HA 1 1 9 11012 1 1 71 ILE HB H 15.332 -2.127 -14.877 1.70 . A A . 71 ILE HB 1 1 9 11013 1 1 71 ILE HD11 H 16.817 0.230 -11.947 2.20 . A A . 71 ILE HD11 1 1 9 11014 1 1 71 ILE HD12 H 16.285 1.014 -13.436 2.30 . A A . 71 ILE HD12 1 1 9 11015 1 1 71 ILE HD13 H 17.991 0.630 -13.202 2.10 . A A . 71 ILE HD13 1 1 9 11016 1 1 71 ILE HG12 H 16.595 -1.840 -12.889 1.60 . A A . 71 ILE HG12 1 1 9 11017 1 1 71 ILE HG13 H 17.654 -1.393 -14.205 1.70 . A A . 71 ILE HG13 1 1 9 11018 1 1 71 ILE HG21 H 15.156 -0.558 -16.690 2.30 . A A . 71 ILE HG21 1 1 9 11019 1 1 71 ILE HG22 H 16.874 -0.666 -16.303 2.20 . A A . 71 ILE HG22 1 1 9 11020 1 1 71 ILE HG23 H 15.931 0.723 -15.759 2.20 . A A . 71 ILE HG23 1 1 9 11021 1 1 71 ILE N N 14.260 -0.895 -12.571 0.90 . A A . 71 ILE N 1 1 9 11022 1 1 71 ILE O O 13.117 -1.150 -15.945 0.90 . A A . 71 ILE O 1 1 9 11023 1 1 72 LEU C C 10.806 0.673 -15.389 0.80 . A A . 72 LEU C 1 1 9 11024 1 1 72 LEU CA C 11.062 0.175 -13.975 0.80 . A A . 72 LEU CA 1 1 9 11025 1 1 72 LEU CB C 11.672 1.278 -13.105 0.80 . A A . 72 LEU CB 1 1 9 11026 1 1 72 LEU CD1 C 9.779 2.595 -12.332 0.70 . A A . 72 LEU CD1 1 1 9 11027 1 1 72 LEU CD2 C 11.904 3.782 -12.909 0.60 . A A . 72 LEU CD2 1 1 9 11028 1 1 72 LEU CG C 10.977 2.621 -13.247 0.70 . A A . 72 LEU CG 1 1 9 11029 1 1 72 LEU H H 11.823 -1.720 -13.350 0.90 . A A . 72 LEU H 1 1 9 11030 1 1 72 LEU HA H 10.110 -0.186 -13.589 0.80 . A A . 72 LEU HA 1 1 9 11031 1 1 72 LEU HB2 H 11.639 0.967 -12.061 1.00 . A A . 72 LEU HB2 1 1 9 11032 1 1 72 LEU HB3 H 12.711 1.432 -13.341 1.00 . A A . 72 LEU HB3 1 1 9 11033 1 1 72 LEU HD11 H 9.830 3.420 -11.625 1.40 . A A . 72 LEU HD11 1 1 9 11034 1 1 72 LEU HD12 H 9.772 1.656 -11.781 1.20 . A A . 72 LEU HD12 1 1 9 11035 1 1 72 LEU HD13 H 8.875 2.646 -12.929 1.20 . A A . 72 LEU HD13 1 1 9 11036 1 1 72 LEU HD21 H 11.644 4.662 -13.498 1.10 . A A . 72 LEU HD21 1 1 9 11037 1 1 72 LEU HD22 H 12.939 3.522 -13.127 1.10 . A A . 72 LEU HD22 1 1 9 11038 1 1 72 LEU HD23 H 11.825 4.043 -11.855 1.20 . A A . 72 LEU HD23 1 1 9 11039 1 1 72 LEU HG H 10.642 2.777 -14.269 0.70 . A A . 72 LEU HG 1 1 9 11040 1 1 72 LEU N N 11.946 -0.973 -14.002 0.80 . A A . 72 LEU N 1 1 9 11041 1 1 72 LEU O O 11.667 0.644 -16.259 0.90 . A A . 72 LEU O 1 1 9 11042 1 1 73 ASP C C 7.888 2.233 -16.961 1.20 . A A . 73 ASP C 1 1 9 11043 1 1 73 ASP CA C 9.108 1.305 -16.905 1.00 . A A . 73 ASP CA 1 1 9 11044 1 1 73 ASP CB C 8.883 -0.081 -17.517 1.50 . A A . 73 ASP CB 1 1 9 11045 1 1 73 ASP CG C 7.456 -0.299 -18.036 2.00 . A A . 73 ASP CG 1 1 9 11046 1 1 73 ASP H H 8.962 1.342 -14.765 0.80 . A A . 73 ASP H 1 1 9 11047 1 1 73 ASP HA H 9.944 1.810 -17.391 1.20 . A A . 73 ASP HA 1 1 9 11048 1 1 73 ASP HB2 H 9.586 -0.227 -18.335 1.90 . A A . 73 ASP HB2 1 1 9 11049 1 1 73 ASP HB3 H 9.099 -0.843 -16.767 1.90 . A A . 73 ASP HB3 1 1 9 11050 1 1 73 ASP N N 9.551 1.131 -15.546 0.90 . A A . 73 ASP N 1 1 9 11051 1 1 73 ASP O O 6.753 1.860 -16.691 1.70 . A A . 73 ASP O 1 1 9 11052 1 1 73 ASP OD1 O 6.560 -0.506 -17.219 2.30 . A A . 73 ASP OD1 1 1 9 11053 1 1 73 ASP OD2 O 7.261 -0.260 -19.250 2.80 . A A . 73 ASP OD2 1 1 9 11054 1 1 74 ASP C C 6.404 4.754 -16.495 1.40 . A A . 74 ASP C 1 1 9 11055 1 1 74 ASP CA C 7.235 4.434 -17.729 1.80 . A A . 74 ASP CA 1 1 9 11056 1 1 74 ASP CB C 6.358 3.909 -18.867 2.60 . A A . 74 ASP CB 1 1 9 11057 1 1 74 ASP CG C 6.912 4.368 -20.218 3.20 . A A . 74 ASP CG 1 1 9 11058 1 1 74 ASP H H 9.171 3.501 -17.717 1.40 . A A . 74 ASP H 1 1 9 11059 1 1 74 ASP HA H 7.758 5.355 -17.988 2.30 . A A . 74 ASP HA 1 1 9 11060 1 1 74 ASP HB2 H 6.321 2.820 -18.854 3.00 . A A . 74 ASP HB2 1 1 9 11061 1 1 74 ASP HB3 H 5.337 4.278 -18.760 3.10 . A A . 74 ASP HB3 1 1 9 11062 1 1 74 ASP N N 8.245 3.459 -17.365 1.30 . A A . 74 ASP N 1 1 9 11063 1 1 74 ASP O O 5.527 4.002 -16.089 1.80 . A A . 74 ASP O 1 1 9 11064 1 1 74 ASP OD1 O 7.259 5.542 -20.343 3.60 . A A . 74 ASP OD1 1 1 9 11065 1 1 74 ASP OD2 O 6.989 3.547 -21.130 3.70 . A A . 74 ASP OD2 1 1 9 11066 1 1 75 GLY C C 8.656 6.665 -14.459 1.10 . A A . 75 GLY C 1 1 9 11067 1 1 75 GLY CA C 8.157 6.305 -15.863 1.10 . A A . 75 GLY CA 1 1 9 11068 1 1 75 GLY H H 6.056 6.633 -15.788 1.30 . A A . 75 GLY H 1 1 9 11069 1 1 75 GLY HA2 H 8.752 5.495 -16.275 1.50 . A A . 75 GLY HA2 1 1 9 11070 1 1 75 GLY HA3 H 8.237 7.196 -16.462 1.30 . A A . 75 GLY HA3 1 1 9 11071 1 1 75 GLY N N 6.747 5.934 -15.941 1.00 . A A . 75 GLY N 1 1 9 11072 1 1 75 GLY O O 9.644 7.366 -14.276 1.40 . A A . 75 GLY O 1 1 9 11073 1 1 76 PHE C C 7.647 4.385 -11.774 0.80 . A A . 76 PHE C 1 1 9 11074 1 1 76 PHE CA C 8.543 5.494 -12.361 0.90 . A A . 76 PHE CA 1 1 9 11075 1 1 76 PHE CB C 8.847 6.557 -11.302 1.00 . A A . 76 PHE CB 1 1 9 11076 1 1 76 PHE CD1 C 11.140 5.962 -10.357 2.00 . A A . 76 PHE CD1 1 1 9 11077 1 1 76 PHE CD2 C 10.921 7.930 -11.865 1.80 . A A . 76 PHE CD2 1 1 9 11078 1 1 76 PHE CE1 C 12.553 6.210 -10.236 2.70 . A A . 76 PHE CE1 1 1 9 11079 1 1 76 PHE CE2 C 12.333 8.182 -11.745 2.50 . A A . 76 PHE CE2 1 1 9 11080 1 1 76 PHE CG C 10.319 6.819 -11.173 1.20 . A A . 76 PHE CG 1 1 9 11081 1 1 76 PHE CZ C 13.148 7.321 -10.931 2.80 . A A . 76 PHE CZ 1 1 9 11082 1 1 76 PHE H H 6.990 5.887 -13.836 1.00 . A A . 76 PHE H 1 1 9 11083 1 1 76 PHE HA H 9.459 5.040 -12.741 0.80 . A A . 76 PHE HA 1 1 9 11084 1 1 76 PHE HB2 H 8.352 7.492 -11.568 1.60 . A A . 76 PHE HB2 1 1 9 11085 1 1 76 PHE HB3 H 8.456 6.249 -10.332 1.30 . A A . 76 PHE HB3 1 1 9 11086 1 1 76 PHE HD1 H 10.693 5.132 -9.831 2.50 . A A . 76 PHE HD1 1 1 9 11087 1 1 76 PHE HD2 H 10.309 8.579 -12.475 2.30 . A A . 76 PHE HD2 1 1 9 11088 1 1 76 PHE HE1 H 13.165 5.563 -9.625 3.50 . A A . 76 PHE HE1 1 1 9 11089 1 1 76 PHE HE2 H 12.778 9.019 -12.262 3.20 . A A . 76 PHE HE2 1 1 9 11090 1 1 76 PHE HZ H 14.208 7.506 -10.842 3.50 . A A . 76 PHE HZ 1 1 9 11091 1 1 76 PHE N N 7.902 6.127 -13.502 0.90 . A A . 76 PHE N 1 1 9 11092 1 1 76 PHE O O 7.691 4.094 -10.585 0.80 . A A . 76 PHE O 1 1 9 11093 1 1 77 ILE C C 5.542 2.264 -11.273 0.70 . A A . 77 ILE C 1 1 9 11094 1 1 77 ILE CA C 5.510 3.449 -12.269 0.80 . A A . 77 ILE CA 1 1 9 11095 1 1 77 ILE CB C 4.699 3.185 -13.510 0.90 . A A . 77 ILE CB 1 1 9 11096 1 1 77 ILE CD1 C 2.814 3.694 -11.833 1.20 . A A . 77 ILE CD1 1 1 9 11097 1 1 77 ILE CG1 C 3.226 3.022 -13.147 1.10 . A A . 77 ILE CG1 1 1 9 11098 1 1 77 ILE CG2 C 5.313 2.093 -14.393 0.90 . A A . 77 ILE CG2 1 1 9 11099 1 1 77 ILE H H 7.003 4.035 -13.639 0.80 . A A . 77 ILE H 1 1 9 11100 1 1 77 ILE HA H 5.058 4.369 -11.906 0.80 . A A . 77 ILE HA 1 1 9 11101 1 1 77 ILE HB H 4.753 4.107 -14.086 0.90 . A A . 77 ILE HB 1 1 9 11102 1 1 77 ILE HD11 H 1.830 3.350 -11.517 1.50 . A A . 77 ILE HD11 1 1 9 11103 1 1 77 ILE HD12 H 2.757 4.775 -11.966 1.60 . A A . 77 ILE HD12 1 1 9 11104 1 1 77 ILE HD13 H 3.512 3.509 -11.023 1.70 . A A . 77 ILE HD13 1 1 9 11105 1 1 77 ILE HG12 H 2.686 3.571 -13.892 1.30 . A A . 77 ILE HG12 1 1 9 11106 1 1 77 ILE HG13 H 2.917 1.977 -13.184 1.10 . A A . 77 ILE HG13 1 1 9 11107 1 1 77 ILE HG21 H 4.771 1.988 -15.334 1.10 . A A . 77 ILE HG21 1 1 9 11108 1 1 77 ILE HG22 H 5.344 1.128 -13.894 1.40 . A A . 77 ILE HG22 1 1 9 11109 1 1 77 ILE HG23 H 6.343 2.359 -14.641 1.40 . A A . 77 ILE HG23 1 1 9 11110 1 1 77 ILE N N 6.844 3.794 -12.683 0.80 . A A . 77 ILE N 1 1 9 11111 1 1 77 ILE O O 6.452 2.137 -10.463 0.80 . A A . 77 ILE O 1 1 9 11112 1 1 78 CYS C C 4.102 -0.565 -12.748 0.70 . A A . 78 CYS C 1 1 9 11113 1 1 78 CYS CA C 4.725 -0.026 -11.458 0.50 . A A . 78 CYS CA 1 1 9 11114 1 1 78 CYS CB C 4.063 -0.746 -10.280 0.40 . A A . 78 CYS CB 1 1 9 11115 1 1 78 CYS H H 3.579 1.783 -11.445 0.50 . A A . 78 CYS H 1 1 9 11116 1 1 78 CYS HA H 5.802 -0.183 -11.457 0.60 . A A . 78 CYS HA 1 1 9 11117 1 1 78 CYS HB2 H 3.242 -0.153 -9.884 0.70 . A A . 78 CYS HB2 1 1 9 11118 1 1 78 CYS HB3 H 3.608 -1.663 -10.653 0.70 . A A . 78 CYS HB3 1 1 9 11119 1 1 78 CYS N N 4.504 1.409 -11.387 0.50 . A A . 78 CYS N 1 1 9 11120 1 1 78 CYS O O 4.783 -0.973 -13.682 1.70 . A A . 78 CYS O 1 1 9 11121 1 1 78 CYS SG S 5.209 -1.200 -8.948 1.00 . A A . 78 CYS SG 1 1 9 11122 1 1 79 THR C C 0.518 -0.797 -13.651 0.90 . A A . 79 THR C 1 1 9 11123 1 1 79 THR CA C 2.022 -0.954 -13.899 0.70 . A A . 79 THR CA 1 1 9 11124 1 1 79 THR CB C 2.374 -2.408 -14.226 0.90 . A A . 79 THR CB 1 1 9 11125 1 1 79 THR CG2 C 1.392 -3.399 -13.598 1.60 . A A . 79 THR CG2 1 1 9 11126 1 1 79 THR H H 2.273 -0.226 -11.901 1.30 . A A . 79 THR H 1 1 9 11127 1 1 79 THR HA H 2.326 -0.289 -14.707 0.80 . A A . 79 THR HA 1 1 9 11128 1 1 79 THR HB H 3.382 -2.622 -13.870 0.70 . A A . 79 THR HB 1 1 9 11129 1 1 79 THR HG1 H 1.652 -3.145 -15.830 2.00 . A A . 79 THR HG1 1 1 9 11130 1 1 79 THR HG21 H 1.223 -3.168 -12.547 2.00 . A A . 79 THR HG21 1 1 9 11131 1 1 79 THR HG22 H 1.773 -4.418 -13.662 2.20 . A A . 79 THR HG22 1 1 9 11132 1 1 79 THR HG23 H 0.428 -3.368 -14.108 2.10 . A A . 79 THR HG23 1 1 9 11133 1 1 79 THR N N 2.756 -0.532 -12.721 0.70 . A A . 79 THR N 1 1 9 11134 1 1 79 THR O O -0.068 -1.455 -12.800 1.50 . A A . 79 THR O 1 1 9 11135 1 1 79 THR OG1 O 2.385 -2.581 -15.620 1.70 . A A . 79 THR OG1 1 1 9 11136 1 1 80 ASP C C -0.949 -1.742 -15.826 1.10 . A A . 80 ASP C 1 1 9 11137 1 1 80 ASP CA C -1.063 -0.261 -15.436 1.20 . A A . 80 ASP CA 1 1 9 11138 1 1 80 ASP CB C -0.905 0.628 -16.668 1.70 . A A . 80 ASP CB 1 1 9 11139 1 1 80 ASP CG C 0.246 0.123 -17.542 2.40 . A A . 80 ASP CG 1 1 9 11140 1 1 80 ASP H H 0.154 1.091 -14.339 0.80 . A A . 80 ASP H 1 1 9 11141 1 1 80 ASP HA H -2.028 -0.082 -14.964 1.50 . A A . 80 ASP HA 1 1 9 11142 1 1 80 ASP HB2 H -1.823 0.637 -17.260 1.80 . A A . 80 ASP HB2 1 1 9 11143 1 1 80 ASP HB3 H -0.685 1.650 -16.356 2.10 . A A . 80 ASP HB3 1 1 9 11144 1 1 80 ASP N N -0.059 0.120 -14.453 0.80 . A A . 80 ASP N 1 1 9 11145 1 1 80 ASP O O 0.126 -2.249 -16.123 1.90 . A A . 80 ASP O 1 1 9 11146 1 1 80 ASP OD1 O 1.368 0.042 -17.046 2.90 . A A . 80 ASP OD1 1 1 9 11147 1 1 80 ASP OD2 O 0.006 -0.182 -18.709 2.90 . A A . 80 ASP OD2 1 1 9 11148 1 1 81 ILE C C -1.832 -2.985 -18.166 1.60 . A A . 81 ILE C 1 1 9 11149 1 1 81 ILE CA C -2.831 -2.693 -17.038 1.30 . A A . 81 ILE CA 1 1 9 11150 1 1 81 ILE CB C -3.780 -1.544 -17.396 1.70 . A A . 81 ILE CB 1 1 9 11151 1 1 81 ILE CD1 C -5.548 -2.084 -15.667 3.00 . A A . 81 ILE CD1 1 1 9 11152 1 1 81 ILE CG1 C -4.536 -1.050 -16.161 2.50 . A A . 81 ILE CG1 1 1 9 11153 1 1 81 ILE CG2 C -4.774 -1.976 -18.475 1.90 . A A . 81 ILE CG2 1 1 9 11154 1 1 81 ILE H H -2.530 -2.660 -14.921 1.50 . A A . 81 ILE H 1 1 9 11155 1 1 81 ILE HA H -3.405 -3.600 -16.855 1.50 . A A . 81 ILE HA 1 1 9 11156 1 1 81 ILE HB H -3.187 -0.718 -17.789 2.20 . A A . 81 ILE HB 1 1 9 11157 1 1 81 ILE HD11 H -5.567 -2.126 -14.578 3.20 . A A . 81 ILE HD11 1 1 9 11158 1 1 81 ILE HD12 H -5.300 -3.079 -16.037 3.40 . A A . 81 ILE HD12 1 1 9 11159 1 1 81 ILE HD13 H -6.552 -1.839 -16.014 3.30 . A A . 81 ILE HD13 1 1 9 11160 1 1 81 ILE HG12 H -3.836 -0.815 -15.360 2.70 . A A . 81 ILE HG12 1 1 9 11161 1 1 81 ILE HG13 H -5.053 -0.120 -16.398 3.00 . A A . 81 ILE HG13 1 1 9 11162 1 1 81 ILE HG21 H -5.800 -1.778 -18.163 2.20 . A A . 81 ILE HG21 1 1 9 11163 1 1 81 ILE HG22 H -4.685 -3.044 -18.680 2.30 . A A . 81 ILE HG22 1 1 9 11164 1 1 81 ILE HG23 H -4.595 -1.438 -19.406 2.30 . A A . 81 ILE HG23 1 1 9 11165 1 1 81 ILE N N -2.129 -2.394 -15.797 1.00 . A A . 81 ILE N 1 1 9 11166 1 1 81 ILE O O -0.734 -3.478 -17.941 2.40 . A A . 81 ILE O 1 1 9 11167 1 1 82 ASP C C -0.317 -2.355 -20.784 2.70 . A A . 82 ASP C 1 1 9 11168 1 1 82 ASP CA C -1.603 -3.154 -20.558 2.60 . A A . 82 ASP CA 1 1 9 11169 1 1 82 ASP CB C -2.515 -3.036 -21.781 3.50 . A A . 82 ASP CB 1 1 9 11170 1 1 82 ASP CG C -3.497 -4.209 -21.813 3.90 . A A . 82 ASP CG 1 1 9 11171 1 1 82 ASP H H -3.114 -2.089 -19.466 2.10 . A A . 82 ASP H 1 1 9 11172 1 1 82 ASP HA H -1.356 -4.195 -20.354 3.00 . A A . 82 ASP HA 1 1 9 11173 1 1 82 ASP HB2 H -3.078 -2.103 -21.751 3.90 . A A . 82 ASP HB2 1 1 9 11174 1 1 82 ASP HB3 H -1.929 -3.039 -22.700 3.90 . A A . 82 ASP HB3 1 1 9 11175 1 1 82 ASP N N -2.294 -2.654 -19.385 1.90 . A A . 82 ASP N 1 1 9 11176 1 1 82 ASP O O -0.212 -1.546 -21.698 3.30 . A A . 82 ASP O 1 1 9 11177 1 1 82 ASP OD1 O -3.996 -4.585 -20.753 4.20 . A A . 82 ASP OD1 1 1 9 11178 1 1 82 ASP OD2 O -3.751 -4.732 -22.897 4.50 . A A . 82 ASP OD2 1 1 9 11179 1 1 83 GLU C C 2.105 -4.177 -18.691 1.00 . A A . 83 GLU C 1 1 9 11180 1 1 83 GLU CA C 1.333 -3.909 -19.984 1.00 . A A . 83 GLU CA 1 1 9 11181 1 1 83 GLU CB C 2.285 -3.898 -21.180 1.00 . A A . 83 GLU CB 1 1 9 11182 1 1 83 GLU CD C 2.456 -5.326 -23.234 1.00 . A A . 83 GLU CD 1 1 9 11183 1 1 83 GLU CG C 1.582 -4.331 -22.467 1.00 . A A . 83 GLU CG 1 1 9 11184 1 1 83 GLU H H 0.886 -1.978 -19.173 1.00 . A A . 83 GLU H 1 1 9 11185 1 1 83 GLU HA H 0.562 -4.670 -20.107 1.00 . A A . 83 GLU HA 1 1 9 11186 1 1 83 GLU HB2 H 2.699 -2.898 -21.309 1.00 . A A . 83 GLU HB2 1 1 9 11187 1 1 83 GLU HB3 H 3.129 -4.560 -20.983 1.00 . A A . 83 GLU HB3 1 1 9 11188 1 1 83 GLU HG2 H 0.626 -4.804 -22.240 1.00 . A A . 83 GLU HG2 1 1 9 11189 1 1 83 GLU HG3 H 1.383 -3.470 -23.104 1.00 . A A . 83 GLU HG3 1 1 9 11190 1 1 83 GLU N N 0.647 -2.635 -19.888 1.00 . A A . 83 GLU N 1 1 9 11191 1 1 83 GLU O O 1.952 -5.261 -18.130 1.00 . A A . 83 GLU O 1 1 9 11192 1 1 83 GLU OXT O 2.850 -3.299 -18.259 1.00 . A A . 83 GLU OXT 1 1 9 11193 1 1 83 GLU OE1 O 3.414 -4.895 -23.873 1.00 . A A . 83 GLU OE1 1 1 9 11194 1 1 83 GLU OE2 O 2.166 -6.520 -23.184 1.00 . A A . 83 GLU OE2 1 1 9 11195 2 2 1 NAG C1 C -14.279 -2.130 4.869 1.00 . B A . 121 NAG C1 1 1 9 11196 2 2 1 NAG C2 C -14.383 -0.652 5.248 1.00 . B A . 121 NAG C2 1 1 9 11197 2 2 1 NAG C3 C -15.170 0.149 4.210 1.00 . B A . 121 NAG C3 1 1 9 11198 2 2 1 NAG C4 C -14.752 -0.215 2.786 1.00 . B A . 121 NAG C4 1 1 9 11199 2 2 1 NAG C5 C -14.661 -1.730 2.595 1.00 . B A . 121 NAG C5 1 1 9 11200 2 2 1 NAG C6 C -14.150 -2.095 1.200 1.00 . B A . 121 NAG C6 1 1 9 11201 2 2 1 NAG C7 C -14.353 0.041 7.549 1.00 . B A . 121 NAG C7 1 1 9 11202 2 2 1 NAG C8 C -13.302 -0.884 8.166 1.00 . B A . 121 NAG C8 1 1 9 11203 2 2 1 NAG H1 H -15.247 -2.624 4.947 1.00 . B A . 121 NAG H1 1 1 9 11204 2 2 1 NAG H2 H -13.388 -0.227 5.372 1.00 . B A . 121 NAG H2 1 1 9 11205 2 2 1 NAG H3 H -16.235 -0.046 4.334 1.00 . B A . 121 NAG H3 1 1 9 11206 2 2 1 NAG H4 H -13.783 0.235 2.566 1.00 . B A . 121 NAG H4 1 1 9 11207 2 2 1 NAG H5 H -15.646 -2.171 2.743 1.00 . B A . 121 NAG H5 1 1 9 11208 2 2 1 NAG H61 H -14.308 -1.273 0.502 1.00 . B A . 121 NAG H61 1 1 9 11209 2 2 1 NAG H62 H -14.668 -2.972 0.812 1.00 . B A . 121 NAG H62 1 1 9 11210 2 2 1 NAG H81 H -12.619 -1.240 7.395 1.00 . B A . 121 NAG H81 1 1 9 11211 2 2 1 NAG H82 H -12.732 -0.348 8.924 1.00 . B A . 121 NAG H82 1 1 9 11212 2 2 1 NAG H83 H -13.792 -1.739 8.633 1.00 . B A . 121 NAG H83 1 1 9 11213 2 2 1 NAG HN2 H -15.968 -0.861 6.676 1.00 . B A . 121 NAG HN2 1 1 9 11214 2 2 1 NAG HO3 H -14.410 1.831 3.727 1.00 . B A . 121 NAG HO3 1 1 9 11215 2 2 1 NAG HO4 H -16.475 -0.179 1.965 1.00 . B A . 121 NAG HO4 1 1 9 11216 2 2 1 NAG HO6 H -12.363 -1.671 1.714 1.00 . B A . 121 NAG HO6 1 1 9 11217 2 2 1 NAG N2 N -15.033 -0.533 6.540 1.00 . B A . 121 NAG N2 1 1 9 11218 2 2 1 NAG O3 O -14.971 1.523 4.426 1.00 . B A . 121 NAG O3 1 1 9 11219 2 2 1 NAG O4 O -15.674 0.321 1.871 1.00 . B A . 121 NAG O4 1 1 9 11220 2 2 1 NAG O5 O -13.783 -2.262 3.559 1.00 . B A . 121 NAG O5 1 1 9 11221 2 2 1 NAG O6 O -12.775 -2.379 1.236 1.00 . B A . 121 NAG O6 1 1 9 11222 2 2 1 NAG O7 O -14.531 1.182 7.959 1.00 . B A . 121 NAG O7 1 1 9 11223 3 2 1 NAG C1 C -8.558 -2.699 -6.056 1.00 . C A . 148 NAG C1 1 1 9 11224 3 2 1 NAG C2 C -8.234 -3.110 -4.619 1.00 . C A . 148 NAG C2 1 1 9 11225 3 2 1 NAG C3 C -9.431 -3.744 -3.911 1.00 . C A . 148 NAG C3 1 1 9 11226 3 2 1 NAG C4 C -10.728 -2.988 -4.197 1.00 . C A . 148 NAG C4 1 1 9 11227 3 2 1 NAG C5 C -10.865 -2.638 -5.679 1.00 . C A . 148 NAG C5 1 1 9 11228 3 2 1 NAG C6 C -12.111 -1.793 -5.948 1.00 . C A . 148 NAG C6 1 1 9 11229 3 2 1 NAG C7 C -6.133 -3.874 -3.753 1.00 . C A . 148 NAG C7 1 1 9 11230 3 2 1 NAG C8 C -5.487 -2.489 -3.854 1.00 . C A . 148 NAG C8 1 1 9 11231 3 2 1 NAG H1 H -8.680 -3.573 -6.695 1.00 . C A . 148 NAG H1 1 1 9 11232 3 2 1 NAG H2 H -7.878 -2.248 -4.055 1.00 . C A . 148 NAG H2 1 1 9 11233 3 2 1 NAG H3 H -9.537 -4.780 -4.234 1.00 . C A . 148 NAG H3 1 1 9 11234 3 2 1 NAG H4 H -10.754 -2.073 -3.605 1.00 . C A . 148 NAG H4 1 1 9 11235 3 2 1 NAG H5 H -10.922 -3.557 -6.262 1.00 . C A . 148 NAG H5 1 1 9 11236 3 2 1 NAG H61 H -12.050 -0.837 -5.429 1.00 . C A . 148 NAG H61 1 1 9 11237 3 2 1 NAG H62 H -13.010 -2.306 -5.606 1.00 . C A . 148 NAG H62 1 1 9 11238 3 2 1 NAG H81 H -5.575 -2.104 -4.868 1.00 . C A . 148 NAG H81 1 1 9 11239 3 2 1 NAG H82 H -5.978 -1.800 -3.166 1.00 . C A . 148 NAG H82 1 1 9 11240 3 2 1 NAG H83 H -4.431 -2.553 -3.599 1.00 . C A . 148 NAG H83 1 1 9 11241 3 2 1 NAG HN2 H -7.119 -4.823 -5.273 1.00 . C A . 148 NAG HN2 1 1 9 11242 3 2 1 NAG HO3 H -10.042 -3.892 -2.110 1.00 . C A . 148 NAG HO3 1 1 9 11243 3 2 1 NAG HO4 H -12.006 -3.545 -2.896 1.00 . C A . 148 NAG HO4 1 1 9 11244 3 2 1 NAG HO6 H -11.882 -0.676 -7.477 1.00 . C A . 148 NAG HO6 1 1 9 11245 3 2 1 NAG N2 N -7.134 -4.055 -4.633 1.00 . C A . 148 NAG N2 1 1 9 11246 3 2 1 NAG O3 O -9.200 -3.764 -2.526 1.00 . C A . 148 NAG O3 1 1 9 11247 3 2 1 NAG O4 O -11.824 -3.771 -3.799 1.00 . C A . 148 NAG O4 1 1 9 11248 3 2 1 NAG O5 O -9.728 -1.918 -6.088 1.00 . C A . 148 NAG O5 1 1 9 11249 3 2 1 NAG O6 O -12.249 -1.536 -7.323 1.00 . C A . 148 NAG O6 1 1 9 11250 3 2 1 NAG O7 O -5.752 -4.708 -2.941 1.00 . C A . 148 NAG O7 1 1 10 11251 1 1 1 HIS C C 6.540 2.631 21.882 1.00 . A A . 1 HIS C 1 1 10 11252 1 1 1 HIS CA C 6.299 1.391 21.013 1.00 . A A . 1 HIS CA 1 1 10 11253 1 1 1 HIS CB C 7.643 0.723 20.720 1.00 . A A . 1 HIS CB 1 1 10 11254 1 1 1 HIS CD2 C 9.850 1.395 19.639 1.00 . A A . 1 HIS CD2 1 1 10 11255 1 1 1 HIS CE1 C 9.390 3.503 19.043 1.00 . A A . 1 HIS CE1 1 1 10 11256 1 1 1 HIS CG C 8.588 1.657 20.020 1.00 . A A . 1 HIS CG 1 1 10 11257 1 1 1 HIS H1 H 6.113 2.478 19.278 1.00 . A A . 1 HIS H1 1 1 10 11258 1 1 1 HIS H2 H 5.543 0.881 19.172 1.00 . A A . 1 HIS H2 1 1 10 11259 1 1 1 HIS H3 H 4.637 2.053 20.003 1.00 . A A . 1 HIS H3 1 1 10 11260 1 1 1 HIS HA H 5.661 0.706 21.570 1.00 . A A . 1 HIS HA 1 1 10 11261 1 1 1 HIS HB2 H 8.096 0.380 21.650 1.00 . A A . 1 HIS HB2 1 1 10 11262 1 1 1 HIS HB3 H 7.486 -0.161 20.101 1.00 . A A . 1 HIS HB3 1 1 10 11263 1 1 1 HIS HD2 H 10.370 0.466 19.781 1.00 . A A . 1 HIS HD2 1 1 10 11264 1 1 1 HIS HE1 H 9.480 4.510 18.643 1.00 . A A . 1 HIS HE1 1 1 10 11265 1 1 1 HIS HE2 H 11.307 2.695 18.625 1.00 . A A . 1 HIS HE2 1 1 10 11266 1 1 1 HIS N N 5.598 1.724 19.777 1.00 . A A . 1 HIS N 1 1 10 11267 1 1 1 HIS ND1 N 8.273 3.043 19.632 1.00 . A A . 1 HIS ND1 1 1 10 11268 1 1 1 HIS NE2 N 10.383 2.603 18.998 1.00 . A A . 1 HIS NE2 1 1 10 11269 1 1 1 HIS O O 7.569 2.772 22.532 1.00 . A A . 1 HIS O 1 1 10 11270 1 1 2 MET C C 3.635 4.406 23.196 1.00 . A A . 2 MET C 1 1 10 11271 1 1 2 MET CA C 5.157 4.204 23.073 1.00 . A A . 2 MET CA 1 1 10 11272 1 1 2 MET CB C 5.834 5.573 23.091 1.00 . A A . 2 MET CB 1 1 10 11273 1 1 2 MET CE C 7.215 8.125 22.409 1.00 . A A . 2 MET CE 1 1 10 11274 1 1 2 MET CG C 7.354 5.468 22.960 1.00 . A A . 2 MET CG 1 1 10 11275 1 1 2 MET H H 5.066 3.714 20.983 1.00 . A A . 2 MET H 1 1 10 11276 1 1 2 MET HA H 5.507 3.582 23.897 1.00 . A A . 2 MET HA 1 1 10 11277 1 1 2 MET HB2 H 5.434 6.175 22.275 1.00 . A A . 2 MET HB2 1 1 10 11278 1 1 2 MET HB3 H 5.582 6.094 24.015 1.00 . A A . 2 MET HB3 1 1 10 11279 1 1 2 MET HE1 H 6.223 8.289 22.828 1.00 . A A . 2 MET HE1 1 1 10 11280 1 1 2 MET HE2 H 7.107 7.705 21.409 1.00 . A A . 2 MET HE2 1 1 10 11281 1 1 2 MET HE3 H 7.726 9.085 22.332 1.00 . A A . 2 MET HE3 1 1 10 11282 1 1 2 MET HG2 H 7.731 4.654 23.580 1.00 . A A . 2 MET HG2 1 1 10 11283 1 1 2 MET HG3 H 7.628 5.241 21.929 1.00 . A A . 2 MET HG3 1 1 10 11284 1 1 2 MET N N 5.525 3.515 21.847 1.00 . A A . 2 MET N 1 1 10 11285 1 1 2 MET O O 3.179 5.297 23.902 1.00 . A A . 2 MET O 1 1 10 11286 1 1 2 MET SD S 8.155 7.002 23.456 1.00 . A A . 2 MET SD 1 1 10 11287 1 1 3 GLU C C 0.453 3.299 22.561 1.00 . A A . 3 GLU C 1 1 10 11288 1 1 3 GLU CA C 1.629 4.048 21.936 1.00 . A A . 3 GLU CA 1 1 10 11289 1 1 3 GLU CB C 1.610 3.870 20.422 1.00 . A A . 3 GLU CB 1 1 10 11290 1 1 3 GLU CD C 2.719 6.016 19.738 1.00 . A A . 3 GLU CD 1 1 10 11291 1 1 3 GLU CG C 2.835 4.491 19.749 1.00 . A A . 3 GLU CG 1 1 10 11292 1 1 3 GLU H H 3.153 2.595 22.357 1.00 . A A . 3 GLU H 1 1 10 11293 1 1 3 GLU HA H 1.571 5.102 22.195 1.00 . A A . 3 GLU HA 1 1 10 11294 1 1 3 GLU HB2 H 1.574 2.802 20.204 1.00 . A A . 3 GLU HB2 1 1 10 11295 1 1 3 GLU HB3 H 0.701 4.323 20.019 1.00 . A A . 3 GLU HB3 1 1 10 11296 1 1 3 GLU HG2 H 3.743 4.214 20.282 1.00 . A A . 3 GLU HG2 1 1 10 11297 1 1 3 GLU HG3 H 2.931 4.134 18.724 1.00 . A A . 3 GLU HG3 1 1 10 11298 1 1 3 GLU N N 2.877 3.548 22.484 1.00 . A A . 3 GLU N 1 1 10 11299 1 1 3 GLU O O 0.592 2.209 23.103 1.00 . A A . 3 GLU O 1 1 10 11300 1 1 3 GLU OE1 O 1.946 6.553 20.529 1.00 . A A . 3 GLU OE1 1 1 10 11301 1 1 3 GLU OE2 O 3.405 6.650 18.937 1.00 . A A . 3 GLU OE2 1 1 10 11302 1 1 4 PRO C C -2.273 2.350 21.246 1.00 . A A . 4 PRO C 1 1 10 11303 1 1 4 PRO CA C -2.001 3.255 22.460 1.00 . A A . 4 PRO CA 1 1 10 11304 1 1 4 PRO CB C -3.057 4.363 22.521 1.00 . A A . 4 PRO CB 1 1 10 11305 1 1 4 PRO CD C -0.820 5.400 22.358 1.00 . A A . 4 PRO CD 1 1 10 11306 1 1 4 PRO CG C -2.317 5.709 22.455 1.00 . A A . 4 PRO CG 1 1 10 11307 1 1 4 PRO HA H -2.032 2.626 23.345 1.00 . A A . 4 PRO HA 1 1 10 11308 1 1 4 PRO HB2 H -3.756 4.272 21.689 1.00 . A A . 4 PRO HB2 1 1 10 11309 1 1 4 PRO HB3 H -3.633 4.288 23.443 1.00 . A A . 4 PRO HB3 1 1 10 11310 1 1 4 PRO HD2 H -0.406 5.745 21.410 1.00 . A A . 4 PRO HD2 1 1 10 11311 1 1 4 PRO HD3 H -0.262 5.864 23.171 1.00 . A A . 4 PRO HD3 1 1 10 11312 1 1 4 PRO HG2 H -2.647 6.287 21.591 1.00 . A A . 4 PRO HG2 1 1 10 11313 1 1 4 PRO HG3 H -2.525 6.301 23.346 1.00 . A A . 4 PRO HG3 1 1 10 11314 1 1 4 PRO N N -0.722 3.953 22.446 1.00 . A A . 4 PRO N 1 1 10 11315 1 1 4 PRO O O -3.402 1.951 20.990 1.00 . A A . 4 PRO O 1 1 10 11316 1 1 5 VAL C C -2.376 0.279 19.348 1.00 . A A . 5 VAL C 1 1 10 11317 1 1 5 VAL CA C -1.034 0.922 19.655 1.00 . A A . 5 VAL CA 1 1 10 11318 1 1 5 VAL CB C -0.088 -0.072 20.280 1.00 . A A . 5 VAL CB 1 1 10 11319 1 1 5 VAL CG1 C -0.329 -0.239 21.781 1.00 . A A . 5 VAL CG1 1 1 10 11320 1 1 5 VAL CG2 C -0.111 -1.415 19.552 1.00 . A A . 5 VAL CG2 1 1 10 11321 1 1 5 VAL H H -0.357 2.615 20.774 1.00 . A A . 5 VAL H 1 1 10 11322 1 1 5 VAL HA H -0.585 1.294 18.729 1.00 . A A . 5 VAL HA 1 1 10 11323 1 1 5 VAL HB H 0.862 0.415 20.116 1.00 . A A . 5 VAL HB 1 1 10 11324 1 1 5 VAL HG11 H -0.441 -1.292 22.039 1.00 . A A . 5 VAL HG11 1 1 10 11325 1 1 5 VAL HG12 H 0.508 0.160 22.356 1.00 . A A . 5 VAL HG12 1 1 10 11326 1 1 5 VAL HG13 H -1.234 0.280 22.093 1.00 . A A . 5 VAL HG13 1 1 10 11327 1 1 5 VAL HG21 H -0.778 -1.383 18.690 1.00 . A A . 5 VAL HG21 1 1 10 11328 1 1 5 VAL HG22 H 0.884 -1.676 19.198 1.00 . A A . 5 VAL HG22 1 1 10 11329 1 1 5 VAL HG23 H -0.453 -2.210 20.215 1.00 . A A . 5 VAL HG23 1 1 10 11330 1 1 5 VAL N N -1.159 2.067 20.542 1.00 . A A . 5 VAL N 1 1 10 11331 1 1 5 VAL O O -2.690 -0.843 19.725 1.00 . A A . 5 VAL O 1 1 10 11332 1 1 6 ASP C C -4.361 -0.717 17.637 1.00 . A A . 6 ASP C 1 1 10 11333 1 1 6 ASP CA C -4.461 0.688 18.247 1.00 . A A . 6 ASP CA 1 1 10 11334 1 1 6 ASP CB C -5.084 1.669 17.244 1.00 . A A . 6 ASP CB 1 1 10 11335 1 1 6 ASP CG C -6.442 2.171 17.738 1.00 . A A . 6 ASP CG 1 1 10 11336 1 1 6 ASP H H -2.728 2.030 18.648 1.00 . A A . 6 ASP H 1 1 10 11337 1 1 6 ASP HA H -5.054 0.674 19.161 1.00 . A A . 6 ASP HA 1 1 10 11338 1 1 6 ASP HB2 H -4.475 2.527 17.015 1.00 . A A . 6 ASP HB2 1 1 10 11339 1 1 6 ASP HB3 H -5.183 1.200 16.283 1.00 . A A . 6 ASP HB3 1 1 10 11340 1 1 6 ASP N N -3.125 1.113 18.626 1.00 . A A . 6 ASP N 1 1 10 11341 1 1 6 ASP O O -3.277 -1.210 17.351 1.00 . A A . 6 ASP O 1 1 10 11342 1 1 6 ASP OD1 O -6.536 2.553 18.903 1.00 . A A . 6 ASP OD1 1 1 10 11343 1 1 6 ASP OD2 O -7.388 2.176 16.952 1.00 . A A . 6 ASP OD2 1 1 10 11344 1 1 7 PRO C C -5.442 -1.900 15.010 1.00 . A A . 7 PRO C 1 1 10 11345 1 1 7 PRO CA C -5.733 -2.369 16.441 1.00 . A A . 7 PRO CA 1 1 10 11346 1 1 7 PRO CB C -7.195 -2.805 16.571 1.00 . A A . 7 PRO CB 1 1 10 11347 1 1 7 PRO CD C -6.701 -1.123 18.309 1.00 . A A . 7 PRO CD 1 1 10 11348 1 1 7 PRO CG C -7.788 -2.059 17.776 1.00 . A A . 7 PRO CG 1 1 10 11349 1 1 7 PRO HA H -5.075 -3.208 16.667 1.00 . A A . 7 PRO HA 1 1 10 11350 1 1 7 PRO HB2 H -7.746 -2.564 15.662 1.00 . A A . 7 PRO HB2 1 1 10 11351 1 1 7 PRO HB3 H -7.260 -3.883 16.720 1.00 . A A . 7 PRO HB3 1 1 10 11352 1 1 7 PRO HD2 H -7.023 -0.085 18.256 1.00 . A A . 7 PRO HD2 1 1 10 11353 1 1 7 PRO HD3 H -6.448 -1.356 19.343 1.00 . A A . 7 PRO HD3 1 1 10 11354 1 1 7 PRO HG2 H -8.668 -1.491 17.477 1.00 . A A . 7 PRO HG2 1 1 10 11355 1 1 7 PRO HG3 H -8.095 -2.764 18.548 1.00 . A A . 7 PRO HG3 1 1 10 11356 1 1 7 PRO N N -5.545 -1.342 17.455 1.00 . A A . 7 PRO N 1 1 10 11357 1 1 7 PRO O O -5.079 -2.685 14.142 1.00 . A A . 7 PRO O 1 1 10 11358 1 1 8 CYS C C -3.433 0.379 14.332 1.00 . A A . 8 CYS C 1 1 10 11359 1 1 8 CYS CA C -4.827 0.068 13.793 1.00 . A A . 8 CYS CA 1 1 10 11360 1 1 8 CYS CB C -5.544 1.325 13.290 1.00 . A A . 8 CYS CB 1 1 10 11361 1 1 8 CYS H H -6.222 -0.033 15.397 1.00 . A A . 8 CYS H 1 1 10 11362 1 1 8 CYS HA H -4.725 -0.652 12.998 1.00 . A A . 8 CYS HA 1 1 10 11363 1 1 8 CYS HB2 H -6.338 1.041 12.596 1.00 . A A . 8 CYS HB2 1 1 10 11364 1 1 8 CYS HB3 H -6.005 1.821 14.143 1.00 . A A . 8 CYS HB3 1 1 10 11365 1 1 8 CYS N N -5.618 -0.581 14.819 1.00 . A A . 8 CYS N 1 1 10 11366 1 1 8 CYS O O -2.514 -0.428 14.269 1.00 . A A . 8 CYS O 1 1 10 11367 1 1 8 CYS SG S -4.451 2.516 12.470 1.00 . A A . 8 CYS SG 1 1 10 11368 1 1 9 PHE C C -1.168 1.125 15.799 1.00 . A A . 9 PHE C 1 1 10 11369 1 1 9 PHE CA C -2.073 2.186 15.174 1.00 . A A . 9 PHE CA 1 1 10 11370 1 1 9 PHE CB C -2.324 3.311 16.165 1.00 . A A . 9 PHE CB 1 1 10 11371 1 1 9 PHE CD1 C -0.255 4.530 15.273 1.00 . A A . 9 PHE CD1 1 1 10 11372 1 1 9 PHE CD2 C -0.869 4.745 17.675 1.00 . A A . 9 PHE CD2 1 1 10 11373 1 1 9 PHE CE1 C 0.876 5.394 15.483 1.00 . A A . 9 PHE CE1 1 1 10 11374 1 1 9 PHE CE2 C 0.263 5.607 17.890 1.00 . A A . 9 PHE CE2 1 1 10 11375 1 1 9 PHE CG C -1.133 4.201 16.368 1.00 . A A . 9 PHE CG 1 1 10 11376 1 1 9 PHE CZ C 1.133 5.932 16.792 1.00 . A A . 9 PHE CZ 1 1 10 11377 1 1 9 PHE H H -4.195 2.150 14.917 1.00 . A A . 9 PHE H 1 1 10 11378 1 1 9 PHE HA H -1.662 2.571 14.245 1.00 . A A . 9 PHE HA 1 1 10 11379 1 1 9 PHE HB2 H -3.172 3.917 15.832 1.00 . A A . 9 PHE HB2 1 1 10 11380 1 1 9 PHE HB3 H -2.582 2.832 17.107 1.00 . A A . 9 PHE HB3 1 1 10 11381 1 1 9 PHE HD1 H -0.443 4.137 14.285 1.00 . A A . 9 PHE HD1 1 1 10 11382 1 1 9 PHE HD2 H -1.527 4.508 18.498 1.00 . A A . 9 PHE HD2 1 1 10 11383 1 1 9 PHE HE1 H 1.529 5.641 14.660 1.00 . A A . 9 PHE HE1 1 1 10 11384 1 1 9 PHE HE2 H 0.460 6.003 18.876 1.00 . A A . 9 PHE HE2 1 1 10 11385 1 1 9 PHE HZ H 1.980 6.583 16.949 1.00 . A A . 9 PHE HZ 1 1 10 11386 1 1 9 PHE N N -3.357 1.608 14.861 1.00 . A A . 9 PHE N 1 1 10 11387 1 1 9 PHE O O -1.618 0.124 16.343 1.00 . A A . 9 PHE O 1 1 10 11388 1 1 10 ARG C C 1.079 -0.506 14.361 1.00 . A A . 10 ARG C 1 1 10 11389 1 1 10 ARG CA C 1.109 0.347 15.646 1.00 . A A . 10 ARG CA 1 1 10 11390 1 1 10 ARG CB C 0.966 -0.518 16.889 1.00 . A A . 10 ARG CB 1 1 10 11391 1 1 10 ARG CD C 2.858 -1.946 17.846 1.00 . A A . 10 ARG CD 1 1 10 11392 1 1 10 ARG CG C 2.272 -0.540 17.677 1.00 . A A . 10 ARG CG 1 1 10 11393 1 1 10 ARG CZ C 3.529 -2.916 19.943 1.00 . A A . 10 ARG CZ 1 1 10 11394 1 1 10 ARG H H 0.435 2.374 15.631 1.00 . A A . 10 ARG H 1 1 10 11395 1 1 10 ARG HA H 2.038 0.888 15.675 1.00 . A A . 10 ARG HA 1 1 10 11396 1 1 10 ARG HB2 H 0.183 -0.093 17.526 1.00 . A A . 10 ARG HB2 1 1 10 11397 1 1 10 ARG HB3 H 0.648 -1.524 16.603 1.00 . A A . 10 ARG HB3 1 1 10 11398 1 1 10 ARG HD2 H 2.092 -2.705 18.002 1.00 . A A . 10 ARG HD2 1 1 10 11399 1 1 10 ARG HD3 H 3.461 -2.232 16.984 1.00 . A A . 10 ARG HD3 1 1 10 11400 1 1 10 ARG HE H 4.486 -1.323 19.089 1.00 . A A . 10 ARG HE 1 1 10 11401 1 1 10 ARG HG2 H 3.001 0.109 17.204 1.00 . A A . 10 ARG HG2 1 1 10 11402 1 1 10 ARG HG3 H 2.095 -0.071 18.635 1.00 . A A . 10 ARG HG3 1 1 10 11403 1 1 10 ARG HH11 H 1.653 -3.674 20.050 1.00 . A A . 10 ARG HH11 1 1 10 11404 1 1 10 ARG HH12 H 2.083 -2.574 21.317 1.00 . A A . 10 ARG HH12 1 1 10 11405 1 1 10 ARG HH21 H 5.132 -4.121 19.669 1.00 . A A . 10 ARG HH21 1 1 10 11406 1 1 10 ARG HH22 H 4.689 -3.839 21.320 1.00 . A A . 10 ARG HH22 1 1 10 11407 1 1 10 ARG N N 0.133 1.424 15.680 1.00 . A A . 10 ARG N 1 1 10 11408 1 1 10 ARG NE N 3.737 -1.978 19.000 1.00 . A A . 10 ARG NE 1 1 10 11409 1 1 10 ARG NH1 N 2.322 -3.067 20.481 1.00 . A A . 10 ARG NH1 1 1 10 11410 1 1 10 ARG NH2 N 4.534 -3.689 20.343 1.00 . A A . 10 ARG NH2 1 1 10 11411 1 1 10 ARG O O 2.001 -1.254 14.061 1.00 . A A . 10 ARG O 1 1 10 11412 1 1 11 ALA C C 0.880 -1.570 11.755 1.00 . A A . 11 ALA C 1 1 10 11413 1 1 11 ALA CA C -0.380 -1.267 12.577 1.00 . A A . 11 ALA CA 1 1 10 11414 1 1 11 ALA CB C -1.465 -0.632 11.703 1.00 . A A . 11 ALA CB 1 1 10 11415 1 1 11 ALA H H -0.623 0.362 14.038 1.00 . A A . 11 ALA H 1 1 10 11416 1 1 11 ALA HA H -0.772 -2.168 13.051 1.00 . A A . 11 ALA HA 1 1 10 11417 1 1 11 ALA HB1 H -1.260 -0.783 10.644 1.00 . A A . 11 ALA HB1 1 1 10 11418 1 1 11 ALA HB2 H -2.441 -1.066 11.922 1.00 . A A . 11 ALA HB2 1 1 10 11419 1 1 11 ALA HB3 H -1.535 0.441 11.886 1.00 . A A . 11 ALA HB3 1 1 10 11420 1 1 11 ALA N N -0.038 -0.341 13.642 1.00 . A A . 11 ALA N 1 1 10 11421 1 1 11 ALA O O 1.850 -0.822 11.783 1.00 . A A . 11 ALA O 1 1 10 11422 1 1 12 ASN C C 1.345 -2.788 8.576 1.00 . A A . 12 ASN C 1 1 10 11423 1 1 12 ASN CA C 1.858 -2.921 10.023 1.00 . A A . 12 ASN CA 1 1 10 11424 1 1 12 ASN CB C 2.474 -4.308 10.222 1.00 . A A . 12 ASN CB 1 1 10 11425 1 1 12 ASN CG C 3.752 -4.206 11.057 1.00 . A A . 12 ASN CG 1 1 10 11426 1 1 12 ASN H H 0.084 -3.369 11.167 1.00 . A A . 12 ASN H 1 1 10 11427 1 1 12 ASN HA H 2.591 -2.135 10.181 1.00 . A A . 12 ASN HA 1 1 10 11428 1 1 12 ASN HB2 H 1.772 -4.969 10.729 1.00 . A A . 12 ASN HB2 1 1 10 11429 1 1 12 ASN HB3 H 2.716 -4.760 9.260 1.00 . A A . 12 ASN HB3 1 1 10 11430 1 1 12 ASN HD21 H 4.847 -5.819 10.473 1.00 . A A . 12 ASN HD21 1 1 10 11431 1 1 12 ASN HD22 H 4.302 -5.839 12.140 1.00 . A A . 12 ASN HD22 1 1 10 11432 1 1 12 ASN N N 0.815 -2.702 11.025 1.00 . A A . 12 ASN N 1 1 10 11433 1 1 12 ASN ND2 N 4.354 -5.395 11.240 1.00 . A A . 12 ASN ND2 1 1 10 11434 1 1 12 ASN O O 1.906 -3.347 7.641 1.00 . A A . 12 ASN O 1 1 10 11435 1 1 12 ASN OD1 O 4.154 -3.136 11.498 1.00 . A A . 12 ASN OD1 1 1 10 11436 1 1 13 CYS C C 0.928 -1.030 6.336 1.00 . A A . 13 CYS C 1 1 10 11437 1 1 13 CYS CA C -0.223 -1.570 7.174 1.00 . A A . 13 CYS CA 1 1 10 11438 1 1 13 CYS CB C -1.323 -0.533 7.376 1.00 . A A . 13 CYS CB 1 1 10 11439 1 1 13 CYS H H -0.334 -1.974 9.262 1.00 . A A . 13 CYS H 1 1 10 11440 1 1 13 CYS HA H -0.644 -2.449 6.686 1.00 . A A . 13 CYS HA 1 1 10 11441 1 1 13 CYS HB2 H -0.934 0.372 7.849 1.00 . A A . 13 CYS HB2 1 1 10 11442 1 1 13 CYS HB3 H -1.739 -0.262 6.406 1.00 . A A . 13 CYS HB3 1 1 10 11443 1 1 13 CYS N N 0.252 -2.016 8.463 1.00 . A A . 13 CYS N 1 1 10 11444 1 1 13 CYS O O 1.487 0.034 6.571 1.00 . A A . 13 CYS O 1 1 10 11445 1 1 13 CYS SG S -2.644 -1.219 8.401 1.00 . A A . 13 CYS SG 1 1 10 11446 1 1 14 GLU C C 1.247 0.009 3.758 1.00 . A A . 14 GLU C 1 1 10 11447 1 1 14 GLU CA C 1.792 -1.387 4.101 1.00 . A A . 14 GLU CA 1 1 10 11448 1 1 14 GLU CB C 1.546 -2.373 2.961 1.00 . A A . 14 GLU CB 1 1 10 11449 1 1 14 GLU CD C 3.460 -1.097 1.938 1.00 . A A . 14 GLU CD 1 1 10 11450 1 1 14 GLU CG C 2.198 -1.916 1.653 1.00 . A A . 14 GLU CG 1 1 10 11451 1 1 14 GLU H H 1.043 -2.843 5.551 1.00 . A A . 14 GLU H 1 1 10 11452 1 1 14 GLU HA H 2.861 -1.312 4.269 1.00 . A A . 14 GLU HA 1 1 10 11453 1 1 14 GLU HB2 H 1.935 -3.353 3.236 1.00 . A A . 14 GLU HB2 1 1 10 11454 1 1 14 GLU HB3 H 0.477 -2.499 2.810 1.00 . A A . 14 GLU HB3 1 1 10 11455 1 1 14 GLU HG2 H 2.470 -2.777 1.042 1.00 . A A . 14 GLU HG2 1 1 10 11456 1 1 14 GLU HG3 H 1.506 -1.303 1.075 1.00 . A A . 14 GLU HG3 1 1 10 11457 1 1 14 GLU N N 1.226 -1.882 5.346 1.00 . A A . 14 GLU N 1 1 10 11458 1 1 14 GLU O O 1.970 0.998 3.772 1.00 . A A . 14 GLU O 1 1 10 11459 1 1 14 GLU OE1 O 4.508 -1.695 2.176 1.00 . A A . 14 GLU OE1 1 1 10 11460 1 1 14 GLU OE2 O 3.380 0.130 1.920 1.00 . A A . 14 GLU OE2 1 1 10 11461 1 1 15 TYR C C -1.067 1.578 5.040 1.00 . A A . 15 TYR C 1 1 10 11462 1 1 15 TYR CA C -0.777 1.286 3.562 1.00 . A A . 15 TYR CA 1 1 10 11463 1 1 15 TYR CB C -2.045 1.245 2.694 1.00 . A A . 15 TYR CB 1 1 10 11464 1 1 15 TYR CD1 C -1.699 3.101 0.982 1.00 . A A . 15 TYR CD1 1 1 10 11465 1 1 15 TYR CD2 C -3.417 3.398 2.758 1.00 . A A . 15 TYR CD2 1 1 10 11466 1 1 15 TYR CE1 C -2.054 4.378 0.424 1.00 . A A . 15 TYR CE1 1 1 10 11467 1 1 15 TYR CE2 C -3.778 4.672 2.199 1.00 . A A . 15 TYR CE2 1 1 10 11468 1 1 15 TYR CG C -2.386 2.599 2.145 1.00 . A A . 15 TYR CG 1 1 10 11469 1 1 15 TYR CZ C -3.092 5.165 1.034 1.00 . A A . 15 TYR CZ 1 1 10 11470 1 1 15 TYR H H -0.533 -0.809 3.157 1.00 . A A . 15 TYR H 1 1 10 11471 1 1 15 TYR HA H -0.107 2.059 3.194 1.00 . A A . 15 TYR HA 1 1 10 11472 1 1 15 TYR HB2 H -1.884 0.577 1.859 1.00 . A A . 15 TYR HB2 1 1 10 11473 1 1 15 TYR HB3 H -2.903 0.863 3.255 1.00 . A A . 15 TYR HB3 1 1 10 11474 1 1 15 TYR HD1 H -0.912 2.515 0.529 1.00 . A A . 15 TYR HD1 1 1 10 11475 1 1 15 TYR HD2 H -3.917 3.046 3.647 1.00 . A A . 15 TYR HD2 1 1 10 11476 1 1 15 TYR HE1 H -1.549 4.740 -0.459 1.00 . A A . 15 TYR HE1 1 1 10 11477 1 1 15 TYR HE2 H -4.572 5.251 2.647 1.00 . A A . 15 TYR HE2 1 1 10 11478 1 1 15 TYR HH H -2.653 6.935 0.447 1.00 . A A . 15 TYR HH 1 1 10 11479 1 1 15 TYR N N -0.064 0.024 3.451 1.00 . A A . 15 TYR N 1 1 10 11480 1 1 15 TYR O O -0.203 1.476 5.902 1.00 . A A . 15 TYR O 1 1 10 11481 1 1 15 TYR OH O -3.428 6.392 0.501 1.00 . A A . 15 TYR OH 1 1 10 11482 1 1 16 GLN C C -3.830 1.048 6.980 1.00 . A A . 16 GLN C 1 1 10 11483 1 1 16 GLN CA C -2.812 2.131 6.614 1.00 . A A . 16 GLN CA 1 1 10 11484 1 1 16 GLN CB C -3.439 3.519 6.723 1.00 . A A . 16 GLN CB 1 1 10 11485 1 1 16 GLN CD C -3.726 5.559 8.151 1.00 . A A . 16 GLN CD 1 1 10 11486 1 1 16 GLN CG C -2.967 4.241 7.984 1.00 . A A . 16 GLN CG 1 1 10 11487 1 1 16 GLN H H -2.887 2.129 4.448 1.00 . A A . 16 GLN H 1 1 10 11488 1 1 16 GLN HA H -1.946 2.040 7.266 1.00 . A A . 16 GLN HA 1 1 10 11489 1 1 16 GLN HB2 H -3.173 4.084 5.837 1.00 . A A . 16 GLN HB2 1 1 10 11490 1 1 16 GLN HB3 H -4.528 3.434 6.713 1.00 . A A . 16 GLN HB3 1 1 10 11491 1 1 16 GLN HE21 H -3.196 6.268 6.320 1.00 . A A . 16 GLN HE21 1 1 10 11492 1 1 16 GLN HE22 H -4.857 6.570 6.795 1.00 . A A . 16 GLN HE22 1 1 10 11493 1 1 16 GLN HG2 H -3.135 3.617 8.862 1.00 . A A . 16 GLN HG2 1 1 10 11494 1 1 16 GLN HG3 H -1.898 4.446 7.926 1.00 . A A . 16 GLN HG3 1 1 10 11495 1 1 16 GLN N N -2.335 1.951 5.263 1.00 . A A . 16 GLN N 1 1 10 11496 1 1 16 GLN NE2 N -3.946 6.189 6.984 1.00 . A A . 16 GLN NE2 1 1 10 11497 1 1 16 GLN O O -3.877 -0.036 6.414 1.00 . A A . 16 GLN O 1 1 10 11498 1 1 16 GLN OE1 O -4.079 5.968 9.250 1.00 . A A . 16 GLN OE1 1 1 10 11499 1 1 17 CYS C C -6.849 0.464 8.224 1.00 . A A . 17 CYS C 1 1 10 11500 1 1 17 CYS CA C -5.404 0.472 8.721 1.00 . A A . 17 CYS CA 1 1 10 11501 1 1 17 CYS CB C -5.377 0.795 10.212 1.00 . A A . 17 CYS CB 1 1 10 11502 1 1 17 CYS H H -4.510 2.424 8.193 1.00 . A A . 17 CYS H 1 1 10 11503 1 1 17 CYS HA H -4.939 -0.497 8.544 1.00 . A A . 17 CYS HA 1 1 10 11504 1 1 17 CYS HB2 H -6.309 0.467 10.674 1.00 . A A . 17 CYS HB2 1 1 10 11505 1 1 17 CYS HB3 H -4.576 0.235 10.694 1.00 . A A . 17 CYS HB3 1 1 10 11506 1 1 17 CYS N N -4.631 1.451 7.977 1.00 . A A . 17 CYS N 1 1 10 11507 1 1 17 CYS O O -7.466 1.500 8.008 1.00 . A A . 17 CYS O 1 1 10 11508 1 1 17 CYS SG S -5.147 2.553 10.556 1.00 . A A . 17 CYS SG 1 1 10 11509 1 1 18 GLN C C -8.433 -1.868 9.922 1.00 . A A . 18 GLN C 1 1 10 11510 1 1 18 GLN CA C -8.634 -1.079 8.632 1.00 . A A . 18 GLN CA 1 1 10 11511 1 1 18 GLN CB C -9.424 -1.922 7.639 1.00 . A A . 18 GLN CB 1 1 10 11512 1 1 18 GLN CD C -11.306 -0.828 6.408 1.00 . A A . 18 GLN CD 1 1 10 11513 1 1 18 GLN CG C -10.917 -1.599 7.671 1.00 . A A . 18 GLN CG 1 1 10 11514 1 1 18 GLN H H -6.904 -1.429 7.441 1.00 . A A . 18 GLN H 1 1 10 11515 1 1 18 GLN HA H -9.135 -0.130 8.819 1.00 . A A . 18 GLN HA 1 1 10 11516 1 1 18 GLN HB2 H -9.035 -1.750 6.633 1.00 . A A . 18 GLN HB2 1 1 10 11517 1 1 18 GLN HB3 H -9.274 -2.975 7.882 1.00 . A A . 18 GLN HB3 1 1 10 11518 1 1 18 GLN HE21 H -9.921 0.612 6.789 1.00 . A A . 18 GLN HE21 1 1 10 11519 1 1 18 GLN HE22 H -10.230 0.294 5.092 1.00 . A A . 18 GLN HE22 1 1 10 11520 1 1 18 GLN HG2 H -11.503 -2.516 7.727 1.00 . A A . 18 GLN HG2 1 1 10 11521 1 1 18 GLN HG3 H -11.157 -0.995 8.547 1.00 . A A . 18 GLN HG3 1 1 10 11522 1 1 18 GLN N N -7.341 -0.775 8.058 1.00 . A A . 18 GLN N 1 1 10 11523 1 1 18 GLN NE2 N -10.405 0.110 6.065 1.00 . A A . 18 GLN NE2 1 1 10 11524 1 1 18 GLN O O -7.497 -2.645 10.056 1.00 . A A . 18 GLN O 1 1 10 11525 1 1 18 GLN OE1 O -12.340 -1.069 5.796 1.00 . A A . 18 GLN OE1 1 1 10 11526 1 1 19 PRO C C -11.223 -3.223 10.443 1.00 . A A . 19 PRO C 1 1 10 11527 1 1 19 PRO CA C -10.205 -2.660 11.441 1.00 . A A . 19 PRO CA 1 1 10 11528 1 1 19 PRO CB C -10.948 -1.976 12.590 1.00 . A A . 19 PRO CB 1 1 10 11529 1 1 19 PRO CD C -9.565 -0.296 11.430 1.00 . A A . 19 PRO CD 1 1 10 11530 1 1 19 PRO CG C -10.567 -0.488 12.569 1.00 . A A . 19 PRO CG 1 1 10 11531 1 1 19 PRO HA H -9.578 -3.472 11.811 1.00 . A A . 19 PRO HA 1 1 10 11532 1 1 19 PRO HB2 H -12.023 -2.094 12.460 1.00 . A A . 19 PRO HB2 1 1 10 11533 1 1 19 PRO HB3 H -10.668 -2.425 13.542 1.00 . A A . 19 PRO HB3 1 1 10 11534 1 1 19 PRO HD2 H -9.953 0.382 10.669 1.00 . A A . 19 PRO HD2 1 1 10 11535 1 1 19 PRO HD3 H -8.617 0.098 11.796 1.00 . A A . 19 PRO HD3 1 1 10 11536 1 1 19 PRO HG2 H -11.451 0.130 12.409 1.00 . A A . 19 PRO HG2 1 1 10 11537 1 1 19 PRO HG3 H -10.125 -0.192 13.520 1.00 . A A . 19 PRO HG3 1 1 10 11538 1 1 19 PRO N N -9.368 -1.619 10.862 1.00 . A A . 19 PRO N 1 1 10 11539 1 1 19 PRO O O -12.006 -2.495 9.846 1.00 . A A . 19 PRO O 1 1 10 11540 1 1 20 LEU C C -13.144 -4.858 11.659 1.00 . A A . 20 LEU C 1 1 10 11541 1 1 20 LEU CA C -12.318 -5.404 10.513 1.00 . A A . 20 LEU CA 1 1 10 11542 1 1 20 LEU CB C -11.902 -6.828 10.865 1.00 . A A . 20 LEU CB 1 1 10 11543 1 1 20 LEU CD1 C -10.525 -8.724 9.927 1.00 . A A . 20 LEU CD1 1 1 10 11544 1 1 20 LEU CD2 C -11.187 -6.791 8.465 1.00 . A A . 20 LEU CD2 1 1 10 11545 1 1 20 LEU CG C -10.834 -7.229 9.886 1.00 . A A . 20 LEU CG 1 1 10 11546 1 1 20 LEU H H -10.328 -4.968 9.904 1.00 . A A . 20 LEU H 1 1 10 11547 1 1 20 LEU HA H -12.837 -5.408 9.566 1.00 . A A . 20 LEU HA 1 1 10 11548 1 1 20 LEU HB2 H -11.490 -6.874 11.876 1.00 . A A . 20 LEU HB2 1 1 10 11549 1 1 20 LEU HB3 H -12.737 -7.525 10.827 1.00 . A A . 20 LEU HB3 1 1 10 11550 1 1 20 LEU HD11 H -9.477 -8.911 9.703 1.00 . A A . 20 LEU HD11 1 1 10 11551 1 1 20 LEU HD12 H -10.761 -9.152 10.900 1.00 . A A . 20 LEU HD12 1 1 10 11552 1 1 20 LEU HD13 H -11.119 -9.255 9.183 1.00 . A A . 20 LEU HD13 1 1 10 11553 1 1 20 LEU HD21 H -10.872 -5.766 8.281 1.00 . A A . 20 LEU HD21 1 1 10 11554 1 1 20 LEU HD22 H -10.698 -7.430 7.729 1.00 . A A . 20 LEU HD22 1 1 10 11555 1 1 20 LEU HD23 H -12.262 -6.847 8.297 1.00 . A A . 20 LEU HD23 1 1 10 11556 1 1 20 LEU HG H -10.017 -6.623 10.260 1.00 . A A . 20 LEU HG 1 1 10 11557 1 1 20 LEU N N -11.150 -4.561 10.297 1.00 . A A . 20 LEU N 1 1 10 11558 1 1 20 LEU O O -14.296 -4.462 11.539 1.00 . A A . 20 LEU O 1 1 10 11559 1 1 21 ASN C C -14.251 -5.707 14.175 1.00 . A A . 21 ASN C 1 1 10 11560 1 1 21 ASN CA C -13.017 -4.800 14.092 1.00 . A A . 21 ASN CA 1 1 10 11561 1 1 21 ASN CB C -13.325 -3.361 14.530 1.00 . A A . 21 ASN CB 1 1 10 11562 1 1 21 ASN CG C -14.592 -2.795 13.879 1.00 . A A . 21 ASN CG 1 1 10 11563 1 1 21 ASN H H -11.415 -4.897 12.571 1.00 . A A . 21 ASN H 1 1 10 11564 1 1 21 ASN HA H -12.292 -5.240 14.768 1.00 . A A . 21 ASN HA 1 1 10 11565 1 1 21 ASN HB2 H -13.475 -3.343 15.614 1.00 . A A . 21 ASN HB2 1 1 10 11566 1 1 21 ASN HB3 H -12.488 -2.700 14.292 1.00 . A A . 21 ASN HB3 1 1 10 11567 1 1 21 ASN HD21 H -14.931 -1.049 14.882 1.00 . A A . 21 ASN HD21 1 1 10 11568 1 1 21 ASN N N -12.402 -4.880 12.772 1.00 . A A . 21 ASN N 1 1 10 11569 1 1 21 ASN ND2 N -14.688 -1.459 14.005 1.00 . A A . 21 ASN ND2 1 1 10 11570 1 1 21 ASN O O -15.067 -5.795 13.266 1.00 . A A . 21 ASN O 1 1 10 11571 1 1 21 ASN OD1 O -15.420 -3.508 13.325 1.00 . A A . 21 ASN OD1 1 1 10 11572 1 1 22 GLN C C -12.745 -8.155 16.084 1.00 . A A . 22 GLN C 1 1 10 11573 1 1 22 GLN CA C -14.065 -7.827 15.366 1.00 . A A . 22 GLN CA 1 1 10 11574 1 1 22 GLN CB C -14.065 -8.432 13.958 1.00 . A A . 22 GLN CB 1 1 10 11575 1 1 22 GLN CD C -15.452 -9.021 11.950 1.00 . A A . 22 GLN CD 1 1 10 11576 1 1 22 GLN CG C -15.487 -8.616 13.425 1.00 . A A . 22 GLN CG 1 1 10 11577 1 1 22 GLN H H -14.550 -5.910 16.183 1.00 . A A . 22 GLN H 1 1 10 11578 1 1 22 GLN HA H -14.882 -8.253 15.948 1.00 . A A . 22 GLN HA 1 1 10 11579 1 1 22 GLN HB2 H -13.496 -7.797 13.279 1.00 . A A . 22 GLN HB2 1 1 10 11580 1 1 22 GLN HB3 H -13.558 -9.396 13.976 1.00 . A A . 22 GLN HB3 1 1 10 11581 1 1 22 GLN HE21 H -17.247 -9.935 12.238 1.00 . A A . 22 GLN HE21 1 1 10 11582 1 1 22 GLN HE22 H -16.737 -9.781 10.567 1.00 . A A . 22 GLN HE22 1 1 10 11583 1 1 22 GLN HG2 H -16.008 -9.390 13.989 1.00 . A A . 22 GLN HG2 1 1 10 11584 1 1 22 GLN HG3 H -16.059 -7.694 13.527 1.00 . A A . 22 GLN HG3 1 1 10 11585 1 1 22 GLN N N -14.315 -6.389 15.337 1.00 . A A . 22 GLN N 1 1 10 11586 1 1 22 GLN NE2 N -16.580 -9.634 11.549 1.00 . A A . 22 GLN NE2 1 1 10 11587 1 1 22 GLN O O -12.613 -9.189 16.727 1.00 . A A . 22 GLN O 1 1 10 11588 1 1 22 GLN OE1 O -14.482 -8.793 11.238 1.00 . A A . 22 GLN OE1 1 1 10 11589 1 1 23 THR C C -10.475 -8.601 14.416 1.00 . A A . 23 THR C 1 1 10 11590 1 1 23 THR CA C -11.018 -7.202 14.704 1.00 . A A . 23 THR CA 1 1 10 11591 1 1 23 THR CB C -9.865 -6.188 14.781 1.00 . A A . 23 THR CB 1 1 10 11592 1 1 23 THR CG2 C -10.001 -5.170 15.918 1.00 . A A . 23 THR CG2 1 1 10 11593 1 1 23 THR H H -11.598 -6.561 16.663 1.00 . A A . 23 THR H 1 1 10 11594 1 1 23 THR HA H -11.718 -6.936 13.911 1.00 . A A . 23 THR HA 1 1 10 11595 1 1 23 THR HB H -9.791 -5.652 13.830 1.00 . A A . 23 THR HB 1 1 10 11596 1 1 23 THR HG1 H -8.031 -6.505 14.360 1.00 . A A . 23 THR HG1 1 1 10 11597 1 1 23 THR HG21 H -10.746 -4.408 15.690 1.00 . A A . 23 THR HG21 1 1 10 11598 1 1 23 THR HG22 H -10.279 -5.649 16.856 1.00 . A A . 23 THR HG22 1 1 10 11599 1 1 23 THR HG23 H -9.053 -4.658 16.083 1.00 . A A . 23 THR HG23 1 1 10 11600 1 1 23 THR N N -11.782 -7.224 15.938 1.00 . A A . 23 THR N 1 1 10 11601 1 1 23 THR O O -10.471 -9.485 15.264 1.00 . A A . 23 THR O 1 1 10 11602 1 1 23 THR OG1 O -8.657 -6.882 14.964 1.00 . A A . 23 THR OG1 1 1 10 11603 1 1 24 SER C C -7.786 -7.662 12.688 1.00 . A A . 24 SER C 1 1 10 11604 1 1 24 SER CA C -8.593 -8.945 12.952 1.00 . A A . 24 SER CA 1 1 10 11605 1 1 24 SER CB C -8.375 -9.900 11.787 1.00 . A A . 24 SER CB 1 1 10 11606 1 1 24 SER H H -10.650 -8.628 12.386 1.00 . A A . 24 SER H 1 1 10 11607 1 1 24 SER HA H -8.260 -9.345 13.889 1.00 . A A . 24 SER HA 1 1 10 11608 1 1 24 SER HB2 H -9.306 -10.376 11.481 1.00 . A A . 24 SER HB2 1 1 10 11609 1 1 24 SER HB3 H -7.988 -9.329 10.944 1.00 . A A . 24 SER HB3 1 1 10 11610 1 1 24 SER HG H -6.634 -10.672 11.684 1.00 . A A . 24 SER HG 1 1 10 11611 1 1 24 SER N N -10.022 -8.729 13.156 1.00 . A A . 24 SER N 1 1 10 11612 1 1 24 SER O O -6.597 -7.559 12.962 1.00 . A A . 24 SER O 1 1 10 11613 1 1 24 SER OG O -7.446 -10.901 12.115 1.00 . A A . 24 SER OG 1 1 10 11614 1 1 25 TYR C C -6.949 -5.845 10.500 1.00 . A A . 25 TYR C 1 1 10 11615 1 1 25 TYR CA C -8.045 -5.525 11.497 1.00 . A A . 25 TYR CA 1 1 10 11616 1 1 25 TYR CB C -7.567 -4.489 12.508 1.00 . A A . 25 TYR CB 1 1 10 11617 1 1 25 TYR CD1 C -5.042 -4.895 12.508 1.00 . A A . 25 TYR CD1 1 1 10 11618 1 1 25 TYR CD2 C -6.334 -5.278 14.599 1.00 . A A . 25 TYR CD2 1 1 10 11619 1 1 25 TYR CE1 C -3.833 -5.291 13.180 1.00 . A A . 25 TYR CE1 1 1 10 11620 1 1 25 TYR CE2 C -5.128 -5.678 15.273 1.00 . A A . 25 TYR CE2 1 1 10 11621 1 1 25 TYR CG C -6.301 -4.895 13.211 1.00 . A A . 25 TYR CG 1 1 10 11622 1 1 25 TYR CZ C -3.877 -5.683 14.563 1.00 . A A . 25 TYR CZ 1 1 10 11623 1 1 25 TYR H H -9.504 -6.982 12.206 1.00 . A A . 25 TYR H 1 1 10 11624 1 1 25 TYR HA H -8.902 -5.134 10.944 1.00 . A A . 25 TYR HA 1 1 10 11625 1 1 25 TYR HB2 H -7.391 -3.532 12.007 1.00 . A A . 25 TYR HB2 1 1 10 11626 1 1 25 TYR HB3 H -8.368 -4.351 13.230 1.00 . A A . 25 TYR HB3 1 1 10 11627 1 1 25 TYR HD1 H -4.997 -4.586 11.474 1.00 . A A . 25 TYR HD1 1 1 10 11628 1 1 25 TYR HD2 H -7.265 -5.244 15.144 1.00 . A A . 25 TYR HD2 1 1 10 11629 1 1 25 TYR HE1 H -2.893 -5.292 12.649 1.00 . A A . 25 TYR HE1 1 1 10 11630 1 1 25 TYR HE2 H -5.160 -5.973 16.312 1.00 . A A . 25 TYR HE2 1 1 10 11631 1 1 25 TYR HH H -2.150 -6.514 14.601 1.00 . A A . 25 TYR HH 1 1 10 11632 1 1 25 TYR N N -8.546 -6.719 12.136 1.00 . A A . 25 TYR N 1 1 10 11633 1 1 25 TYR O O -6.075 -6.683 10.684 1.00 . A A . 25 TYR O 1 1 10 11634 1 1 25 TYR OH O -2.719 -6.062 15.210 1.00 . A A . 25 TYR OH 1 1 10 11635 1 1 26 LEU C C -5.561 -4.486 7.738 1.00 . A A . 26 LEU C 1 1 10 11636 1 1 26 LEU CA C -6.614 -5.517 8.153 1.00 . A A . 26 LEU CA 1 1 10 11637 1 1 26 LEU CB C -7.839 -5.708 7.243 1.00 . A A . 26 LEU CB 1 1 10 11638 1 1 26 LEU CD1 C -7.451 -4.998 4.862 1.00 . A A . 26 LEU CD1 1 1 10 11639 1 1 26 LEU CD2 C -9.562 -4.358 6.014 1.00 . A A . 26 LEU CD2 1 1 10 11640 1 1 26 LEU CG C -8.066 -4.610 6.207 1.00 . A A . 26 LEU CG 1 1 10 11641 1 1 26 LEU H H -7.896 -4.449 9.488 1.00 . A A . 26 LEU H 1 1 10 11642 1 1 26 LEU HA H -6.151 -6.488 8.326 1.00 . A A . 26 LEU HA 1 1 10 11643 1 1 26 LEU HB2 H -7.747 -6.666 6.726 1.00 . A A . 26 LEU HB2 1 1 10 11644 1 1 26 LEU HB3 H -8.729 -5.773 7.887 1.00 . A A . 26 LEU HB3 1 1 10 11645 1 1 26 LEU HD11 H -6.723 -5.801 4.977 1.00 . A A . 26 LEU HD11 1 1 10 11646 1 1 26 LEU HD12 H -8.221 -5.345 4.174 1.00 . A A . 26 LEU HD12 1 1 10 11647 1 1 26 LEU HD13 H -6.956 -4.144 4.404 1.00 . A A . 26 LEU HD13 1 1 10 11648 1 1 26 LEU HD21 H -9.748 -3.340 5.673 1.00 . A A . 26 LEU HD21 1 1 10 11649 1 1 26 LEU HD22 H -9.974 -5.038 5.268 1.00 . A A . 26 LEU HD22 1 1 10 11650 1 1 26 LEU HD23 H -10.111 -4.510 6.942 1.00 . A A . 26 LEU HD23 1 1 10 11651 1 1 26 LEU HG H -7.603 -3.694 6.573 1.00 . A A . 26 LEU HG 1 1 10 11652 1 1 26 LEU N N -7.112 -5.069 9.428 1.00 . A A . 26 LEU N 1 1 10 11653 1 1 26 LEU O O -4.976 -3.840 8.598 1.00 . A A . 26 LEU O 1 1 10 11654 1 1 27 CYS C C -5.065 -2.582 4.699 1.00 . A A . 27 CYS C 1 1 10 11655 1 1 27 CYS CA C -4.670 -3.082 6.085 1.00 . A A . 27 CYS CA 1 1 10 11656 1 1 27 CYS CB C -3.157 -3.204 6.191 1.00 . A A . 27 CYS CB 1 1 10 11657 1 1 27 CYS H H -5.563 -5.037 5.753 1.00 . A A . 27 CYS H 1 1 10 11658 1 1 27 CYS HA H -5.004 -2.353 6.820 1.00 . A A . 27 CYS HA 1 1 10 11659 1 1 27 CYS HB2 H -2.850 -4.128 5.705 1.00 . A A . 27 CYS HB2 1 1 10 11660 1 1 27 CYS HB3 H -2.689 -2.366 5.667 1.00 . A A . 27 CYS HB3 1 1 10 11661 1 1 27 CYS N N -5.330 -4.333 6.424 1.00 . A A . 27 CYS N 1 1 10 11662 1 1 27 CYS O O -5.103 -3.301 3.708 1.00 . A A . 27 CYS O 1 1 10 11663 1 1 27 CYS SG S -2.581 -3.199 7.908 1.00 . A A . 27 CYS SG 1 1 10 11664 1 1 28 VAL C C -4.587 -0.677 2.522 1.00 . A A . 28 VAL C 1 1 10 11665 1 1 28 VAL CA C -5.709 -0.548 3.545 1.00 . A A . 28 VAL CA 1 1 10 11666 1 1 28 VAL CB C -5.979 0.947 3.795 1.00 . A A . 28 VAL CB 1 1 10 11667 1 1 28 VAL CG1 C -7.217 1.393 3.018 1.00 . A A . 28 VAL CG1 1 1 10 11668 1 1 28 VAL CG2 C -6.105 1.378 5.262 1.00 . A A . 28 VAL CG2 1 1 10 11669 1 1 28 VAL H H -5.221 -0.820 5.626 1.00 . A A . 28 VAL H 1 1 10 11670 1 1 28 VAL HA H -6.601 -1.042 3.160 1.00 . A A . 28 VAL HA 1 1 10 11671 1 1 28 VAL HB H -5.129 1.493 3.387 1.00 . A A . 28 VAL HB 1 1 10 11672 1 1 28 VAL HG11 H -6.935 1.893 2.092 1.00 . A A . 28 VAL HG11 1 1 10 11673 1 1 28 VAL HG12 H -7.845 0.539 2.763 1.00 . A A . 28 VAL HG12 1 1 10 11674 1 1 28 VAL HG13 H -7.816 2.087 3.608 1.00 . A A . 28 VAL HG13 1 1 10 11675 1 1 28 VAL HG21 H -7.076 1.837 5.443 1.00 . A A . 28 VAL HG21 1 1 10 11676 1 1 28 VAL HG22 H -5.984 0.583 5.993 1.00 . A A . 28 VAL HG22 1 1 10 11677 1 1 28 VAL HG23 H -5.350 2.131 5.477 1.00 . A A . 28 VAL HG23 1 1 10 11678 1 1 28 VAL N N -5.330 -1.269 4.742 1.00 . A A . 28 VAL N 1 1 10 11679 1 1 28 VAL O O -3.494 -1.153 2.807 1.00 . A A . 28 VAL O 1 1 10 11680 1 1 29 CYS C C -3.881 0.827 -0.625 1.00 . A A . 29 CYS C 1 1 10 11681 1 1 29 CYS CA C -3.959 -0.411 0.259 1.00 . A A . 29 CYS CA 1 1 10 11682 1 1 29 CYS CB C -4.366 -1.630 -0.556 1.00 . A A . 29 CYS CB 1 1 10 11683 1 1 29 CYS H H -5.921 -0.395 1.129 1.00 . A A . 29 CYS H 1 1 10 11684 1 1 29 CYS HA H -3.014 -0.631 0.728 1.00 . A A . 29 CYS HA 1 1 10 11685 1 1 29 CYS HB2 H -5.443 -1.619 -0.736 1.00 . A A . 29 CYS HB2 1 1 10 11686 1 1 29 CYS HB3 H -3.857 -1.602 -1.518 1.00 . A A . 29 CYS HB3 1 1 10 11687 1 1 29 CYS N N -4.952 -0.243 1.305 1.00 . A A . 29 CYS N 1 1 10 11688 1 1 29 CYS O O -2.857 1.471 -0.817 1.00 . A A . 29 CYS O 1 1 10 11689 1 1 29 CYS SG S -3.926 -3.153 0.320 1.00 . A A . 29 CYS SG 1 1 10 11690 1 1 30 ALA C C -4.933 2.405 -3.158 1.00 . A A . 30 ALA C 1 1 10 11691 1 1 30 ALA CA C -5.357 2.390 -1.680 1.00 . A A . 30 ALA CA 1 1 10 11692 1 1 30 ALA CB C -4.634 3.483 -0.894 1.00 . A A . 30 ALA CB 1 1 10 11693 1 1 30 ALA H H -5.675 0.585 -0.452 1.00 . A A . 30 ALA H 1 1 10 11694 1 1 30 ALA HA H -6.440 2.511 -1.673 1.00 . A A . 30 ALA HA 1 1 10 11695 1 1 30 ALA HB1 H -5.297 4.327 -0.704 1.00 . A A . 30 ALA HB1 1 1 10 11696 1 1 30 ALA HB2 H -4.284 3.103 0.065 1.00 . A A . 30 ALA HB2 1 1 10 11697 1 1 30 ALA HB3 H -3.769 3.850 -1.447 1.00 . A A . 30 ALA HB3 1 1 10 11698 1 1 30 ALA N N -5.102 1.087 -1.092 1.00 . A A . 30 ALA N 1 1 10 11699 1 1 30 ALA O O -3.774 2.221 -3.508 1.00 . A A . 30 ALA O 1 1 10 11700 1 1 31 GLU C C -5.087 1.505 -6.061 1.00 . A A . 31 GLU C 1 1 10 11701 1 1 31 GLU CA C -6.265 1.763 -5.100 1.00 . A A . 31 GLU CA 1 1 10 11702 1 1 31 GLU CB C -7.489 2.331 -5.820 1.00 . A A . 31 GLU CB 1 1 10 11703 1 1 31 GLU CD C -8.524 3.265 -7.888 1.00 . A A . 31 GLU CD 1 1 10 11704 1 1 31 GLU CG C -7.275 2.590 -7.306 1.00 . A A . 31 GLU CG 1 1 10 11705 1 1 31 GLU H H -6.732 3.212 -3.658 1.00 . A A . 31 GLU H 1 1 10 11706 1 1 31 GLU HA H -6.532 0.831 -4.632 1.00 . A A . 31 GLU HA 1 1 10 11707 1 1 31 GLU HB2 H -8.308 1.637 -5.681 1.00 . A A . 31 GLU HB2 1 1 10 11708 1 1 31 GLU HB3 H -7.805 3.259 -5.343 1.00 . A A . 31 GLU HB3 1 1 10 11709 1 1 31 GLU HG2 H -6.413 3.245 -7.422 1.00 . A A . 31 GLU HG2 1 1 10 11710 1 1 31 GLU HG3 H -7.080 1.657 -7.835 1.00 . A A . 31 GLU HG3 1 1 10 11711 1 1 31 GLU N N -5.971 2.653 -3.983 1.00 . A A . 31 GLU N 1 1 10 11712 1 1 31 GLU O O -5.034 0.519 -6.787 1.00 . A A . 31 GLU O 1 1 10 11713 1 1 31 GLU OE1 O -9.207 3.968 -7.145 1.00 . A A . 31 GLU OE1 1 1 10 11714 1 1 31 GLU OE2 O -8.809 3.076 -9.070 1.00 . A A . 31 GLU OE2 1 1 10 11715 1 1 32 GLY C C -2.225 0.893 -6.179 1.00 . A A . 32 GLY C 1 1 10 11716 1 1 32 GLY CA C -2.784 2.310 -6.423 1.00 . A A . 32 GLY CA 1 1 10 11717 1 1 32 GLY H H -4.558 3.186 -5.411 1.00 . A A . 32 GLY H 1 1 10 11718 1 1 32 GLY HA2 H -2.737 2.561 -7.484 1.00 . A A . 32 GLY HA2 1 1 10 11719 1 1 32 GLY HA3 H -2.200 3.023 -5.841 1.00 . A A . 32 GLY HA3 1 1 10 11720 1 1 32 GLY N N -4.172 2.473 -5.993 1.00 . A A . 32 GLY N 1 1 10 11721 1 1 32 GLY O O -1.349 0.412 -6.887 1.00 . A A . 32 GLY O 1 1 10 11722 1 1 33 PHE C C -3.246 -1.754 -3.977 1.00 . A A . 33 PHE C 1 1 10 11723 1 1 33 PHE CA C -2.160 -0.730 -4.313 1.00 . A A . 33 PHE CA 1 1 10 11724 1 1 33 PHE CB C -1.684 -0.044 -3.037 1.00 . A A . 33 PHE CB 1 1 10 11725 1 1 33 PHE CD1 C -0.185 1.813 -3.926 1.00 . A A . 33 PHE CD1 1 1 10 11726 1 1 33 PHE CD2 C 0.836 -0.011 -2.577 1.00 . A A . 33 PHE CD2 1 1 10 11727 1 1 33 PHE CE1 C 1.098 2.456 -4.032 1.00 . A A . 33 PHE CE1 1 1 10 11728 1 1 33 PHE CE2 C 2.120 0.630 -2.679 1.00 . A A . 33 PHE CE2 1 1 10 11729 1 1 33 PHE CG C -0.327 0.585 -3.187 1.00 . A A . 33 PHE CG 1 1 10 11730 1 1 33 PHE CZ C 2.250 1.865 -3.406 1.00 . A A . 33 PHE CZ 1 1 10 11731 1 1 33 PHE H H -3.715 0.582 -4.880 1.00 . A A . 33 PHE H 1 1 10 11732 1 1 33 PHE HA H -1.341 -1.195 -4.859 1.00 . A A . 33 PHE HA 1 1 10 11733 1 1 33 PHE HB2 H -2.397 0.742 -2.780 1.00 . A A . 33 PHE HB2 1 1 10 11734 1 1 33 PHE HB3 H -1.668 -0.766 -2.225 1.00 . A A . 33 PHE HB3 1 1 10 11735 1 1 33 PHE HD1 H -1.048 2.247 -4.409 1.00 . A A . 33 PHE HD1 1 1 10 11736 1 1 33 PHE HD2 H 0.761 -0.955 -2.061 1.00 . A A . 33 PHE HD2 1 1 10 11737 1 1 33 PHE HE1 H 1.199 3.380 -4.583 1.00 . A A . 33 PHE HE1 1 1 10 11738 1 1 33 PHE HE2 H 2.985 0.187 -2.209 1.00 . A A . 33 PHE HE2 1 1 10 11739 1 1 33 PHE HZ H 3.214 2.346 -3.483 1.00 . A A . 33 PHE HZ 1 1 10 11740 1 1 33 PHE N N -2.799 0.279 -5.132 1.00 . A A . 33 PHE N 1 1 10 11741 1 1 33 PHE O O -4.349 -1.384 -3.594 1.00 . A A . 33 PHE O 1 1 10 11742 1 1 34 ALA C C -3.632 -5.400 -4.451 1.00 . A A . 34 ALA C 1 1 10 11743 1 1 34 ALA CA C -3.957 -4.015 -3.893 1.00 . A A . 34 ALA CA 1 1 10 11744 1 1 34 ALA CB C -5.276 -3.529 -4.500 1.00 . A A . 34 ALA CB 1 1 10 11745 1 1 34 ALA H H -1.981 -3.304 -4.448 1.00 . A A . 34 ALA H 1 1 10 11746 1 1 34 ALA HA H -4.015 -4.094 -2.812 1.00 . A A . 34 ALA HA 1 1 10 11747 1 1 34 ALA HB1 H -5.095 -2.735 -5.225 1.00 . A A . 34 ALA HB1 1 1 10 11748 1 1 34 ALA HB2 H -5.791 -4.341 -5.013 1.00 . A A . 34 ALA HB2 1 1 10 11749 1 1 34 ALA HB3 H -5.938 -3.136 -3.729 1.00 . A A . 34 ALA HB3 1 1 10 11750 1 1 34 ALA N N -2.903 -3.045 -4.158 1.00 . A A . 34 ALA N 1 1 10 11751 1 1 34 ALA O O -3.446 -5.598 -5.645 1.00 . A A . 34 ALA O 1 1 10 11752 1 1 35 PRO C C -1.621 -7.831 -3.749 1.00 . A A . 35 PRO C 1 1 10 11753 1 1 35 PRO CA C -2.382 -6.832 -2.872 1.00 . A A . 35 PRO CA 1 1 10 11754 1 1 35 PRO CB C -2.839 -7.553 -1.602 1.00 . A A . 35 PRO CB 1 1 10 11755 1 1 35 PRO CD C -4.823 -6.888 -2.905 1.00 . A A . 35 PRO CD 1 1 10 11756 1 1 35 PRO CG C -4.370 -7.658 -1.661 1.00 . A A . 35 PRO CG 1 1 10 11757 1 1 35 PRO HA H -1.732 -5.992 -2.635 1.00 . A A . 35 PRO HA 1 1 10 11758 1 1 35 PRO HB2 H -2.385 -8.542 -1.550 1.00 . A A . 35 PRO HB2 1 1 10 11759 1 1 35 PRO HB3 H -2.534 -6.998 -0.715 1.00 . A A . 35 PRO HB3 1 1 10 11760 1 1 35 PRO HD2 H -5.325 -7.543 -3.618 1.00 . A A . 35 PRO HD2 1 1 10 11761 1 1 35 PRO HD3 H -5.500 -6.074 -2.645 1.00 . A A . 35 PRO HD3 1 1 10 11762 1 1 35 PRO HG2 H -4.679 -8.701 -1.721 1.00 . A A . 35 PRO HG2 1 1 10 11763 1 1 35 PRO HG3 H -4.817 -7.234 -0.761 1.00 . A A . 35 PRO HG3 1 1 10 11764 1 1 35 PRO N N -3.607 -6.353 -3.492 1.00 . A A . 35 PRO N 1 1 10 11765 1 1 35 PRO O O -2.157 -8.841 -4.189 1.00 . A A . 35 PRO O 1 1 10 11766 1 1 36 ILE C C 0.289 -9.814 -3.374 1.00 . A A . 36 ILE C 1 1 10 11767 1 1 36 ILE CA C 0.758 -8.453 -3.928 1.00 . A A . 36 ILE CA 1 1 10 11768 1 1 36 ILE CB C 1.956 -7.852 -3.174 1.00 . A A . 36 ILE CB 1 1 10 11769 1 1 36 ILE CD1 C 2.768 -9.047 -1.137 1.00 . A A . 36 ILE CD1 1 1 10 11770 1 1 36 ILE CG1 C 2.939 -8.887 -2.633 1.00 . A A . 36 ILE CG1 1 1 10 11771 1 1 36 ILE CG2 C 1.527 -6.865 -2.080 1.00 . A A . 36 ILE CG2 1 1 10 11772 1 1 36 ILE H H -0.137 -6.514 -4.139 1.00 . A A . 36 ILE H 1 1 10 11773 1 1 36 ILE HA H 1.040 -8.588 -4.965 1.00 . A A . 36 ILE HA 1 1 10 11774 1 1 36 ILE HB H 2.533 -7.285 -3.892 1.00 . A A . 36 ILE HB 1 1 10 11775 1 1 36 ILE HD11 H 3.435 -9.817 -0.758 1.00 . A A . 36 ILE HD11 1 1 10 11776 1 1 36 ILE HD12 H 2.991 -8.098 -0.650 1.00 . A A . 36 ILE HD12 1 1 10 11777 1 1 36 ILE HD13 H 1.734 -9.311 -0.918 1.00 . A A . 36 ILE HD13 1 1 10 11778 1 1 36 ILE HG12 H 2.827 -9.852 -3.117 1.00 . A A . 36 ILE HG12 1 1 10 11779 1 1 36 ILE HG13 H 3.956 -8.560 -2.844 1.00 . A A . 36 ILE HG13 1 1 10 11780 1 1 36 ILE HG21 H 1.003 -7.387 -1.281 1.00 . A A . 36 ILE HG21 1 1 10 11781 1 1 36 ILE HG22 H 2.396 -6.373 -1.643 1.00 . A A . 36 ILE HG22 1 1 10 11782 1 1 36 ILE HG23 H 0.868 -6.091 -2.472 1.00 . A A . 36 ILE HG23 1 1 10 11783 1 1 36 ILE N N -0.334 -7.481 -3.956 1.00 . A A . 36 ILE N 1 1 10 11784 1 1 36 ILE O O -0.576 -9.884 -2.510 1.00 . A A . 36 ILE O 1 1 10 11785 1 1 37 PRO C C 0.826 -12.264 -1.837 1.00 . A A . 37 PRO C 1 1 10 11786 1 1 37 PRO CA C 0.810 -12.225 -3.362 1.00 . A A . 37 PRO CA 1 1 10 11787 1 1 37 PRO CB C 2.051 -12.934 -3.900 1.00 . A A . 37 PRO CB 1 1 10 11788 1 1 37 PRO CD C 1.741 -10.819 -5.119 1.00 . A A . 37 PRO CD 1 1 10 11789 1 1 37 PRO CG C 2.497 -12.151 -5.145 1.00 . A A . 37 PRO CG 1 1 10 11790 1 1 37 PRO HA H -0.095 -12.719 -3.716 1.00 . A A . 37 PRO HA 1 1 10 11791 1 1 37 PRO HB2 H 2.840 -12.913 -3.148 1.00 . A A . 37 PRO HB2 1 1 10 11792 1 1 37 PRO HB3 H 1.842 -13.978 -4.120 1.00 . A A . 37 PRO HB3 1 1 10 11793 1 1 37 PRO HD2 H 2.437 -9.984 -5.054 1.00 . A A . 37 PRO HD2 1 1 10 11794 1 1 37 PRO HD3 H 1.130 -10.692 -6.013 1.00 . A A . 37 PRO HD3 1 1 10 11795 1 1 37 PRO HG2 H 3.574 -11.982 -5.127 1.00 . A A . 37 PRO HG2 1 1 10 11796 1 1 37 PRO HG3 H 2.263 -12.707 -6.053 1.00 . A A . 37 PRO HG3 1 1 10 11797 1 1 37 PRO N N 0.887 -10.892 -3.940 1.00 . A A . 37 PRO N 1 1 10 11798 1 1 37 PRO O O 0.714 -11.251 -1.161 1.00 . A A . 37 PRO O 1 1 10 11799 1 1 38 HIS C C -0.249 -12.777 0.683 1.00 . A A . 38 HIS C 1 1 10 11800 1 1 38 HIS CA C 0.579 -13.879 -0.001 1.00 . A A . 38 HIS CA 1 1 10 11801 1 1 38 HIS CB C 1.767 -14.434 0.813 1.00 . A A . 38 HIS CB 1 1 10 11802 1 1 38 HIS CD2 C 3.342 -12.478 0.256 1.00 . A A . 38 HIS CD2 1 1 10 11803 1 1 38 HIS CE1 C 4.755 -12.586 1.971 1.00 . A A . 38 HIS CE1 1 1 10 11804 1 1 38 HIS CG C 2.941 -13.512 1.014 1.00 . A A . 38 HIS CG 1 1 10 11805 1 1 38 HIS H H 1.437 -14.199 -1.926 1.00 . A A . 38 HIS H 1 1 10 11806 1 1 38 HIS HA H -0.112 -14.695 -0.116 1.00 . A A . 38 HIS HA 1 1 10 11807 1 1 38 HIS HB2 H 1.395 -14.729 1.799 1.00 . A A . 38 HIS HB2 1 1 10 11808 1 1 38 HIS HB3 H 2.128 -15.339 0.313 1.00 . A A . 38 HIS HB3 1 1 10 11809 1 1 38 HIS HD1 H 3.882 -14.313 2.834 1.00 . A A . 38 HIS HD1 1 1 10 11810 1 1 38 HIS HD2 H 2.879 -12.158 -0.652 1.00 . A A . 38 HIS HD2 1 1 10 11811 1 1 38 HIS HE1 H 5.510 -12.323 2.706 1.00 . A A . 38 HIS HE1 1 1 10 11812 1 1 38 HIS N N 1.000 -13.510 -1.348 1.00 . A A . 38 HIS N 1 1 10 11813 1 1 38 HIS ND1 N 3.889 -13.599 2.134 1.00 . A A . 38 HIS ND1 1 1 10 11814 1 1 38 HIS NE2 N 4.526 -11.856 0.869 1.00 . A A . 38 HIS NE2 1 1 10 11815 1 1 38 HIS O O -1.264 -12.314 0.179 1.00 . A A . 38 HIS O 1 1 10 11816 1 1 39 GLU C C -1.785 -11.694 3.035 1.00 . A A . 39 GLU C 1 1 10 11817 1 1 39 GLU CA C -0.330 -12.178 3.119 1.00 . A A . 39 GLU CA 1 1 10 11818 1 1 39 GLU CB C 0.547 -11.179 3.860 1.00 . A A . 39 GLU CB 1 1 10 11819 1 1 39 GLU CD C 1.851 -12.640 5.424 1.00 . A A . 39 GLU CD 1 1 10 11820 1 1 39 GLU CG C 1.913 -11.799 4.147 1.00 . A A . 39 GLU CG 1 1 10 11821 1 1 39 GLU H H 1.292 -12.546 1.780 1.00 . A A . 39 GLU H 1 1 10 11822 1 1 39 GLU HA H -0.311 -13.136 3.632 1.00 . A A . 39 GLU HA 1 1 10 11823 1 1 39 GLU HB2 H 0.675 -10.304 3.220 1.00 . A A . 39 GLU HB2 1 1 10 11824 1 1 39 GLU HB3 H 0.077 -10.862 4.791 1.00 . A A . 39 GLU HB3 1 1 10 11825 1 1 39 GLU HG2 H 2.202 -12.437 3.314 1.00 . A A . 39 GLU HG2 1 1 10 11826 1 1 39 GLU HG3 H 2.686 -11.042 4.255 1.00 . A A . 39 GLU HG3 1 1 10 11827 1 1 39 GLU N N 0.312 -12.403 1.834 1.00 . A A . 39 GLU N 1 1 10 11828 1 1 39 GLU O O -2.509 -11.930 2.076 1.00 . A A . 39 GLU O 1 1 10 11829 1 1 39 GLU OE1 O 1.900 -12.063 6.509 1.00 . A A . 39 GLU OE1 1 1 10 11830 1 1 39 GLU OE2 O 1.756 -13.861 5.319 1.00 . A A . 39 GLU OE2 1 1 10 11831 1 1 40 PRO C C -1.479 -8.716 4.632 1.00 . A A . 40 PRO C 1 1 10 11832 1 1 40 PRO CA C -2.623 -9.655 4.218 1.00 . A A . 40 PRO CA 1 1 10 11833 1 1 40 PRO CB C -3.629 -9.646 5.373 1.00 . A A . 40 PRO CB 1 1 10 11834 1 1 40 PRO CD C -2.403 -11.786 5.380 1.00 . A A . 40 PRO CD 1 1 10 11835 1 1 40 PRO CG C -3.404 -10.940 6.173 1.00 . A A . 40 PRO CG 1 1 10 11836 1 1 40 PRO HA H -3.077 -9.335 3.280 1.00 . A A . 40 PRO HA 1 1 10 11837 1 1 40 PRO HB2 H -3.475 -8.772 6.006 1.00 . A A . 40 PRO HB2 1 1 10 11838 1 1 40 PRO HB3 H -4.649 -9.602 4.993 1.00 . A A . 40 PRO HB3 1 1 10 11839 1 1 40 PRO HD2 H -1.450 -11.896 5.900 1.00 . A A . 40 PRO HD2 1 1 10 11840 1 1 40 PRO HD3 H -2.786 -12.779 5.145 1.00 . A A . 40 PRO HD3 1 1 10 11841 1 1 40 PRO HG2 H -3.013 -10.714 7.165 1.00 . A A . 40 PRO HG2 1 1 10 11842 1 1 40 PRO HG3 H -4.342 -11.479 6.302 1.00 . A A . 40 PRO HG3 1 1 10 11843 1 1 40 PRO N N -2.190 -11.050 4.153 1.00 . A A . 40 PRO N 1 1 10 11844 1 1 40 PRO O O -0.732 -9.020 5.553 1.00 . A A . 40 PRO O 1 1 10 11845 1 1 41 HIS C C -0.538 -5.206 3.719 1.00 . A A . 41 HIS C 1 1 10 11846 1 1 41 HIS CA C -1.054 -6.335 4.633 1.00 . A A . 41 HIS CA 1 1 10 11847 1 1 41 HIS CB C 0.119 -6.572 5.560 1.00 . A A . 41 HIS CB 1 1 10 11848 1 1 41 HIS CD2 C 2.240 -6.482 4.169 1.00 . A A . 41 HIS CD2 1 1 10 11849 1 1 41 HIS CE1 C 2.611 -8.638 3.741 1.00 . A A . 41 HIS CE1 1 1 10 11850 1 1 41 HIS CG C 1.277 -7.166 4.806 1.00 . A A . 41 HIS CG 1 1 10 11851 1 1 41 HIS H H -1.430 -7.605 2.928 1.00 . A A . 41 HIS H 1 1 10 11852 1 1 41 HIS HA H -1.946 -5.999 5.168 1.00 . A A . 41 HIS HA 1 1 10 11853 1 1 41 HIS HB2 H 0.389 -5.568 5.874 1.00 . A A . 41 HIS HB2 1 1 10 11854 1 1 41 HIS HB3 H -0.141 -7.162 6.441 1.00 . A A . 41 HIS HB3 1 1 10 11855 1 1 41 HIS HD1 H 1.033 -9.344 4.971 1.00 . A A . 41 HIS HD1 1 1 10 11856 1 1 41 HIS HD2 H 2.311 -5.416 4.136 1.00 . A A . 41 HIS HD2 1 1 10 11857 1 1 41 HIS HE1 H 2.771 -9.469 3.061 1.00 . A A . 41 HIS HE1 1 1 10 11858 1 1 41 HIS N N -1.392 -7.568 3.925 1.00 . A A . 41 HIS N 1 1 10 11859 1 1 41 HIS ND1 N 1.561 -8.590 4.582 1.00 . A A . 41 HIS ND1 1 1 10 11860 1 1 41 HIS NE2 N 3.150 -7.430 3.510 1.00 . A A . 41 HIS NE2 1 1 10 11861 1 1 41 HIS O O 0.121 -4.277 4.169 1.00 . A A . 41 HIS O 1 1 10 11862 1 1 42 ARG C C 0.563 -5.096 0.438 1.00 . A A . 42 ARG C 1 1 10 11863 1 1 42 ARG CA C 0.056 -5.997 1.538 1.00 . A A . 42 ARG CA 1 1 10 11864 1 1 42 ARG CB C -0.639 -7.192 0.922 1.00 . A A . 42 ARG CB 1 1 10 11865 1 1 42 ARG CD C -0.622 -9.479 0.579 1.00 . A A . 42 ARG CD 1 1 10 11866 1 1 42 ARG CG C 0.135 -8.384 1.276 1.00 . A A . 42 ARG CG 1 1 10 11867 1 1 42 ARG CZ C -3.005 -9.780 0.405 1.00 . A A . 42 ARG CZ 1 1 10 11868 1 1 42 ARG H H -1.831 -5.153 2.295 1.00 . A A . 42 ARG H 1 1 10 11869 1 1 42 ARG HA H 0.899 -6.311 2.127 1.00 . A A . 42 ARG HA 1 1 10 11870 1 1 42 ARG HB2 H -1.669 -7.273 1.270 1.00 . A A . 42 ARG HB2 1 1 10 11871 1 1 42 ARG HB3 H -0.637 -7.253 -0.167 1.00 . A A . 42 ARG HB3 1 1 10 11872 1 1 42 ARG HD2 H -0.791 -9.235 -0.467 1.00 . A A . 42 ARG HD2 1 1 10 11873 1 1 42 ARG HD3 H -0.074 -10.389 0.635 1.00 . A A . 42 ARG HD3 1 1 10 11874 1 1 42 ARG HE H -1.998 -9.702 2.184 1.00 . A A . 42 ARG HE 1 1 10 11875 1 1 42 ARG HG2 H 1.147 -8.284 0.882 1.00 . A A . 42 ARG HG2 1 1 10 11876 1 1 42 ARG HG3 H 0.162 -8.403 2.360 1.00 . A A . 42 ARG HG3 1 1 10 11877 1 1 42 ARG HH11 H -2.265 -11.325 -0.674 1.00 . A A . 42 ARG HH11 1 1 10 11878 1 1 42 ARG HH12 H -3.689 -10.582 -1.324 1.00 . A A . 42 ARG HH12 1 1 10 11879 1 1 42 ARG HH21 H -4.536 -9.116 1.550 1.00 . A A . 42 ARG HH21 1 1 10 11880 1 1 42 ARG HH22 H -4.482 -8.476 -0.059 1.00 . A A . 42 ARG HH22 1 1 10 11881 1 1 42 ARG N N -0.868 -5.333 2.438 1.00 . A A . 42 ARG N 1 1 10 11882 1 1 42 ARG NE N -1.922 -9.643 1.190 1.00 . A A . 42 ARG NE 1 1 10 11883 1 1 42 ARG NH1 N -2.984 -10.633 -0.615 1.00 . A A . 42 ARG NH1 1 1 10 11884 1 1 42 ARG NH2 N -4.098 -9.065 0.652 1.00 . A A . 42 ARG NH2 1 1 10 11885 1 1 42 ARG O O 1.717 -4.695 0.350 1.00 . A A . 42 ARG O 1 1 10 11886 1 1 43 CYS C C 0.972 -3.355 -1.690 1.00 . A A . 43 CYS C 1 1 10 11887 1 1 43 CYS CA C -0.443 -3.814 -1.371 1.00 . A A . 43 CYS CA 1 1 10 11888 1 1 43 CYS CB C -1.261 -2.652 -0.863 1.00 . A A . 43 CYS CB 1 1 10 11889 1 1 43 CYS H H -1.236 -5.082 0.213 1.00 . A A . 43 CYS H 1 1 10 11890 1 1 43 CYS HA H -0.842 -4.249 -2.287 1.00 . A A . 43 CYS HA 1 1 10 11891 1 1 43 CYS HB2 H -0.630 -1.764 -0.912 1.00 . A A . 43 CYS HB2 1 1 10 11892 1 1 43 CYS HB3 H -2.102 -2.578 -1.537 1.00 . A A . 43 CYS HB3 1 1 10 11893 1 1 43 CYS N N -0.464 -4.849 -0.371 1.00 . A A . 43 CYS N 1 1 10 11894 1 1 43 CYS O O 1.613 -2.636 -0.933 1.00 . A A . 43 CYS O 1 1 10 11895 1 1 43 CYS SG S -1.968 -2.827 0.794 1.00 . A A . 43 CYS SG 1 1 10 11896 1 1 44 GLN C C 2.814 -3.212 -4.729 1.00 . A A . 44 GLN C 1 1 10 11897 1 1 44 GLN CA C 2.758 -3.497 -3.238 1.00 . A A . 44 GLN CA 1 1 10 11898 1 1 44 GLN CB C 3.704 -4.634 -2.886 1.00 . A A . 44 GLN CB 1 1 10 11899 1 1 44 GLN CD C 6.045 -5.523 -2.967 1.00 . A A . 44 GLN CD 1 1 10 11900 1 1 44 GLN CG C 5.104 -4.423 -3.462 1.00 . A A . 44 GLN CG 1 1 10 11901 1 1 44 GLN H H 0.783 -4.282 -3.502 1.00 . A A . 44 GLN H 1 1 10 11902 1 1 44 GLN HA H 2.997 -2.596 -2.677 1.00 . A A . 44 GLN HA 1 1 10 11903 1 1 44 GLN HB2 H 3.757 -4.736 -1.807 1.00 . A A . 44 GLN HB2 1 1 10 11904 1 1 44 GLN HB3 H 3.282 -5.557 -3.266 1.00 . A A . 44 GLN HB3 1 1 10 11905 1 1 44 GLN HE21 H 5.874 -4.844 -1.056 1.00 . A A . 44 GLN HE21 1 1 10 11906 1 1 44 GLN HE22 H 6.225 -6.555 -1.223 1.00 . A A . 44 GLN HE22 1 1 10 11907 1 1 44 GLN HG2 H 5.078 -4.445 -4.552 1.00 . A A . 44 GLN HG2 1 1 10 11908 1 1 44 GLN HG3 H 5.502 -3.454 -3.160 1.00 . A A . 44 GLN HG3 1 1 10 11909 1 1 44 GLN N N 1.406 -3.822 -2.869 1.00 . A A . 44 GLN N 1 1 10 11910 1 1 44 GLN NE2 N 6.048 -5.652 -1.629 1.00 . A A . 44 GLN NE2 1 1 10 11911 1 1 44 GLN O O 2.633 -4.071 -5.584 1.00 . A A . 44 GLN O 1 1 10 11912 1 1 44 GLN OE1 O 6.714 -6.198 -3.741 1.00 . A A . 44 GLN OE1 1 1 10 11913 1 1 45 MET C C 1.479 -1.860 -6.795 1.00 . A A . 45 MET C 1 1 10 11914 1 1 45 MET CA C 2.068 -1.116 -5.592 1.00 . A A . 45 MET CA 1 1 10 11915 1 1 45 MET CB C 2.683 0.218 -6.013 1.00 . A A . 45 MET CB 1 1 10 11916 1 1 45 MET CE C 2.644 0.031 -10.108 1.00 . A A . 45 MET CE 1 1 10 11917 1 1 45 MET CG C 3.198 0.181 -7.451 1.00 . A A . 45 MET CG 1 1 10 11918 1 1 45 MET H H 3.856 -1.563 -4.422 1.00 . A A . 45 MET H 1 1 10 11919 1 1 45 MET HA H 1.275 -0.976 -4.860 1.00 . A A . 45 MET HA 1 1 10 11920 1 1 45 MET HB2 H 1.940 1.008 -5.919 1.00 . A A . 45 MET HB2 1 1 10 11921 1 1 45 MET HB3 H 3.500 0.474 -5.338 1.00 . A A . 45 MET HB3 1 1 10 11922 1 1 45 MET HE1 H 1.943 -0.603 -10.649 1.00 . A A . 45 MET HE1 1 1 10 11923 1 1 45 MET HE2 H 2.927 0.862 -10.754 1.00 . A A . 45 MET HE2 1 1 10 11924 1 1 45 MET HE3 H 3.533 -0.557 -9.877 1.00 . A A . 45 MET HE3 1 1 10 11925 1 1 45 MET HG2 H 4.048 0.853 -7.569 1.00 . A A . 45 MET HG2 1 1 10 11926 1 1 45 MET HG3 H 3.541 -0.823 -7.701 1.00 . A A . 45 MET HG3 1 1 10 11927 1 1 45 MET N N 3.085 -1.925 -4.945 1.00 . A A . 45 MET N 1 1 10 11928 1 1 45 MET O O 2.184 -2.497 -7.568 1.00 . A A . 45 MET O 1 1 10 11929 1 1 45 MET SD S 1.894 0.649 -8.593 1.00 . A A . 45 MET SD 1 1 10 11930 1 1 46 PHE C C -0.160 -2.891 -9.072 1.00 . A A . 46 PHE C 1 1 10 11931 1 1 46 PHE CA C -0.578 -2.791 -7.591 1.00 . A A . 46 PHE CA 1 1 10 11932 1 1 46 PHE CB C -2.097 -2.616 -7.352 1.00 . A A . 46 PHE CB 1 1 10 11933 1 1 46 PHE CD1 C -2.944 -4.412 -8.972 1.00 . A A . 46 PHE CD1 1 1 10 11934 1 1 46 PHE CD2 C -3.915 -2.125 -9.074 1.00 . A A . 46 PHE CD2 1 1 10 11935 1 1 46 PHE CE1 C -3.797 -4.825 -10.055 1.00 . A A . 46 PHE CE1 1 1 10 11936 1 1 46 PHE CE2 C -4.770 -2.533 -10.157 1.00 . A A . 46 PHE CE2 1 1 10 11937 1 1 46 PHE CG C -2.995 -3.060 -8.478 1.00 . A A . 46 PHE CG 1 1 10 11938 1 1 46 PHE CZ C -4.709 -3.884 -10.648 1.00 . A A . 46 PHE CZ 1 1 10 11939 1 1 46 PHE H H -0.353 -0.975 -6.468 1.00 . A A . 46 PHE H 1 1 10 11940 1 1 46 PHE HA H -0.191 -3.678 -7.113 1.00 . A A . 46 PHE HA 1 1 10 11941 1 1 46 PHE HB2 H -2.387 -3.166 -6.460 1.00 . A A . 46 PHE HB2 1 1 10 11942 1 1 46 PHE HB3 H -2.315 -1.569 -7.140 1.00 . A A . 46 PHE HB3 1 1 10 11943 1 1 46 PHE HD1 H -2.262 -5.125 -8.534 1.00 . A A . 46 PHE HD1 1 1 10 11944 1 1 46 PHE HD2 H -3.966 -1.112 -8.701 1.00 . A A . 46 PHE HD2 1 1 10 11945 1 1 46 PHE HE1 H -3.752 -5.841 -10.421 1.00 . A A . 46 PHE HE1 1 1 10 11946 1 1 46 PHE HE2 H -5.458 -1.828 -10.598 1.00 . A A . 46 PHE HE2 1 1 10 11947 1 1 46 PHE HZ H -5.347 -4.191 -11.464 1.00 . A A . 46 PHE HZ 1 1 10 11948 1 1 46 PHE N N 0.141 -1.735 -6.893 1.00 . A A . 46 PHE N 1 1 10 11949 1 1 46 PHE O O -0.099 -3.963 -9.661 1.00 . A A . 46 PHE O 1 1 10 11950 1 1 47 CYS C C 0.339 -2.157 -12.011 1.30 . A A . 47 CYS C 1 1 10 11951 1 1 47 CYS CA C -0.391 -1.360 -10.922 0.80 . A A . 47 CYS CA 1 1 10 11952 1 1 47 CYS CB C -0.289 0.148 -11.175 0.60 . A A . 47 CYS CB 1 1 10 11953 1 1 47 CYS H H 0.534 -1.116 -8.910 1.00 . A A . 47 CYS H 1 1 10 11954 1 1 47 CYS HA H -1.434 -1.664 -10.911 1.10 . A A . 47 CYS HA 1 1 10 11955 1 1 47 CYS HB2 H 0.381 0.614 -10.457 0.90 . A A . 47 CYS HB2 1 1 10 11956 1 1 47 CYS HB3 H 0.135 0.342 -12.160 0.90 . A A . 47 CYS HB3 1 1 10 11957 1 1 47 CYS N N 0.127 -1.704 -9.606 0.60 . A A . 47 CYS N 1 1 10 11958 1 1 47 CYS O O 1.551 -2.078 -12.167 1.90 . A A . 47 CYS O 1 1 10 11959 1 1 47 CYS SG S -1.895 0.970 -11.052 1.30 . A A . 47 CYS SG 1 1 10 11960 1 1 48 ASN C C -0.767 -4.608 -14.535 1.90 . A A . 48 ASN C 1 1 10 11961 1 1 48 ASN CA C 0.105 -4.104 -13.378 2.30 . A A . 48 ASN CA 1 1 10 11962 1 1 48 ASN CB C 0.265 -5.210 -12.334 3.00 . A A . 48 ASN CB 1 1 10 11963 1 1 48 ASN CG C -1.109 -5.619 -11.795 3.70 . A A . 48 ASN CG 1 1 10 11964 1 1 48 ASN H H -1.448 -2.712 -12.865 2.00 . A A . 48 ASN H 1 1 10 11965 1 1 48 ASN HA H 1.074 -3.790 -13.766 2.70 . A A . 48 ASN HA 1 1 10 11966 1 1 48 ASN HB2 H 0.748 -6.085 -12.770 3.30 . A A . 48 ASN HB2 1 1 10 11967 1 1 48 ASN HB3 H 0.883 -4.870 -11.503 3.20 . A A . 48 ASN HB3 1 1 10 11968 1 1 48 ASN HD21 H -1.365 -5.586 -9.769 1.00 . A A . 48 ASN HD21 1 1 10 11969 1 1 48 ASN N N -0.480 -2.932 -12.751 1.70 . A A . 48 ASN N 1 1 10 11970 1 1 48 ASN ND2 N -1.055 -6.125 -10.551 4.10 . A A . 48 ASN ND2 1 1 10 11971 1 1 48 ASN O O -1.197 -5.755 -14.556 2.30 . A A . 48 ASN O 1 1 10 11972 1 1 48 ASN OD1 O -2.133 -5.480 -12.453 4.40 . A A . 48 ASN OD1 1 1 10 11973 1 1 49 GLN C C -1.340 -3.055 -17.841 1.80 . A A . 49 GLN C 1 1 10 11974 1 1 49 GLN CA C -1.244 -4.206 -16.835 2.00 . A A . 49 GLN CA 1 1 10 11975 1 1 49 GLN CB C -2.548 -5.004 -16.831 2.20 . A A . 49 GLN CB 1 1 10 11976 1 1 49 GLN CD C -4.354 -6.080 -18.191 3.40 . A A . 49 GLN CD 1 1 10 11977 1 1 49 GLN CG C -3.107 -5.194 -18.241 2.70 . A A . 49 GLN CG 1 1 10 11978 1 1 49 GLN H H -1.037 -2.719 -15.299 2.50 . A A . 49 GLN H 1 1 10 11979 1 1 49 GLN HA H -0.395 -4.840 -17.093 2.50 . A A . 49 GLN HA 1 1 10 11980 1 1 49 GLN HB2 H -2.380 -5.977 -16.369 2.60 . A A . 49 GLN HB2 1 1 10 11981 1 1 49 GLN HB3 H -3.286 -4.491 -16.212 2.10 . A A . 49 GLN HB3 1 1 10 11982 1 1 49 GLN HE21 H -5.494 -4.409 -18.411 4.50 . A A . 49 GLN HE21 1 1 10 11983 1 1 49 GLN HE22 H -6.302 -5.926 -18.760 4.10 . A A . 49 GLN HE22 1 1 10 11984 1 1 49 GLN HG2 H -3.374 -4.234 -18.682 2.70 . A A . 49 GLN HG2 1 1 10 11985 1 1 49 GLN HG3 H -2.366 -5.663 -18.888 2.80 . A A . 49 GLN HG3 1 1 10 11986 1 1 49 GLN N N -0.988 -3.696 -15.500 2.00 . A A . 49 GLN N 1 1 10 11987 1 1 49 GLN NE2 N -5.485 -5.412 -18.480 4.00 . A A . 49 GLN NE2 1 1 10 11988 1 1 49 GLN O O -2.385 -2.441 -18.020 2.20 . A A . 49 GLN O 1 1 10 11989 1 1 49 GLN OE1 O -4.291 -7.272 -17.913 3.70 . A A . 49 GLN OE1 1 1 10 11990 1 1 50 THR C C 0.036 -0.456 -17.870 1.50 . A A . 50 THR C 1 1 10 11991 1 1 50 THR CA C 0.730 -1.821 -17.960 1.80 . A A . 50 THR CA 1 1 10 11992 1 1 50 THR CB C 1.968 -1.734 -18.854 1.90 . A A . 50 THR CB 1 1 10 11993 1 1 50 THR CG2 C 2.427 -3.113 -19.332 2.30 . A A . 50 THR CG2 1 1 10 11994 1 1 50 THR H H 0.037 -3.313 -19.330 2.00 . A A . 50 THR H 1 1 10 11995 1 1 50 THR HA H 0.997 -2.158 -16.959 2.10 . A A . 50 THR HA 1 1 10 11996 1 1 50 THR HB H 2.779 -1.255 -18.305 2.20 . A A . 50 THR HB 1 1 10 11997 1 1 50 THR HG1 H 2.125 -1.319 -20.708 2.50 . A A . 50 THR HG1 1 1 10 11998 1 1 50 THR HG21 H 1.894 -3.906 -18.808 2.40 . A A . 50 THR HG21 1 1 10 11999 1 1 50 THR HG22 H 3.494 -3.250 -19.157 2.60 . A A . 50 THR HG22 1 1 10 12000 1 1 50 THR HG23 H 2.245 -3.234 -20.400 2.80 . A A . 50 THR HG23 1 1 10 12001 1 1 50 THR N N -0.185 -2.815 -18.492 1.70 . A A . 50 THR N 1 1 10 12002 1 1 50 THR O O 0.387 0.500 -18.550 2.20 . A A . 50 THR O 1 1 10 12003 1 1 50 THR OG1 O 1.685 -0.925 -19.967 2.20 . A A . 50 THR OG1 1 1 10 12004 1 1 51 ALA C C -0.277 1.582 -15.782 0.60 . A A . 51 ALA C 1 1 10 12005 1 1 51 ALA CA C -0.725 0.124 -15.672 0.60 . A A . 51 ALA CA 1 1 10 12006 1 1 51 ALA CB C 0.352 -0.678 -14.942 0.70 . A A . 51 ALA CB 1 1 10 12007 1 1 51 ALA H H -1.712 -1.110 -17.095 0.90 . A A . 51 ALA H 1 1 10 12008 1 1 51 ALA HA H -1.681 0.112 -15.148 0.70 . A A . 51 ALA HA 1 1 10 12009 1 1 51 ALA HB1 H 0.637 -0.187 -14.012 1.20 . A A . 51 ALA HB1 1 1 10 12010 1 1 51 ALA HB2 H 1.249 -0.771 -15.552 1.00 . A A . 51 ALA HB2 1 1 10 12011 1 1 51 ALA HB3 H 0.001 -1.680 -14.700 1.30 . A A . 51 ALA HB3 1 1 10 12012 1 1 51 ALA N N -0.972 -0.449 -16.980 0.80 . A A . 51 ALA N 1 1 10 12013 1 1 51 ALA O O -0.242 2.192 -16.843 1.10 . A A . 51 ALA O 1 1 10 12014 1 1 52 CYS C C 0.940 4.265 -14.106 0.80 . A A . 52 CYS C 1 1 10 12015 1 1 52 CYS CA C -0.337 3.408 -14.182 0.80 . A A . 52 CYS CA 1 1 10 12016 1 1 52 CYS CB C -1.107 3.258 -12.877 0.90 . A A . 52 CYS CB 1 1 10 12017 1 1 52 CYS H H 0.305 1.413 -13.861 0.90 . A A . 52 CYS H 1 1 10 12018 1 1 52 CYS HA H -1.012 3.782 -14.947 0.80 . A A . 52 CYS HA 1 1 10 12019 1 1 52 CYS HB2 H -0.412 3.178 -12.048 1.00 . A A . 52 CYS HB2 1 1 10 12020 1 1 52 CYS HB3 H -1.732 4.134 -12.707 1.10 . A A . 52 CYS HB3 1 1 10 12021 1 1 52 CYS N N 0.056 2.068 -14.574 0.70 . A A . 52 CYS N 1 1 10 12022 1 1 52 CYS O O 1.967 3.847 -14.615 1.20 . A A . 52 CYS O 1 1 10 12023 1 1 52 CYS SG S -2.157 1.781 -12.904 1.00 . A A . 52 CYS SG 1 1 10 12024 1 1 53 PRO C C 2.483 7.200 -14.440 0.80 . A A . 53 PRO C 1 1 10 12025 1 1 53 PRO CA C 1.047 6.692 -14.312 0.70 . A A . 53 PRO CA 1 1 10 12026 1 1 53 PRO CB C 0.232 7.758 -13.576 0.90 . A A . 53 PRO CB 1 1 10 12027 1 1 53 PRO CD C 0.506 5.769 -12.138 0.80 . A A . 53 PRO CD 1 1 10 12028 1 1 53 PRO CG C 0.033 7.228 -12.145 0.90 . A A . 53 PRO CG 1 1 10 12029 1 1 53 PRO HA H 0.736 6.474 -15.319 0.80 . A A . 53 PRO HA 1 1 10 12030 1 1 53 PRO HB2 H 0.759 8.712 -13.568 1.00 . A A . 53 PRO HB2 1 1 10 12031 1 1 53 PRO HB3 H -0.729 7.915 -14.067 1.10 . A A . 53 PRO HB3 1 1 10 12032 1 1 53 PRO HD2 H 1.383 5.640 -11.505 0.80 . A A . 53 PRO HD2 1 1 10 12033 1 1 53 PRO HD3 H -0.280 5.124 -11.767 0.90 . A A . 53 PRO HD3 1 1 10 12034 1 1 53 PRO HG2 H 0.607 7.818 -11.431 0.90 . A A . 53 PRO HG2 1 1 10 12035 1 1 53 PRO HG3 H -1.015 7.290 -11.853 1.00 . A A . 53 PRO HG3 1 1 10 12036 1 1 53 PRO N N 0.850 5.490 -13.526 0.60 . A A . 53 PRO N 1 1 10 12037 1 1 53 PRO O O 2.782 8.071 -15.247 1.60 . A A . 53 PRO O 1 1 10 12038 1 1 54 ALA C C 3.670 8.794 -12.474 0.90 . A A . 54 ALA C 1 1 10 12039 1 1 54 ALA CA C 4.313 7.472 -12.933 0.80 . A A . 54 ALA CA 1 1 10 12040 1 1 54 ALA CB C 5.473 7.770 -13.892 0.80 . A A . 54 ALA CB 1 1 10 12041 1 1 54 ALA H H 3.329 5.606 -13.579 1.40 . A A . 54 ALA H 1 1 10 12042 1 1 54 ALA HA H 4.642 6.937 -12.042 0.70 . A A . 54 ALA HA 1 1 10 12043 1 1 54 ALA HB1 H 6.428 7.710 -13.370 1.20 . A A . 54 ALA HB1 1 1 10 12044 1 1 54 ALA HB2 H 5.383 8.770 -14.314 1.40 . A A . 54 ALA HB2 1 1 10 12045 1 1 54 ALA HB3 H 5.492 7.053 -14.713 1.30 . A A . 54 ALA HB3 1 1 10 12046 1 1 54 ALA N N 3.343 6.611 -13.601 0.80 . A A . 54 ALA N 1 1 10 12047 1 1 54 ALA O O 2.467 8.892 -12.262 1.50 . A A . 54 ALA O 1 1 10 12048 1 1 55 ASP C C 3.070 10.966 -10.803 1.10 . A A . 55 ASP C 1 1 10 12049 1 1 55 ASP CA C 4.135 11.106 -11.903 1.20 . A A . 55 ASP CA 1 1 10 12050 1 1 55 ASP CB C 3.661 11.858 -13.147 1.40 . A A . 55 ASP CB 1 1 10 12051 1 1 55 ASP CG C 2.720 13.015 -12.806 2.10 . A A . 55 ASP CG 1 1 10 12052 1 1 55 ASP H H 5.520 9.649 -12.589 1.40 . A A . 55 ASP H 1 1 10 12053 1 1 55 ASP HA H 5.015 11.588 -11.480 1.30 . A A . 55 ASP HA 1 1 10 12054 1 1 55 ASP HB2 H 4.519 12.263 -13.685 1.50 . A A . 55 ASP HB2 1 1 10 12055 1 1 55 ASP HB3 H 3.166 11.156 -13.816 1.80 . A A . 55 ASP HB3 1 1 10 12056 1 1 55 ASP N N 4.567 9.792 -12.335 1.00 . A A . 55 ASP N 1 1 10 12057 1 1 55 ASP O O 2.024 11.603 -10.801 1.50 . A A . 55 ASP O 1 1 10 12058 1 1 55 ASP OD1 O 2.906 13.636 -11.760 2.80 . A A . 55 ASP OD1 1 1 10 12059 1 1 55 ASP OD2 O 1.812 13.282 -13.591 2.60 . A A . 55 ASP OD2 1 1 10 12060 1 1 56 CYS C C 3.122 11.674 -8.036 0.80 . A A . 56 CYS C 1 1 10 12061 1 1 56 CYS CA C 3.111 10.204 -8.476 0.80 . A A . 56 CYS CA 1 1 10 12062 1 1 56 CYS CB C 4.161 9.388 -7.720 0.90 . A A . 56 CYS CB 1 1 10 12063 1 1 56 CYS H H 3.935 9.224 -10.042 1.10 . A A . 56 CYS H 1 1 10 12064 1 1 56 CYS HA H 2.125 9.761 -8.336 0.70 . A A . 56 CYS HA 1 1 10 12065 1 1 56 CYS HB2 H 4.832 10.075 -7.212 1.00 . A A . 56 CYS HB2 1 1 10 12066 1 1 56 CYS HB3 H 3.641 8.775 -6.990 0.90 . A A . 56 CYS HB3 1 1 10 12067 1 1 56 CYS N N 3.432 10.069 -9.869 0.90 . A A . 56 CYS N 1 1 10 12068 1 1 56 CYS O O 2.972 12.596 -8.829 1.10 . A A . 56 CYS O 1 1 10 12069 1 1 56 CYS SG S 5.194 8.275 -8.720 1.30 . A A . 56 CYS SG 1 1 10 12070 1 1 57 ASP C C 3.886 14.174 -7.027 0.90 . A A . 57 ASP C 1 1 10 12071 1 1 57 ASP CA C 3.259 13.129 -6.098 1.00 . A A . 57 ASP CA 1 1 10 12072 1 1 57 ASP CB C 4.006 13.084 -4.764 1.10 . A A . 57 ASP CB 1 1 10 12073 1 1 57 ASP CG C 3.525 14.203 -3.840 1.60 . A A . 57 ASP CG 1 1 10 12074 1 1 57 ASP H H 3.474 11.005 -6.142 1.10 . A A . 57 ASP H 1 1 10 12075 1 1 57 ASP HA H 2.205 13.357 -5.950 1.20 . A A . 57 ASP HA 1 1 10 12076 1 1 57 ASP HB2 H 3.843 12.127 -4.268 1.20 . A A . 57 ASP HB2 1 1 10 12077 1 1 57 ASP HB3 H 5.079 13.194 -4.920 1.10 . A A . 57 ASP HB3 1 1 10 12078 1 1 57 ASP N N 3.309 11.813 -6.709 0.80 . A A . 57 ASP N 1 1 10 12079 1 1 57 ASP O O 4.759 13.881 -7.836 1.00 . A A . 57 ASP O 1 1 10 12080 1 1 57 ASP OD1 O 2.369 14.163 -3.422 2.00 . A A . 57 ASP OD1 1 1 10 12081 1 1 57 ASP OD2 O 4.313 15.100 -3.545 2.20 . A A . 57 ASP OD2 1 1 10 12082 1 1 58 PRO C C 5.471 16.695 -6.458 1.20 . A A . 58 PRO C 1 1 10 12083 1 1 58 PRO CA C 4.138 16.614 -7.204 1.20 . A A . 58 PRO CA 1 1 10 12084 1 1 58 PRO CB C 3.238 17.791 -6.812 1.40 . A A . 58 PRO CB 1 1 10 12085 1 1 58 PRO CD C 2.056 15.677 -6.333 1.30 . A A . 58 PRO CD 1 1 10 12086 1 1 58 PRO CG C 1.929 17.201 -6.268 1.50 . A A . 58 PRO CG 1 1 10 12087 1 1 58 PRO HA H 4.328 16.621 -8.277 1.30 . A A . 58 PRO HA 1 1 10 12088 1 1 58 PRO HB2 H 3.721 18.412 -6.058 1.50 . A A . 58 PRO HB2 1 1 10 12089 1 1 58 PRO HB3 H 3.039 18.425 -7.677 1.70 . A A . 58 PRO HB3 1 1 10 12090 1 1 58 PRO HD2 H 1.952 15.235 -5.343 1.30 . A A . 58 PRO HD2 1 1 10 12091 1 1 58 PRO HD3 H 1.303 15.242 -6.990 1.40 . A A . 58 PRO HD3 1 1 10 12092 1 1 58 PRO HG2 H 1.762 17.528 -5.241 1.50 . A A . 58 PRO HG2 1 1 10 12093 1 1 58 PRO HG3 H 1.080 17.539 -6.862 1.70 . A A . 58 PRO HG3 1 1 10 12094 1 1 58 PRO N N 3.386 15.420 -6.860 1.00 . A A . 58 PRO N 1 1 10 12095 1 1 58 PRO O O 6.542 16.553 -7.035 1.50 . A A . 58 PRO O 1 1 10 12096 1 1 59 ASN C C 7.686 17.128 -4.561 1.30 . A A . 59 ASN C 1 1 10 12097 1 1 59 ASN CA C 6.316 17.783 -4.502 1.30 . A A . 59 ASN CA 1 1 10 12098 1 1 59 ASN CB C 5.876 18.052 -3.063 1.50 . A A . 59 ASN CB 1 1 10 12099 1 1 59 ASN CG C 6.142 19.511 -2.691 1.90 . A A . 59 ASN CG 1 1 10 12100 1 1 59 ASN H H 4.564 16.587 -4.609 1.10 . A A . 59 ASN H 1 1 10 12101 1 1 59 ASN HA H 6.362 18.688 -5.071 1.50 . A A . 59 ASN HA 1 1 10 12102 1 1 59 ASN HB2 H 4.803 17.864 -2.965 1.70 . A A . 59 ASN HB2 1 1 10 12103 1 1 59 ASN HB3 H 6.407 17.407 -2.360 1.70 . A A . 59 ASN HB3 1 1 10 12104 1 1 59 ASN HD21 H 4.299 19.498 -1.861 2.10 . A A . 59 ASN HD21 1 1 10 12105 1 1 59 ASN HD22 H 5.169 21.016 -1.713 2.50 . A A . 59 ASN HD22 1 1 10 12106 1 1 59 ASN N N 5.332 16.938 -5.143 1.10 . A A . 59 ASN N 1 1 10 12107 1 1 59 ASN ND2 N 5.113 20.064 -2.028 2.00 . A A . 59 ASN ND2 1 1 10 12108 1 1 59 ASN O O 8.628 17.569 -5.208 1.70 . A A . 59 ASN O 1 1 10 12109 1 1 59 ASN OD1 O 7.188 20.080 -2.979 2.70 . A A . 59 ASN OD1 1 1 10 12110 1 1 60 THR C C 9.324 14.146 -4.038 0.90 . A A . 60 THR C 1 1 10 12111 1 1 60 THR CA C 8.916 15.449 -3.324 1.20 . A A . 60 THR CA 1 1 10 12112 1 1 60 THR CB C 8.882 15.217 -1.818 1.40 . A A . 60 THR CB 1 1 10 12113 1 1 60 THR CG2 C 7.465 14.963 -1.339 1.40 . A A . 60 THR CG2 1 1 10 12114 1 1 60 THR H H 6.736 15.897 -3.492 1.00 . A A . 60 THR H 1 1 10 12115 1 1 60 THR HA H 9.655 16.201 -3.533 1.40 . A A . 60 THR HA 1 1 10 12116 1 1 60 THR HB H 9.298 16.083 -1.303 1.90 . A A . 60 THR HB 1 1 10 12117 1 1 60 THR HG1 H 10.221 14.369 -0.754 2.30 . A A . 60 THR HG1 1 1 10 12118 1 1 60 THR HG21 H 7.469 14.317 -0.464 1.90 . A A . 60 THR HG21 1 1 10 12119 1 1 60 THR HG22 H 6.899 14.484 -2.139 1.80 . A A . 60 THR HG22 1 1 10 12120 1 1 60 THR HG23 H 6.985 15.910 -1.101 1.70 . A A . 60 THR HG23 1 1 10 12121 1 1 60 THR N N 7.670 16.034 -3.811 1.10 . A A . 60 THR N 1 1 10 12122 1 1 60 THR O O 10.326 13.530 -3.699 1.10 . A A . 60 THR O 1 1 10 12123 1 1 60 THR OG1 O 9.690 14.113 -1.496 2.10 . A A . 60 THR OG1 1 1 10 12124 1 1 61 GLN C C 8.781 11.423 -4.333 0.90 . A A . 61 GLN C 1 1 10 12125 1 1 61 GLN CA C 7.910 12.450 -5.072 0.80 . A A . 61 GLN CA 1 1 10 12126 1 1 61 GLN CB C 7.710 12.020 -6.527 1.00 . A A . 61 GLN CB 1 1 10 12127 1 1 61 GLN CD C 9.050 12.185 -8.639 1.90 . A A . 61 GLN CD 1 1 10 12128 1 1 61 GLN CG C 9.029 11.648 -7.205 1.40 . A A . 61 GLN CG 1 1 10 12129 1 1 61 GLN H H 8.257 14.503 -5.681 1.20 . A A . 61 GLN H 1 1 10 12130 1 1 61 GLN HA H 6.952 12.539 -4.560 0.70 . A A . 61 GLN HA 1 1 10 12131 1 1 61 GLN HB2 H 7.027 11.171 -6.566 1.60 . A A . 61 GLN HB2 1 1 10 12132 1 1 61 GLN HB3 H 7.231 12.827 -7.082 1.60 . A A . 61 GLN HB3 1 1 10 12133 1 1 61 GLN HE21 H 8.144 10.659 -9.634 2.80 . A A . 61 GLN HE21 1 1 10 12134 1 1 61 GLN HE22 H 7.365 12.223 -9.779 2.60 . A A . 61 GLN HE22 1 1 10 12135 1 1 61 GLN HG2 H 9.874 12.068 -6.659 1.80 . A A . 61 GLN HG2 1 1 10 12136 1 1 61 GLN HG3 H 9.155 10.566 -7.231 1.90 . A A . 61 GLN HG3 1 1 10 12137 1 1 61 GLN N N 8.512 13.776 -5.044 0.90 . A A . 61 GLN N 1 1 10 12138 1 1 61 GLN NE2 N 8.101 11.640 -9.420 2.40 . A A . 61 GLN NE2 1 1 10 12139 1 1 61 GLN O O 9.369 10.530 -4.930 1.50 . A A . 61 GLN O 1 1 10 12140 1 1 61 GLN OE1 O 9.865 13.025 -9.003 2.40 . A A . 61 GLN OE1 1 1 10 12141 1 1 62 ALA C C 7.938 9.384 -2.369 0.90 . A A . 62 ALA C 1 1 10 12142 1 1 62 ALA CA C 8.986 10.476 -2.106 1.00 . A A . 62 ALA CA 1 1 10 12143 1 1 62 ALA CB C 8.845 10.956 -0.660 1.30 . A A . 62 ALA CB 1 1 10 12144 1 1 62 ALA H H 9.048 12.530 -2.665 1.50 . A A . 62 ALA H 1 1 10 12145 1 1 62 ALA HA H 9.993 10.093 -2.266 1.20 . A A . 62 ALA HA 1 1 10 12146 1 1 62 ALA HB1 H 8.841 12.045 -0.608 1.70 . A A . 62 ALA HB1 1 1 10 12147 1 1 62 ALA HB2 H 9.672 10.593 -0.048 1.60 . A A . 62 ALA HB2 1 1 10 12148 1 1 62 ALA HB3 H 7.916 10.594 -0.218 1.70 . A A . 62 ALA HB3 1 1 10 12149 1 1 62 ALA N N 8.827 11.616 -2.999 1.00 . A A . 62 ALA N 1 1 10 12150 1 1 62 ALA O O 7.166 9.019 -1.490 1.80 . A A . 62 ALA O 1 1 10 12151 1 1 63 SER C C 6.975 7.891 -5.615 0.60 . A A . 63 SER C 1 1 10 12152 1 1 63 SER CA C 6.703 8.471 -4.224 0.50 . A A . 63 SER CA 1 1 10 12153 1 1 63 SER CB C 5.732 9.655 -4.347 0.60 . A A . 63 SER CB 1 1 10 12154 1 1 63 SER H H 8.821 8.803 -4.116 1.20 . A A . 63 SER H 1 1 10 12155 1 1 63 SER HA H 6.294 7.689 -3.584 0.50 . A A . 63 SER HA 1 1 10 12156 1 1 63 SER HB2 H 5.830 10.136 -5.321 1.20 . A A . 63 SER HB2 1 1 10 12157 1 1 63 SER HB3 H 4.700 9.321 -4.247 0.90 . A A . 63 SER HB3 1 1 10 12158 1 1 63 SER HG H 5.601 10.295 -2.556 1.60 . A A . 63 SER HG 1 1 10 12159 1 1 63 SER N N 7.957 8.886 -3.619 0.60 . A A . 63 SER N 1 1 10 12160 1 1 63 SER O O 6.700 8.513 -6.634 1.60 . A A . 63 SER O 1 1 10 12161 1 1 63 SER OG O 5.952 10.637 -3.368 1.30 . A A . 63 SER OG 1 1 10 12162 1 1 64 CYS C C 7.559 4.245 -5.951 0.50 . A A . 64 CYS C 1 1 10 12163 1 1 64 CYS CA C 6.777 5.551 -6.133 0.50 . A A . 64 CYS CA 1 1 10 12164 1 1 64 CYS CB C 6.495 5.796 -7.617 0.50 . A A . 64 CYS CB 1 1 10 12165 1 1 64 CYS H H 8.451 6.531 -5.216 1.40 . A A . 64 CYS H 1 1 10 12166 1 1 64 CYS HA H 5.849 5.496 -5.563 0.60 . A A . 64 CYS HA 1 1 10 12167 1 1 64 CYS HB2 H 7.221 6.500 -8.026 0.70 . A A . 64 CYS HB2 1 1 10 12168 1 1 64 CYS HB3 H 6.611 4.866 -8.174 0.70 . A A . 64 CYS HB3 1 1 10 12169 1 1 64 CYS N N 7.531 6.665 -5.585 0.60 . A A . 64 CYS N 1 1 10 12170 1 1 64 CYS O O 8.783 4.219 -5.938 1.10 . A A . 64 CYS O 1 1 10 12171 1 1 64 CYS SG S 4.830 6.441 -7.909 1.30 . A A . 64 CYS SG 1 1 10 12172 1 1 65 GLU C C 6.863 0.751 -5.093 1.00 . A A . 65 GLU C 1 1 10 12173 1 1 65 GLU CA C 6.989 2.241 -4.712 1.10 . A A . 65 GLU CA 1 1 10 12174 1 1 65 GLU CB C 5.946 2.526 -3.646 1.30 . A A . 65 GLU CB 1 1 10 12175 1 1 65 GLU CD C 5.639 3.185 -1.249 1.90 . A A . 65 GLU CD 1 1 10 12176 1 1 65 GLU CG C 6.525 2.425 -2.237 1.50 . A A . 65 GLU CG 1 1 10 12177 1 1 65 GLU H H 5.976 3.021 -6.420 1.60 . A A . 65 GLU H 1 1 10 12178 1 1 65 GLU HA H 8.004 2.426 -4.374 1.30 . A A . 65 GLU HA 1 1 10 12179 1 1 65 GLU HB2 H 5.530 3.511 -3.835 1.50 . A A . 65 GLU HB2 1 1 10 12180 1 1 65 GLU HB3 H 5.124 1.823 -3.768 1.30 . A A . 65 GLU HB3 1 1 10 12181 1 1 65 GLU HG2 H 6.588 1.381 -1.929 1.70 . A A . 65 GLU HG2 1 1 10 12182 1 1 65 GLU HG3 H 7.532 2.841 -2.209 1.70 . A A . 65 GLU HG3 1 1 10 12183 1 1 65 GLU N N 6.760 3.168 -5.818 1.00 . A A . 65 GLU N 1 1 10 12184 1 1 65 GLU O O 6.829 -0.130 -4.243 1.10 . A A . 65 GLU O 1 1 10 12185 1 1 65 GLU OE1 O 4.483 2.800 -1.081 2.40 . A A . 65 GLU OE1 1 1 10 12186 1 1 65 GLU OE2 O 6.114 4.154 -0.659 1.90 . A A . 65 GLU OE2 1 1 10 12187 1 1 66 CYS C C 7.027 -1.870 -6.617 0.90 . A A . 66 CYS C 1 1 10 12188 1 1 66 CYS CA C 6.223 -0.628 -7.005 1.00 . A A . 66 CYS CA 1 1 10 12189 1 1 66 CYS CB C 6.251 -0.385 -8.513 1.20 . A A . 66 CYS CB 1 1 10 12190 1 1 66 CYS H H 6.905 1.321 -7.023 1.10 . A A . 66 CYS H 1 1 10 12191 1 1 66 CYS HA H 5.208 -0.692 -6.617 1.10 . A A . 66 CYS HA 1 1 10 12192 1 1 66 CYS HB2 H 6.968 -1.067 -8.959 1.20 . A A . 66 CYS HB2 1 1 10 12193 1 1 66 CYS HB3 H 5.266 -0.601 -8.897 1.50 . A A . 66 CYS HB3 1 1 10 12194 1 1 66 CYS N N 6.796 0.544 -6.412 1.00 . A A . 66 CYS N 1 1 10 12195 1 1 66 CYS O O 7.995 -1.800 -5.870 1.10 . A A . 66 CYS O 1 1 10 12196 1 1 66 CYS SG S 6.687 1.290 -9.070 1.70 . A A . 66 CYS SG 1 1 10 12197 1 1 67 PRO C C 8.542 -4.427 -7.498 0.90 . A A . 67 PRO C 1 1 10 12198 1 1 67 PRO CA C 7.158 -4.307 -6.862 0.90 . A A . 67 PRO CA 1 1 10 12199 1 1 67 PRO CB C 6.217 -5.342 -7.483 0.90 . A A . 67 PRO CB 1 1 10 12200 1 1 67 PRO CD C 5.432 -3.074 -8.073 0.80 . A A . 67 PRO CD 1 1 10 12201 1 1 67 PRO CG C 5.151 -4.568 -8.272 0.80 . A A . 67 PRO CG 1 1 10 12202 1 1 67 PRO HA H 7.237 -4.438 -5.783 1.10 . A A . 67 PRO HA 1 1 10 12203 1 1 67 PRO HB2 H 6.771 -6.011 -8.147 1.00 . A A . 67 PRO HB2 1 1 10 12204 1 1 67 PRO HB3 H 5.744 -5.941 -6.699 0.80 . A A . 67 PRO HB3 1 1 10 12205 1 1 67 PRO HD2 H 5.687 -2.600 -9.021 0.70 . A A . 67 PRO HD2 1 1 10 12206 1 1 67 PRO HD3 H 4.576 -2.555 -7.643 0.90 . A A . 67 PRO HD3 1 1 10 12207 1 1 67 PRO HG2 H 5.200 -4.830 -9.329 0.80 . A A . 67 PRO HG2 1 1 10 12208 1 1 67 PRO HG3 H 4.154 -4.823 -7.915 1.00 . A A . 67 PRO HG3 1 1 10 12209 1 1 67 PRO N N 6.566 -3.017 -7.164 0.80 . A A . 67 PRO N 1 1 10 12210 1 1 67 PRO O O 8.878 -3.720 -8.440 1.30 . A A . 67 PRO O 1 1 10 12211 1 1 68 GLU C C 10.962 -3.601 -6.387 1.10 . A A . 68 GLU C 1 1 10 12212 1 1 68 GLU CA C 10.669 -5.107 -6.473 1.20 . A A . 68 GLU CA 1 1 10 12213 1 1 68 GLU CB C 11.653 -5.806 -7.412 1.50 . A A . 68 GLU CB 1 1 10 12214 1 1 68 GLU CD C 12.333 -7.975 -6.366 2.80 . A A . 68 GLU CD 1 1 10 12215 1 1 68 GLU CG C 11.442 -7.319 -7.423 2.10 . A A . 68 GLU CG 1 1 10 12216 1 1 68 GLU H H 8.957 -6.306 -6.880 1.60 . A A . 68 GLU H 1 1 10 12217 1 1 68 GLU HA H 10.736 -5.532 -5.472 1.30 . A A . 68 GLU HA 1 1 10 12218 1 1 68 GLU HB2 H 11.537 -5.414 -8.422 1.90 . A A . 68 GLU HB2 1 1 10 12219 1 1 68 GLU HB3 H 12.675 -5.581 -7.105 1.90 . A A . 68 GLU HB3 1 1 10 12220 1 1 68 GLU HG2 H 10.401 -7.562 -7.211 2.40 . A A . 68 GLU HG2 1 1 10 12221 1 1 68 GLU HG3 H 11.685 -7.734 -8.401 2.50 . A A . 68 GLU HG3 1 1 10 12222 1 1 68 GLU N N 9.310 -5.375 -6.928 1.20 . A A . 68 GLU N 1 1 10 12223 1 1 68 GLU O O 10.075 -2.785 -6.167 1.20 . A A . 68 GLU O 1 1 10 12224 1 1 68 GLU OE1 O 13.549 -7.806 -6.436 3.30 . A A . 68 GLU OE1 1 1 10 12225 1 1 68 GLU OE2 O 11.800 -8.647 -5.484 3.40 . A A . 68 GLU OE2 1 1 10 12226 1 1 69 GLY C C 12.468 -3.170 -9.000 1.20 . A A . 69 GLY C 1 1 10 12227 1 1 69 GLY CA C 12.596 -2.417 -7.675 1.50 . A A . 69 GLY CA 1 1 10 12228 1 1 69 GLY H H 12.967 -3.680 -5.981 1.40 . A A . 69 GLY H 1 1 10 12229 1 1 69 GLY HA2 H 11.908 -1.570 -7.645 1.70 . A A . 69 GLY HA2 1 1 10 12230 1 1 69 GLY HA3 H 13.622 -2.077 -7.524 1.80 . A A . 69 GLY HA3 1 1 10 12231 1 1 69 GLY N N 12.258 -3.294 -6.571 1.20 . A A . 69 GLY N 1 1 10 12232 1 1 69 GLY O O 13.449 -3.607 -9.589 1.40 . A A . 69 GLY O 1 1 10 12233 1 1 70 TYR C C 12.013 -3.786 -11.691 0.80 . A A . 70 TYR C 1 1 10 12234 1 1 70 TYR CA C 10.843 -3.869 -10.698 0.80 . A A . 70 TYR CA 1 1 10 12235 1 1 70 TYR CB C 9.601 -3.174 -11.266 0.60 . A A . 70 TYR CB 1 1 10 12236 1 1 70 TYR CD1 C 8.788 -5.312 -12.392 1.50 . A A . 70 TYR CD1 1 1 10 12237 1 1 70 TYR CD2 C 8.861 -3.201 -13.707 1.30 . A A . 70 TYR CD2 1 1 10 12238 1 1 70 TYR CE1 C 8.289 -6.015 -13.544 1.70 . A A . 70 TYR CE1 1 1 10 12239 1 1 70 TYR CE2 C 8.361 -3.901 -14.861 1.40 . A A . 70 TYR CE2 1 1 10 12240 1 1 70 TYR CG C 9.076 -3.903 -12.468 0.70 . A A . 70 TYR CG 1 1 10 12241 1 1 70 TYR CZ C 8.076 -5.308 -14.778 1.10 . A A . 70 TYR CZ 1 1 10 12242 1 1 70 TYR H H 10.455 -3.054 -8.764 1.00 . A A . 70 TYR H 1 1 10 12243 1 1 70 TYR HA H 10.628 -4.919 -10.502 0.90 . A A . 70 TYR HA 1 1 10 12244 1 1 70 TYR HB2 H 8.816 -3.122 -10.512 0.60 . A A . 70 TYR HB2 1 1 10 12245 1 1 70 TYR HB3 H 9.841 -2.150 -11.552 0.60 . A A . 70 TYR HB3 1 1 10 12246 1 1 70 TYR HD1 H 8.948 -5.844 -11.465 2.30 . A A . 70 TYR HD1 1 1 10 12247 1 1 70 TYR HD2 H 9.075 -2.144 -13.771 2.10 . A A . 70 TYR HD2 1 1 10 12248 1 1 70 TYR HE1 H 8.075 -7.072 -13.482 2.50 . A A . 70 TYR HE1 1 1 10 12249 1 1 70 TYR HE2 H 8.203 -3.371 -15.789 2.10 . A A . 70 TYR HE2 1 1 10 12250 1 1 70 TYR HH H 7.138 -6.763 -15.605 1.50 . A A . 70 TYR HH 1 1 10 12251 1 1 70 TYR N N 11.186 -3.288 -9.406 0.90 . A A . 70 TYR N 1 1 10 12252 1 1 70 TYR O O 12.892 -4.639 -11.712 1.10 . A A . 70 TYR O 1 1 10 12253 1 1 70 TYR OH O 7.597 -5.981 -15.884 1.30 . A A . 70 TYR OH 1 1 10 12254 1 1 71 ILE C C 12.470 -0.355 -12.823 0.90 . A A . 71 ILE C 1 1 10 12255 1 1 71 ILE CA C 13.013 -1.717 -12.387 1.00 . A A . 71 ILE CA 1 1 10 12256 1 1 71 ILE CB C 14.196 -2.124 -13.265 1.20 . A A . 71 ILE CB 1 1 10 12257 1 1 71 ILE CD1 C 16.713 -2.012 -13.545 1.80 . A A . 71 ILE CD1 1 1 10 12258 1 1 71 ILE CG1 C 15.515 -1.618 -12.680 1.40 . A A . 71 ILE CG1 1 1 10 12259 1 1 71 ILE CG2 C 14.012 -1.636 -14.704 1.80 . A A . 71 ILE CG2 1 1 10 12260 1 1 71 ILE H H 11.268 -2.637 -13.212 1.10 . A A . 71 ILE H 1 1 10 12261 1 1 71 ILE HA H 13.292 -1.679 -11.334 1.20 . A A . 71 ILE HA 1 1 10 12262 1 1 71 ILE HB H 14.227 -3.213 -13.284 1.70 . A A . 71 ILE HB 1 1 10 12263 1 1 71 ILE HD11 H 16.889 -3.086 -13.496 2.20 . A A . 71 ILE HD11 1 1 10 12264 1 1 71 ILE HD12 H 17.618 -1.505 -13.211 2.30 . A A . 71 ILE HD12 1 1 10 12265 1 1 71 ILE HD13 H 16.546 -1.745 -14.589 2.10 . A A . 71 ILE HD13 1 1 10 12266 1 1 71 ILE HG12 H 15.477 -0.533 -12.581 1.60 . A A . 71 ILE HG12 1 1 10 12267 1 1 71 ILE HG13 H 15.645 -2.016 -11.673 1.70 . A A . 71 ILE HG13 1 1 10 12268 1 1 71 ILE HG21 H 14.746 -2.089 -15.369 2.30 . A A . 71 ILE HG21 1 1 10 12269 1 1 71 ILE HG22 H 14.125 -0.553 -14.762 2.20 . A A . 71 ILE HG22 1 1 10 12270 1 1 71 ILE HG23 H 13.020 -1.892 -15.076 2.20 . A A . 71 ILE HG23 1 1 10 12271 1 1 71 ILE N N 11.969 -2.715 -12.504 0.90 . A A . 71 ILE N 1 1 10 12272 1 1 71 ILE O O 12.006 -0.179 -13.943 0.90 . A A . 71 ILE O 1 1 10 12273 1 1 72 LEU C C 11.583 2.264 -13.343 0.80 . A A . 72 LEU C 1 1 10 12274 1 1 72 LEU CA C 11.753 1.780 -11.902 0.80 . A A . 72 LEU CA 1 1 10 12275 1 1 72 LEU CB C 12.447 2.877 -11.088 0.80 . A A . 72 LEU CB 1 1 10 12276 1 1 72 LEU CD1 C 11.842 5.279 -11.263 0.60 . A A . 72 LEU CD1 1 1 10 12277 1 1 72 LEU CD2 C 10.063 3.597 -10.732 0.70 . A A . 72 LEU CD2 1 1 10 12278 1 1 72 LEU CG C 11.527 3.966 -10.556 0.70 . A A . 72 LEU CG 1 1 10 12279 1 1 72 LEU H H 13.134 0.394 -11.051 0.90 . A A . 72 LEU H 1 1 10 12280 1 1 72 LEU HA H 10.784 1.503 -11.489 0.80 . A A . 72 LEU HA 1 1 10 12281 1 1 72 LEU HB2 H 13.006 2.447 -10.261 1.00 . A A . 72 LEU HB2 1 1 10 12282 1 1 72 LEU HB3 H 13.163 3.369 -11.734 1.00 . A A . 72 LEU HB3 1 1 10 12283 1 1 72 LEU HD11 H 12.842 5.621 -10.999 1.10 . A A . 72 LEU HD11 1 1 10 12284 1 1 72 LEU HD12 H 11.125 6.050 -10.987 1.10 . A A . 72 LEU HD12 1 1 10 12285 1 1 72 LEU HD13 H 11.805 5.145 -12.344 1.20 . A A . 72 LEU HD13 1 1 10 12286 1 1 72 LEU HD21 H 9.839 3.450 -11.787 1.40 . A A . 72 LEU HD21 1 1 10 12287 1 1 72 LEU HD22 H 9.426 4.393 -10.352 1.20 . A A . 72 LEU HD22 1 1 10 12288 1 1 72 LEU HD23 H 9.838 2.676 -10.194 1.20 . A A . 72 LEU HD23 1 1 10 12289 1 1 72 LEU HG H 11.722 4.091 -9.491 0.70 . A A . 72 LEU HG 1 1 10 12290 1 1 72 LEU N N 12.571 0.579 -11.857 0.80 . A A . 72 LEU N 1 1 10 12291 1 1 72 LEU O O 12.535 2.632 -14.020 0.90 . A A . 72 LEU O 1 1 10 12292 1 1 73 ASP C C 8.892 2.835 -15.638 1.20 . A A . 73 ASP C 1 1 10 12293 1 1 73 ASP CA C 10.042 1.955 -15.153 1.00 . A A . 73 ASP CA 1 1 10 12294 1 1 73 ASP CB C 9.678 0.480 -15.311 1.50 . A A . 73 ASP CB 1 1 10 12295 1 1 73 ASP CG C 10.469 -0.131 -16.468 2.00 . A A . 73 ASP CG 1 1 10 12296 1 1 73 ASP H H 9.556 2.402 -13.115 0.80 . A A . 73 ASP H 1 1 10 12297 1 1 73 ASP HA H 10.950 2.213 -15.696 1.20 . A A . 73 ASP HA 1 1 10 12298 1 1 73 ASP HB2 H 9.900 -0.068 -14.395 1.90 . A A . 73 ASP HB2 1 1 10 12299 1 1 73 ASP HB3 H 8.612 0.369 -15.509 1.90 . A A . 73 ASP HB3 1 1 10 12300 1 1 73 ASP N N 10.305 2.235 -13.757 0.90 . A A . 73 ASP N 1 1 10 12301 1 1 73 ASP O O 8.417 3.710 -14.925 1.70 . A A . 73 ASP O 1 1 10 12302 1 1 73 ASP OD1 O 11.690 -0.231 -16.356 2.30 . A A . 73 ASP OD1 1 1 10 12303 1 1 73 ASP OD2 O 9.856 -0.500 -17.468 2.80 . A A . 73 ASP OD2 1 1 10 12304 1 1 74 ASP C C 7.806 4.858 -17.261 1.40 . A A . 74 ASP C 1 1 10 12305 1 1 74 ASP CA C 8.337 3.567 -17.889 1.80 . A A . 74 ASP CA 1 1 10 12306 1 1 74 ASP CB C 7.376 3.101 -18.984 2.60 . A A . 74 ASP CB 1 1 10 12307 1 1 74 ASP CG C 7.976 1.920 -19.749 3.20 . A A . 74 ASP CG 1 1 10 12308 1 1 74 ASP H H 8.382 1.565 -17.138 1.40 . A A . 74 ASP H 1 1 10 12309 1 1 74 ASP HA H 9.332 3.742 -18.298 2.30 . A A . 74 ASP HA 1 1 10 12310 1 1 74 ASP HB2 H 6.422 2.796 -18.553 3.00 . A A . 74 ASP HB2 1 1 10 12311 1 1 74 ASP HB3 H 7.177 3.910 -19.687 3.10 . A A . 74 ASP HB3 1 1 10 12312 1 1 74 ASP N N 8.481 2.526 -16.884 1.30 . A A . 74 ASP N 1 1 10 12313 1 1 74 ASP O O 6.632 5.192 -17.364 1.80 . A A . 74 ASP O 1 1 10 12314 1 1 74 ASP OD1 O 8.284 0.908 -19.121 3.70 . A A . 74 ASP OD1 1 1 10 12315 1 1 74 ASP OD2 O 8.128 2.025 -20.965 3.60 . A A . 74 ASP OD2 1 1 10 12316 1 1 75 GLY C C 9.063 7.426 -15.023 1.10 . A A . 75 GLY C 1 1 10 12317 1 1 75 GLY CA C 8.544 6.975 -16.386 1.10 . A A . 75 GLY CA 1 1 10 12318 1 1 75 GLY H H 9.493 5.060 -16.153 1.30 . A A . 75 GLY H 1 1 10 12319 1 1 75 GLY HA2 H 9.102 7.482 -17.144 1.30 . A A . 75 GLY HA2 1 1 10 12320 1 1 75 GLY HA3 H 7.479 7.182 -16.492 1.50 . A A . 75 GLY HA3 1 1 10 12321 1 1 75 GLY N N 8.752 5.552 -16.608 1.00 . A A . 75 GLY N 1 1 10 12322 1 1 75 GLY O O 9.743 8.431 -14.853 1.40 . A A . 75 GLY O 1 1 10 12323 1 1 76 PHE C C 8.113 5.828 -11.805 0.80 . A A . 76 PHE C 1 1 10 12324 1 1 76 PHE CA C 9.085 6.622 -12.703 0.90 . A A . 76 PHE CA 1 1 10 12325 1 1 76 PHE CB C 9.163 8.080 -12.243 1.00 . A A . 76 PHE CB 1 1 10 12326 1 1 76 PHE CD1 C 11.617 8.108 -12.940 1.80 . A A . 76 PHE CD1 1 1 10 12327 1 1 76 PHE CD2 C 10.921 9.346 -10.897 2.00 . A A . 76 PHE CD2 1 1 10 12328 1 1 76 PHE CE1 C 12.980 8.517 -12.726 2.50 . A A . 76 PHE CE1 1 1 10 12329 1 1 76 PHE CE2 C 12.283 9.756 -10.680 2.70 . A A . 76 PHE CE2 1 1 10 12330 1 1 76 PHE CG C 10.582 8.518 -12.026 1.20 . A A . 76 PHE CG 1 1 10 12331 1 1 76 PHE CZ C 13.312 9.340 -11.595 2.80 . A A . 76 PHE CZ 1 1 10 12332 1 1 76 PHE H H 8.154 5.823 -14.531 1.00 . A A . 76 PHE H 1 1 10 12333 1 1 76 PHE HA H 10.061 6.137 -12.669 0.80 . A A . 76 PHE HA 1 1 10 12334 1 1 76 PHE HB2 H 8.701 8.732 -12.984 1.60 . A A . 76 PHE HB2 1 1 10 12335 1 1 76 PHE HB3 H 8.607 8.207 -11.314 1.30 . A A . 76 PHE HB3 1 1 10 12336 1 1 76 PHE HD1 H 11.369 7.490 -13.791 2.30 . A A . 76 PHE HD1 1 1 10 12337 1 1 76 PHE HD2 H 10.149 9.661 -10.211 2.50 . A A . 76 PHE HD2 1 1 10 12338 1 1 76 PHE HE1 H 13.752 8.204 -13.414 3.20 . A A . 76 PHE HE1 1 1 10 12339 1 1 76 PHE HE2 H 12.533 10.375 -9.831 3.50 . A A . 76 PHE HE2 1 1 10 12340 1 1 76 PHE HZ H 14.336 9.644 -11.433 3.50 . A A . 76 PHE HZ 1 1 10 12341 1 1 76 PHE N N 8.660 6.567 -14.094 0.90 . A A . 76 PHE N 1 1 10 12342 1 1 76 PHE O O 7.874 6.169 -10.654 0.80 . A A . 76 PHE O 1 1 10 12343 1 1 77 ILE C C 5.532 4.519 -11.139 0.70 . A A . 77 ILE C 1 1 10 12344 1 1 77 ILE CA C 6.134 4.733 -12.528 0.80 . A A . 77 ILE CA 1 1 10 12345 1 1 77 ILE CB C 5.782 3.637 -13.518 0.90 . A A . 77 ILE CB 1 1 10 12346 1 1 77 ILE CD1 C 4.031 2.395 -14.828 1.20 . A A . 77 ILE CD1 1 1 10 12347 1 1 77 ILE CG1 C 4.322 3.583 -13.910 1.10 . A A . 77 ILE CG1 1 1 10 12348 1 1 77 ILE CG2 C 6.204 2.315 -12.950 0.90 . A A . 77 ILE CG2 1 1 10 12349 1 1 77 ILE H H 8.128 4.354 -13.148 0.80 . A A . 77 ILE H 1 1 10 12350 1 1 77 ILE HA H 5.829 5.667 -12.976 0.80 . A A . 77 ILE HA 1 1 10 12351 1 1 77 ILE HB H 6.336 3.823 -14.431 0.90 . A A . 77 ILE HB 1 1 10 12352 1 1 77 ILE HD11 H 3.120 1.881 -14.521 1.50 . A A . 77 ILE HD11 1 1 10 12353 1 1 77 ILE HD12 H 4.849 1.675 -14.802 1.60 . A A . 77 ILE HD12 1 1 10 12354 1 1 77 ILE HD13 H 3.902 2.723 -15.859 1.70 . A A . 77 ILE HD13 1 1 10 12355 1 1 77 ILE HG12 H 3.697 3.502 -13.024 1.30 . A A . 77 ILE HG12 1 1 10 12356 1 1 77 ILE HG13 H 4.050 4.503 -14.426 1.10 . A A . 77 ILE HG13 1 1 10 12357 1 1 77 ILE HG21 H 5.310 1.736 -12.727 1.10 . A A . 77 ILE HG21 1 1 10 12358 1 1 77 ILE HG22 H 6.762 2.500 -12.034 1.40 . A A . 77 ILE HG22 1 1 10 12359 1 1 77 ILE HG23 H 6.824 1.798 -13.676 1.40 . A A . 77 ILE HG23 1 1 10 12360 1 1 77 ILE N N 7.577 4.754 -12.418 0.80 . A A . 77 ILE N 1 1 10 12361 1 1 77 ILE O O 6.234 4.195 -10.190 0.80 . A A . 77 ILE O 1 1 10 12362 1 1 78 CYS C C 2.490 4.810 -9.339 0.70 . A A . 78 CYS C 1 1 10 12363 1 1 78 CYS CA C 3.361 3.909 -10.214 0.50 . A A . 78 CYS CA 1 1 10 12364 1 1 78 CYS CB C 4.184 2.968 -9.331 0.40 . A A . 78 CYS CB 1 1 10 12365 1 1 78 CYS H H 3.773 5.349 -11.733 0.50 . A A . 78 CYS H 1 1 10 12366 1 1 78 CYS HA H 2.717 3.333 -10.879 0.60 . A A . 78 CYS HA 1 1 10 12367 1 1 78 CYS HB2 H 4.853 3.536 -8.684 0.70 . A A . 78 CYS HB2 1 1 10 12368 1 1 78 CYS HB3 H 3.518 2.424 -8.666 0.70 . A A . 78 CYS HB3 1 1 10 12369 1 1 78 CYS N N 4.202 4.723 -11.082 0.50 . A A . 78 CYS N 1 1 10 12370 1 1 78 CYS O O 2.338 6.001 -9.583 1.70 . A A . 78 CYS O 1 1 10 12371 1 1 78 CYS SG S 5.142 1.780 -10.305 1.00 . A A . 78 CYS SG 1 1 10 12372 1 1 79 THR C C -0.280 4.587 -9.365 0.90 . A A . 79 THR C 1 1 10 12373 1 1 79 THR CA C 0.494 3.884 -8.242 0.70 . A A . 79 THR CA 1 1 10 12374 1 1 79 THR CB C -0.061 4.341 -6.892 0.90 . A A . 79 THR CB 1 1 10 12375 1 1 79 THR CG2 C 0.674 5.568 -6.350 1.60 . A A . 79 THR CG2 1 1 10 12376 1 1 79 THR H H 2.515 3.834 -7.559 1.30 . A A . 79 THR H 1 1 10 12377 1 1 79 THR HA H 0.383 2.806 -8.358 0.80 . A A . 79 THR HA 1 1 10 12378 1 1 79 THR HB H 0.011 3.525 -6.175 0.70 . A A . 79 THR HB 1 1 10 12379 1 1 79 THR HG1 H -1.876 3.828 -7.186 2.00 . A A . 79 THR HG1 1 1 10 12380 1 1 79 THR HG21 H 0.724 6.354 -7.104 2.00 . A A . 79 THR HG21 1 1 10 12381 1 1 79 THR HG22 H 1.694 5.315 -6.061 2.20 . A A . 79 THR HG22 1 1 10 12382 1 1 79 THR HG23 H 0.166 5.974 -5.475 2.10 . A A . 79 THR HG23 1 1 10 12383 1 1 79 THR N N 1.929 4.153 -8.303 0.70 . A A . 79 THR N 1 1 10 12384 1 1 79 THR O O -0.038 5.743 -9.689 1.50 . A A . 79 THR O 1 1 10 12385 1 1 79 THR OG1 O -1.425 4.648 -7.031 1.70 . A A . 79 THR OG1 1 1 10 12386 1 1 80 ASP C C -3.544 3.103 -10.237 1.10 . A A . 80 ASP C 1 1 10 12387 1 1 80 ASP CA C -2.607 4.226 -9.768 1.20 . A A . 80 ASP CA 1 1 10 12388 1 1 80 ASP CB C -2.836 5.531 -10.537 1.70 . A A . 80 ASP CB 1 1 10 12389 1 1 80 ASP CG C -2.536 6.726 -9.631 2.40 . A A . 80 ASP CG 1 1 10 12390 1 1 80 ASP H H -0.985 2.985 -10.433 0.80 . A A . 80 ASP H 1 1 10 12391 1 1 80 ASP HA H -2.754 4.390 -8.704 1.50 . A A . 80 ASP HA 1 1 10 12392 1 1 80 ASP HB2 H -2.179 5.570 -11.408 2.10 . A A . 80 ASP HB2 1 1 10 12393 1 1 80 ASP HB3 H -3.872 5.601 -10.875 1.80 . A A . 80 ASP HB3 1 1 10 12394 1 1 80 ASP N N -1.227 3.810 -9.920 0.80 . A A . 80 ASP N 1 1 10 12395 1 1 80 ASP O O -3.753 2.115 -9.543 1.90 . A A . 80 ASP O 1 1 10 12396 1 1 80 ASP OD1 O -2.054 6.514 -8.520 2.90 . A A . 80 ASP OD1 1 1 10 12397 1 1 80 ASP OD2 O -2.791 7.855 -10.047 2.90 . A A . 80 ASP OD2 1 1 10 12398 1 1 81 ILE C C -6.052 4.291 -10.287 1.60 . A A . 81 ILE C 1 1 10 12399 1 1 81 ILE CA C -5.389 3.956 -11.626 1.30 . A A . 81 ILE CA 1 1 10 12400 1 1 81 ILE CB C -6.307 3.027 -12.418 1.70 . A A . 81 ILE CB 1 1 10 12401 1 1 81 ILE CD1 C -8.351 2.994 -13.918 3.00 . A A . 81 ILE CD1 1 1 10 12402 1 1 81 ILE CG1 C -7.585 3.754 -12.834 2.50 . A A . 81 ILE CG1 1 1 10 12403 1 1 81 ILE CG2 C -6.634 1.767 -11.615 1.90 . A A . 81 ILE CG2 1 1 10 12404 1 1 81 ILE H H -3.585 3.037 -12.273 1.50 . A A . 81 ILE H 1 1 10 12405 1 1 81 ILE HA H -5.205 4.880 -12.173 1.50 . A A . 81 ILE HA 1 1 10 12406 1 1 81 ILE HB H -5.779 2.724 -13.321 2.20 . A A . 81 ILE HB 1 1 10 12407 1 1 81 ILE HD11 H -7.692 2.311 -14.455 3.20 . A A . 81 ILE HD11 1 1 10 12408 1 1 81 ILE HD12 H -8.786 3.683 -14.641 3.40 . A A . 81 ILE HD12 1 1 10 12409 1 1 81 ILE HD13 H -9.160 2.408 -13.481 3.30 . A A . 81 ILE HD13 1 1 10 12410 1 1 81 ILE HG12 H -8.225 3.890 -11.962 2.70 . A A . 81 ILE HG12 1 1 10 12411 1 1 81 ILE HG13 H -7.336 4.752 -13.196 3.00 . A A . 81 ILE HG13 1 1 10 12412 1 1 81 ILE HG21 H -5.810 1.498 -10.954 2.20 . A A . 81 ILE HG21 1 1 10 12413 1 1 81 ILE HG22 H -6.823 0.922 -12.278 2.30 . A A . 81 ILE HG22 1 1 10 12414 1 1 81 ILE HG23 H -7.520 1.919 -10.999 2.30 . A A . 81 ILE HG23 1 1 10 12415 1 1 81 ILE N N -4.089 3.315 -11.456 1.00 . A A . 81 ILE N 1 1 10 12416 1 1 81 ILE O O -6.491 3.411 -9.560 2.40 . A A . 81 ILE O 1 1 10 12417 1 1 82 ASP C C -7.407 7.612 -10.454 2.70 . A A . 82 ASP C 1 1 10 12418 1 1 82 ASP CA C -7.384 6.225 -9.809 2.60 . A A . 82 ASP CA 1 1 10 12419 1 1 82 ASP CB C -7.670 6.332 -8.311 3.50 . A A . 82 ASP CB 1 1 10 12420 1 1 82 ASP CG C -9.179 6.442 -8.076 3.90 . A A . 82 ASP CG 1 1 10 12421 1 1 82 ASP H H -5.251 6.150 -9.948 2.10 . A A . 82 ASP H 1 1 10 12422 1 1 82 ASP HA H -8.114 5.585 -10.303 3.00 . A A . 82 ASP HA 1 1 10 12423 1 1 82 ASP HB2 H -7.292 5.455 -7.786 3.90 . A A . 82 ASP HB2 1 1 10 12424 1 1 82 ASP HB3 H -7.176 7.209 -7.892 3.90 . A A . 82 ASP HB3 1 1 10 12425 1 1 82 ASP N N -6.090 5.609 -10.019 1.90 . A A . 82 ASP N 1 1 10 12426 1 1 82 ASP O O -7.246 8.634 -9.798 3.30 . A A . 82 ASP O 1 1 10 12427 1 1 82 ASP OD1 O -9.935 6.259 -9.029 4.50 . A A . 82 ASP OD1 1 1 10 12428 1 1 82 ASP OD2 O -9.578 6.709 -6.944 4.20 . A A . 82 ASP OD2 1 1 10 12429 1 1 83 GLU C C -8.846 9.638 -12.166 1.00 . A A . 83 GLU C 1 1 10 12430 1 1 83 GLU CA C -7.606 8.814 -12.522 1.00 . A A . 83 GLU CA 1 1 10 12431 1 1 83 GLU CB C -7.586 8.517 -14.021 1.00 . A A . 83 GLU CB 1 1 10 12432 1 1 83 GLU CD C -5.367 8.443 -15.175 1.00 . A A . 83 GLU CD 1 1 10 12433 1 1 83 GLU CG C -6.409 7.623 -14.412 1.00 . A A . 83 GLU CG 1 1 10 12434 1 1 83 GLU H H -7.778 6.697 -12.243 1.00 . A A . 83 GLU H 1 1 10 12435 1 1 83 GLU HA H -6.711 9.353 -12.213 1.00 . A A . 83 GLU HA 1 1 10 12436 1 1 83 GLU HB2 H -8.520 8.035 -14.309 1.00 . A A . 83 GLU HB2 1 1 10 12437 1 1 83 GLU HB3 H -7.535 9.453 -14.578 1.00 . A A . 83 GLU HB3 1 1 10 12438 1 1 83 GLU HG2 H -5.942 7.193 -13.526 1.00 . A A . 83 GLU HG2 1 1 10 12439 1 1 83 GLU HG3 H -6.744 6.800 -15.043 1.00 . A A . 83 GLU HG3 1 1 10 12440 1 1 83 GLU N N -7.617 7.569 -11.781 1.00 . A A . 83 GLU N 1 1 10 12441 1 1 83 GLU O O -9.642 9.178 -11.349 1.00 . A A . 83 GLU O 1 1 10 12442 1 1 83 GLU OXT O -9.001 10.729 -12.712 1.00 . A A . 83 GLU OXT 1 1 10 12443 1 1 83 GLU OE1 O -4.821 9.381 -14.597 1.00 . A A . 83 GLU OE1 1 1 10 12444 1 1 83 GLU OE2 O -5.114 8.134 -16.338 1.00 . A A . 83 GLU OE2 1 1 10 12445 2 2 1 NAG C1 C -14.498 -0.629 12.832 1.00 . B A . 121 NAG C1 1 1 10 12446 2 2 1 NAG C2 C -15.819 -0.509 12.078 1.00 . B A . 121 NAG C2 1 1 10 12447 2 2 1 NAG C3 C -16.562 0.770 12.451 1.00 . B A . 121 NAG C3 1 1 10 12448 2 2 1 NAG C4 C -16.290 1.154 13.904 1.00 . B A . 121 NAG C4 1 1 10 12449 2 2 1 NAG C5 C -14.794 1.299 14.196 1.00 . B A . 121 NAG C5 1 1 10 12450 2 2 1 NAG C6 C -14.427 0.744 15.573 1.00 . B A . 121 NAG C6 1 1 10 12451 2 2 1 NAG C7 C -15.803 -1.651 9.968 1.00 . B A . 121 NAG C7 1 1 10 12452 2 2 1 NAG C8 C -14.565 -2.539 9.830 1.00 . B A . 121 NAG C8 1 1 10 12453 2 2 1 NAG H1 H -13.749 -1.129 12.219 1.00 . B A . 121 NAG H1 1 1 10 12454 2 2 1 NAG H2 H -16.440 -1.379 12.286 1.00 . B A . 121 NAG H2 1 1 10 12455 2 2 1 NAG H3 H -16.250 1.580 11.792 1.00 . B A . 121 NAG H3 1 1 10 12456 2 2 1 NAG H4 H -16.715 0.397 14.563 1.00 . B A . 121 NAG H4 1 1 10 12457 2 2 1 NAG H5 H -14.542 2.359 14.173 1.00 . B A . 121 NAG H5 1 1 10 12458 2 2 1 NAG H61 H -15.218 0.100 15.956 1.00 . B A . 121 NAG H61 1 1 10 12459 2 2 1 NAG H62 H -14.271 1.550 16.290 1.00 . B A . 121 NAG H62 1 1 10 12460 2 2 1 NAG H81 H -14.863 -3.574 9.659 1.00 . B A . 121 NAG H81 1 1 10 12461 2 2 1 NAG H82 H -13.960 -2.206 8.986 1.00 . B A . 121 NAG H82 1 1 10 12462 2 2 1 NAG H83 H -13.968 -2.486 10.740 1.00 . B A . 121 NAG H83 1 1 10 12463 2 2 1 NAG HN2 H -15.220 0.298 10.186 1.00 . B A . 121 NAG HN2 1 1 10 12464 2 2 1 NAG HO3 H -18.231 1.270 11.676 1.00 . B A . 121 NAG HO3 1 1 10 12465 2 2 1 NAG HO4 H -17.303 2.681 13.375 1.00 . B A . 121 NAG HO4 1 1 10 12466 2 2 1 NAG HO6 H -13.153 -0.285 14.597 1.00 . B A . 121 NAG HO6 1 1 10 12467 2 2 1 NAG N2 N -15.563 -0.518 10.651 1.00 . B A . 121 NAG N2 1 1 10 12468 2 2 1 NAG O3 O -17.942 0.584 12.262 1.00 . B A . 121 NAG O3 1 1 10 12469 2 2 1 NAG O4 O -16.940 2.366 14.192 1.00 . B A . 121 NAG O4 1 1 10 12470 2 2 1 NAG O5 O -14.027 0.647 13.206 1.00 . B A . 121 NAG O5 1 1 10 12471 2 2 1 NAG O6 O -13.245 -0.012 15.500 1.00 . B A . 121 NAG O6 1 1 10 12472 2 2 1 NAG O7 O -16.885 -1.970 9.490 1.00 . B A . 121 NAG O7 1 1 10 12473 3 2 1 NAG C1 C -0.498 -7.446 -10.354 1.00 . C A . 148 NAG C1 1 1 10 12474 3 2 1 NAG C2 C -0.950 -7.991 -9.001 1.00 . C A . 148 NAG C2 1 1 10 12475 3 2 1 NAG C3 C -0.500 -9.435 -8.797 1.00 . C A . 148 NAG C3 1 1 10 12476 3 2 1 NAG C4 C -0.766 -10.280 -10.044 1.00 . C A . 148 NAG C4 1 1 10 12477 3 2 1 NAG C5 C -0.321 -9.568 -11.323 1.00 . C A . 148 NAG C5 1 1 10 12478 3 2 1 NAG C6 C -0.706 -10.357 -12.575 1.00 . C A . 148 NAG C6 1 1 10 12479 3 2 1 NAG C7 C -1.111 -7.069 -6.790 1.00 . C A . 148 NAG C7 1 1 10 12480 3 2 1 NAG C8 C -0.992 -5.695 -6.126 1.00 . C A . 148 NAG C8 1 1 10 12481 3 2 1 NAG H1 H 0.586 -7.334 -10.392 1.00 . C A . 148 NAG H1 1 1 10 12482 3 2 1 NAG H2 H -2.034 -7.921 -8.914 1.00 . C A . 148 NAG H2 1 1 10 12483 3 2 1 NAG H3 H 0.565 -9.455 -8.563 1.00 . C A . 148 NAG H3 1 1 10 12484 3 2 1 NAG H4 H -1.831 -10.503 -10.107 1.00 . C A . 148 NAG H4 1 1 10 12485 3 2 1 NAG H5 H 0.761 -9.434 -11.302 1.00 . C A . 148 NAG H5 1 1 10 12486 3 2 1 NAG H61 H -1.137 -11.322 -12.309 1.00 . C A . 148 NAG H61 1 1 10 12487 3 2 1 NAG H62 H 0.166 -10.537 -13.204 1.00 . C A . 148 NAG H62 1 1 10 12488 3 2 1 NAG H81 H -1.606 -4.980 -6.667 1.00 . C A . 148 NAG H81 1 1 10 12489 3 2 1 NAG H82 H -1.360 -5.716 -5.103 1.00 . C A . 148 NAG H82 1 1 10 12490 3 2 1 NAG H83 H 0.047 -5.372 -6.113 1.00 . C A . 148 NAG H83 1 1 10 12491 3 2 1 NAG HN2 H 0.439 -6.652 -8.062 1.00 . C A . 148 NAG HN2 1 1 10 12492 3 2 1 NAG HO3 H -1.996 -10.335 -8.028 1.00 . C A . 148 NAG HO3 1 1 10 12493 3 2 1 NAG HO4 H 0.810 -11.345 -10.177 1.00 . C A . 148 NAG HO4 1 1 10 12494 3 2 1 NAG HO6 H -2.384 -9.466 -12.756 1.00 . C A . 148 NAG HO6 1 1 10 12495 3 2 1 NAG N2 N -0.414 -7.160 -7.939 1.00 . C A . 148 NAG N2 1 1 10 12496 3 2 1 NAG O3 O -1.178 -9.988 -7.697 1.00 . C A . 148 NAG O3 1 1 10 12497 3 2 1 NAG O4 O -0.090 -11.507 -9.931 1.00 . C A . 148 NAG O4 1 1 10 12498 3 2 1 NAG O5 O -0.927 -8.300 -11.386 1.00 . C A . 148 NAG O5 1 1 10 12499 3 2 1 NAG O6 O -1.654 -9.648 -13.333 1.00 . C A . 148 NAG O6 1 1 10 12500 3 2 1 NAG O7 O -1.787 -7.967 -6.306 1.00 . C A . 148 NAG O7 1 1 11 12501 1 1 1 HIS C C 5.103 -13.899 21.108 1.00 . A A . 1 HIS C 1 1 11 12502 1 1 1 HIS CA C 6.115 -13.088 21.920 1.00 . A A . 1 HIS CA 1 1 11 12503 1 1 1 HIS CB C 7.310 -12.743 21.031 1.00 . A A . 1 HIS CB 1 1 11 12504 1 1 1 HIS CD2 C 9.108 -14.454 21.599 1.00 . A A . 1 HIS CD2 1 1 11 12505 1 1 1 HIS CE1 C 9.096 -15.700 19.739 1.00 . A A . 1 HIS CE1 1 1 11 12506 1 1 1 HIS CG C 8.184 -13.936 20.771 1.00 . A A . 1 HIS CG 1 1 11 12507 1 1 1 HIS H1 H 7.222 -13.247 23.643 1.00 . A A . 1 HIS H1 1 1 11 12508 1 1 1 HIS H2 H 5.695 -13.986 23.718 1.00 . A A . 1 HIS H2 1 1 11 12509 1 1 1 HIS H3 H 6.950 -14.721 22.844 1.00 . A A . 1 HIS H3 1 1 11 12510 1 1 1 HIS HA H 5.627 -12.171 22.251 1.00 . A A . 1 HIS HA 1 1 11 12511 1 1 1 HIS HB2 H 6.958 -12.342 20.080 1.00 . A A . 1 HIS HB2 1 1 11 12512 1 1 1 HIS HB3 H 7.903 -11.958 21.501 1.00 . A A . 1 HIS HB3 1 1 11 12513 1 1 1 HIS HD2 H 9.356 -14.082 22.575 1.00 . A A . 1 HIS HD2 1 1 11 12514 1 1 1 HIS HE1 H 9.328 -16.467 19.004 1.00 . A A . 1 HIS HE1 1 1 11 12515 1 1 1 HIS HE2 H 10.443 -16.178 21.306 1.00 . A A . 1 HIS HE2 1 1 11 12516 1 1 1 HIS N N 6.525 -13.812 23.117 1.00 . A A . 1 HIS N 1 1 11 12517 1 1 1 HIS ND1 N 8.167 -14.747 19.541 1.00 . A A . 1 HIS ND1 1 1 11 12518 1 1 1 HIS NE2 N 9.710 -15.612 20.927 1.00 . A A . 1 HIS NE2 1 1 11 12519 1 1 1 HIS O O 5.447 -14.624 20.182 1.00 . A A . 1 HIS O 1 1 11 12520 1 1 2 MET C C 1.927 -12.204 21.635 1.00 . A A . 2 MET C 1 1 11 12521 1 1 2 MET CA C 2.976 -12.855 20.740 1.00 . A A . 2 MET CA 1 1 11 12522 1 1 2 MET CB C 2.295 -13.650 19.627 1.00 . A A . 2 MET CB 1 1 11 12523 1 1 2 MET CE C 2.679 -16.138 17.855 1.00 . A A . 2 MET CE 1 1 11 12524 1 1 2 MET CG C 1.737 -14.982 20.129 1.00 . A A . 2 MET CG 1 1 11 12525 1 1 2 MET H H 3.497 -14.175 22.348 1.00 . A A . 2 MET H 1 1 11 12526 1 1 2 MET HA H 3.603 -12.072 20.319 1.00 . A A . 2 MET HA 1 1 11 12527 1 1 2 MET HB2 H 1.489 -13.049 19.205 1.00 . A A . 2 MET HB2 1 1 11 12528 1 1 2 MET HB3 H 3.004 -13.832 18.820 1.00 . A A . 2 MET HB3 1 1 11 12529 1 1 2 MET HE1 H 1.684 -15.787 17.582 1.00 . A A . 2 MET HE1 1 1 11 12530 1 1 2 MET HE2 H 2.869 -17.084 17.349 1.00 . A A . 2 MET HE2 1 1 11 12531 1 1 2 MET HE3 H 3.413 -15.407 17.516 1.00 . A A . 2 MET HE3 1 1 11 12532 1 1 2 MET HG2 H 1.652 -14.969 21.216 1.00 . A A . 2 MET HG2 1 1 11 12533 1 1 2 MET HG3 H 0.736 -15.146 19.729 1.00 . A A . 2 MET HG3 1 1 11 12534 1 1 2 MET N N 3.835 -13.722 21.523 1.00 . A A . 2 MET N 1 1 11 12535 1 1 2 MET O O 1.915 -12.349 22.851 1.00 . A A . 2 MET O 1 1 11 12536 1 1 2 MET SD S 2.795 -16.354 19.639 1.00 . A A . 2 MET SD 1 1 11 12537 1 1 3 GLU C C -0.023 -9.702 22.205 1.00 . A A . 3 GLU C 1 1 11 12538 1 1 3 GLU CA C 1.007 -10.044 21.123 1.00 . A A . 3 GLU CA 1 1 11 12539 1 1 3 GLU CB C 0.652 -9.365 19.800 1.00 . A A . 3 GLU CB 1 1 11 12540 1 1 3 GLU CD C -0.768 -9.394 17.737 1.00 . A A . 3 GLU CD 1 1 11 12541 1 1 3 GLU CG C -0.428 -10.132 19.035 1.00 . A A . 3 GLU CG 1 1 11 12542 1 1 3 GLU H H 0.567 -11.910 20.163 1.00 . A A . 3 GLU H 1 1 11 12543 1 1 3 GLU HA H 2.003 -9.756 21.456 1.00 . A A . 3 GLU HA 1 1 11 12544 1 1 3 GLU HB2 H 0.306 -8.347 19.992 1.00 . A A . 3 GLU HB2 1 1 11 12545 1 1 3 GLU HB3 H 1.548 -9.296 19.179 1.00 . A A . 3 GLU HB3 1 1 11 12546 1 1 3 GLU HG2 H -0.083 -11.136 18.788 1.00 . A A . 3 GLU HG2 1 1 11 12547 1 1 3 GLU HG3 H -1.331 -10.231 19.636 1.00 . A A . 3 GLU HG3 1 1 11 12548 1 1 3 GLU N N 1.051 -11.478 20.922 1.00 . A A . 3 GLU N 1 1 11 12549 1 1 3 GLU O O -0.989 -10.421 22.426 1.00 . A A . 3 GLU O 1 1 11 12550 1 1 3 GLU OE1 O 0.004 -8.524 17.337 1.00 . A A . 3 GLU OE1 1 1 11 12551 1 1 3 GLU OE2 O -1.799 -9.700 17.142 1.00 . A A . 3 GLU OE2 1 1 11 12552 1 1 4 PRO C C -1.237 -6.818 21.927 1.00 . A A . 4 PRO C 1 1 11 12553 1 1 4 PRO CA C -0.775 -7.567 23.175 1.00 . A A . 4 PRO CA 1 1 11 12554 1 1 4 PRO CB C -0.111 -6.575 24.130 1.00 . A A . 4 PRO CB 1 1 11 12555 1 1 4 PRO CD C 1.560 -8.245 23.407 1.00 . A A . 4 PRO CD 1 1 11 12556 1 1 4 PRO CG C 1.363 -6.981 24.251 1.00 . A A . 4 PRO CG 1 1 11 12557 1 1 4 PRO HA H -1.630 -8.049 23.647 1.00 . A A . 4 PRO HA 1 1 11 12558 1 1 4 PRO HB2 H -0.196 -5.559 23.743 1.00 . A A . 4 PRO HB2 1 1 11 12559 1 1 4 PRO HB3 H -0.597 -6.598 25.106 1.00 . A A . 4 PRO HB3 1 1 11 12560 1 1 4 PRO HD2 H 2.261 -8.070 22.591 1.00 . A A . 4 PRO HD2 1 1 11 12561 1 1 4 PRO HD3 H 1.924 -9.077 24.010 1.00 . A A . 4 PRO HD3 1 1 11 12562 1 1 4 PRO HG2 H 2.002 -6.176 23.891 1.00 . A A . 4 PRO HG2 1 1 11 12563 1 1 4 PRO HG3 H 1.615 -7.172 25.293 1.00 . A A . 4 PRO HG3 1 1 11 12564 1 1 4 PRO N N 0.246 -8.556 22.871 1.00 . A A . 4 PRO N 1 1 11 12565 1 1 4 PRO O O -0.488 -6.605 20.983 1.00 . A A . 4 PRO O 1 1 11 12566 1 1 5 VAL C C -4.580 -5.788 20.862 1.00 . A A . 5 VAL C 1 1 11 12567 1 1 5 VAL CA C -3.379 -6.730 20.865 1.00 . A A . 5 VAL CA 1 1 11 12568 1 1 5 VAL CB C -3.957 -8.125 21.012 1.00 . A A . 5 VAL CB 1 1 11 12569 1 1 5 VAL CG1 C -4.682 -8.565 19.741 1.00 . A A . 5 VAL CG1 1 1 11 12570 1 1 5 VAL CG2 C -2.908 -9.153 21.429 1.00 . A A . 5 VAL CG2 1 1 11 12571 1 1 5 VAL H H -2.848 -5.963 22.816 1.00 . A A . 5 VAL H 1 1 11 12572 1 1 5 VAL HA H -2.772 -6.608 19.966 1.00 . A A . 5 VAL HA 1 1 11 12573 1 1 5 VAL HB H -4.689 -8.012 21.808 1.00 . A A . 5 VAL HB 1 1 11 12574 1 1 5 VAL HG11 H -4.061 -8.396 18.861 1.00 . A A . 5 VAL HG11 1 1 11 12575 1 1 5 VAL HG12 H -4.927 -9.626 19.781 1.00 . A A . 5 VAL HG12 1 1 11 12576 1 1 5 VAL HG13 H -5.611 -8.010 19.611 1.00 . A A . 5 VAL HG13 1 1 11 12577 1 1 5 VAL HG21 H -1.938 -8.911 20.998 1.00 . A A . 5 VAL HG21 1 1 11 12578 1 1 5 VAL HG22 H -2.805 -9.191 22.513 1.00 . A A . 5 VAL HG22 1 1 11 12579 1 1 5 VAL HG23 H -3.183 -10.149 21.083 1.00 . A A . 5 VAL HG23 1 1 11 12580 1 1 5 VAL N N -2.520 -6.432 21.996 1.00 . A A . 5 VAL N 1 1 11 12581 1 1 5 VAL O O -5.707 -6.181 21.138 1.00 . A A . 5 VAL O 1 1 11 12582 1 1 6 ASP C C -6.109 -4.257 18.960 1.00 . A A . 6 ASP C 1 1 11 12583 1 1 6 ASP CA C -4.671 -3.891 19.336 1.00 . A A . 6 ASP CA 1 1 11 12584 1 1 6 ASP CB C -3.688 -4.201 18.202 1.00 . A A . 6 ASP CB 1 1 11 12585 1 1 6 ASP CG C -4.141 -5.357 17.293 1.00 . A A . 6 ASP CG 1 1 11 12586 1 1 6 ASP H H -3.625 -4.086 21.214 1.00 . A A . 6 ASP H 1 1 11 12587 1 1 6 ASP HA H -4.657 -2.822 19.546 1.00 . A A . 6 ASP HA 1 1 11 12588 1 1 6 ASP HB2 H -3.502 -3.278 17.655 1.00 . A A . 6 ASP HB2 1 1 11 12589 1 1 6 ASP HB3 H -2.721 -4.511 18.577 1.00 . A A . 6 ASP HB3 1 1 11 12590 1 1 6 ASP N N -4.246 -4.527 20.571 1.00 . A A . 6 ASP N 1 1 11 12591 1 1 6 ASP O O -6.586 -5.365 19.166 1.00 . A A . 6 ASP O 1 1 11 12592 1 1 6 ASP OD1 O -5.226 -5.296 16.717 1.00 . A A . 6 ASP OD1 1 1 11 12593 1 1 6 ASP OD2 O -3.386 -6.320 17.172 1.00 . A A . 6 ASP OD2 1 1 11 12594 1 1 7 PRO C C -5.393 -2.496 16.415 1.00 . A A . 7 PRO C 1 1 11 12595 1 1 7 PRO CA C -6.743 -3.025 16.920 1.00 . A A . 7 PRO CA 1 1 11 12596 1 1 7 PRO CB C -7.829 -1.979 16.661 1.00 . A A . 7 PRO CB 1 1 11 12597 1 1 7 PRO CD C -7.621 -2.323 19.094 1.00 . A A . 7 PRO CD 1 1 11 12598 1 1 7 PRO CG C -8.334 -1.490 18.026 1.00 . A A . 7 PRO CG 1 1 11 12599 1 1 7 PRO HA H -6.985 -3.953 16.404 1.00 . A A . 7 PRO HA 1 1 11 12600 1 1 7 PRO HB2 H -7.438 -1.150 16.072 1.00 . A A . 7 PRO HB2 1 1 11 12601 1 1 7 PRO HB3 H -8.644 -2.435 16.100 1.00 . A A . 7 PRO HB3 1 1 11 12602 1 1 7 PRO HD2 H -7.016 -1.696 19.748 1.00 . A A . 7 PRO HD2 1 1 11 12603 1 1 7 PRO HD3 H -8.332 -2.881 19.704 1.00 . A A . 7 PRO HD3 1 1 11 12604 1 1 7 PRO HG2 H -8.113 -0.431 18.157 1.00 . A A . 7 PRO HG2 1 1 11 12605 1 1 7 PRO HG3 H -9.414 -1.613 18.102 1.00 . A A . 7 PRO HG3 1 1 11 12606 1 1 7 PRO N N -6.767 -3.241 18.360 1.00 . A A . 7 PRO N 1 1 11 12607 1 1 7 PRO O O -4.620 -3.188 15.766 1.00 . A A . 7 PRO O 1 1 11 12608 1 1 8 CYS C C -2.745 -0.674 16.945 1.00 . A A . 8 CYS C 1 1 11 12609 1 1 8 CYS CA C -4.045 -0.525 16.148 1.00 . A A . 8 CYS CA 1 1 11 12610 1 1 8 CYS CB C -4.365 0.957 16.028 1.00 . A A . 8 CYS CB 1 1 11 12611 1 1 8 CYS H H -5.797 -0.735 17.356 1.00 . A A . 8 CYS H 1 1 11 12612 1 1 8 CYS HA H -3.902 -0.980 15.173 1.00 . A A . 8 CYS HA 1 1 11 12613 1 1 8 CYS HB2 H -5.365 1.081 15.614 1.00 . A A . 8 CYS HB2 1 1 11 12614 1 1 8 CYS HB3 H -4.361 1.392 17.027 1.00 . A A . 8 CYS HB3 1 1 11 12615 1 1 8 CYS N N -5.169 -1.217 16.753 1.00 . A A . 8 CYS N 1 1 11 12616 1 1 8 CYS O O -1.662 -0.438 16.425 1.00 . A A . 8 CYS O 1 1 11 12617 1 1 8 CYS SG S -3.166 1.850 15.008 1.00 . A A . 8 CYS SG 1 1 11 12618 1 1 9 PHE C C -0.869 -2.412 18.049 1.00 . A A . 9 PHE C 1 1 11 12619 1 1 9 PHE CA C -1.699 -1.482 18.933 1.00 . A A . 9 PHE CA 1 1 11 12620 1 1 9 PHE CB C -2.151 -2.217 20.183 1.00 . A A . 9 PHE CB 1 1 11 12621 1 1 9 PHE CD1 C -0.099 -2.959 21.486 1.00 . A A . 9 PHE CD1 1 1 11 12622 1 1 9 PHE CD2 C -1.346 -0.944 22.248 1.00 . A A . 9 PHE CD2 1 1 11 12623 1 1 9 PHE CE1 C 0.830 -2.799 22.573 1.00 . A A . 9 PHE CE1 1 1 11 12624 1 1 9 PHE CE2 C -0.418 -0.782 23.336 1.00 . A A . 9 PHE CE2 1 1 11 12625 1 1 9 PHE CG C -1.190 -2.033 21.319 1.00 . A A . 9 PHE CG 1 1 11 12626 1 1 9 PHE CZ C 0.669 -1.710 23.499 1.00 . A A . 9 PHE CZ 1 1 11 12627 1 1 9 PHE H H -3.734 -0.917 18.733 1.00 . A A . 9 PHE H 1 1 11 12628 1 1 9 PHE HA H -1.149 -0.581 19.205 1.00 . A A . 9 PHE HA 1 1 11 12629 1 1 9 PHE HB2 H -3.155 -1.873 20.434 1.00 . A A . 9 PHE HB2 1 1 11 12630 1 1 9 PHE HB3 H -2.208 -3.280 19.981 1.00 . A A . 9 PHE HB3 1 1 11 12631 1 1 9 PHE HD1 H 0.023 -3.779 20.794 1.00 . A A . 9 PHE HD1 1 1 11 12632 1 1 9 PHE HD2 H -2.162 -0.248 22.127 1.00 . A A . 9 PHE HD2 1 1 11 12633 1 1 9 PHE HE1 H 1.646 -3.498 22.689 1.00 . A A . 9 PHE HE1 1 1 11 12634 1 1 9 PHE HE2 H -0.539 0.036 24.031 1.00 . A A . 9 PHE HE2 1 1 11 12635 1 1 9 PHE HZ H 1.364 -1.590 24.317 1.00 . A A . 9 PHE HZ 1 1 11 12636 1 1 9 PHE N N -2.887 -1.063 18.225 1.00 . A A . 9 PHE N 1 1 11 12637 1 1 9 PHE O O -1.321 -2.897 17.019 1.00 . A A . 9 PHE O 1 1 11 12638 1 1 10 ARG C C 1.432 -3.431 16.385 1.00 . A A . 10 ARG C 1 1 11 12639 1 1 10 ARG CA C 1.125 -3.683 17.881 1.00 . A A . 10 ARG CA 1 1 11 12640 1 1 10 ARG CB C 0.421 -4.998 18.094 1.00 . A A . 10 ARG CB 1 1 11 12641 1 1 10 ARG CD C 2.814 -5.916 18.470 1.00 . A A . 10 ARG CD 1 1 11 12642 1 1 10 ARG CG C 1.332 -5.942 18.860 1.00 . A A . 10 ARG CG 1 1 11 12643 1 1 10 ARG CZ C 4.905 -5.578 19.603 1.00 . A A . 10 ARG CZ 1 1 11 12644 1 1 10 ARG H H 0.701 -2.121 19.318 1.00 . A A . 10 ARG H 1 1 11 12645 1 1 10 ARG HA H 2.027 -3.749 18.460 1.00 . A A . 10 ARG HA 1 1 11 12646 1 1 10 ARG HB2 H -0.476 -4.828 18.700 1.00 . A A . 10 ARG HB2 1 1 11 12647 1 1 10 ARG HB3 H 0.093 -5.423 17.142 1.00 . A A . 10 ARG HB3 1 1 11 12648 1 1 10 ARG HD2 H 3.210 -6.919 18.308 1.00 . A A . 10 ARG HD2 1 1 11 12649 1 1 10 ARG HD3 H 2.987 -5.316 17.577 1.00 . A A . 10 ARG HD3 1 1 11 12650 1 1 10 ARG HE H 3.148 -4.739 20.227 1.00 . A A . 10 ARG HE 1 1 11 12651 1 1 10 ARG HG2 H 1.194 -5.783 19.926 1.00 . A A . 10 ARG HG2 1 1 11 12652 1 1 10 ARG HG3 H 0.971 -6.914 18.645 1.00 . A A . 10 ARG HG3 1 1 11 12653 1 1 10 ARG HH11 H 4.761 -7.509 19.011 1.00 . A A . 10 ARG HH11 1 1 11 12654 1 1 10 ARG HH12 H 6.265 -7.072 19.749 1.00 . A A . 10 ARG HH12 1 1 11 12655 1 1 10 ARG HH21 H 5.647 -3.996 20.625 1.00 . A A . 10 ARG HH21 1 1 11 12656 1 1 10 ARG HH22 H 6.532 -4.440 19.204 1.00 . A A . 10 ARG HH22 1 1 11 12657 1 1 10 ARG N N 0.363 -2.626 18.524 1.00 . A A . 10 ARG N 1 1 11 12658 1 1 10 ARG NE N 3.587 -5.319 19.541 1.00 . A A . 10 ARG NE 1 1 11 12659 1 1 10 ARG NH1 N 5.347 -6.822 19.441 1.00 . A A . 10 ARG NH1 1 1 11 12660 1 1 10 ARG NH2 N 5.766 -4.590 19.829 1.00 . A A . 10 ARG NH2 1 1 11 12661 1 1 10 ARG O O 2.126 -4.206 15.738 1.00 . A A . 10 ARG O 1 1 11 12662 1 1 11 ALA C C 0.999 -2.945 13.514 1.00 . A A . 11 ALA C 1 1 11 12663 1 1 11 ALA CA C 0.114 -2.420 14.652 1.00 . A A . 11 ALA CA 1 1 11 12664 1 1 11 ALA CB C -0.501 -1.068 14.279 1.00 . A A . 11 ALA CB 1 1 11 12665 1 1 11 ALA H H 0.699 -1.635 16.602 1.00 . A A . 11 ALA H 1 1 11 12666 1 1 11 ALA HA H -0.689 -3.128 14.854 1.00 . A A . 11 ALA HA 1 1 11 12667 1 1 11 ALA HB1 H -0.279 -0.805 13.246 1.00 . A A . 11 ALA HB1 1 1 11 12668 1 1 11 ALA HB2 H -1.588 -1.099 14.377 1.00 . A A . 11 ALA HB2 1 1 11 12669 1 1 11 ALA HB3 H -0.128 -0.270 14.920 1.00 . A A . 11 ALA HB3 1 1 11 12670 1 1 11 ALA N N 0.871 -2.313 15.890 1.00 . A A . 11 ALA N 1 1 11 12671 1 1 11 ALA O O 0.576 -3.746 12.690 1.00 . A A . 11 ALA O 1 1 11 12672 1 1 12 ASN C C 2.441 -1.276 11.381 1.00 . A A . 12 ASN C 1 1 11 12673 1 1 12 ASN CA C 2.488 -1.151 12.908 1.00 . A A . 12 ASN CA 1 1 11 12674 1 1 12 ASN CB C 3.856 -0.628 13.345 1.00 . A A . 12 ASN CB 1 1 11 12675 1 1 12 ASN CG C 3.998 -0.732 14.865 1.00 . A A . 12 ASN CG 1 1 11 12676 1 1 12 ASN H H 2.997 -2.949 13.951 1.00 . A A . 12 ASN H 1 1 11 12677 1 1 12 ASN HA H 1.689 -0.492 13.245 1.00 . A A . 12 ASN HA 1 1 11 12678 1 1 12 ASN HB2 H 4.652 -1.207 12.878 1.00 . A A . 12 ASN HB2 1 1 11 12679 1 1 12 ASN HB3 H 3.982 0.414 13.049 1.00 . A A . 12 ASN HB3 1 1 11 12680 1 1 12 ASN HD21 H 3.713 1.279 14.983 1.00 . A A . 12 ASN HD21 1 1 11 12681 1 1 12 ASN HD22 H 4.433 0.535 16.398 1.00 . A A . 12 ASN HD22 1 1 11 12682 1 1 12 ASN N N 2.248 -2.443 13.524 1.00 . A A . 12 ASN N 1 1 11 12683 1 1 12 ASN ND2 N 4.053 0.468 15.470 1.00 . A A . 12 ASN ND2 1 1 11 12684 1 1 12 ASN O O 3.411 -1.649 10.733 1.00 . A A . 12 ASN O 1 1 11 12685 1 1 12 ASN OD1 O 4.056 -1.814 15.438 1.00 . A A . 12 ASN OD1 1 1 11 12686 1 1 13 CYS C C 2.428 0.731 9.451 1.00 . A A . 13 CYS C 1 1 11 12687 1 1 13 CYS CA C 1.092 0.069 9.817 1.00 . A A . 13 CYS CA 1 1 11 12688 1 1 13 CYS CB C 0.065 1.103 10.283 1.00 . A A . 13 CYS CB 1 1 11 12689 1 1 13 CYS H H 0.412 -1.374 11.191 1.00 . A A . 13 CYS H 1 1 11 12690 1 1 13 CYS HA H 0.711 -0.461 8.942 1.00 . A A . 13 CYS HA 1 1 11 12691 1 1 13 CYS HB2 H 0.437 1.659 11.146 1.00 . A A . 13 CYS HB2 1 1 11 12692 1 1 13 CYS HB3 H -0.126 1.814 9.478 1.00 . A A . 13 CYS HB3 1 1 11 12693 1 1 13 CYS N N 1.244 -0.937 10.858 1.00 . A A . 13 CYS N 1 1 11 12694 1 1 13 CYS O O 3.006 1.503 10.206 1.00 . A A . 13 CYS O 1 1 11 12695 1 1 13 CYS SG S -1.497 0.314 10.742 1.00 . A A . 13 CYS SG 1 1 11 12696 1 1 14 GLU C C 3.517 2.683 7.772 1.00 . A A . 14 GLU C 1 1 11 12697 1 1 14 GLU CA C 3.755 1.197 7.461 1.00 . A A . 14 GLU CA 1 1 11 12698 1 1 14 GLU CB C 3.599 0.904 5.969 1.00 . A A . 14 GLU CB 1 1 11 12699 1 1 14 GLU CD C 4.514 2.947 4.838 1.00 . A A . 14 GLU CD 1 1 11 12700 1 1 14 GLU CG C 4.760 1.469 5.149 1.00 . A A . 14 GLU CG 1 1 11 12701 1 1 14 GLU H H 2.619 -0.572 7.926 1.00 . A A . 14 GLU H 1 1 11 12702 1 1 14 GLU HA H 4.764 0.934 7.764 1.00 . A A . 14 GLU HA 1 1 11 12703 1 1 14 GLU HB2 H 3.538 -0.172 5.808 1.00 . A A . 14 GLU HB2 1 1 11 12704 1 1 14 GLU HB3 H 2.660 1.316 5.615 1.00 . A A . 14 GLU HB3 1 1 11 12705 1 1 14 GLU HG2 H 5.697 1.378 5.698 1.00 . A A . 14 GLU HG2 1 1 11 12706 1 1 14 GLU HG3 H 4.870 0.924 4.211 1.00 . A A . 14 GLU HG3 1 1 11 12707 1 1 14 GLU N N 2.868 0.344 8.240 1.00 . A A . 14 GLU N 1 1 11 12708 1 1 14 GLU O O 4.043 3.224 8.737 1.00 . A A . 14 GLU O 1 1 11 12709 1 1 14 GLU OE1 O 3.553 3.245 4.130 1.00 . A A . 14 GLU OE1 1 1 11 12710 1 1 14 GLU OE2 O 5.284 3.782 5.311 1.00 . A A . 14 GLU OE2 1 1 11 12711 1 1 15 TYR C C 1.031 3.814 8.597 1.00 . A A . 15 TYR C 1 1 11 12712 1 1 15 TYR CA C 1.847 4.356 7.418 1.00 . A A . 15 TYR CA 1 1 11 12713 1 1 15 TYR CB C 0.979 4.932 6.287 1.00 . A A . 15 TYR CB 1 1 11 12714 1 1 15 TYR CD1 C 0.539 6.866 7.910 1.00 . A A . 15 TYR CD1 1 1 11 12715 1 1 15 TYR CD2 C 0.198 7.220 5.472 1.00 . A A . 15 TYR CD2 1 1 11 12716 1 1 15 TYR CE1 C 0.132 8.221 8.165 1.00 . A A . 15 TYR CE1 1 1 11 12717 1 1 15 TYR CE2 C -0.210 8.576 5.723 1.00 . A A . 15 TYR CE2 1 1 11 12718 1 1 15 TYR CG C 0.568 6.353 6.562 1.00 . A A . 15 TYR CG 1 1 11 12719 1 1 15 TYR CZ C -0.239 9.077 7.070 1.00 . A A . 15 TYR CZ 1 1 11 12720 1 1 15 TYR H H 2.701 3.080 5.928 1.00 . A A . 15 TYR H 1 1 11 12721 1 1 15 TYR HA H 2.506 5.131 7.799 1.00 . A A . 15 TYR HA 1 1 11 12722 1 1 15 TYR HB2 H 1.549 4.924 5.364 1.00 . A A . 15 TYR HB2 1 1 11 12723 1 1 15 TYR HB3 H 0.089 4.311 6.128 1.00 . A A . 15 TYR HB3 1 1 11 12724 1 1 15 TYR HD1 H 0.836 6.233 8.733 1.00 . A A . 15 TYR HD1 1 1 11 12725 1 1 15 TYR HD2 H 0.224 6.847 4.458 1.00 . A A . 15 TYR HD2 1 1 11 12726 1 1 15 TYR HE1 H 0.098 8.591 9.179 1.00 . A A . 15 TYR HE1 1 1 11 12727 1 1 15 TYR HE2 H -0.503 9.212 4.901 1.00 . A A . 15 TYR HE2 1 1 11 12728 1 1 15 TYR HH H -1.328 10.392 7.944 1.00 . A A . 15 TYR HH 1 1 11 12729 1 1 15 TYR N N 2.699 3.303 6.902 1.00 . A A . 15 TYR N 1 1 11 12730 1 1 15 TYR O O 1.550 3.162 9.494 1.00 . A A . 15 TYR O 1 1 11 12731 1 1 15 TYR OH O -0.621 10.381 7.312 1.00 . A A . 15 TYR OH 1 1 11 12732 1 1 16 GLN C C -2.214 2.996 9.539 1.00 . A A . 16 GLN C 1 1 11 12733 1 1 16 GLN CA C -1.075 4.011 9.732 1.00 . A A . 16 GLN CA 1 1 11 12734 1 1 16 GLN CB C -1.633 5.376 10.134 1.00 . A A . 16 GLN CB 1 1 11 12735 1 1 16 GLN CD C -2.825 6.540 12.007 1.00 . A A . 16 GLN CD 1 1 11 12736 1 1 16 GLN CG C -1.815 5.448 11.649 1.00 . A A . 16 GLN CG 1 1 11 12737 1 1 16 GLN H H -0.509 4.669 7.716 1.00 . A A . 16 GLN H 1 1 11 12738 1 1 16 GLN HA H -0.408 3.643 10.509 1.00 . A A . 16 GLN HA 1 1 11 12739 1 1 16 GLN HB2 H -0.955 6.160 9.820 1.00 . A A . 16 GLN HB2 1 1 11 12740 1 1 16 GLN HB3 H -2.589 5.524 9.619 1.00 . A A . 16 GLN HB3 1 1 11 12741 1 1 16 GLN HE21 H -4.523 5.776 11.185 1.00 . A A . 16 GLN HE21 1 1 11 12742 1 1 16 GLN HE22 H -4.590 6.083 12.911 1.00 . A A . 16 GLN HE22 1 1 11 12743 1 1 16 GLN HG2 H -2.164 4.492 12.039 1.00 . A A . 16 GLN HG2 1 1 11 12744 1 1 16 GLN HG3 H -0.861 5.662 12.132 1.00 . A A . 16 GLN HG3 1 1 11 12745 1 1 16 GLN N N -0.266 4.148 8.536 1.00 . A A . 16 GLN N 1 1 11 12746 1 1 16 GLN NE2 N -4.094 6.093 12.037 1.00 . A A . 16 GLN NE2 1 1 11 12747 1 1 16 GLN O O -2.137 2.061 8.752 1.00 . A A . 16 GLN O 1 1 11 12748 1 1 16 GLN OE1 O -2.479 7.693 12.236 1.00 . A A . 16 GLN OE1 1 1 11 12749 1 1 17 CYS C C -5.528 2.408 10.100 1.00 . A A . 17 CYS C 1 1 11 12750 1 1 17 CYS CA C -4.162 2.209 10.763 1.00 . A A . 17 CYS CA 1 1 11 12751 1 1 17 CYS CB C -4.324 2.272 12.283 1.00 . A A . 17 CYS CB 1 1 11 12752 1 1 17 CYS H H -3.175 4.161 10.785 1.00 . A A . 17 CYS H 1 1 11 12753 1 1 17 CYS HA H -3.711 1.262 10.468 1.00 . A A . 17 CYS HA 1 1 11 12754 1 1 17 CYS HB2 H -3.999 3.248 12.644 1.00 . A A . 17 CYS HB2 1 1 11 12755 1 1 17 CYS HB3 H -5.376 2.174 12.546 1.00 . A A . 17 CYS HB3 1 1 11 12756 1 1 17 CYS N N -3.260 3.265 10.340 1.00 . A A . 17 CYS N 1 1 11 12757 1 1 17 CYS O O -5.973 3.527 9.877 1.00 . A A . 17 CYS O 1 1 11 12758 1 1 17 CYS SG S -3.392 1.001 13.168 1.00 . A A . 17 CYS SG 1 1 11 12759 1 1 18 GLN C C -7.447 0.042 11.477 1.00 . A A . 18 GLN C 1 1 11 12760 1 1 18 GLN CA C -7.496 1.086 10.365 1.00 . A A . 18 GLN CA 1 1 11 12761 1 1 18 GLN CB C -8.458 0.638 9.269 1.00 . A A . 18 GLN CB 1 1 11 12762 1 1 18 GLN CD C -9.799 2.765 9.539 1.00 . A A . 18 GLN CD 1 1 11 12763 1 1 18 GLN CG C -9.853 1.229 9.479 1.00 . A A . 18 GLN CG 1 1 11 12764 1 1 18 GLN H H -5.856 0.673 9.064 1.00 . A A . 18 GLN H 1 1 11 12765 1 1 18 GLN HA H -7.810 2.056 10.751 1.00 . A A . 18 GLN HA 1 1 11 12766 1 1 18 GLN HB2 H -8.080 0.976 8.303 1.00 . A A . 18 GLN HB2 1 1 11 12767 1 1 18 GLN HB3 H -8.512 -0.452 9.254 1.00 . A A . 18 GLN HB3 1 1 11 12768 1 1 18 GLN HE21 H -8.198 2.729 8.286 1.00 . A A . 18 GLN HE21 1 1 11 12769 1 1 18 GLN HE22 H -8.489 4.267 9.075 1.00 . A A . 18 GLN HE22 1 1 11 12770 1 1 18 GLN HG2 H -10.518 0.927 8.670 1.00 . A A . 18 GLN HG2 1 1 11 12771 1 1 18 GLN HG3 H -10.280 0.854 10.409 1.00 . A A . 18 GLN HG3 1 1 11 12772 1 1 18 GLN N N -6.168 1.261 9.809 1.00 . A A . 18 GLN N 1 1 11 12773 1 1 18 GLN NE2 N -8.735 3.306 8.910 1.00 . A A . 18 GLN NE2 1 1 11 12774 1 1 18 GLN O O -6.615 -0.856 11.481 1.00 . A A . 18 GLN O 1 1 11 12775 1 1 18 GLN OE1 O -10.667 3.410 10.114 1.00 . A A . 18 GLN OE1 1 1 11 12776 1 1 19 PRO C C -10.488 -1.053 11.903 1.00 . A A . 19 PRO C 1 1 11 12777 1 1 19 PRO CA C -9.294 -0.838 12.845 1.00 . A A . 19 PRO CA 1 1 11 12778 1 1 19 PRO CB C -9.834 -0.384 14.204 1.00 . A A . 19 PRO CB 1 1 11 12779 1 1 19 PRO CD C -8.402 1.394 13.281 1.00 . A A . 19 PRO CD 1 1 11 12780 1 1 19 PRO CG C -9.193 0.973 14.519 1.00 . A A . 19 PRO CG 1 1 11 12781 1 1 19 PRO HA H -8.728 -1.764 12.934 1.00 . A A . 19 PRO HA 1 1 11 12782 1 1 19 PRO HB2 H -10.920 -0.291 14.168 1.00 . A A . 19 PRO HB2 1 1 11 12783 1 1 19 PRO HB3 H -9.595 -1.110 14.977 1.00 . A A . 19 PRO HB3 1 1 11 12784 1 1 19 PRO HD2 H -8.885 2.222 12.762 1.00 . A A . 19 PRO HD2 1 1 11 12785 1 1 19 PRO HD3 H -7.384 1.687 13.537 1.00 . A A . 19 PRO HD3 1 1 11 12786 1 1 19 PRO HG2 H -9.956 1.711 14.758 1.00 . A A . 19 PRO HG2 1 1 11 12787 1 1 19 PRO HG3 H -8.527 0.880 15.377 1.00 . A A . 19 PRO HG3 1 1 11 12788 1 1 19 PRO N N -8.382 0.218 12.432 1.00 . A A . 19 PRO N 1 1 11 12789 1 1 19 PRO O O -11.473 -0.326 11.942 1.00 . A A . 19 PRO O 1 1 11 12790 1 1 20 LEU C C -12.384 -3.536 11.060 1.00 . A A . 20 LEU C 1 1 11 12791 1 1 20 LEU CA C -10.884 -3.418 11.407 1.00 . A A . 20 LEU CA 1 1 11 12792 1 1 20 LEU CB C -10.629 -3.752 12.891 1.00 . A A . 20 LEU CB 1 1 11 12793 1 1 20 LEU CD1 C -11.435 -5.081 14.872 1.00 . A A . 20 LEU CD1 1 1 11 12794 1 1 20 LEU CD2 C -12.817 -3.163 13.995 1.00 . A A . 20 LEU CD2 1 1 11 12795 1 1 20 LEU CG C -11.848 -4.289 13.632 1.00 . A A . 20 LEU CG 1 1 11 12796 1 1 20 LEU H H -9.888 -1.948 10.186 1.00 . A A . 20 LEU H 1 1 11 12797 1 1 20 LEU HA H -10.342 -4.111 10.781 1.00 . A A . 20 LEU HA 1 1 11 12798 1 1 20 LEU HB2 H -9.848 -4.505 12.964 1.00 . A A . 20 LEU HB2 1 1 11 12799 1 1 20 LEU HB3 H -10.272 -2.884 13.432 1.00 . A A . 20 LEU HB3 1 1 11 12800 1 1 20 LEU HD11 H -12.196 -5.814 15.137 1.00 . A A . 20 LEU HD11 1 1 11 12801 1 1 20 LEU HD12 H -10.499 -5.614 14.698 1.00 . A A . 20 LEU HD12 1 1 11 12802 1 1 20 LEU HD13 H -11.292 -4.419 15.726 1.00 . A A . 20 LEU HD13 1 1 11 12803 1 1 20 LEU HD21 H -12.383 -2.189 13.768 1.00 . A A . 20 LEU HD21 1 1 11 12804 1 1 20 LEU HD22 H -13.748 -3.254 13.436 1.00 . A A . 20 LEU HD22 1 1 11 12805 1 1 20 LEU HD23 H -13.057 -3.186 15.058 1.00 . A A . 20 LEU HD23 1 1 11 12806 1 1 20 LEU HG H -12.341 -4.962 12.939 1.00 . A A . 20 LEU HG 1 1 11 12807 1 1 20 LEU N N -10.341 -2.095 11.064 1.00 . A A . 20 LEU N 1 1 11 12808 1 1 20 LEU O O -12.930 -4.561 10.675 1.00 . A A . 20 LEU O 1 1 11 12809 1 1 21 ASN C C -14.776 -2.996 9.731 1.00 . A A . 21 ASN C 1 1 11 12810 1 1 21 ASN CA C -14.310 -2.041 10.841 1.00 . A A . 21 ASN CA 1 1 11 12811 1 1 21 ASN CB C -14.300 -0.592 10.351 1.00 . A A . 21 ASN CB 1 1 11 12812 1 1 21 ASN CG C -14.748 0.332 11.484 1.00 . A A . 21 ASN CG 1 1 11 12813 1 1 21 ASN H H -12.320 -1.975 11.948 1.00 . A A . 21 ASN H 1 1 11 12814 1 1 21 ASN HA H -14.984 -2.160 11.680 1.00 . A A . 21 ASN HA 1 1 11 12815 1 1 21 ASN HB2 H -13.296 -0.300 10.036 1.00 . A A . 21 ASN HB2 1 1 11 12816 1 1 21 ASN HB3 H -14.986 -0.469 9.509 1.00 . A A . 21 ASN HB3 1 1 11 12817 1 1 21 ASN HD21 H -15.700 1.504 10.107 1.00 . A A . 21 ASN HD21 1 1 11 12818 1 1 21 ASN N N -12.999 -2.406 11.354 1.00 . A A . 21 ASN N 1 1 11 12819 1 1 21 ASN ND2 N -15.348 1.451 11.042 1.00 . A A . 21 ASN ND2 1 1 11 12820 1 1 21 ASN O O -15.340 -4.051 9.993 1.00 . A A . 21 ASN O 1 1 11 12821 1 1 21 ASN OD1 O -14.562 0.050 12.662 1.00 . A A . 21 ASN OD1 1 1 11 12822 1 1 22 GLN C C -13.595 -4.708 7.785 1.00 . A A . 22 GLN C 1 1 11 12823 1 1 22 GLN CA C -14.517 -3.544 7.420 1.00 . A A . 22 GLN CA 1 1 11 12824 1 1 22 GLN CB C -14.043 -2.896 6.120 1.00 . A A . 22 GLN CB 1 1 11 12825 1 1 22 GLN CD C -14.532 -2.981 3.667 1.00 . A A . 22 GLN CD 1 1 11 12826 1 1 22 GLN CG C -15.146 -2.861 5.063 1.00 . A A . 22 GLN CG 1 1 11 12827 1 1 22 GLN H H -14.286 -1.604 8.306 1.00 . A A . 22 GLN H 1 1 11 12828 1 1 22 GLN HA H -15.543 -3.903 7.334 1.00 . A A . 22 GLN HA 1 1 11 12829 1 1 22 GLN HB2 H -13.697 -1.883 6.325 1.00 . A A . 22 GLN HB2 1 1 11 12830 1 1 22 GLN HB3 H -13.184 -3.445 5.735 1.00 . A A . 22 GLN HB3 1 1 11 12831 1 1 22 GLN HE21 H -16.036 -3.909 2.659 1.00 . A A . 22 GLN HE21 1 1 11 12832 1 1 22 GLN HE22 H -15.548 -2.349 2.021 1.00 . A A . 22 GLN HE22 1 1 11 12833 1 1 22 GLN HG2 H -15.847 -3.682 5.213 1.00 . A A . 22 GLN HG2 1 1 11 12834 1 1 22 GLN HG3 H -15.709 -1.930 5.124 1.00 . A A . 22 GLN HG3 1 1 11 12835 1 1 22 GLN N N -14.506 -2.562 8.488 1.00 . A A . 22 GLN N 1 1 11 12836 1 1 22 GLN NE2 N -15.455 -3.089 2.695 1.00 . A A . 22 GLN NE2 1 1 11 12837 1 1 22 GLN O O -13.943 -5.877 7.671 1.00 . A A . 22 GLN O 1 1 11 12838 1 1 22 GLN OE1 O -13.320 -2.974 3.489 1.00 . A A . 22 GLN OE1 1 1 11 12839 1 1 23 THR C C -10.580 -6.042 8.433 1.00 . A A . 23 THR C 1 1 11 12840 1 1 23 THR CA C -11.197 -4.872 7.633 1.00 . A A . 23 THR CA 1 1 11 12841 1 1 23 THR CB C -10.165 -3.767 7.435 1.00 . A A . 23 THR CB 1 1 11 12842 1 1 23 THR CG2 C -9.052 -4.192 6.480 1.00 . A A . 23 THR CG2 1 1 11 12843 1 1 23 THR H H -12.365 -3.514 8.861 1.00 . A A . 23 THR H 1 1 11 12844 1 1 23 THR HA H -11.536 -5.271 6.691 1.00 . A A . 23 THR HA 1 1 11 12845 1 1 23 THR HB H -9.744 -3.501 8.404 1.00 . A A . 23 THR HB 1 1 11 12846 1 1 23 THR HG1 H -10.867 -2.006 7.651 1.00 . A A . 23 THR HG1 1 1 11 12847 1 1 23 THR HG21 H -9.443 -4.847 5.701 1.00 . A A . 23 THR HG21 1 1 11 12848 1 1 23 THR HG22 H -8.606 -3.321 5.998 1.00 . A A . 23 THR HG22 1 1 11 12849 1 1 23 THR HG23 H -8.267 -4.729 7.012 1.00 . A A . 23 THR HG23 1 1 11 12850 1 1 23 THR N N -12.396 -4.292 8.228 1.00 . A A . 23 THR N 1 1 11 12851 1 1 23 THR O O -9.794 -6.835 7.928 1.00 . A A . 23 THR O 1 1 11 12852 1 1 23 THR OG1 O -10.801 -2.620 6.932 1.00 . A A . 23 THR OG1 1 1 11 12853 1 1 24 SER C C -8.708 -6.093 10.528 1.00 . A A . 24 SER C 1 1 11 12854 1 1 24 SER CA C -10.163 -6.464 10.802 1.00 . A A . 24 SER CA 1 1 11 12855 1 1 24 SER CB C -10.367 -7.928 11.147 1.00 . A A . 24 SER CB 1 1 11 12856 1 1 24 SER H H -11.742 -5.432 9.849 1.00 . A A . 24 SER H 1 1 11 12857 1 1 24 SER HA H -10.518 -5.878 11.649 1.00 . A A . 24 SER HA 1 1 11 12858 1 1 24 SER HB2 H -9.969 -8.139 12.139 1.00 . A A . 24 SER HB2 1 1 11 12859 1 1 24 SER HB3 H -11.436 -8.128 11.173 1.00 . A A . 24 SER HB3 1 1 11 12860 1 1 24 SER HG H -10.441 -9.058 9.613 1.00 . A A . 24 SER HG 1 1 11 12861 1 1 24 SER N N -11.004 -6.073 9.699 1.00 . A A . 24 SER N 1 1 11 12862 1 1 24 SER O O -8.129 -6.355 9.481 1.00 . A A . 24 SER O 1 1 11 12863 1 1 24 SER OG O -9.759 -8.782 10.211 1.00 . A A . 24 SER OG 1 1 11 12864 1 1 25 TYR C C -6.531 -4.060 10.468 1.00 . A A . 25 TYR C 1 1 11 12865 1 1 25 TYR CA C -7.680 -4.110 11.462 1.00 . A A . 25 TYR CA 1 1 11 12866 1 1 25 TYR CB C -7.202 -3.602 12.829 1.00 . A A . 25 TYR CB 1 1 11 12867 1 1 25 TYR CD1 C -6.268 -5.737 13.871 1.00 . A A . 25 TYR CD1 1 1 11 12868 1 1 25 TYR CD2 C -4.695 -3.934 13.186 1.00 . A A . 25 TYR CD2 1 1 11 12869 1 1 25 TYR CE1 C -5.156 -6.563 14.257 1.00 . A A . 25 TYR CE1 1 1 11 12870 1 1 25 TYR CE2 C -3.580 -4.754 13.581 1.00 . A A . 25 TYR CE2 1 1 11 12871 1 1 25 TYR CG C -6.043 -4.426 13.317 1.00 . A A . 25 TYR CG 1 1 11 12872 1 1 25 TYR CZ C -3.812 -6.071 14.113 1.00 . A A . 25 TYR CZ 1 1 11 12873 1 1 25 TYR H H -8.566 -5.775 12.461 1.00 . A A . 25 TYR H 1 1 11 12874 1 1 25 TYR HA H -8.490 -3.494 11.057 1.00 . A A . 25 TYR HA 1 1 11 12875 1 1 25 TYR HB2 H -6.904 -2.547 12.786 1.00 . A A . 25 TYR HB2 1 1 11 12876 1 1 25 TYR HB3 H -8.024 -3.678 13.541 1.00 . A A . 25 TYR HB3 1 1 11 12877 1 1 25 TYR HD1 H -7.277 -6.098 13.998 1.00 . A A . 25 TYR HD1 1 1 11 12878 1 1 25 TYR HD2 H -4.517 -2.945 12.790 1.00 . A A . 25 TYR HD2 1 1 11 12879 1 1 25 TYR HE1 H -5.330 -7.554 14.652 1.00 . A A . 25 TYR HE1 1 1 11 12880 1 1 25 TYR HE2 H -2.572 -4.381 13.479 1.00 . A A . 25 TYR HE2 1 1 11 12881 1 1 25 TYR HH H -1.947 -6.350 14.465 1.00 . A A . 25 TYR HH 1 1 11 12882 1 1 25 TYR N N -8.196 -5.459 11.590 1.00 . A A . 25 TYR N 1 1 11 12883 1 1 25 TYR O O -5.787 -5.004 10.234 1.00 . A A . 25 TYR O 1 1 11 12884 1 1 25 TYR OH O -2.745 -6.863 14.485 1.00 . A A . 25 TYR OH 1 1 11 12885 1 1 26 LEU C C -4.858 -1.551 8.743 1.00 . A A . 26 LEU C 1 1 11 12886 1 1 26 LEU CA C -5.841 -2.718 8.638 1.00 . A A . 26 LEU CA 1 1 11 12887 1 1 26 LEU CB C -6.954 -2.536 7.599 1.00 . A A . 26 LEU CB 1 1 11 12888 1 1 26 LEU CD1 C -6.218 -0.916 5.815 1.00 . A A . 26 LEU CD1 1 1 11 12889 1 1 26 LEU CD2 C -8.551 -0.811 6.719 1.00 . A A . 26 LEU CD2 1 1 11 12890 1 1 26 LEU CG C -7.089 -1.115 7.055 1.00 . A A . 26 LEU CG 1 1 11 12891 1 1 26 LEU H H -7.287 -2.288 10.140 1.00 . A A . 26 LEU H 1 1 11 12892 1 1 26 LEU HA H -5.340 -3.664 8.430 1.00 . A A . 26 LEU HA 1 1 11 12893 1 1 26 LEU HB2 H -6.771 -3.218 6.766 1.00 . A A . 26 LEU HB2 1 1 11 12894 1 1 26 LEU HB3 H -7.907 -2.833 8.060 1.00 . A A . 26 LEU HB3 1 1 11 12895 1 1 26 LEU HD11 H -5.486 -1.717 5.715 1.00 . A A . 26 LEU HD11 1 1 11 12896 1 1 26 LEU HD12 H -6.828 -0.907 4.912 1.00 . A A . 26 LEU HD12 1 1 11 12897 1 1 26 LEU HD13 H -5.685 0.032 5.866 1.00 . A A . 26 LEU HD13 1 1 11 12898 1 1 26 LEU HD21 H -8.852 -1.330 5.809 1.00 . A A . 26 LEU HD21 1 1 11 12899 1 1 26 LEU HD22 H -9.215 -1.135 7.520 1.00 . A A . 26 LEU HD22 1 1 11 12900 1 1 26 LEU HD23 H -8.705 0.255 6.558 1.00 . A A . 26 LEU HD23 1 1 11 12901 1 1 26 LEU HG H -6.755 -0.424 7.827 1.00 . A A . 26 LEU HG 1 1 11 12902 1 1 26 LEU N N -6.487 -2.845 9.921 1.00 . A A . 26 LEU N 1 1 11 12903 1 1 26 LEU O O -4.742 -0.923 9.789 1.00 . A A . 26 LEU O 1 1 11 12904 1 1 27 CYS C C -3.464 0.731 6.430 1.00 . A A . 27 CYS C 1 1 11 12905 1 1 27 CYS CA C -3.296 -0.118 7.684 1.00 . A A . 27 CYS CA 1 1 11 12906 1 1 27 CYS CB C -1.840 -0.517 7.881 1.00 . A A . 27 CYS CB 1 1 11 12907 1 1 27 CYS H H -4.288 -1.816 6.791 1.00 . A A . 27 CYS H 1 1 11 12908 1 1 27 CYS HA H -3.612 0.471 8.542 1.00 . A A . 27 CYS HA 1 1 11 12909 1 1 27 CYS HB2 H -1.560 -1.208 7.090 1.00 . A A . 27 CYS HB2 1 1 11 12910 1 1 27 CYS HB3 H -1.200 0.368 7.805 1.00 . A A . 27 CYS HB3 1 1 11 12911 1 1 27 CYS N N -4.161 -1.284 7.628 1.00 . A A . 27 CYS N 1 1 11 12912 1 1 27 CYS O O -3.409 0.266 5.297 1.00 . A A . 27 CYS O 1 1 11 12913 1 1 27 CYS SG S -1.557 -1.295 9.489 1.00 . A A . 27 CYS SG 1 1 11 12914 1 1 28 VAL C C -2.477 3.261 5.063 1.00 . A A . 28 VAL C 1 1 11 12915 1 1 28 VAL CA C -3.832 3.000 5.702 1.00 . A A . 28 VAL CA 1 1 11 12916 1 1 28 VAL CB C -4.369 4.330 6.244 1.00 . A A . 28 VAL CB 1 1 11 12917 1 1 28 VAL CG1 C -5.846 4.518 5.899 1.00 . A A . 28 VAL CG1 1 1 11 12918 1 1 28 VAL CG2 C -4.137 4.487 7.747 1.00 . A A . 28 VAL CG2 1 1 11 12919 1 1 28 VAL H H -3.582 2.263 7.712 1.00 . A A . 28 VAL H 1 1 11 12920 1 1 28 VAL HA H -4.508 2.569 4.964 1.00 . A A . 28 VAL HA 1 1 11 12921 1 1 28 VAL HB H -3.803 5.118 5.745 1.00 . A A . 28 VAL HB 1 1 11 12922 1 1 28 VAL HG11 H -6.007 4.426 4.825 1.00 . A A . 28 VAL HG11 1 1 11 12923 1 1 28 VAL HG12 H -6.461 3.773 6.402 1.00 . A A . 28 VAL HG12 1 1 11 12924 1 1 28 VAL HG13 H -6.191 5.505 6.208 1.00 . A A . 28 VAL HG13 1 1 11 12925 1 1 28 VAL HG21 H -4.636 5.376 8.134 1.00 . A A . 28 VAL HG21 1 1 11 12926 1 1 28 VAL HG22 H -4.515 3.622 8.290 1.00 . A A . 28 VAL HG22 1 1 11 12927 1 1 28 VAL HG23 H -3.071 4.573 7.948 1.00 . A A . 28 VAL HG23 1 1 11 12928 1 1 28 VAL N N -3.673 2.014 6.749 1.00 . A A . 28 VAL N 1 1 11 12929 1 1 28 VAL O O -1.436 2.799 5.515 1.00 . A A . 28 VAL O 1 1 11 12930 1 1 29 CYS C C -2.462 6.414 3.568 1.00 . A A . 29 CYS C 1 1 11 12931 1 1 29 CYS CA C -1.652 5.130 3.827 1.00 . A A . 29 CYS CA 1 1 11 12932 1 1 29 CYS CB C -0.707 4.731 2.684 1.00 . A A . 29 CYS CB 1 1 11 12933 1 1 29 CYS H H -2.934 3.620 3.151 1.00 . A A . 29 CYS H 1 1 11 12934 1 1 29 CYS HA H -1.059 5.164 4.740 1.00 . A A . 29 CYS HA 1 1 11 12935 1 1 29 CYS HB2 H -1.283 4.117 1.998 1.00 . A A . 29 CYS HB2 1 1 11 12936 1 1 29 CYS HB3 H -0.335 5.571 2.097 1.00 . A A . 29 CYS HB3 1 1 11 12937 1 1 29 CYS N N -2.582 4.039 3.977 1.00 . A A . 29 CYS N 1 1 11 12938 1 1 29 CYS O O -3.507 6.650 4.162 1.00 . A A . 29 CYS O 1 1 11 12939 1 1 29 CYS SG S 0.721 3.762 3.267 1.00 . A A . 29 CYS SG 1 1 11 12940 1 1 30 ALA C C -3.874 8.211 1.492 1.00 . A A . 30 ALA C 1 1 11 12941 1 1 30 ALA CA C -2.547 8.447 2.228 1.00 . A A . 30 ALA CA 1 1 11 12942 1 1 30 ALA CB C -1.601 9.174 1.275 1.00 . A A . 30 ALA CB 1 1 11 12943 1 1 30 ALA H H -0.913 7.107 2.610 1.00 . A A . 30 ALA H 1 1 11 12944 1 1 30 ALA HA H -2.672 9.061 3.120 1.00 . A A . 30 ALA HA 1 1 11 12945 1 1 30 ALA HB1 H -1.930 10.200 1.109 1.00 . A A . 30 ALA HB1 1 1 11 12946 1 1 30 ALA HB2 H -0.590 9.202 1.681 1.00 . A A . 30 ALA HB2 1 1 11 12947 1 1 30 ALA HB3 H -1.565 8.670 0.309 1.00 . A A . 30 ALA HB3 1 1 11 12948 1 1 30 ALA N N -1.901 7.214 2.648 1.00 . A A . 30 ALA N 1 1 11 12949 1 1 30 ALA O O -4.249 8.982 0.617 1.00 . A A . 30 ALA O 1 1 11 12950 1 1 31 GLU C C -5.357 6.544 -0.382 1.00 . A A . 31 GLU C 1 1 11 12951 1 1 31 GLU CA C -4.941 6.047 1.014 1.00 . A A . 31 GLU CA 1 1 11 12952 1 1 31 GLU CB C -6.071 5.269 1.706 1.00 . A A . 31 GLU CB 1 1 11 12953 1 1 31 GLU CD C -8.472 4.543 1.733 1.00 . A A . 31 GLU CD 1 1 11 12954 1 1 31 GLU CG C -7.380 5.235 0.915 1.00 . A A . 31 GLU CG 1 1 11 12955 1 1 31 GLU H H -4.730 6.971 2.876 1.00 . A A . 31 GLU H 1 1 11 12956 1 1 31 GLU HA H -4.062 5.409 0.920 1.00 . A A . 31 GLU HA 1 1 11 12957 1 1 31 GLU HB2 H -5.725 4.259 1.907 1.00 . A A . 31 GLU HB2 1 1 11 12958 1 1 31 GLU HB3 H -6.274 5.706 2.683 1.00 . A A . 31 GLU HB3 1 1 11 12959 1 1 31 GLU HG2 H -7.702 6.250 0.681 1.00 . A A . 31 GLU HG2 1 1 11 12960 1 1 31 GLU HG3 H -7.241 4.703 -0.025 1.00 . A A . 31 GLU HG3 1 1 11 12961 1 1 31 GLU N N -4.557 7.127 1.906 1.00 . A A . 31 GLU N 1 1 11 12962 1 1 31 GLU O O -5.734 7.691 -0.588 1.00 . A A . 31 GLU O 1 1 11 12963 1 1 31 GLU OE1 O -8.440 4.644 2.958 1.00 . A A . 31 GLU OE1 1 1 11 12964 1 1 31 GLU OE2 O -9.342 3.912 1.135 1.00 . A A . 31 GLU OE2 1 1 11 12965 1 1 32 GLY C C -3.295 5.004 -2.702 1.00 . A A . 32 GLY C 1 1 11 12966 1 1 32 GLY CA C -4.576 5.833 -2.564 1.00 . A A . 32 GLY CA 1 1 11 12967 1 1 32 GLY H H -5.732 4.693 -1.156 1.00 . A A . 32 GLY H 1 1 11 12968 1 1 32 GLY HA2 H -5.244 5.539 -3.349 1.00 . A A . 32 GLY HA2 1 1 11 12969 1 1 32 GLY HA3 H -4.359 6.903 -2.613 1.00 . A A . 32 GLY HA3 1 1 11 12970 1 1 32 GLY N N -5.290 5.575 -1.317 1.00 . A A . 32 GLY N 1 1 11 12971 1 1 32 GLY O O -2.946 4.455 -3.739 1.00 . A A . 32 GLY O 1 1 11 12972 1 1 33 PHE C C -2.297 3.065 -0.207 1.00 . A A . 33 PHE C 1 1 11 12973 1 1 33 PHE CA C -1.619 4.104 -1.116 1.00 . A A . 33 PHE CA 1 1 11 12974 1 1 33 PHE CB C -0.554 4.983 -0.434 1.00 . A A . 33 PHE CB 1 1 11 12975 1 1 33 PHE CD1 C 0.532 6.487 -2.172 1.00 . A A . 33 PHE CD1 1 1 11 12976 1 1 33 PHE CD2 C 1.750 4.459 -1.399 1.00 . A A . 33 PHE CD2 1 1 11 12977 1 1 33 PHE CE1 C 1.652 6.847 -3.000 1.00 . A A . 33 PHE CE1 1 1 11 12978 1 1 33 PHE CE2 C 2.871 4.815 -2.227 1.00 . A A . 33 PHE CE2 1 1 11 12979 1 1 33 PHE CG C 0.583 5.304 -1.355 1.00 . A A . 33 PHE CG 1 1 11 12980 1 1 33 PHE CZ C 2.824 6.013 -3.024 1.00 . A A . 33 PHE CZ 1 1 11 12981 1 1 33 PHE H H -3.099 5.643 -0.926 1.00 . A A . 33 PHE H 1 1 11 12982 1 1 33 PHE HA H -1.218 3.577 -1.981 1.00 . A A . 33 PHE HA 1 1 11 12983 1 1 33 PHE HB2 H -1.003 5.933 -0.121 1.00 . A A . 33 PHE HB2 1 1 11 12984 1 1 33 PHE HB3 H -0.118 4.523 0.447 1.00 . A A . 33 PHE HB3 1 1 11 12985 1 1 33 PHE HD1 H -0.355 7.103 -2.166 1.00 . A A . 33 PHE HD1 1 1 11 12986 1 1 33 PHE HD2 H 1.787 3.553 -0.811 1.00 . A A . 33 PHE HD2 1 1 11 12987 1 1 33 PHE HE1 H 1.611 7.741 -3.605 1.00 . A A . 33 PHE HE1 1 1 11 12988 1 1 33 PHE HE2 H 3.748 4.186 -2.250 1.00 . A A . 33 PHE HE2 1 1 11 12989 1 1 33 PHE HZ H 3.669 6.288 -3.637 1.00 . A A . 33 PHE HZ 1 1 11 12990 1 1 33 PHE N N -2.644 5.019 -1.547 1.00 . A A . 33 PHE N 1 1 11 12991 1 1 33 PHE O O -2.911 3.386 0.804 1.00 . A A . 33 PHE O 1 1 11 12992 1 1 34 ALA C C -2.565 -0.621 -0.661 1.00 . A A . 34 ALA C 1 1 11 12993 1 1 34 ALA CA C -2.979 0.745 -0.089 1.00 . A A . 34 ALA CA 1 1 11 12994 1 1 34 ALA CB C -4.450 1.007 -0.413 1.00 . A A . 34 ALA CB 1 1 11 12995 1 1 34 ALA H H -1.497 1.597 -1.382 1.00 . A A . 34 ALA H 1 1 11 12996 1 1 34 ALA HA H -2.801 0.762 0.986 1.00 . A A . 34 ALA HA 1 1 11 12997 1 1 34 ALA HB1 H -5.006 0.072 -0.474 1.00 . A A . 34 ALA HB1 1 1 11 12998 1 1 34 ALA HB2 H -4.914 1.630 0.351 1.00 . A A . 34 ALA HB2 1 1 11 12999 1 1 34 ALA HB3 H -4.548 1.517 -1.371 1.00 . A A . 34 ALA HB3 1 1 11 13000 1 1 34 ALA N N -2.161 1.803 -0.664 1.00 . A A . 34 ALA N 1 1 11 13001 1 1 34 ALA O O -2.037 -0.728 -1.759 1.00 . A A . 34 ALA O 1 1 11 13002 1 1 35 PRO C C -1.356 -3.420 -0.845 1.00 . A A . 35 PRO C 1 1 11 13003 1 1 35 PRO CA C -1.895 -2.738 0.416 1.00 . A A . 35 PRO CA 1 1 11 13004 1 1 35 PRO CB C -2.659 -3.747 1.278 1.00 . A A . 35 PRO CB 1 1 11 13005 1 1 35 PRO CD C -4.143 -1.836 0.781 1.00 . A A . 35 PRO CD 1 1 11 13006 1 1 35 PRO CG C -4.058 -3.167 1.532 1.00 . A A . 35 PRO CG 1 1 11 13007 1 1 35 PRO HA H -1.047 -2.338 0.967 1.00 . A A . 35 PRO HA 1 1 11 13008 1 1 35 PRO HB2 H -2.731 -4.706 0.765 1.00 . A A . 35 PRO HB2 1 1 11 13009 1 1 35 PRO HB3 H -2.137 -3.916 2.220 1.00 . A A . 35 PRO HB3 1 1 11 13010 1 1 35 PRO HD2 H -4.929 -1.858 0.026 1.00 . A A . 35 PRO HD2 1 1 11 13011 1 1 35 PRO HD3 H -4.335 -1.007 1.462 1.00 . A A . 35 PRO HD3 1 1 11 13012 1 1 35 PRO HG2 H -4.827 -3.855 1.181 1.00 . A A . 35 PRO HG2 1 1 11 13013 1 1 35 PRO HG3 H -4.219 -3.013 2.599 1.00 . A A . 35 PRO HG3 1 1 11 13014 1 1 35 PRO N N -2.847 -1.668 0.145 1.00 . A A . 35 PRO N 1 1 11 13015 1 1 35 PRO O O -1.975 -4.307 -1.420 1.00 . A A . 35 PRO O 1 1 11 13016 1 1 36 ILE C C 0.621 -5.235 -1.796 1.00 . A A . 36 ILE C 1 1 11 13017 1 1 36 ILE CA C 0.690 -3.724 -2.110 1.00 . A A . 36 ILE CA 1 1 11 13018 1 1 36 ILE CB C 2.093 -3.117 -2.166 1.00 . A A . 36 ILE CB 1 1 11 13019 1 1 36 ILE CD1 C 4.103 -4.400 -1.446 1.00 . A A . 36 ILE CD1 1 1 11 13020 1 1 36 ILE CG1 C 3.158 -4.121 -2.588 1.00 . A A . 36 ILE CG1 1 1 11 13021 1 1 36 ILE CG2 C 2.468 -2.337 -0.897 1.00 . A A . 36 ILE CG2 1 1 11 13022 1 1 36 ILE H H 0.090 -1.987 -1.019 1.00 . A A . 36 ILE H 1 1 11 13023 1 1 36 ILE HA H 0.292 -3.586 -3.107 1.00 . A A . 36 ILE HA 1 1 11 13024 1 1 36 ILE HB H 2.061 -2.397 -2.976 1.00 . A A . 36 ILE HB 1 1 11 13025 1 1 36 ILE HD11 H 4.570 -5.373 -1.567 1.00 . A A . 36 ILE HD11 1 1 11 13026 1 1 36 ILE HD12 H 4.860 -3.625 -1.385 1.00 . A A . 36 ILE HD12 1 1 11 13027 1 1 36 ILE HD13 H 3.539 -4.365 -0.523 1.00 . A A . 36 ILE HD13 1 1 11 13028 1 1 36 ILE HG12 H 2.706 -5.045 -2.941 1.00 . A A . 36 ILE HG12 1 1 11 13029 1 1 36 ILE HG13 H 3.733 -3.718 -3.416 1.00 . A A . 36 ILE HG13 1 1 11 13030 1 1 36 ILE HG21 H 3.500 -1.986 -0.928 1.00 . A A . 36 ILE HG21 1 1 11 13031 1 1 36 ILE HG22 H 1.817 -1.487 -0.761 1.00 . A A . 36 ILE HG22 1 1 11 13032 1 1 36 ILE HG23 H 2.349 -2.926 0.005 1.00 . A A . 36 ILE HG23 1 1 11 13033 1 1 36 ILE N N -0.156 -2.938 -1.222 1.00 . A A . 36 ILE N 1 1 11 13034 1 1 36 ILE O O -0.049 -5.995 -2.485 1.00 . A A . 36 ILE O 1 1 11 13035 1 1 37 PRO C C 1.767 -8.035 -0.740 1.00 . A A . 37 PRO C 1 1 11 13036 1 1 37 PRO CA C 2.394 -6.642 -0.789 1.00 . A A . 37 PRO CA 1 1 11 13037 1 1 37 PRO CB C 3.233 -6.416 0.478 1.00 . A A . 37 PRO CB 1 1 11 13038 1 1 37 PRO CD C 1.112 -5.126 0.604 1.00 . A A . 37 PRO CD 1 1 11 13039 1 1 37 PRO CG C 2.407 -5.444 1.355 1.00 . A A . 37 PRO CG 1 1 11 13040 1 1 37 PRO HA H 2.983 -6.551 -1.699 1.00 . A A . 37 PRO HA 1 1 11 13041 1 1 37 PRO HB2 H 3.493 -7.348 0.960 1.00 . A A . 37 PRO HB2 1 1 11 13042 1 1 37 PRO HB3 H 4.217 -6.006 0.265 1.00 . A A . 37 PRO HB3 1 1 11 13043 1 1 37 PRO HD2 H 0.265 -5.654 1.038 1.00 . A A . 37 PRO HD2 1 1 11 13044 1 1 37 PRO HD3 H 0.866 -4.067 0.591 1.00 . A A . 37 PRO HD3 1 1 11 13045 1 1 37 PRO HG2 H 2.162 -5.858 2.329 1.00 . A A . 37 PRO HG2 1 1 11 13046 1 1 37 PRO HG3 H 2.961 -4.519 1.504 1.00 . A A . 37 PRO HG3 1 1 11 13047 1 1 37 PRO N N 1.346 -5.632 -0.728 1.00 . A A . 37 PRO N 1 1 11 13048 1 1 37 PRO O O 0.566 -8.212 -0.902 1.00 . A A . 37 PRO O 1 1 11 13049 1 1 38 HIS C C 1.503 -9.450 1.645 1.00 . A A . 38 HIS C 1 1 11 13050 1 1 38 HIS CA C 2.687 -9.765 0.742 1.00 . A A . 38 HIS CA 1 1 11 13051 1 1 38 HIS CB C 4.006 -9.604 1.520 1.00 . A A . 38 HIS CB 1 1 11 13052 1 1 38 HIS CD2 C 6.355 -8.702 1.053 1.00 . A A . 38 HIS CD2 1 1 11 13053 1 1 38 HIS CE1 C 6.568 -9.183 -1.115 1.00 . A A . 38 HIS CE1 1 1 11 13054 1 1 38 HIS CG C 5.215 -9.305 0.673 1.00 . A A . 38 HIS CG 1 1 11 13055 1 1 38 HIS H H 3.352 -9.213 -1.207 1.00 . A A . 38 HIS H 1 1 11 13056 1 1 38 HIS HA H 2.549 -10.778 0.440 1.00 . A A . 38 HIS HA 1 1 11 13057 1 1 38 HIS HB2 H 3.890 -8.809 2.265 1.00 . A A . 38 HIS HB2 1 1 11 13058 1 1 38 HIS HB3 H 4.196 -10.535 2.062 1.00 . A A . 38 HIS HB3 1 1 11 13059 1 1 38 HIS HD1 H 4.657 -10.083 -1.308 1.00 . A A . 38 HIS HD1 1 1 11 13060 1 1 38 HIS HD2 H 6.567 -8.338 2.041 1.00 . A A . 38 HIS HD2 1 1 11 13061 1 1 38 HIS HE1 H 6.928 -9.206 -2.141 1.00 . A A . 38 HIS HE1 1 1 11 13062 1 1 38 HIS N N 2.670 -9.005 -0.506 1.00 . A A . 38 HIS N 1 1 11 13063 1 1 38 HIS ND1 N 5.354 -9.627 -0.753 1.00 . A A . 38 HIS ND1 1 1 11 13064 1 1 38 HIS NE2 N 7.259 -8.624 -0.107 1.00 . A A . 38 HIS NE2 1 1 11 13065 1 1 38 HIS O O 0.609 -10.248 1.898 1.00 . A A . 38 HIS O 1 1 11 13066 1 1 39 GLU C C 0.342 -7.077 3.847 1.00 . A A . 39 GLU C 1 1 11 13067 1 1 39 GLU CA C 1.545 -7.964 3.523 1.00 . A A . 39 GLU CA 1 1 11 13068 1 1 39 GLU CB C 2.846 -7.324 4.027 1.00 . A A . 39 GLU CB 1 1 11 13069 1 1 39 GLU CD C 3.879 -7.729 6.286 1.00 . A A . 39 GLU CD 1 1 11 13070 1 1 39 GLU CG C 3.643 -8.300 4.886 1.00 . A A . 39 GLU CG 1 1 11 13071 1 1 39 GLU H H 2.082 -7.671 1.394 1.00 . A A . 39 GLU H 1 1 11 13072 1 1 39 GLU HA H 1.402 -8.940 3.981 1.00 . A A . 39 GLU HA 1 1 11 13073 1 1 39 GLU HB2 H 3.479 -7.034 3.185 1.00 . A A . 39 GLU HB2 1 1 11 13074 1 1 39 GLU HB3 H 2.615 -6.426 4.608 1.00 . A A . 39 GLU HB3 1 1 11 13075 1 1 39 GLU HG2 H 3.100 -9.235 4.974 1.00 . A A . 39 GLU HG2 1 1 11 13076 1 1 39 GLU HG3 H 4.599 -8.519 4.414 1.00 . A A . 39 GLU HG3 1 1 11 13077 1 1 39 GLU N N 1.613 -8.206 2.093 1.00 . A A . 39 GLU N 1 1 11 13078 1 1 39 GLU O O -0.026 -6.182 3.098 1.00 . A A . 39 GLU O 1 1 11 13079 1 1 39 GLU OE1 O 2.903 -7.469 6.989 1.00 . A A . 39 GLU OE1 1 1 11 13080 1 1 39 GLU OE2 O 5.038 -7.548 6.658 1.00 . A A . 39 GLU OE2 1 1 11 13081 1 1 40 PRO C C 0.075 -5.338 6.355 1.00 . A A . 40 PRO C 1 1 11 13082 1 1 40 PRO CA C -0.922 -6.364 5.817 1.00 . A A . 40 PRO CA 1 1 11 13083 1 1 40 PRO CB C -1.567 -7.125 6.979 1.00 . A A . 40 PRO CB 1 1 11 13084 1 1 40 PRO CD C -0.312 -8.719 5.571 1.00 . A A . 40 PRO CD 1 1 11 13085 1 1 40 PRO CG C -1.189 -8.606 6.821 1.00 . A A . 40 PRO CG 1 1 11 13086 1 1 40 PRO HA H -1.675 -5.858 5.212 1.00 . A A . 40 PRO HA 1 1 11 13087 1 1 40 PRO HB2 H -1.207 -6.739 7.932 1.00 . A A . 40 PRO HB2 1 1 11 13088 1 1 40 PRO HB3 H -2.649 -7.001 6.960 1.00 . A A . 40 PRO HB3 1 1 11 13089 1 1 40 PRO HD2 H 0.689 -9.064 5.831 1.00 . A A . 40 PRO HD2 1 1 11 13090 1 1 40 PRO HD3 H -0.741 -9.405 4.840 1.00 . A A . 40 PRO HD3 1 1 11 13091 1 1 40 PRO HG2 H -0.649 -8.959 7.699 1.00 . A A . 40 PRO HG2 1 1 11 13092 1 1 40 PRO HG3 H -2.084 -9.219 6.717 1.00 . A A . 40 PRO HG3 1 1 11 13093 1 1 40 PRO N N -0.252 -7.375 5.021 1.00 . A A . 40 PRO N 1 1 11 13094 1 1 40 PRO O O 0.612 -5.477 7.447 1.00 . A A . 40 PRO O 1 1 11 13095 1 1 41 HIS C C 0.109 -1.901 5.007 1.00 . A A . 41 HIS C 1 1 11 13096 1 1 41 HIS CA C 0.146 -2.976 6.091 1.00 . A A . 41 HIS CA 1 1 11 13097 1 1 41 HIS CB C 1.264 -2.699 7.111 1.00 . A A . 41 HIS CB 1 1 11 13098 1 1 41 HIS CD2 C 3.801 -2.626 6.794 1.00 . A A . 41 HIS CD2 1 1 11 13099 1 1 41 HIS CE1 C 4.209 -4.694 6.055 1.00 . A A . 41 HIS CE1 1 1 11 13100 1 1 41 HIS CG C 2.616 -3.262 6.748 1.00 . A A . 41 HIS CG 1 1 11 13101 1 1 41 HIS H H 0.768 -4.441 4.645 1.00 . A A . 41 HIS H 1 1 11 13102 1 1 41 HIS HA H -0.817 -2.978 6.562 1.00 . A A . 41 HIS HA 1 1 11 13103 1 1 41 HIS HB2 H 1.356 -1.618 7.232 1.00 . A A . 41 HIS HB2 1 1 11 13104 1 1 41 HIS HB3 H 0.965 -3.107 8.080 1.00 . A A . 41 HIS HB3 1 1 11 13105 1 1 41 HIS HD1 H 2.184 -5.277 5.986 1.00 . A A . 41 HIS HD1 1 1 11 13106 1 1 41 HIS HD2 H 3.949 -1.613 7.118 1.00 . A A . 41 HIS HD2 1 1 11 13107 1 1 41 HIS HE1 H 4.695 -5.574 5.637 1.00 . A A . 41 HIS HE1 1 1 11 13108 1 1 41 HIS N N 0.291 -4.306 5.518 1.00 . A A . 41 HIS N 1 1 11 13109 1 1 41 HIS ND1 N 2.889 -4.629 6.276 1.00 . A A . 41 HIS ND1 1 1 11 13110 1 1 41 HIS NE2 N 4.854 -3.548 6.333 1.00 . A A . 41 HIS NE2 1 1 11 13111 1 1 41 HIS O O -0.756 -1.037 4.926 1.00 . A A . 41 HIS O 1 1 11 13112 1 1 42 ARG C C 0.536 -0.620 2.319 1.00 . A A . 42 ARG C 1 1 11 13113 1 1 42 ARG CA C 1.631 -1.092 3.263 1.00 . A A . 42 ARG CA 1 1 11 13114 1 1 42 ARG CB C 2.733 -1.741 2.432 1.00 . A A . 42 ARG CB 1 1 11 13115 1 1 42 ARG CD C 4.551 -3.449 2.858 1.00 . A A . 42 ARG CD 1 1 11 13116 1 1 42 ARG CG C 3.889 -2.155 3.324 1.00 . A A . 42 ARG CG 1 1 11 13117 1 1 42 ARG CZ C 6.833 -4.190 2.724 1.00 . A A . 42 ARG CZ 1 1 11 13118 1 1 42 ARG H H 1.629 -2.902 4.481 1.00 . A A . 42 ARG H 1 1 11 13119 1 1 42 ARG HA H 2.009 -0.252 3.847 1.00 . A A . 42 ARG HA 1 1 11 13120 1 1 42 ARG HB2 H 2.286 -2.596 1.949 1.00 . A A . 42 ARG HB2 1 1 11 13121 1 1 42 ARG HB3 H 3.078 -1.114 1.610 1.00 . A A . 42 ARG HB3 1 1 11 13122 1 1 42 ARG HD2 H 3.985 -4.320 3.178 1.00 . A A . 42 ARG HD2 1 1 11 13123 1 1 42 ARG HD3 H 4.665 -3.481 1.775 1.00 . A A . 42 ARG HD3 1 1 11 13124 1 1 42 ARG HE H 6.081 -3.172 4.331 1.00 . A A . 42 ARG HE 1 1 11 13125 1 1 42 ARG HG2 H 4.626 -1.357 3.345 1.00 . A A . 42 ARG HG2 1 1 11 13126 1 1 42 ARG HG3 H 3.493 -2.263 4.334 1.00 . A A . 42 ARG HG3 1 1 11 13127 1 1 42 ARG HH11 H 5.632 -4.927 1.270 1.00 . A A . 42 ARG HH11 1 1 11 13128 1 1 42 ARG HH12 H 7.106 -5.800 1.527 1.00 . A A . 42 ARG HH12 1 1 11 13129 1 1 42 ARG HH21 H 8.544 -3.108 2.681 1.00 . A A . 42 ARG HH21 1 1 11 13130 1 1 42 ARG HH22 H 8.651 -4.632 3.496 1.00 . A A . 42 ARG HH22 1 1 11 13131 1 1 42 ARG N N 1.147 -2.077 4.202 1.00 . A A . 42 ARG N 1 1 11 13132 1 1 42 ARG NE N 5.878 -3.562 3.433 1.00 . A A . 42 ARG NE 1 1 11 13133 1 1 42 ARG NH1 N 6.496 -5.043 1.761 1.00 . A A . 42 ARG NH1 1 1 11 13134 1 1 42 ARG NH2 N 8.116 -3.957 2.989 1.00 . A A . 42 ARG NH2 1 1 11 13135 1 1 42 ARG O O -0.654 -0.864 2.474 1.00 . A A . 42 ARG O 1 1 11 13136 1 1 43 CYS C C 0.745 0.603 -1.059 1.00 . A A . 43 CYS C 1 1 11 13137 1 1 43 CYS CA C 0.262 0.764 0.375 1.00 . A A . 43 CYS CA 1 1 11 13138 1 1 43 CYS CB C 0.209 2.228 0.715 1.00 . A A . 43 CYS CB 1 1 11 13139 1 1 43 CYS H H 1.917 0.519 1.748 1.00 . A A . 43 CYS H 1 1 11 13140 1 1 43 CYS HA H -0.714 0.353 0.491 1.00 . A A . 43 CYS HA 1 1 11 13141 1 1 43 CYS HB2 H 0.065 2.737 -0.233 1.00 . A A . 43 CYS HB2 1 1 11 13142 1 1 43 CYS HB3 H -0.646 2.341 1.364 1.00 . A A . 43 CYS HB3 1 1 11 13143 1 1 43 CYS N N 1.096 0.121 1.356 1.00 . A A . 43 CYS N 1 1 11 13144 1 1 43 CYS O O 0.015 0.311 -1.997 1.00 . A A . 43 CYS O 1 1 11 13145 1 1 43 CYS SG S 1.607 2.959 1.597 1.00 . A A . 43 CYS SG 1 1 11 13146 1 1 44 GLN C C 1.833 1.393 -3.507 1.00 . A A . 44 GLN C 1 1 11 13147 1 1 44 GLN CA C 2.778 1.166 -2.323 1.00 . A A . 44 GLN CA 1 1 11 13148 1 1 44 GLN CB C 3.782 0.065 -2.633 1.00 . A A . 44 GLN CB 1 1 11 13149 1 1 44 GLN CD C 4.779 -1.145 -4.571 1.00 . A A . 44 GLN CD 1 1 11 13150 1 1 44 GLN CG C 4.461 0.235 -3.993 1.00 . A A . 44 GLN CG 1 1 11 13151 1 1 44 GLN H H 2.403 0.784 -0.176 1.00 . A A . 44 GLN H 1 1 11 13152 1 1 44 GLN HA H 3.309 2.090 -2.114 1.00 . A A . 44 GLN HA 1 1 11 13153 1 1 44 GLN HB2 H 4.537 0.050 -1.854 1.00 . A A . 44 GLN HB2 1 1 11 13154 1 1 44 GLN HB3 H 3.280 -0.894 -2.582 1.00 . A A . 44 GLN HB3 1 1 11 13155 1 1 44 GLN HE21 H 2.812 -1.364 -5.034 1.00 . A A . 44 GLN HE21 1 1 11 13156 1 1 44 GLN HE22 H 3.737 -2.854 -4.945 1.00 . A A . 44 GLN HE22 1 1 11 13157 1 1 44 GLN HG2 H 3.821 0.774 -4.692 1.00 . A A . 44 GLN HG2 1 1 11 13158 1 1 44 GLN HG3 H 5.388 0.799 -3.892 1.00 . A A . 44 GLN HG3 1 1 11 13159 1 1 44 GLN N N 2.053 0.835 -1.107 1.00 . A A . 44 GLN N 1 1 11 13160 1 1 44 GLN NE2 N 3.676 -1.852 -4.875 1.00 . A A . 44 GLN NE2 1 1 11 13161 1 1 44 GLN O O 1.162 0.494 -4.000 1.00 . A A . 44 GLN O 1 1 11 13162 1 1 44 GLN OE1 O 5.931 -1.534 -4.725 1.00 . A A . 44 GLN OE1 1 1 11 13163 1 1 45 MET C C -0.350 2.339 -4.971 1.00 . A A . 45 MET C 1 1 11 13164 1 1 45 MET CA C 0.636 3.337 -4.358 1.00 . A A . 45 MET CA 1 1 11 13165 1 1 45 MET CB C 0.960 4.387 -5.425 1.00 . A A . 45 MET CB 1 1 11 13166 1 1 45 MET CE C 2.457 3.041 -9.049 1.00 . A A . 45 MET CE 1 1 11 13167 1 1 45 MET CG C 1.928 3.867 -6.493 1.00 . A A . 45 MET CG 1 1 11 13168 1 1 45 MET H H 2.749 3.125 -3.866 1.00 . A A . 45 MET H 1 1 11 13169 1 1 45 MET HA H 0.195 3.792 -3.471 1.00 . A A . 45 MET HA 1 1 11 13170 1 1 45 MET HB2 H 0.034 4.701 -5.909 1.00 . A A . 45 MET HB2 1 1 11 13171 1 1 45 MET HB3 H 1.377 5.278 -4.959 1.00 . A A . 45 MET HB3 1 1 11 13172 1 1 45 MET HE1 H 2.366 1.961 -8.934 1.00 . A A . 45 MET HE1 1 1 11 13173 1 1 45 MET HE2 H 2.374 3.283 -10.109 1.00 . A A . 45 MET HE2 1 1 11 13174 1 1 45 MET HE3 H 3.440 3.352 -8.696 1.00 . A A . 45 MET HE3 1 1 11 13175 1 1 45 MET HG2 H 2.818 4.492 -6.524 1.00 . A A . 45 MET HG2 1 1 11 13176 1 1 45 MET HG3 H 2.258 2.856 -6.262 1.00 . A A . 45 MET HG3 1 1 11 13177 1 1 45 MET N N 1.860 2.669 -3.928 1.00 . A A . 45 MET N 1 1 11 13178 1 1 45 MET O O -0.113 1.838 -6.063 1.00 . A A . 45 MET O 1 1 11 13179 1 1 45 MET SD S 1.161 3.878 -8.120 1.00 . A A . 45 MET SD 1 1 11 13180 1 1 46 PHE C C -2.127 0.337 -5.802 1.00 . A A . 46 PHE C 1 1 11 13181 1 1 46 PHE CA C -2.336 0.975 -4.413 1.00 . A A . 46 PHE CA 1 1 11 13182 1 1 46 PHE CB C -3.767 1.439 -4.058 1.00 . A A . 46 PHE CB 1 1 11 13183 1 1 46 PHE CD1 C -5.314 0.178 -5.665 1.00 . A A . 46 PHE CD1 1 1 11 13184 1 1 46 PHE CD2 C -5.207 2.661 -5.767 1.00 . A A . 46 PHE CD2 1 1 11 13185 1 1 46 PHE CE1 C -6.281 0.175 -6.730 1.00 . A A . 46 PHE CE1 1 1 11 13186 1 1 46 PHE CE2 C -6.172 2.662 -6.834 1.00 . A A . 46 PHE CE2 1 1 11 13187 1 1 46 PHE CG C -4.773 1.420 -5.175 1.00 . A A . 46 PHE CG 1 1 11 13188 1 1 46 PHE CZ C -6.710 1.418 -7.313 1.00 . A A . 46 PHE CZ 1 1 11 13189 1 1 46 PHE H H -1.742 2.706 -3.452 1.00 . A A . 46 PHE H 1 1 11 13190 1 1 46 PHE HA H -2.002 0.241 -3.676 1.00 . A A . 46 PHE HA 1 1 11 13191 1 1 46 PHE HB2 H -4.143 0.854 -3.225 1.00 . A A . 46 PHE HB2 1 1 11 13192 1 1 46 PHE HB3 H -3.732 2.458 -3.679 1.00 . A A . 46 PHE HB3 1 1 11 13193 1 1 46 PHE HD1 H -4.995 -0.761 -5.242 1.00 . A A . 46 PHE HD1 1 1 11 13194 1 1 46 PHE HD2 H -4.804 3.596 -5.407 1.00 . A A . 46 PHE HD2 1 1 11 13195 1 1 46 PHE HE1 H -6.681 -0.761 -7.093 1.00 . A A . 46 PHE HE1 1 1 11 13196 1 1 46 PHE HE2 H -6.491 3.596 -7.272 1.00 . A A . 46 PHE HE2 1 1 11 13197 1 1 46 PHE HZ H -7.437 1.415 -8.111 1.00 . A A . 46 PHE HZ 1 1 11 13198 1 1 46 PHE N N -1.453 2.114 -4.210 1.00 . A A . 46 PHE N 1 1 11 13199 1 1 46 PHE O O -2.817 0.594 -6.780 1.00 . A A . 46 PHE O 1 1 11 13200 1 1 47 CYS C C -0.655 -1.931 -7.723 1.30 . A A . 47 CYS C 1 1 11 13201 1 1 47 CYS CA C -0.302 -0.611 -7.035 0.80 . A A . 47 CYS CA 1 1 11 13202 1 1 47 CYS CB C 1.199 -0.538 -6.743 0.60 . A A . 47 CYS CB 1 1 11 13203 1 1 47 CYS H H -0.819 -1.016 -4.991 1.00 . A A . 47 CYS H 1 1 11 13204 1 1 47 CYS HA H -0.599 0.224 -7.671 1.10 . A A . 47 CYS HA 1 1 11 13205 1 1 47 CYS HB2 H 1.517 0.504 -6.697 0.90 . A A . 47 CYS HB2 1 1 11 13206 1 1 47 CYS HB3 H 1.421 -0.975 -5.770 0.90 . A A . 47 CYS HB3 1 1 11 13207 1 1 47 CYS N N -1.069 -0.496 -5.808 0.60 . A A . 47 CYS N 1 1 11 13208 1 1 47 CYS O O 0.115 -2.884 -7.738 1.90 . A A . 47 CYS O 1 1 11 13209 1 1 47 CYS SG S 2.189 -1.381 -8.000 1.30 . A A . 47 CYS SG 1 1 11 13210 1 1 48 ASN C C -2.539 -4.012 -7.225 1.90 . A A . 48 ASN C 1 1 11 13211 1 1 48 ASN CA C -2.962 -2.587 -7.592 2.30 . A A . 48 ASN CA 1 1 11 13212 1 1 48 ASN CB C -4.199 -2.609 -8.492 3.00 . A A . 48 ASN CB 1 1 11 13213 1 1 48 ASN CG C -5.208 -3.647 -7.992 3.70 . A A . 48 ASN CG 1 1 11 13214 1 1 48 ASN H H -2.038 -1.434 -9.144 2.00 . A A . 48 ASN H 1 1 11 13215 1 1 48 ASN HA H -3.149 -2.021 -6.679 2.70 . A A . 48 ASN HA 1 1 11 13216 1 1 48 ASN HB2 H -4.679 -1.630 -8.506 3.30 . A A . 48 ASN HB2 1 1 11 13217 1 1 48 ASN HB3 H -3.920 -2.853 -9.517 3.20 . A A . 48 ASN HB3 1 1 11 13218 1 1 48 ASN HD21 H -5.846 -2.613 -6.344 1.00 . A A . 48 ASN HD21 1 1 11 13219 1 1 48 ASN N N -1.878 -1.915 -8.283 1.70 . A A . 48 ASN N 1 1 11 13220 1 1 48 ASN ND2 N -5.519 -3.492 -6.692 4.10 . A A . 48 ASN ND2 1 1 11 13221 1 1 48 ASN O O -2.076 -4.289 -6.125 2.30 . A A . 48 ASN O 1 1 11 13222 1 1 48 ASN OD1 O -5.663 -4.514 -8.728 4.40 . A A . 48 ASN OD1 1 1 11 13223 1 1 49 GLN C C -2.179 -5.714 -10.450 1.80 . A A . 49 GLN C 1 1 11 13224 1 1 49 GLN CA C -1.638 -5.132 -9.143 2.00 . A A . 49 GLN CA 1 1 11 13225 1 1 49 GLN CB C -0.636 -6.098 -8.508 2.20 . A A . 49 GLN CB 1 1 11 13226 1 1 49 GLN CD C -2.349 -7.768 -7.771 3.40 . A A . 49 GLN CD 1 1 11 13227 1 1 49 GLN CG C -1.095 -7.553 -8.620 2.70 . A A . 49 GLN CG 1 1 11 13228 1 1 49 GLN H H -3.611 -5.359 -8.333 2.50 . A A . 49 GLN H 1 1 11 13229 1 1 49 GLN HA H -1.180 -4.163 -9.340 2.50 . A A . 49 GLN HA 1 1 11 13230 1 1 49 GLN HB2 H 0.335 -5.983 -8.989 2.60 . A A . 49 GLN HB2 1 1 11 13231 1 1 49 GLN HB3 H -0.495 -5.840 -7.458 2.10 . A A . 49 GLN HB3 1 1 11 13232 1 1 49 GLN HE21 H -1.672 -6.816 -6.104 4.10 . A A . 49 GLN HE21 1 1 11 13233 1 1 49 GLN HE22 H -2.395 -8.391 -5.835 4.50 . A A . 49 GLN HE22 1 1 11 13234 1 1 49 GLN HG2 H -1.320 -7.809 -9.656 2.70 . A A . 49 GLN HG2 1 1 11 13235 1 1 49 GLN HG3 H -0.313 -8.229 -8.275 2.80 . A A . 49 GLN HG3 1 1 11 13236 1 1 49 GLN N N -2.734 -4.890 -8.225 2.00 . A A . 49 GLN N 1 1 11 13237 1 1 49 GLN NE2 N -2.117 -7.647 -6.451 4.00 . A A . 49 GLN NE2 1 1 11 13238 1 1 49 GLN O O -2.977 -6.644 -10.464 2.20 . A A . 49 GLN O 1 1 11 13239 1 1 49 GLN OE1 O -3.436 -8.022 -8.275 3.70 . A A . 49 GLN OE1 1 1 11 13240 1 1 50 THR C C -0.219 -5.838 -13.340 1.50 . A A . 50 THR C 1 1 11 13241 1 1 50 THR CA C -1.647 -5.841 -12.786 1.80 . A A . 50 THR CA 1 1 11 13242 1 1 50 THR CB C -2.615 -5.206 -13.785 1.90 . A A . 50 THR CB 1 1 11 13243 1 1 50 THR CG2 C -2.383 -5.708 -15.210 2.30 . A A . 50 THR CG2 1 1 11 13244 1 1 50 THR H H -1.366 -4.154 -11.501 2.00 . A A . 50 THR H 1 1 11 13245 1 1 50 THR HA H -1.942 -6.864 -12.549 2.10 . A A . 50 THR HA 1 1 11 13246 1 1 50 THR HB H -2.500 -4.122 -13.760 2.20 . A A . 50 THR HB 1 1 11 13247 1 1 50 THR HG1 H -4.495 -4.893 -13.874 2.50 . A A . 50 THR HG1 1 1 11 13248 1 1 50 THR HG21 H -1.736 -5.025 -15.760 2.40 . A A . 50 THR HG21 1 1 11 13249 1 1 50 THR HG22 H -3.325 -5.789 -15.751 2.60 . A A . 50 THR HG22 1 1 11 13250 1 1 50 THR HG23 H -1.910 -6.690 -15.204 2.80 . A A . 50 THR HG23 1 1 11 13251 1 1 50 THR N N -1.687 -5.100 -11.541 1.70 . A A . 50 THR N 1 1 11 13252 1 1 50 THR O O 0.023 -5.555 -14.507 2.20 . A A . 50 THR O 1 1 11 13253 1 1 50 THR OG1 O -3.936 -5.491 -13.398 2.20 . A A . 50 THR OG1 1 1 11 13254 1 1 51 ALA C C 1.610 -3.888 -12.515 0.60 . A A . 51 ALA C 1 1 11 13255 1 1 51 ALA CA C 1.904 -5.369 -12.258 0.60 . A A . 51 ALA CA 1 1 11 13256 1 1 51 ALA CB C 3.002 -5.853 -13.206 0.70 . A A . 51 ALA CB 1 1 11 13257 1 1 51 ALA H H 0.576 -6.997 -11.862 0.90 . A A . 51 ALA H 1 1 11 13258 1 1 51 ALA HA H 2.211 -5.489 -11.219 0.70 . A A . 51 ALA HA 1 1 11 13259 1 1 51 ALA HB1 H 2.799 -5.537 -14.230 1.20 . A A . 51 ALA HB1 1 1 11 13260 1 1 51 ALA HB2 H 3.078 -6.940 -13.193 1.00 . A A . 51 ALA HB2 1 1 11 13261 1 1 51 ALA HB3 H 3.969 -5.444 -12.915 1.30 . A A . 51 ALA HB3 1 1 11 13262 1 1 51 ALA N N 0.703 -6.175 -12.418 0.80 . A A . 51 ALA N 1 1 11 13263 1 1 51 ALA O O 0.861 -3.516 -13.409 1.10 . A A . 51 ALA O 1 1 11 13264 1 1 52 CYS C C 3.271 -1.552 -13.279 0.80 . A A . 52 CYS C 1 1 11 13265 1 1 52 CYS CA C 2.408 -1.682 -12.021 0.80 . A A . 52 CYS CA 1 1 11 13266 1 1 52 CYS CB C 3.034 -0.926 -10.851 0.90 . A A . 52 CYS CB 1 1 11 13267 1 1 52 CYS H H 2.645 -3.433 -10.810 0.90 . A A . 52 CYS H 1 1 11 13268 1 1 52 CYS HA H 1.406 -1.311 -12.228 0.80 . A A . 52 CYS HA 1 1 11 13269 1 1 52 CYS HB2 H 3.715 -1.586 -10.317 1.00 . A A . 52 CYS HB2 1 1 11 13270 1 1 52 CYS HB3 H 3.625 -0.090 -11.219 1.10 . A A . 52 CYS HB3 1 1 11 13271 1 1 52 CYS N N 2.265 -3.079 -11.665 0.70 . A A . 52 CYS N 1 1 11 13272 1 1 52 CYS O O 2.779 -1.416 -14.392 1.20 . A A . 52 CYS O 1 1 11 13273 1 1 52 CYS SG S 1.802 -0.298 -9.685 1.00 . A A . 52 CYS SG 1 1 11 13274 1 1 53 PRO C C 5.537 0.102 -14.566 0.80 . A A . 53 PRO C 1 1 11 13275 1 1 53 PRO CA C 5.459 -0.439 -13.139 0.70 . A A . 53 PRO CA 1 1 11 13276 1 1 53 PRO CB C 6.843 -0.912 -12.692 0.90 . A A . 53 PRO CB 1 1 11 13277 1 1 53 PRO CD C 5.266 -2.811 -12.580 0.80 . A A . 53 PRO CD 1 1 11 13278 1 1 53 PRO CG C 6.715 -2.394 -12.314 0.90 . A A . 53 PRO CG 1 1 11 13279 1 1 53 PRO HA H 5.091 0.349 -12.484 0.80 . A A . 53 PRO HA 1 1 11 13280 1 1 53 PRO HB2 H 7.567 -0.784 -13.498 1.00 . A A . 53 PRO HB2 1 1 11 13281 1 1 53 PRO HB3 H 7.191 -0.328 -11.840 1.10 . A A . 53 PRO HB3 1 1 11 13282 1 1 53 PRO HD2 H 5.207 -3.578 -13.352 0.80 . A A . 53 PRO HD2 1 1 11 13283 1 1 53 PRO HD3 H 4.790 -3.190 -11.675 0.90 . A A . 53 PRO HD3 1 1 11 13284 1 1 53 PRO HG2 H 7.405 -2.999 -12.902 0.90 . A A . 53 PRO HG2 1 1 11 13285 1 1 53 PRO HG3 H 6.961 -2.536 -11.263 1.00 . A A . 53 PRO HG3 1 1 11 13286 1 1 53 PRO N N 4.596 -1.602 -13.026 0.60 . A A . 53 PRO N 1 1 11 13287 1 1 53 PRO O O 5.309 -0.604 -15.541 1.60 . A A . 53 PRO O 1 1 11 13288 1 1 54 ALA C C 5.776 1.629 -17.039 0.90 . A A . 54 ALA C 1 1 11 13289 1 1 54 ALA CA C 5.362 2.215 -15.691 0.80 . A A . 54 ALA CA 1 1 11 13290 1 1 54 ALA CB C 5.906 3.639 -15.585 0.80 . A A . 54 ALA CB 1 1 11 13291 1 1 54 ALA H H 6.136 1.843 -13.741 1.40 . A A . 54 ALA H 1 1 11 13292 1 1 54 ALA HA H 4.277 2.239 -15.590 0.70 . A A . 54 ALA HA 1 1 11 13293 1 1 54 ALA HB1 H 5.941 4.101 -16.571 1.20 . A A . 54 ALA HB1 1 1 11 13294 1 1 54 ALA HB2 H 6.914 3.649 -15.173 1.40 . A A . 54 ALA HB2 1 1 11 13295 1 1 54 ALA HB3 H 5.272 4.253 -14.947 1.30 . A A . 54 ALA HB3 1 1 11 13296 1 1 54 ALA N N 5.866 1.407 -14.597 0.80 . A A . 54 ALA N 1 1 11 13297 1 1 54 ALA O O 6.454 0.614 -17.140 1.50 . A A . 54 ALA O 1 1 11 13298 1 1 55 ASP C C 5.576 4.332 -19.477 1.10 . A A . 55 ASP C 1 1 11 13299 1 1 55 ASP CA C 6.261 3.090 -18.892 1.20 . A A . 55 ASP CA 1 1 11 13300 1 1 55 ASP CB C 6.668 2.158 -20.017 1.40 . A A . 55 ASP CB 1 1 11 13301 1 1 55 ASP CG C 8.063 2.515 -20.535 2.10 . A A . 55 ASP CG 1 1 11 13302 1 1 55 ASP H H 4.362 2.557 -18.236 1.40 . A A . 55 ASP H 1 1 11 13303 1 1 55 ASP HA H 7.104 3.377 -18.262 1.30 . A A . 55 ASP HA 1 1 11 13304 1 1 55 ASP HB2 H 6.648 1.130 -19.660 1.50 . A A . 55 ASP HB2 1 1 11 13305 1 1 55 ASP HB3 H 5.937 2.244 -20.816 1.80 . A A . 55 ASP HB3 1 1 11 13306 1 1 55 ASP N N 5.325 2.369 -18.063 1.00 . A A . 55 ASP N 1 1 11 13307 1 1 55 ASP O O 5.734 4.667 -20.645 1.50 . A A . 55 ASP O 1 1 11 13308 1 1 55 ASP OD1 O 9.043 2.073 -19.936 2.60 . A A . 55 ASP OD1 1 1 11 13309 1 1 55 ASP OD2 O 8.153 3.232 -21.530 2.80 . A A . 55 ASP OD2 1 1 11 13310 1 1 56 CYS C C 2.745 4.517 -19.795 0.80 . A A . 56 CYS C 1 1 11 13311 1 1 56 CYS CA C 3.414 4.684 -18.435 0.80 . A A . 56 CYS CA 1 1 11 13312 1 1 56 CYS CB C 2.800 5.823 -17.625 0.90 . A A . 56 CYS CB 1 1 11 13313 1 1 56 CYS H H 5.112 5.526 -17.809 1.10 . A A . 56 CYS H 1 1 11 13314 1 1 56 CYS HA H 3.355 3.744 -17.887 0.70 . A A . 56 CYS HA 1 1 11 13315 1 1 56 CYS HB2 H 2.256 6.489 -18.295 0.90 . A A . 56 CYS HB2 1 1 11 13316 1 1 56 CYS HB3 H 2.106 5.366 -16.930 1.00 . A A . 56 CYS HB3 1 1 11 13317 1 1 56 CYS N N 4.808 4.983 -18.584 0.90 . A A . 56 CYS N 1 1 11 13318 1 1 56 CYS O O 3.172 5.064 -20.804 1.10 . A A . 56 CYS O 1 1 11 13319 1 1 56 CYS SG S 3.996 6.806 -16.666 1.30 . A A . 56 CYS SG 1 1 11 13320 1 1 57 ASP C C 2.653 2.119 -21.315 0.90 . A A . 57 ASP C 1 1 11 13321 1 1 57 ASP CA C 1.912 2.294 -19.986 1.00 . A A . 57 ASP CA 1 1 11 13322 1 1 57 ASP CB C 0.605 1.503 -19.971 1.10 . A A . 57 ASP CB 1 1 11 13323 1 1 57 ASP CG C 0.899 0.025 -20.245 1.60 . A A . 57 ASP CG 1 1 11 13324 1 1 57 ASP H H 0.815 4.040 -19.350 1.10 . A A . 57 ASP H 1 1 11 13325 1 1 57 ASP HA H 2.557 1.955 -19.176 1.20 . A A . 57 ASP HA 1 1 11 13326 1 1 57 ASP HB2 H 0.132 1.585 -18.992 1.10 . A A . 57 ASP HB2 1 1 11 13327 1 1 57 ASP HB3 H -0.093 1.878 -20.720 1.20 . A A . 57 ASP HB3 1 1 11 13328 1 1 57 ASP N N 1.676 3.703 -19.732 0.80 . A A . 57 ASP N 1 1 11 13329 1 1 57 ASP O O 3.862 1.927 -21.352 1.00 . A A . 57 ASP O 1 1 11 13330 1 1 57 ASP OD1 O 2.071 -0.329 -20.366 2.20 . A A . 57 ASP OD1 1 1 11 13331 1 1 57 ASP OD2 O -0.048 -0.755 -20.337 2.00 . A A . 57 ASP OD2 1 1 11 13332 1 1 58 PRO C C 0.812 4.426 -22.681 1.20 . A A . 58 PRO C 1 1 11 13333 1 1 58 PRO CA C 1.793 3.388 -23.242 1.20 . A A . 58 PRO CA 1 1 11 13334 1 1 58 PRO CB C 1.336 2.878 -24.615 1.40 . A A . 58 PRO CB 1 1 11 13335 1 1 58 PRO CD C 1.191 1.040 -22.977 1.30 . A A . 58 PRO CD 1 1 11 13336 1 1 58 PRO CG C 0.856 1.431 -24.419 1.50 . A A . 58 PRO CG 1 1 11 13337 1 1 58 PRO HA H 2.783 3.839 -23.313 1.30 . A A . 58 PRO HA 1 1 11 13338 1 1 58 PRO HB2 H 0.549 3.498 -25.043 1.50 . A A . 58 PRO HB2 1 1 11 13339 1 1 58 PRO HB3 H 2.173 2.896 -25.313 1.70 . A A . 58 PRO HB3 1 1 11 13340 1 1 58 PRO HD2 H 0.283 0.823 -22.417 1.30 . A A . 58 PRO HD2 1 1 11 13341 1 1 58 PRO HD3 H 1.847 0.171 -22.938 1.40 . A A . 58 PRO HD3 1 1 11 13342 1 1 58 PRO HG2 H -0.217 1.355 -24.594 1.50 . A A . 58 PRO HG2 1 1 11 13343 1 1 58 PRO HG3 H 1.354 0.762 -25.121 1.70 . A A . 58 PRO HG3 1 1 11 13344 1 1 58 PRO N N 1.865 2.197 -22.412 1.00 . A A . 58 PRO N 1 1 11 13345 1 1 58 PRO O O 1.190 5.348 -21.969 1.50 . A A . 58 PRO O 1 1 11 13346 1 1 59 ASN C C -2.107 5.967 -22.505 1.30 . A A . 59 ASN C 1 1 11 13347 1 1 59 ASN CA C -1.207 5.359 -23.565 1.30 . A A . 59 ASN CA 1 1 11 13348 1 1 59 ASN CB C -2.072 4.870 -24.717 1.50 . A A . 59 ASN CB 1 1 11 13349 1 1 59 ASN CG C -1.713 5.616 -26.003 1.90 . A A . 59 ASN CG 1 1 11 13350 1 1 59 ASN H H -0.942 3.350 -23.043 1.10 . A A . 59 ASN H 1 1 11 13351 1 1 59 ASN HA H -0.475 6.090 -23.835 1.50 . A A . 59 ASN HA 1 1 11 13352 1 1 59 ASN HB2 H -1.927 3.799 -24.863 1.70 . A A . 59 ASN HB2 1 1 11 13353 1 1 59 ASN HB3 H -3.120 5.033 -24.466 1.70 . A A . 59 ASN HB3 1 1 11 13354 1 1 59 ASN HD21 H -0.866 3.934 -26.773 2.10 . A A . 59 ASN HD21 1 1 11 13355 1 1 59 ASN HD22 H -0.181 5.449 -27.333 2.50 . A A . 59 ASN HD22 1 1 11 13356 1 1 59 ASN N N -0.468 4.229 -23.047 1.10 . A A . 59 ASN N 1 1 11 13357 1 1 59 ASN ND2 N -0.842 4.939 -26.773 2.00 . A A . 59 ASN ND2 1 1 11 13358 1 1 59 ASN O O -2.126 7.158 -22.222 1.70 . A A . 59 ASN O 1 1 11 13359 1 1 59 ASN OD1 O -2.188 6.714 -26.269 2.70 . A A . 59 ASN OD1 1 1 11 13360 1 1 60 THR C C -4.885 5.292 -20.556 0.90 . A A . 60 THR C 1 1 11 13361 1 1 60 THR CA C -4.290 5.115 -21.971 1.20 . A A . 60 THR CA 1 1 11 13362 1 1 60 THR CB C -4.906 3.917 -22.667 1.40 . A A . 60 THR CB 1 1 11 13363 1 1 60 THR CG2 C -4.353 2.655 -22.049 1.40 . A A . 60 THR CG2 1 1 11 13364 1 1 60 THR H H -2.274 4.189 -21.906 1.00 . A A . 60 THR H 1 1 11 13365 1 1 60 THR HA H -4.500 5.969 -22.586 1.40 . A A . 60 THR HA 1 1 11 13366 1 1 60 THR HB H -4.672 3.946 -23.731 1.90 . A A . 60 THR HB 1 1 11 13367 1 1 60 THR HG1 H -6.499 3.776 -21.628 2.30 . A A . 60 THR HG1 1 1 11 13368 1 1 60 THR HG21 H -4.772 1.783 -22.541 1.90 . A A . 60 THR HG21 1 1 11 13369 1 1 60 THR HG22 H -4.604 2.638 -20.988 1.80 . A A . 60 THR HG22 1 1 11 13370 1 1 60 THR HG23 H -3.269 2.651 -22.157 1.70 . A A . 60 THR HG23 1 1 11 13371 1 1 60 THR N N -2.842 5.002 -21.967 1.10 . A A . 60 THR N 1 1 11 13372 1 1 60 THR O O -6.085 5.151 -20.354 1.10 . A A . 60 THR O 1 1 11 13373 1 1 60 THR OG1 O -6.305 3.950 -22.539 2.10 . A A . 60 THR OG1 1 1 11 13374 1 1 61 GLN C C -4.116 5.602 -17.085 0.90 . A A . 61 GLN C 1 1 11 13375 1 1 61 GLN CA C -3.965 4.801 -18.379 0.80 . A A . 61 GLN CA 1 1 11 13376 1 1 61 GLN CB C -2.661 4.010 -18.314 1.00 . A A . 61 GLN CB 1 1 11 13377 1 1 61 GLN CD C -3.719 1.823 -18.913 1.90 . A A . 61 GLN CD 1 1 11 13378 1 1 61 GLN CG C -2.646 2.845 -19.295 1.40 . A A . 61 GLN CG 1 1 11 13379 1 1 61 GLN H H -3.233 6.210 -19.845 1.20 . A A . 61 GLN H 1 1 11 13380 1 1 61 GLN HA H -4.849 4.187 -18.435 0.70 . A A . 61 GLN HA 1 1 11 13381 1 1 61 GLN HB2 H -1.823 4.673 -18.530 1.60 . A A . 61 GLN HB2 1 1 11 13382 1 1 61 GLN HB3 H -2.509 3.642 -17.302 1.60 . A A . 61 GLN HB3 1 1 11 13383 1 1 61 GLN HE21 H -2.832 0.343 -19.993 2.80 . A A . 61 GLN HE21 1 1 11 13384 1 1 61 GLN HE22 H -4.586 0.321 -19.976 2.60 . A A . 61 GLN HE22 1 1 11 13385 1 1 61 GLN HG2 H -2.828 3.212 -20.303 1.80 . A A . 61 GLN HG2 1 1 11 13386 1 1 61 GLN HG3 H -1.672 2.361 -19.289 1.90 . A A . 61 GLN HG3 1 1 11 13387 1 1 61 GLN N N -3.988 5.604 -19.597 0.90 . A A . 61 GLN N 1 1 11 13388 1 1 61 GLN NE2 N -3.711 0.731 -19.699 2.40 . A A . 61 GLN NE2 1 1 11 13389 1 1 61 GLN O O -4.536 5.092 -16.053 1.50 . A A . 61 GLN O 1 1 11 13390 1 1 61 GLN OE1 O -4.488 2.011 -17.978 2.40 . A A . 61 GLN OE1 1 1 11 13391 1 1 62 ALA C C -1.927 6.429 -15.585 0.90 . A A . 62 ALA C 1 1 11 13392 1 1 62 ALA CA C -2.457 7.333 -16.713 1.00 . A A . 62 ALA CA 1 1 11 13393 1 1 62 ALA CB C -2.584 8.774 -16.216 1.30 . A A . 62 ALA CB 1 1 11 13394 1 1 62 ALA H H -4.269 7.294 -17.957 1.50 . A A . 62 ALA H 1 1 11 13395 1 1 62 ALA HA H -1.771 7.265 -17.558 1.20 . A A . 62 ALA HA 1 1 11 13396 1 1 62 ALA HB1 H -3.431 8.877 -15.538 1.70 . A A . 62 ALA HB1 1 1 11 13397 1 1 62 ALA HB2 H -2.735 9.461 -17.049 1.60 . A A . 62 ALA HB2 1 1 11 13398 1 1 62 ALA HB3 H -1.686 9.085 -15.683 1.70 . A A . 62 ALA HB3 1 1 11 13399 1 1 62 ALA N N -3.746 6.876 -17.219 1.00 . A A . 62 ALA N 1 1 11 13400 1 1 62 ALA O O -2.085 6.703 -14.401 1.80 . A A . 62 ALA O 1 1 11 13401 1 1 63 SER C C 0.775 4.596 -15.047 0.60 . A A . 63 SER C 1 1 11 13402 1 1 63 SER CA C -0.729 4.387 -15.114 0.50 . A A . 63 SER CA 1 1 11 13403 1 1 63 SER CB C -0.985 2.952 -15.561 0.60 . A A . 63 SER CB 1 1 11 13404 1 1 63 SER H H -1.116 5.245 -17.033 1.20 . A A . 63 SER H 1 1 11 13405 1 1 63 SER HA H -1.175 4.594 -14.141 0.50 . A A . 63 SER HA 1 1 11 13406 1 1 63 SER HB2 H -2.050 2.736 -15.597 1.20 . A A . 63 SER HB2 1 1 11 13407 1 1 63 SER HB3 H -0.551 2.778 -16.547 0.90 . A A . 63 SER HB3 1 1 11 13408 1 1 63 SER HG H -0.272 2.520 -13.847 1.60 . A A . 63 SER HG 1 1 11 13409 1 1 63 SER N N -1.292 5.338 -16.054 0.60 . A A . 63 SER N 1 1 11 13410 1 1 63 SER O O 1.572 3.722 -15.363 1.60 . A A . 63 SER O 1 1 11 13411 1 1 63 SER OG O -0.393 2.050 -14.661 1.30 . A A . 63 SER OG 1 1 11 13412 1 1 64 CYS C C 1.183 6.374 -12.238 0.50 . A A . 64 CYS C 1 1 11 13413 1 1 64 CYS CA C 1.979 5.915 -13.464 0.50 . A A . 64 CYS CA 1 1 11 13414 1 1 64 CYS CB C 3.125 6.886 -13.770 0.50 . A A . 64 CYS CB 1 1 11 13415 1 1 64 CYS H H 0.725 6.628 -15.065 1.40 . A A . 64 CYS H 1 1 11 13416 1 1 64 CYS HA H 2.348 4.904 -13.285 0.60 . A A . 64 CYS HA 1 1 11 13417 1 1 64 CYS HB2 H 3.250 7.584 -12.941 0.70 . A A . 64 CYS HB2 1 1 11 13418 1 1 64 CYS HB3 H 4.064 6.336 -13.847 0.70 . A A . 64 CYS HB3 1 1 11 13419 1 1 64 CYS N N 1.097 5.820 -14.609 0.60 . A A . 64 CYS N 1 1 11 13420 1 1 64 CYS O O 1.159 7.546 -11.880 1.10 . A A . 64 CYS O 1 1 11 13421 1 1 64 CYS SG S 2.882 7.834 -15.298 1.30 . A A . 64 CYS SG 1 1 11 13422 1 1 65 GLU C C 0.072 6.200 -9.293 1.00 . A A . 65 GLU C 1 1 11 13423 1 1 65 GLU CA C -0.479 5.664 -10.626 1.10 . A A . 65 GLU CA 1 1 11 13424 1 1 65 GLU CB C -1.232 4.384 -10.312 1.30 . A A . 65 GLU CB 1 1 11 13425 1 1 65 GLU CD C -3.481 3.329 -10.640 1.90 . A A . 65 GLU CD 1 1 11 13426 1 1 65 GLU CG C -2.738 4.619 -10.290 1.50 . A A . 65 GLU CG 1 1 11 13427 1 1 65 GLU H H 0.765 4.408 -11.829 1.60 . A A . 65 GLU H 1 1 11 13428 1 1 65 GLU HA H -1.116 6.426 -11.067 1.30 . A A . 65 GLU HA 1 1 11 13429 1 1 65 GLU HB2 H -0.953 3.630 -11.043 1.50 . A A . 65 GLU HB2 1 1 11 13430 1 1 65 GLU HB3 H -0.904 4.011 -9.344 1.30 . A A . 65 GLU HB3 1 1 11 13431 1 1 65 GLU HG2 H -3.044 4.958 -9.301 1.70 . A A . 65 GLU HG2 1 1 11 13432 1 1 65 GLU HG3 H -2.999 5.397 -11.007 1.70 . A A . 65 GLU HG3 1 1 11 13433 1 1 65 GLU N N 0.540 5.361 -11.628 1.00 . A A . 65 GLU N 1 1 11 13434 1 1 65 GLU O O -0.641 6.318 -8.303 1.10 . A A . 65 GLU O 1 1 11 13435 1 1 65 GLU OE1 O -2.837 2.386 -11.096 1.90 . A A . 65 GLU OE1 1 1 11 13436 1 1 65 GLU OE2 O -4.695 3.282 -10.450 2.40 . A A . 65 GLU OE2 1 1 11 13437 1 1 66 CYS C C 1.493 8.142 -7.593 0.90 . A A . 66 CYS C 1 1 11 13438 1 1 66 CYS CA C 2.134 6.880 -8.188 1.00 . A A . 66 CYS CA 1 1 11 13439 1 1 66 CYS CB C 3.553 7.101 -8.726 1.20 . A A . 66 CYS CB 1 1 11 13440 1 1 66 CYS H H 1.828 6.522 -10.224 1.10 . A A . 66 CYS H 1 1 11 13441 1 1 66 CYS HA H 2.057 6.046 -7.492 1.10 . A A . 66 CYS HA 1 1 11 13442 1 1 66 CYS HB2 H 3.523 7.278 -9.799 1.20 . A A . 66 CYS HB2 1 1 11 13443 1 1 66 CYS HB3 H 3.943 8.034 -8.361 1.50 . A A . 66 CYS HB3 1 1 11 13444 1 1 66 CYS N N 1.368 6.509 -9.341 1.00 . A A . 66 CYS N 1 1 11 13445 1 1 66 CYS O O 0.393 8.525 -7.971 1.10 . A A . 66 CYS O 1 1 11 13446 1 1 66 CYS SG S 4.727 5.733 -8.486 1.70 . A A . 66 CYS SG 1 1 11 13447 1 1 67 PRO C C 2.049 11.051 -7.602 0.90 . A A . 67 PRO C 1 1 11 13448 1 1 67 PRO CA C 2.000 10.182 -6.343 0.90 . A A . 67 PRO CA 1 1 11 13449 1 1 67 PRO CB C 3.108 10.560 -5.355 0.90 . A A . 67 PRO CB 1 1 11 13450 1 1 67 PRO CD C 3.224 8.135 -5.815 0.80 . A A . 67 PRO CD 1 1 11 13451 1 1 67 PRO CG C 3.813 9.256 -4.953 0.80 . A A . 67 PRO CG 1 1 11 13452 1 1 67 PRO HA H 1.022 10.304 -5.877 1.10 . A A . 67 PRO HA 1 1 11 13453 1 1 67 PRO HB2 H 3.819 11.245 -5.825 1.00 . A A . 67 PRO HB2 1 1 11 13454 1 1 67 PRO HB3 H 2.680 11.047 -4.475 0.80 . A A . 67 PRO HB3 1 1 11 13455 1 1 67 PRO HD2 H 3.996 7.678 -6.427 0.70 . A A . 67 PRO HD2 1 1 11 13456 1 1 67 PRO HD3 H 2.765 7.358 -5.205 0.90 . A A . 67 PRO HD3 1 1 11 13457 1 1 67 PRO HG2 H 4.888 9.335 -5.115 0.80 . A A . 67 PRO HG2 1 1 11 13458 1 1 67 PRO HG3 H 3.654 9.048 -3.895 1.00 . A A . 67 PRO HG3 1 1 11 13459 1 1 67 PRO N N 2.216 8.777 -6.643 0.80 . A A . 67 PRO N 1 1 11 13460 1 1 67 PRO O O 2.482 10.614 -8.660 1.30 . A A . 67 PRO O 1 1 11 13461 1 1 68 GLU C C 1.888 13.065 -9.728 1.10 . A A . 68 GLU C 1 1 11 13462 1 1 68 GLU CA C 0.975 13.048 -8.498 1.20 . A A . 68 GLU CA 1 1 11 13463 1 1 68 GLU CB C 0.755 14.493 -8.043 1.50 . A A . 68 GLU CB 1 1 11 13464 1 1 68 GLU CD C 1.789 16.560 -7.054 2.80 . A A . 68 GLU CD 1 1 11 13465 1 1 68 GLU CG C 1.993 15.072 -7.355 2.10 . A A . 68 GLU CG 1 1 11 13466 1 1 68 GLU H H 1.387 12.578 -6.460 1.60 . A A . 68 GLU H 1 1 11 13467 1 1 68 GLU HA H 0.018 12.578 -8.729 1.30 . A A . 68 GLU HA 1 1 11 13468 1 1 68 GLU HB2 H 0.502 15.106 -8.908 1.90 . A A . 68 GLU HB2 1 1 11 13469 1 1 68 GLU HB3 H -0.099 14.543 -7.367 1.90 . A A . 68 GLU HB3 1 1 11 13470 1 1 68 GLU HG2 H 2.192 14.549 -6.419 2.40 . A A . 68 GLU HG2 1 1 11 13471 1 1 68 GLU HG3 H 2.872 14.959 -7.989 2.50 . A A . 68 GLU HG3 1 1 11 13472 1 1 68 GLU N N 1.563 12.292 -7.401 1.20 . A A . 68 GLU N 1 1 11 13473 1 1 68 GLU O O 2.701 13.965 -9.898 1.20 . A A . 68 GLU O 1 1 11 13474 1 1 68 GLU OE1 O 1.359 17.289 -7.947 3.40 . A A . 68 GLU OE1 1 1 11 13475 1 1 68 GLU OE2 O 2.064 16.972 -5.928 3.30 . A A . 68 GLU OE2 1 1 11 13476 1 1 69 GLY C C 3.930 11.225 -11.198 1.20 . A A . 69 GLY C 1 1 11 13477 1 1 69 GLY CA C 2.639 11.902 -11.672 1.50 . A A . 69 GLY CA 1 1 11 13478 1 1 69 GLY H H 0.945 11.395 -10.450 1.40 . A A . 69 GLY H 1 1 11 13479 1 1 69 GLY HA2 H 2.158 11.300 -12.445 1.70 . A A . 69 GLY HA2 1 1 11 13480 1 1 69 GLY HA3 H 2.849 12.904 -12.049 1.80 . A A . 69 GLY HA3 1 1 11 13481 1 1 69 GLY N N 1.697 12.042 -10.579 1.20 . A A . 69 GLY N 1 1 11 13482 1 1 69 GLY O O 4.484 10.366 -11.872 1.40 . A A . 69 GLY O 1 1 11 13483 1 1 70 TYR C C 6.281 12.747 -11.147 0.80 . A A . 70 TYR C 1 1 11 13484 1 1 70 TYR CA C 5.369 12.726 -9.910 0.80 . A A . 70 TYR CA 1 1 11 13485 1 1 70 TYR CB C 6.195 12.509 -8.640 0.60 . A A . 70 TYR CB 1 1 11 13486 1 1 70 TYR CD1 C 5.273 14.201 -6.970 1.30 . A A . 70 TYR CD1 1 1 11 13487 1 1 70 TYR CD2 C 7.544 14.551 -7.927 1.50 . A A . 70 TYR CD2 1 1 11 13488 1 1 70 TYR CE1 C 5.409 15.409 -6.200 1.40 . A A . 70 TYR CE1 1 1 11 13489 1 1 70 TYR CE2 C 7.683 15.760 -7.159 1.70 . A A . 70 TYR CE2 1 1 11 13490 1 1 70 TYR CG C 6.339 13.768 -7.837 0.70 . A A . 70 TYR CG 1 1 11 13491 1 1 70 TYR CZ C 6.614 16.189 -6.296 1.10 . A A . 70 TYR CZ 1 1 11 13492 1 1 70 TYR H H 4.029 11.237 -9.166 1.00 . A A . 70 TYR H 1 1 11 13493 1 1 70 TYR HA H 4.824 13.666 -9.850 0.90 . A A . 70 TYR HA 1 1 11 13494 1 1 70 TYR HB2 H 5.725 11.749 -8.018 0.60 . A A . 70 TYR HB2 1 1 11 13495 1 1 70 TYR HB3 H 7.185 12.136 -8.894 0.60 . A A . 70 TYR HB3 1 1 11 13496 1 1 70 TYR HD1 H 4.371 13.613 -6.898 2.10 . A A . 70 TYR HD1 1 1 11 13497 1 1 70 TYR HD2 H 8.346 14.229 -8.573 2.30 . A A . 70 TYR HD2 1 1 11 13498 1 1 70 TYR HE1 H 4.608 15.728 -5.551 2.10 . A A . 70 TYR HE1 1 1 11 13499 1 1 70 TYR HE2 H 8.588 16.344 -7.229 2.50 . A A . 70 TYR HE2 1 1 11 13500 1 1 70 TYR HH H 6.817 17.136 -4.642 1.50 . A A . 70 TYR HH 1 1 11 13501 1 1 70 TYR N N 4.374 11.664 -10.002 0.90 . A A . 70 TYR N 1 1 11 13502 1 1 70 TYR O O 6.290 11.828 -11.955 1.10 . A A . 70 TYR O 1 1 11 13503 1 1 70 TYR OH O 6.745 17.351 -5.563 1.30 . A A . 70 TYR OH 1 1 11 13504 1 1 71 ILE C C 9.118 12.587 -11.111 0.90 . A A . 71 ILE C 1 1 11 13505 1 1 71 ILE CA C 8.378 13.750 -11.793 1.00 . A A . 71 ILE CA 1 1 11 13506 1 1 71 ILE CB C 9.108 15.091 -11.614 1.20 . A A . 71 ILE CB 1 1 11 13507 1 1 71 ILE CD1 C 11.092 15.444 -13.157 1.80 . A A . 71 ILE CD1 1 1 11 13508 1 1 71 ILE CG1 C 9.586 15.631 -12.963 1.40 . A A . 71 ILE CG1 1 1 11 13509 1 1 71 ILE CG2 C 10.273 15.020 -10.621 1.80 . A A . 71 ILE CG2 1 1 11 13510 1 1 71 ILE H H 6.666 14.742 -10.953 1.10 . A A . 71 ILE H 1 1 11 13511 1 1 71 ILE HA H 8.257 13.542 -12.854 1.20 . A A . 71 ILE HA 1 1 11 13512 1 1 71 ILE HB H 8.386 15.805 -11.218 1.70 . A A . 71 ILE HB 1 1 11 13513 1 1 71 ILE HD11 H 11.373 14.397 -13.038 2.20 . A A . 71 ILE HD11 1 1 11 13514 1 1 71 ILE HD12 H 11.655 16.030 -12.430 2.30 . A A . 71 ILE HD12 1 1 11 13515 1 1 71 ILE HD13 H 11.398 15.763 -14.153 2.10 . A A . 71 ILE HD13 1 1 11 13516 1 1 71 ILE HG12 H 9.050 15.129 -13.769 1.60 . A A . 71 ILE HG12 1 1 11 13517 1 1 71 ILE HG13 H 9.340 16.690 -13.039 1.70 . A A . 71 ILE HG13 1 1 11 13518 1 1 71 ILE HG21 H 9.964 14.559 -9.683 2.30 . A A . 71 ILE HG21 1 1 11 13519 1 1 71 ILE HG22 H 10.653 16.017 -10.398 2.20 . A A . 71 ILE HG22 1 1 11 13520 1 1 71 ILE HG23 H 11.094 14.431 -11.031 2.20 . A A . 71 ILE HG23 1 1 11 13521 1 1 71 ILE N N 7.036 13.857 -11.239 0.90 . A A . 71 ILE N 1 1 11 13522 1 1 71 ILE O O 9.064 12.441 -9.897 0.90 . A A . 71 ILE O 1 1 11 13523 1 1 72 LEU C C 8.125 10.567 -13.197 0.80 . A A . 72 LEU C 1 1 11 13524 1 1 72 LEU CA C 9.296 10.458 -12.220 0.80 . A A . 72 LEU CA 1 1 11 13525 1 1 72 LEU CB C 8.851 9.792 -10.909 0.80 . A A . 72 LEU CB 1 1 11 13526 1 1 72 LEU CD1 C 7.906 7.503 -10.438 0.70 . A A . 72 LEU CD1 1 1 11 13527 1 1 72 LEU CD2 C 9.877 7.749 -11.974 0.60 . A A . 72 LEU CD2 1 1 11 13528 1 1 72 LEU CG C 9.170 8.306 -10.752 0.70 . A A . 72 LEU CG 1 1 11 13529 1 1 72 LEU H H 10.819 11.902 -11.886 0.90 . A A . 72 LEU H 1 1 11 13530 1 1 72 LEU HA H 10.075 9.935 -12.772 0.80 . A A . 72 LEU HA 1 1 11 13531 1 1 72 LEU HB2 H 9.318 10.309 -10.076 1.00 . A A . 72 LEU HB2 1 1 11 13532 1 1 72 LEU HB3 H 7.777 9.919 -10.806 1.00 . A A . 72 LEU HB3 1 1 11 13533 1 1 72 LEU HD11 H 7.009 8.087 -10.643 1.40 . A A . 72 LEU HD11 1 1 11 13534 1 1 72 LEU HD12 H 7.886 7.210 -9.387 1.20 . A A . 72 LEU HD12 1 1 11 13535 1 1 72 LEU HD13 H 7.863 6.595 -11.040 1.20 . A A . 72 LEU HD13 1 1 11 13536 1 1 72 LEU HD21 H 10.847 8.228 -12.096 1.10 . A A . 72 LEU HD21 1 1 11 13537 1 1 72 LEU HD22 H 9.284 7.936 -12.866 1.10 . A A . 72 LEU HD22 1 1 11 13538 1 1 72 LEU HD23 H 10.017 6.675 -11.872 1.20 . A A . 72 LEU HD23 1 1 11 13539 1 1 72 LEU HG H 9.845 8.202 -9.903 0.70 . A A . 72 LEU HG 1 1 11 13540 1 1 72 LEU N N 9.828 11.786 -11.937 0.80 . A A . 72 LEU N 1 1 11 13541 1 1 72 LEU O O 7.801 11.633 -13.704 0.90 . A A . 72 LEU O 1 1 11 13542 1 1 73 ASP C C 8.181 7.839 -15.230 1.20 . A A . 73 ASP C 1 1 11 13543 1 1 73 ASP CA C 7.259 8.993 -14.831 1.00 . A A . 73 ASP CA 1 1 11 13544 1 1 73 ASP CB C 7.463 10.153 -15.813 1.50 . A A . 73 ASP CB 1 1 11 13545 1 1 73 ASP CG C 6.260 11.095 -15.770 2.00 . A A . 73 ASP CG 1 1 11 13546 1 1 73 ASP H H 7.299 8.775 -12.699 0.80 . A A . 73 ASP H 1 1 11 13547 1 1 73 ASP HA H 6.226 8.645 -14.853 1.20 . A A . 73 ASP HA 1 1 11 13548 1 1 73 ASP HB2 H 8.366 10.715 -15.572 1.90 . A A . 73 ASP HB2 1 1 11 13549 1 1 73 ASP HB3 H 7.583 9.772 -16.826 1.90 . A A . 73 ASP HB3 1 1 11 13550 1 1 73 ASP N N 7.524 9.390 -13.454 0.90 . A A . 73 ASP N 1 1 11 13551 1 1 73 ASP O O 9.386 7.866 -15.014 1.70 . A A . 73 ASP O 1 1 11 13552 1 1 73 ASP OD1 O 5.512 11.049 -14.794 2.80 . A A . 73 ASP OD1 1 1 11 13553 1 1 73 ASP OD2 O 6.083 11.865 -16.713 2.30 . A A . 73 ASP OD2 1 1 11 13554 1 1 74 ASP C C 9.507 5.430 -15.795 1.40 . A A . 74 ASP C 1 1 11 13555 1 1 74 ASP CA C 8.313 5.900 -16.624 1.80 . A A . 74 ASP CA 1 1 11 13556 1 1 74 ASP CB C 8.786 6.552 -17.923 2.60 . A A . 74 ASP CB 1 1 11 13557 1 1 74 ASP CG C 9.870 5.685 -18.566 3.20 . A A . 74 ASP CG 1 1 11 13558 1 1 74 ASP H H 6.532 6.863 -15.924 1.40 . A A . 74 ASP H 1 1 11 13559 1 1 74 ASP HA H 7.675 5.037 -16.809 2.30 . A A . 74 ASP HA 1 1 11 13560 1 1 74 ASP HB2 H 7.959 6.661 -18.625 3.00 . A A . 74 ASP HB2 1 1 11 13561 1 1 74 ASP HB3 H 9.190 7.546 -17.731 3.10 . A A . 74 ASP HB3 1 1 11 13562 1 1 74 ASP N N 7.528 6.837 -15.846 1.30 . A A . 74 ASP N 1 1 11 13563 1 1 74 ASP O O 10.643 5.842 -15.994 1.80 . A A . 74 ASP O 1 1 11 13564 1 1 74 ASP OD1 O 9.557 4.570 -18.982 3.60 . A A . 74 ASP OD1 1 1 11 13565 1 1 74 ASP OD2 O 11.013 6.133 -18.643 3.70 . A A . 74 ASP OD2 1 1 11 13566 1 1 75 GLY C C 10.126 2.492 -13.859 1.10 . A A . 75 GLY C 1 1 11 13567 1 1 75 GLY CA C 9.489 3.142 -15.079 1.10 . A A . 75 GLY CA 1 1 11 13568 1 1 75 GLY H H 8.672 4.844 -14.031 1.30 . A A . 75 GLY H 1 1 11 13569 1 1 75 GLY HA2 H 8.592 2.609 -15.391 1.50 . A A . 75 GLY HA2 1 1 11 13570 1 1 75 GLY HA3 H 10.214 3.138 -15.863 1.30 . A A . 75 GLY HA3 1 1 11 13571 1 1 75 GLY N N 9.156 4.540 -14.851 1.00 . A A . 75 GLY N 1 1 11 13572 1 1 75 GLY O O 11.121 1.779 -13.919 1.40 . A A . 75 GLY O 1 1 11 13573 1 1 76 PHE C C 9.073 2.713 -10.293 0.80 . A A . 76 PHE C 1 1 11 13574 1 1 76 PHE CA C 10.074 2.608 -11.463 0.90 . A A . 76 PHE CA 1 1 11 13575 1 1 76 PHE CB C 11.182 3.651 -11.307 1.00 . A A . 76 PHE CB 1 1 11 13576 1 1 76 PHE CD1 C 12.741 2.317 -9.790 2.00 . A A . 76 PHE CD1 1 1 11 13577 1 1 76 PHE CD2 C 11.868 4.513 -9.011 1.80 . A A . 76 PHE CD2 1 1 11 13578 1 1 76 PHE CE1 C 13.473 2.170 -8.559 2.70 . A A . 76 PHE CE1 1 1 11 13579 1 1 76 PHE CE2 C 12.596 4.368 -7.778 2.50 . A A . 76 PHE CE2 1 1 11 13580 1 1 76 PHE CG C 11.938 3.489 -10.022 1.20 . A A . 76 PHE CG 1 1 11 13581 1 1 76 PHE CZ C 13.401 3.197 -7.554 2.80 . A A . 76 PHE CZ 1 1 11 13582 1 1 76 PHE H H 8.660 3.376 -13.008 1.00 . A A . 76 PHE H 1 1 11 13583 1 1 76 PHE HA H 10.486 1.599 -11.482 0.80 . A A . 76 PHE HA 1 1 11 13584 1 1 76 PHE HB2 H 11.880 3.574 -12.141 1.60 . A A . 76 PHE HB2 1 1 11 13585 1 1 76 PHE HB3 H 10.754 4.653 -11.343 1.30 . A A . 76 PHE HB3 1 1 11 13586 1 1 76 PHE HD1 H 12.795 1.544 -10.542 2.50 . A A . 76 PHE HD1 1 1 11 13587 1 1 76 PHE HD2 H 11.267 5.394 -9.179 2.30 . A A . 76 PHE HD2 1 1 11 13588 1 1 76 PHE HE1 H 14.075 1.289 -8.392 3.50 . A A . 76 PHE HE1 1 1 11 13589 1 1 76 PHE HE2 H 12.535 5.138 -7.023 3.20 . A A . 76 PHE HE2 1 1 11 13590 1 1 76 PHE HZ H 13.953 3.089 -6.632 3.50 . A A . 76 PHE HZ 1 1 11 13591 1 1 76 PHE N N 9.451 2.815 -12.761 0.90 . A A . 76 PHE N 1 1 11 13592 1 1 76 PHE O O 9.465 2.897 -9.147 0.80 . A A . 76 PHE O 1 1 11 13593 1 1 77 ILE C C 7.043 4.214 -8.997 0.70 . A A . 77 ILE C 1 1 11 13594 1 1 77 ILE CA C 7.032 3.834 -10.465 0.80 . A A . 77 ILE CA 1 1 11 13595 1 1 77 ILE CB C 5.603 3.747 -10.992 0.90 . A A . 77 ILE CB 1 1 11 13596 1 1 77 ILE CD1 C 4.040 2.587 -12.584 1.20 . A A . 77 ILE CD1 1 1 11 13597 1 1 77 ILE CG1 C 5.496 2.934 -12.270 1.10 . A A . 77 ILE CG1 1 1 11 13598 1 1 77 ILE CG2 C 5.094 5.153 -11.281 0.90 . A A . 77 ILE CG2 1 1 11 13599 1 1 77 ILE H H 7.497 1.954 -11.341 0.80 . A A . 77 ILE H 1 1 11 13600 1 1 77 ILE HA H 7.536 4.550 -11.069 0.80 . A A . 77 ILE HA 1 1 11 13601 1 1 77 ILE HB H 4.982 3.274 -10.235 0.90 . A A . 77 ILE HB 1 1 11 13602 1 1 77 ILE HD11 H 3.701 1.747 -11.980 1.50 . A A . 77 ILE HD11 1 1 11 13603 1 1 77 ILE HD12 H 3.910 2.322 -13.633 1.60 . A A . 77 ILE HD12 1 1 11 13604 1 1 77 ILE HD13 H 3.389 3.435 -12.371 1.70 . A A . 77 ILE HD13 1 1 11 13605 1 1 77 ILE HG12 H 5.928 3.495 -13.100 1.10 . A A . 77 ILE HG12 1 1 11 13606 1 1 77 ILE HG13 H 6.089 2.034 -12.161 1.30 . A A . 77 ILE HG13 1 1 11 13607 1 1 77 ILE HG21 H 5.670 5.891 -10.724 1.10 . A A . 77 ILE HG21 1 1 11 13608 1 1 77 ILE HG22 H 4.042 5.249 -11.020 1.40 . A A . 77 ILE HG22 1 1 11 13609 1 1 77 ILE HG23 H 5.206 5.376 -12.343 1.40 . A A . 77 ILE HG23 1 1 11 13610 1 1 77 ILE N N 7.774 2.608 -10.639 0.80 . A A . 77 ILE N 1 1 11 13611 1 1 77 ILE O O 7.536 5.240 -8.545 0.80 . A A . 77 ILE O 1 1 11 13612 1 1 78 CYS C C 6.673 1.687 -6.467 0.70 . A A . 78 CYS C 1 1 11 13613 1 1 78 CYS CA C 6.470 3.149 -6.884 0.50 . A A . 78 CYS CA 1 1 11 13614 1 1 78 CYS CB C 5.167 3.698 -6.301 0.40 . A A . 78 CYS CB 1 1 11 13615 1 1 78 CYS H H 6.047 2.584 -8.976 0.50 . A A . 78 CYS H 1 1 11 13616 1 1 78 CYS HA H 7.327 3.739 -6.559 0.60 . A A . 78 CYS HA 1 1 11 13617 1 1 78 CYS HB2 H 4.322 3.216 -6.793 0.70 . A A . 78 CYS HB2 1 1 11 13618 1 1 78 CYS HB3 H 5.100 3.440 -5.244 0.70 . A A . 78 CYS HB3 1 1 11 13619 1 1 78 CYS N N 6.430 3.241 -8.330 0.50 . A A . 78 CYS N 1 1 11 13620 1 1 78 CYS O O 7.490 1.372 -5.610 1.70 . A A . 78 CYS O 1 1 11 13621 1 1 78 CYS SG S 5.003 5.496 -6.477 1.00 . A A . 78 CYS SG 1 1 11 13622 1 1 79 THR C C 5.578 -1.458 -7.967 0.90 . A A . 79 THR C 1 1 11 13623 1 1 79 THR CA C 6.482 -0.223 -7.944 0.70 . A A . 79 THR CA 1 1 11 13624 1 1 79 THR CB C 7.858 -0.612 -7.399 0.90 . A A . 79 THR CB 1 1 11 13625 1 1 79 THR CG2 C 8.880 0.499 -7.619 1.60 . A A . 79 THR CG2 1 1 11 13626 1 1 79 THR H H 4.884 0.895 -7.056 1.30 . A A . 79 THR H 1 1 11 13627 1 1 79 THR HA H 6.563 0.182 -8.953 0.80 . A A . 79 THR HA 1 1 11 13628 1 1 79 THR HB H 8.199 -1.519 -7.897 0.70 . A A . 79 THR HB 1 1 11 13629 1 1 79 THR HG1 H 8.470 -1.513 -5.836 2.00 . A A . 79 THR HG1 1 1 11 13630 1 1 79 THR HG21 H 9.316 0.825 -6.675 2.00 . A A . 79 THR HG21 1 1 11 13631 1 1 79 THR HG22 H 8.404 1.357 -8.091 2.20 . A A . 79 THR HG22 1 1 11 13632 1 1 79 THR HG23 H 9.688 0.161 -8.269 2.10 . A A . 79 THR HG23 1 1 11 13633 1 1 79 THR N N 5.879 0.822 -7.129 0.70 . A A . 79 THR N 1 1 11 13634 1 1 79 THR O O 4.630 -1.575 -7.203 1.50 . A A . 79 THR O 1 1 11 13635 1 1 79 THR OG1 O 7.767 -0.907 -6.028 1.70 . A A . 79 THR OG1 1 1 11 13636 1 1 80 ASP C C 7.380 -4.326 -8.620 1.10 . A A . 80 ASP C 1 1 11 13637 1 1 80 ASP CA C 5.958 -3.767 -8.500 1.20 . A A . 80 ASP CA 1 1 11 13638 1 1 80 ASP CB C 4.993 -4.555 -9.388 1.70 . A A . 80 ASP CB 1 1 11 13639 1 1 80 ASP CG C 4.370 -5.704 -8.592 2.40 . A A . 80 ASP CG 1 1 11 13640 1 1 80 ASP H H 6.140 -2.104 -9.834 0.80 . A A . 80 ASP H 1 1 11 13641 1 1 80 ASP HA H 5.645 -3.801 -7.456 1.50 . A A . 80 ASP HA 1 1 11 13642 1 1 80 ASP HB2 H 4.191 -3.907 -9.748 2.10 . A A . 80 ASP HB2 1 1 11 13643 1 1 80 ASP HB3 H 5.517 -4.965 -10.254 1.80 . A A . 80 ASP HB3 1 1 11 13644 1 1 80 ASP N N 5.941 -2.370 -8.890 0.80 . A A . 80 ASP N 1 1 11 13645 1 1 80 ASP O O 7.967 -4.813 -7.660 1.90 . A A . 80 ASP O 1 1 11 13646 1 1 80 ASP OD1 O 4.116 -5.523 -7.403 2.90 . A A . 80 ASP OD1 1 1 11 13647 1 1 80 ASP OD2 O 4.143 -6.765 -9.172 2.90 . A A . 80 ASP OD2 1 1 11 13648 1 1 81 ILE C C 7.698 -6.679 -10.085 1.60 . A A . 81 ILE C 1 1 11 13649 1 1 81 ILE CA C 8.375 -5.393 -10.579 1.30 . A A . 81 ILE CA 1 1 11 13650 1 1 81 ILE CB C 9.894 -5.502 -10.434 1.70 . A A . 81 ILE CB 1 1 11 13651 1 1 81 ILE CD1 C 12.045 -4.171 -10.730 3.00 . A A . 81 ILE CD1 1 1 11 13652 1 1 81 ILE CG1 C 10.540 -4.114 -10.460 2.50 . A A . 81 ILE CG1 1 1 11 13653 1 1 81 ILE CG2 C 10.471 -6.413 -11.520 1.90 . A A . 81 ILE CG2 1 1 11 13654 1 1 81 ILE H H 7.952 -3.317 -10.293 1.50 . A A . 81 ILE H 1 1 11 13655 1 1 81 ILE HA H 8.107 -5.236 -11.624 1.50 . A A . 81 ILE HA 1 1 11 13656 1 1 81 ILE HB H 10.111 -5.958 -9.468 2.20 . A A . 81 ILE HB 1 1 11 13657 1 1 81 ILE HD11 H 12.597 -3.639 -9.955 3.20 . A A . 81 ILE HD11 1 1 11 13658 1 1 81 ILE HD12 H 12.285 -3.709 -11.688 3.40 . A A . 81 ILE HD12 1 1 11 13659 1 1 81 ILE HD13 H 12.403 -5.201 -10.749 3.30 . A A . 81 ILE HD13 1 1 11 13660 1 1 81 ILE HG12 H 10.059 -3.502 -11.223 2.70 . A A . 81 ILE HG12 1 1 11 13661 1 1 81 ILE HG13 H 10.362 -3.616 -9.507 3.00 . A A . 81 ILE HG13 1 1 11 13662 1 1 81 ILE HG21 H 11.004 -7.257 -11.079 2.20 . A A . 81 ILE HG21 1 1 11 13663 1 1 81 ILE HG22 H 11.165 -5.869 -12.161 2.30 . A A . 81 ILE HG22 1 1 11 13664 1 1 81 ILE HG23 H 9.677 -6.814 -12.150 2.30 . A A . 81 ILE HG23 1 1 11 13665 1 1 81 ILE N N 7.887 -4.219 -9.865 1.00 . A A . 81 ILE N 1 1 11 13666 1 1 81 ILE O O 6.620 -6.659 -9.503 2.40 . A A . 81 ILE O 1 1 11 13667 1 1 82 ASP C C 8.040 -8.907 -8.220 2.70 . A A . 82 ASP C 1 1 11 13668 1 1 82 ASP CA C 7.981 -9.036 -9.744 2.60 . A A . 82 ASP CA 1 1 11 13669 1 1 82 ASP CB C 8.888 -10.172 -10.219 3.50 . A A . 82 ASP CB 1 1 11 13670 1 1 82 ASP CG C 8.164 -11.513 -10.082 3.90 . A A . 82 ASP CG 1 1 11 13671 1 1 82 ASP H H 9.198 -7.778 -10.965 2.10 . A A . 82 ASP H 1 1 11 13672 1 1 82 ASP HA H 6.949 -9.198 -10.053 3.00 . A A . 82 ASP HA 1 1 11 13673 1 1 82 ASP HB2 H 9.170 -10.026 -11.262 3.90 . A A . 82 ASP HB2 1 1 11 13674 1 1 82 ASP HB3 H 9.806 -10.205 -9.632 3.90 . A A . 82 ASP HB3 1 1 11 13675 1 1 82 ASP N N 8.405 -7.792 -10.356 1.90 . A A . 82 ASP N 1 1 11 13676 1 1 82 ASP O O 7.110 -9.258 -7.505 3.30 . A A . 82 ASP O 1 1 11 13677 1 1 82 ASP OD1 O 7.150 -11.705 -10.753 4.20 . A A . 82 ASP OD1 1 1 11 13678 1 1 82 ASP OD2 O 8.621 -12.351 -9.307 4.50 . A A . 82 ASP OD2 1 1 11 13679 1 1 83 GLU C C 9.348 -9.930 -5.909 1.00 . A A . 83 GLU C 1 1 11 13680 1 1 83 GLU CA C 10.104 -9.243 -7.050 1.00 . A A . 83 GLU CA 1 1 11 13681 1 1 83 GLU CB C 11.297 -8.427 -6.539 1.00 . A A . 83 GLU CB 1 1 11 13682 1 1 83 GLU CD C 12.520 -7.437 -4.591 1.00 . A A . 83 GLU CD 1 1 11 13683 1 1 83 GLU CG C 11.244 -8.153 -5.034 1.00 . A A . 83 GLU CG 1 1 11 13684 1 1 83 GLU H H 9.423 -7.419 -7.949 1.00 . A A . 83 GLU H 1 1 11 13685 1 1 83 GLU HA H 10.439 -10.003 -7.756 1.00 . A A . 83 GLU HA 1 1 11 13686 1 1 83 GLU HB2 H 12.220 -8.956 -6.776 1.00 . A A . 83 GLU HB2 1 1 11 13687 1 1 83 GLU HB3 H 11.341 -7.480 -7.076 1.00 . A A . 83 GLU HB3 1 1 11 13688 1 1 83 GLU HG2 H 10.384 -7.531 -4.786 1.00 . A A . 83 GLU HG2 1 1 11 13689 1 1 83 GLU HG3 H 11.149 -9.086 -4.479 1.00 . A A . 83 GLU HG3 1 1 11 13690 1 1 83 GLU N N 9.197 -8.379 -7.781 1.00 . A A . 83 GLU N 1 1 11 13691 1 1 83 GLU O O 8.677 -9.236 -5.147 1.00 . A A . 83 GLU O 1 1 11 13692 1 1 83 GLU OXT O 9.440 -11.152 -5.798 1.00 . A A . 83 GLU OXT 1 1 11 13693 1 1 83 GLU OE1 O 13.511 -7.501 -5.316 1.00 . A A . 83 GLU OE1 1 1 11 13694 1 1 83 GLU OE2 O 12.508 -6.822 -3.525 1.00 . A A . 83 GLU OE2 1 1 11 13695 2 2 1 NAG C1 C -15.449 2.575 11.952 1.00 . B A . 121 NAG C1 1 1 11 13696 2 2 1 NAG C2 C -14.523 3.699 11.488 1.00 . B A . 121 NAG C2 1 1 11 13697 2 2 1 NAG C3 C -15.275 5.014 11.277 1.00 . B A . 121 NAG C3 1 1 11 13698 2 2 1 NAG C4 C -16.223 5.323 12.437 1.00 . B A . 121 NAG C4 1 1 11 13699 2 2 1 NAG C5 C -16.948 4.072 12.935 1.00 . B A . 121 NAG C5 1 1 11 13700 2 2 1 NAG C6 C -18.443 4.326 13.137 1.00 . B A . 121 NAG C6 1 1 11 13701 2 2 1 NAG C7 C -12.217 3.589 12.150 1.00 . B A . 121 NAG C7 1 1 11 13702 2 2 1 NAG C8 C -12.035 2.115 11.782 1.00 . B A . 121 NAG C8 1 1 11 13703 2 2 1 NAG H1 H -15.153 2.206 12.934 1.00 . B A . 121 NAG H1 1 1 11 13704 2 2 1 NAG H2 H -14.012 3.409 10.570 1.00 . B A . 121 NAG H2 1 1 11 13705 2 2 1 NAG H3 H -14.558 5.828 11.168 1.00 . B A . 121 NAG H3 1 1 11 13706 2 2 1 NAG H4 H -16.956 6.064 12.119 1.00 . B A . 121 NAG H4 1 1 11 13707 2 2 1 NAG H5 H -16.510 3.757 13.882 1.00 . B A . 121 NAG H5 1 1 11 13708 2 2 1 NAG H61 H -18.926 4.576 12.192 1.00 . B A . 121 NAG H61 1 1 11 13709 2 2 1 NAG H62 H -18.606 5.152 13.828 1.00 . B A . 121 NAG H62 1 1 11 13710 2 2 1 NAG H81 H -11.015 1.798 12.003 1.00 . B A . 121 NAG H81 1 1 11 13711 2 2 1 NAG H82 H -12.726 1.499 12.358 1.00 . B A . 121 NAG H82 1 1 11 13712 2 2 1 NAG H83 H -12.229 1.966 10.720 1.00 . B A . 121 NAG H83 1 1 11 13713 2 2 1 NAG HN2 H -13.704 4.250 13.390 1.00 . B A . 121 NAG HN2 1 1 11 13714 2 2 1 NAG HO3 H -15.447 4.529 9.440 1.00 . B A . 121 NAG HO3 1 1 11 13715 2 2 1 NAG HO4 H -16.126 6.152 14.153 1.00 . B A . 121 NAG HO4 1 1 11 13716 2 2 1 NAG HO6 H -19.232 2.601 12.933 1.00 . B A . 121 NAG HO6 1 1 11 13717 2 2 1 NAG N2 N -13.485 3.897 12.481 1.00 . B A . 121 NAG N2 1 1 11 13718 2 2 1 NAG O3 O -16.009 4.945 10.080 1.00 . B A . 121 NAG O3 1 1 11 13719 2 2 1 NAG O4 O -15.494 5.891 13.496 1.00 . B A . 121 NAG O4 1 1 11 13720 2 2 1 NAG O5 O -16.778 3.035 11.999 1.00 . B A . 121 NAG O5 1 1 11 13721 2 2 1 NAG O6 O -19.073 3.185 13.662 1.00 . B A . 121 NAG O6 1 1 11 13722 2 2 1 NAG O7 O -11.282 4.379 12.136 1.00 . B A . 121 NAG O7 1 1 11 13723 3 2 1 NAG C1 C -5.370 -4.631 -5.808 1.00 . C A . 148 NAG C1 1 1 11 13724 3 2 1 NAG C2 C -6.044 -4.334 -4.473 1.00 . C A . 148 NAG C2 1 1 11 13725 3 2 1 NAG C3 C -6.480 -5.622 -3.781 1.00 . C A . 148 NAG C3 1 1 11 13726 3 2 1 NAG C4 C -5.629 -6.811 -4.231 1.00 . C A . 148 NAG C4 1 1 11 13727 3 2 1 NAG C5 C -5.584 -6.968 -5.755 1.00 . C A . 148 NAG C5 1 1 11 13728 3 2 1 NAG C6 C -6.513 -8.087 -6.228 1.00 . C A . 148 NAG C6 1 1 11 13729 3 2 1 NAG C7 C -5.347 -2.291 -3.437 1.00 . C A . 148 NAG C7 1 1 11 13730 3 2 1 NAG C8 C -4.105 -1.526 -2.969 1.00 . C A . 148 NAG C8 1 1 11 13731 3 2 1 NAG H1 H -4.299 -4.796 -5.683 1.00 . C A . 148 NAG H1 1 1 11 13732 3 2 1 NAG H2 H -6.902 -3.678 -4.622 1.00 . C A . 148 NAG H2 1 1 11 13733 3 2 1 NAG H3 H -6.400 -5.501 -2.701 1.00 . C A . 148 NAG H3 1 1 11 13734 3 2 1 NAG H4 H -6.029 -7.724 -3.790 1.00 . C A . 148 NAG H4 1 1 11 13735 3 2 1 NAG H5 H -4.564 -7.202 -6.059 1.00 . C A . 148 NAG H5 1 1 11 13736 3 2 1 NAG H61 H -7.422 -7.677 -6.667 1.00 . C A . 148 NAG H61 1 1 11 13737 3 2 1 NAG H62 H -6.800 -8.732 -5.398 1.00 . C A . 148 NAG H62 1 1 11 13738 3 2 1 NAG H81 H -3.369 -2.217 -2.564 1.00 . C A . 148 NAG H81 1 1 11 13739 3 2 1 NAG H82 H -3.649 -0.984 -3.799 1.00 . C A . 148 NAG H82 1 1 11 13740 3 2 1 NAG H83 H -4.391 -0.816 -2.195 1.00 . C A . 148 NAG H83 1 1 11 13741 3 2 1 NAG HN2 H -4.340 -4.058 -3.196 1.00 . C A . 148 NAG HN2 1 1 11 13742 3 2 1 NAG HO3 H -7.975 -6.801 -3.912 1.00 . C A . 148 NAG HO3 1 1 11 13743 3 2 1 NAG HO4 H -3.773 -7.251 -4.227 1.00 . C A . 148 NAG HO4 1 1 11 13744 3 2 1 NAG HO6 H -5.721 -8.322 -7.947 1.00 . C A . 148 NAG HO6 1 1 11 13745 3 2 1 NAG N2 N -5.123 -3.605 -3.621 1.00 . C A . 148 NAG N2 1 1 11 13746 3 2 1 NAG O3 O -7.832 -5.878 -4.071 1.00 . C A . 148 NAG O3 1 1 11 13747 3 2 1 NAG O4 O -4.323 -6.654 -3.737 1.00 . C A . 148 NAG O4 1 1 11 13748 3 2 1 NAG O5 O -5.966 -5.767 -6.385 1.00 . C A . 148 NAG O5 1 1 11 13749 3 2 1 NAG O6 O -5.878 -8.882 -7.198 1.00 . C A . 148 NAG O6 1 1 11 13750 3 2 1 NAG O7 O -6.420 -1.729 -3.618 1.00 . C A . 148 NAG O7 1 1 12 13751 1 1 1 HIS C C 2.391 -8.087 27.189 1.00 . A A . 1 HIS C 1 1 12 13752 1 1 1 HIS CA C 2.065 -9.127 28.263 1.00 . A A . 1 HIS CA 1 1 12 13753 1 1 1 HIS CB C 3.308 -9.370 29.119 1.00 . A A . 1 HIS CB 1 1 12 13754 1 1 1 HIS CD2 C 5.608 -10.420 28.808 1.00 . A A . 1 HIS CD2 1 1 12 13755 1 1 1 HIS CE1 C 5.547 -10.909 26.624 1.00 . A A . 1 HIS CE1 1 1 12 13756 1 1 1 HIS CG C 4.412 -10.023 28.337 1.00 . A A . 1 HIS CG 1 1 12 13757 1 1 1 HIS H1 H 0.960 -10.857 28.340 1.00 . A A . 1 HIS H1 1 1 12 13758 1 1 1 HIS H2 H 1.034 -10.140 26.803 1.00 . A A . 1 HIS H2 1 1 12 13759 1 1 1 HIS H3 H 2.382 -10.972 27.417 1.00 . A A . 1 HIS H3 1 1 12 13760 1 1 1 HIS HA H 1.262 -8.733 28.885 1.00 . A A . 1 HIS HA 1 1 12 13761 1 1 1 HIS HB2 H 3.666 -8.424 29.524 1.00 . A A . 1 HIS HB2 1 1 12 13762 1 1 1 HIS HB3 H 3.051 -9.999 29.972 1.00 . A A . 1 HIS HB3 1 1 12 13763 1 1 1 HIS HD2 H 5.947 -10.325 29.823 1.00 . A A . 1 HIS HD2 1 1 12 13764 1 1 1 HIS HE1 H 5.822 -11.264 25.634 1.00 . A A . 1 HIS HE1 1 1 12 13765 1 1 1 HIS HE2 H 7.289 -11.362 27.748 1.00 . A A . 1 HIS HE2 1 1 12 13766 1 1 1 HIS N N 1.575 -10.363 27.663 1.00 . A A . 1 HIS N 1 1 12 13767 1 1 1 HIS ND1 N 4.361 -10.340 26.899 1.00 . A A . 1 HIS ND1 1 1 12 13768 1 1 1 HIS NE2 N 6.359 -11.001 27.688 1.00 . A A . 1 HIS NE2 1 1 12 13769 1 1 1 HIS O O 3.475 -7.519 27.146 1.00 . A A . 1 HIS O 1 1 12 13770 1 1 2 MET C C 0.106 -6.004 25.435 1.00 . A A . 2 MET C 1 1 12 13771 1 1 2 MET CA C 1.451 -6.735 25.447 1.00 . A A . 2 MET CA 1 1 12 13772 1 1 2 MET CB C 1.821 -7.197 24.037 1.00 . A A . 2 MET CB 1 1 12 13773 1 1 2 MET CE C 4.371 -9.166 21.923 1.00 . A A . 2 MET CE 1 1 12 13774 1 1 2 MET CG C 3.189 -7.878 24.002 1.00 . A A . 2 MET CG 1 1 12 13775 1 1 2 MET H H 0.589 -8.499 26.309 1.00 . A A . 2 MET H 1 1 12 13776 1 1 2 MET HA H 2.216 -6.077 25.857 1.00 . A A . 2 MET HA 1 1 12 13777 1 1 2 MET HB2 H 1.061 -7.885 23.665 1.00 . A A . 2 MET HB2 1 1 12 13778 1 1 2 MET HB3 H 1.825 -6.341 23.362 1.00 . A A . 2 MET HB3 1 1 12 13779 1 1 2 MET HE1 H 5.355 -9.131 22.392 1.00 . A A . 2 MET HE1 1 1 12 13780 1 1 2 MET HE2 H 4.189 -8.216 21.421 1.00 . A A . 2 MET HE2 1 1 12 13781 1 1 2 MET HE3 H 4.367 -9.962 21.178 1.00 . A A . 2 MET HE3 1 1 12 13782 1 1 2 MET HG2 H 3.911 -7.244 23.486 1.00 . A A . 2 MET HG2 1 1 12 13783 1 1 2 MET HG3 H 3.560 -8.030 25.016 1.00 . A A . 2 MET HG3 1 1 12 13784 1 1 2 MET N N 1.375 -7.881 26.332 1.00 . A A . 2 MET N 1 1 12 13785 1 1 2 MET O O -0.894 -6.484 25.954 1.00 . A A . 2 MET O 1 1 12 13786 1 1 2 MET SD S 3.102 -9.468 23.163 1.00 . A A . 2 MET SD 1 1 12 13787 1 1 3 GLU C C -2.217 -4.316 24.552 1.00 . A A . 3 GLU C 1 1 12 13788 1 1 3 GLU CA C -0.866 -4.469 23.848 1.00 . A A . 3 GLU CA 1 1 12 13789 1 1 3 GLU CB C -0.943 -5.539 22.756 1.00 . A A . 3 GLU CB 1 1 12 13790 1 1 3 GLU CD C -1.977 -7.683 21.980 1.00 . A A . 3 GLU CD 1 1 12 13791 1 1 3 GLU CG C -1.846 -6.709 23.152 1.00 . A A . 3 GLU CG 1 1 12 13792 1 1 3 GLU H H 0.903 -4.171 25.015 1.00 . A A . 3 GLU H 1 1 12 13793 1 1 3 GLU HA H -0.577 -3.506 23.428 1.00 . A A . 3 GLU HA 1 1 12 13794 1 1 3 GLU HB2 H -1.324 -5.087 21.837 1.00 . A A . 3 GLU HB2 1 1 12 13795 1 1 3 GLU HB3 H 0.060 -5.914 22.545 1.00 . A A . 3 GLU HB3 1 1 12 13796 1 1 3 GLU HG2 H -1.432 -7.242 24.008 1.00 . A A . 3 GLU HG2 1 1 12 13797 1 1 3 GLU HG3 H -2.838 -6.353 23.427 1.00 . A A . 3 GLU HG3 1 1 12 13798 1 1 3 GLU N N 0.162 -4.812 24.814 1.00 . A A . 3 GLU N 1 1 12 13799 1 1 3 GLU O O -2.697 -5.203 25.247 1.00 . A A . 3 GLU O 1 1 12 13800 1 1 3 GLU OE1 O -1.209 -7.561 21.027 1.00 . A A . 3 GLU OE1 1 1 12 13801 1 1 3 GLU OE2 O -2.845 -8.552 22.034 1.00 . A A . 3 GLU OE2 1 1 12 13802 1 1 4 PRO C C -4.233 -3.442 22.349 1.00 . A A . 4 PRO C 1 1 12 13803 1 1 4 PRO CA C -4.152 -2.994 23.808 1.00 . A A . 4 PRO CA 1 1 12 13804 1 1 4 PRO CB C -4.482 -1.502 23.900 1.00 . A A . 4 PRO CB 1 1 12 13805 1 1 4 PRO CD C -2.144 -1.857 24.610 1.00 . A A . 4 PRO CD 1 1 12 13806 1 1 4 PRO CG C -3.211 -0.785 24.374 1.00 . A A . 4 PRO CG 1 1 12 13807 1 1 4 PRO HA H -4.838 -3.589 24.411 1.00 . A A . 4 PRO HA 1 1 12 13808 1 1 4 PRO HB2 H -4.798 -1.119 22.930 1.00 . A A . 4 PRO HB2 1 1 12 13809 1 1 4 PRO HB3 H -5.299 -1.335 24.602 1.00 . A A . 4 PRO HB3 1 1 12 13810 1 1 4 PRO HD2 H -1.294 -1.719 23.942 1.00 . A A . 4 PRO HD2 1 1 12 13811 1 1 4 PRO HD3 H -1.781 -1.850 25.637 1.00 . A A . 4 PRO HD3 1 1 12 13812 1 1 4 PRO HG2 H -2.877 -0.072 23.619 1.00 . A A . 4 PRO HG2 1 1 12 13813 1 1 4 PRO HG3 H -3.408 -0.231 25.291 1.00 . A A . 4 PRO HG3 1 1 12 13814 1 1 4 PRO N N -2.801 -3.120 24.324 1.00 . A A . 4 PRO N 1 1 12 13815 1 1 4 PRO O O -3.268 -3.374 21.598 1.00 . A A . 4 PRO O 1 1 12 13816 1 1 5 VAL C C -6.136 -4.570 19.673 1.00 . A A . 5 VAL C 1 1 12 13817 1 1 5 VAL CA C -5.518 -4.984 21.025 1.00 . A A . 5 VAL CA 1 1 12 13818 1 1 5 VAL CB C -6.295 -6.162 21.610 1.00 . A A . 5 VAL CB 1 1 12 13819 1 1 5 VAL CG1 C -5.982 -7.452 20.852 1.00 . A A . 5 VAL CG1 1 1 12 13820 1 1 5 VAL CG2 C -6.018 -6.325 23.105 1.00 . A A . 5 VAL CG2 1 1 12 13821 1 1 5 VAL H H -6.270 -3.498 22.405 1.00 . A A . 5 VAL H 1 1 12 13822 1 1 5 VAL HA H -4.490 -5.267 20.826 1.00 . A A . 5 VAL HA 1 1 12 13823 1 1 5 VAL HB H -7.354 -5.946 21.483 1.00 . A A . 5 VAL HB 1 1 12 13824 1 1 5 VAL HG11 H -6.895 -8.003 20.627 1.00 . A A . 5 VAL HG11 1 1 12 13825 1 1 5 VAL HG12 H -5.478 -7.237 19.909 1.00 . A A . 5 VAL HG12 1 1 12 13826 1 1 5 VAL HG13 H -5.333 -8.101 21.440 1.00 . A A . 5 VAL HG13 1 1 12 13827 1 1 5 VAL HG21 H -6.645 -5.653 23.692 1.00 . A A . 5 VAL HG21 1 1 12 13828 1 1 5 VAL HG22 H -6.222 -7.345 23.429 1.00 . A A . 5 VAL HG22 1 1 12 13829 1 1 5 VAL HG23 H -4.976 -6.099 23.334 1.00 . A A . 5 VAL HG23 1 1 12 13830 1 1 5 VAL N N -5.449 -3.903 22.003 1.00 . A A . 5 VAL N 1 1 12 13831 1 1 5 VAL O O -6.258 -5.389 18.770 1.00 . A A . 5 VAL O 1 1 12 13832 1 1 6 ASP C C -8.015 -3.863 17.722 1.00 . A A . 6 ASP C 1 1 12 13833 1 1 6 ASP CA C -7.382 -2.745 18.565 1.00 . A A . 6 ASP CA 1 1 12 13834 1 1 6 ASP CB C -6.626 -1.724 17.734 1.00 . A A . 6 ASP CB 1 1 12 13835 1 1 6 ASP CG C -6.340 -0.487 18.588 1.00 . A A . 6 ASP CG 1 1 12 13836 1 1 6 ASP H H -5.990 -2.657 20.204 1.00 . A A . 6 ASP H 1 1 12 13837 1 1 6 ASP HA H -8.181 -2.219 19.073 1.00 . A A . 6 ASP HA 1 1 12 13838 1 1 6 ASP HB2 H -5.687 -2.157 17.396 1.00 . A A . 6 ASP HB2 1 1 12 13839 1 1 6 ASP HB3 H -7.224 -1.409 16.885 1.00 . A A . 6 ASP HB3 1 1 12 13840 1 1 6 ASP N N -6.478 -3.268 19.582 1.00 . A A . 6 ASP N 1 1 12 13841 1 1 6 ASP O O -8.454 -4.883 18.238 1.00 . A A . 6 ASP O 1 1 12 13842 1 1 6 ASP OD1 O -6.211 -0.629 19.803 1.00 . A A . 6 ASP OD1 1 1 12 13843 1 1 6 ASP OD2 O -6.248 0.604 18.028 1.00 . A A . 6 ASP OD2 1 1 12 13844 1 1 7 PRO C C -5.799 -3.475 15.396 1.00 . A A . 7 PRO C 1 1 12 13845 1 1 7 PRO CA C -7.141 -4.208 15.442 1.00 . A A . 7 PRO CA 1 1 12 13846 1 1 7 PRO CB C -7.829 -4.051 14.084 1.00 . A A . 7 PRO CB 1 1 12 13847 1 1 7 PRO CD C -9.142 -2.850 15.792 1.00 . A A . 7 PRO CD 1 1 12 13848 1 1 7 PRO CG C -9.057 -3.153 14.294 1.00 . A A . 7 PRO CG 1 1 12 13849 1 1 7 PRO HA H -6.979 -5.257 15.688 1.00 . A A . 7 PRO HA 1 1 12 13850 1 1 7 PRO HB2 H -7.147 -3.599 13.365 1.00 . A A . 7 PRO HB2 1 1 12 13851 1 1 7 PRO HB3 H -8.130 -5.023 13.693 1.00 . A A . 7 PRO HB3 1 1 12 13852 1 1 7 PRO HD2 H -9.010 -1.787 15.992 1.00 . A A . 7 PRO HD2 1 1 12 13853 1 1 7 PRO HD3 H -10.098 -3.168 16.209 1.00 . A A . 7 PRO HD3 1 1 12 13854 1 1 7 PRO HG2 H -8.955 -2.231 13.723 1.00 . A A . 7 PRO HG2 1 1 12 13855 1 1 7 PRO HG3 H -9.962 -3.654 13.953 1.00 . A A . 7 PRO HG3 1 1 12 13856 1 1 7 PRO N N -8.060 -3.608 16.397 1.00 . A A . 7 PRO N 1 1 12 13857 1 1 7 PRO O O -4.738 -4.034 15.646 1.00 . A A . 7 PRO O 1 1 12 13858 1 1 8 CYS C C -3.584 -1.593 15.386 1.00 . A A . 8 CYS C 1 1 12 13859 1 1 8 CYS CA C -4.815 -1.463 14.489 1.00 . A A . 8 CYS CA 1 1 12 13860 1 1 8 CYS CB C -5.179 0.010 14.314 1.00 . A A . 8 CYS CB 1 1 12 13861 1 1 8 CYS H H -6.818 -1.734 15.224 1.00 . A A . 8 CYS H 1 1 12 13862 1 1 8 CYS HA H -4.609 -1.933 13.529 1.00 . A A . 8 CYS HA 1 1 12 13863 1 1 8 CYS HB2 H -5.629 0.161 13.331 1.00 . A A . 8 CYS HB2 1 1 12 13864 1 1 8 CYS HB3 H -5.915 0.289 15.067 1.00 . A A . 8 CYS HB3 1 1 12 13865 1 1 8 CYS N N -5.940 -2.182 15.056 1.00 . A A . 8 CYS N 1 1 12 13866 1 1 8 CYS O O -2.569 -2.143 14.984 1.00 . A A . 8 CYS O 1 1 12 13867 1 1 8 CYS SG S -3.753 1.112 14.475 1.00 . A A . 8 CYS SG 1 1 12 13868 1 1 9 PHE C C -1.380 -1.520 17.158 1.00 . A A . 9 PHE C 1 1 12 13869 1 1 9 PHE CA C -2.649 -0.765 17.514 1.00 . A A . 9 PHE CA 1 1 12 13870 1 1 9 PHE CB C -3.063 -1.091 18.943 1.00 . A A . 9 PHE CB 1 1 12 13871 1 1 9 PHE CD1 C -0.835 -1.367 20.150 1.00 . A A . 9 PHE CD1 1 1 12 13872 1 1 9 PHE CD2 C -2.250 0.617 20.651 1.00 . A A . 9 PHE CD2 1 1 12 13873 1 1 9 PHE CE1 C 0.152 -0.903 21.089 1.00 . A A . 9 PHE CE1 1 1 12 13874 1 1 9 PHE CE2 C -1.265 1.085 21.590 1.00 . A A . 9 PHE CE2 1 1 12 13875 1 1 9 PHE CG C -2.039 -0.609 19.926 1.00 . A A . 9 PHE CG 1 1 12 13876 1 1 9 PHE CZ C -0.064 0.325 21.808 1.00 . A A . 9 PHE CZ 1 1 12 13877 1 1 9 PHE H H -4.676 -0.789 16.899 1.00 . A A . 9 PHE H 1 1 12 13878 1 1 9 PHE HA H -2.443 0.277 17.417 1.00 . A A . 9 PHE HA 1 1 12 13879 1 1 9 PHE HB2 H -4.024 -0.622 19.170 1.00 . A A . 9 PHE HB2 1 1 12 13880 1 1 9 PHE HB3 H -3.169 -2.171 19.040 1.00 . A A . 9 PHE HB3 1 1 12 13881 1 1 9 PHE HD1 H -0.672 -2.289 19.611 1.00 . A A . 9 PHE HD1 1 1 12 13882 1 1 9 PHE HD2 H -3.152 1.188 20.489 1.00 . A A . 9 PHE HD2 1 1 12 13883 1 1 9 PHE HE1 H 1.053 -1.475 21.252 1.00 . A A . 9 PHE HE1 1 1 12 13884 1 1 9 PHE HE2 H -1.429 2.006 22.130 1.00 . A A . 9 PHE HE2 1 1 12 13885 1 1 9 PHE HZ H 0.677 0.676 22.510 1.00 . A A . 9 PHE HZ 1 1 12 13886 1 1 9 PHE N N -3.755 -1.050 16.609 1.00 . A A . 9 PHE N 1 1 12 13887 1 1 9 PHE O O -0.322 -0.978 16.861 1.00 . A A . 9 PHE O 1 1 12 13888 1 1 10 ARG C C 0.255 -3.779 15.816 1.00 . A A . 10 ARG C 1 1 12 13889 1 1 10 ARG CA C -0.559 -3.822 17.132 1.00 . A A . 10 ARG CA 1 1 12 13890 1 1 10 ARG CB C -1.183 -5.199 17.281 1.00 . A A . 10 ARG CB 1 1 12 13891 1 1 10 ARG CD C -0.046 -7.412 17.658 1.00 . A A . 10 ARG CD 1 1 12 13892 1 1 10 ARG CG C -0.383 -6.050 18.260 1.00 . A A . 10 ARG CG 1 1 12 13893 1 1 10 ARG CZ C -1.757 -8.841 18.547 1.00 . A A . 10 ARG CZ 1 1 12 13894 1 1 10 ARG H H -2.594 -2.947 17.406 1.00 . A A . 10 ARG H 1 1 12 13895 1 1 10 ARG HA H 0.112 -3.617 17.961 1.00 . A A . 10 ARG HA 1 1 12 13896 1 1 10 ARG HB2 H -2.209 -5.079 17.638 1.00 . A A . 10 ARG HB2 1 1 12 13897 1 1 10 ARG HB3 H -1.213 -5.695 16.306 1.00 . A A . 10 ARG HB3 1 1 12 13898 1 1 10 ARG HD2 H 0.412 -7.305 16.674 1.00 . A A . 10 ARG HD2 1 1 12 13899 1 1 10 ARG HD3 H 0.621 -7.984 18.302 1.00 . A A . 10 ARG HD3 1 1 12 13900 1 1 10 ARG HE H -1.704 -8.247 16.589 1.00 . A A . 10 ARG HE 1 1 12 13901 1 1 10 ARG HG2 H 0.538 -5.532 18.524 1.00 . A A . 10 ARG HG2 1 1 12 13902 1 1 10 ARG HG3 H -0.948 -6.164 19.184 1.00 . A A . 10 ARG HG3 1 1 12 13903 1 1 10 ARG HH11 H -0.209 -9.168 19.811 1.00 . A A . 10 ARG HH11 1 1 12 13904 1 1 10 ARG HH12 H -1.120 -10.576 19.373 1.00 . A A . 10 ARG HH12 1 1 12 13905 1 1 10 ARG HH21 H -3.452 -7.831 19.003 1.00 . A A . 10 ARG HH21 1 1 12 13906 1 1 10 ARG HH22 H -3.619 -9.552 18.900 1.00 . A A . 10 ARG HH22 1 1 12 13907 1 1 10 ARG N N -1.621 -2.823 17.226 1.00 . A A . 10 ARG N 1 1 12 13908 1 1 10 ARG NE N -1.254 -8.194 17.480 1.00 . A A . 10 ARG NE 1 1 12 13909 1 1 10 ARG NH1 N -0.963 -9.590 19.306 1.00 . A A . 10 ARG NH1 1 1 12 13910 1 1 10 ARG NH2 N -3.050 -8.732 18.841 1.00 . A A . 10 ARG NH2 1 1 12 13911 1 1 10 ARG O O 1.180 -4.555 15.612 1.00 . A A . 10 ARG O 1 1 12 13912 1 1 11 ALA C C 0.753 -3.685 12.798 1.00 . A A . 11 ALA C 1 1 12 13913 1 1 11 ALA CA C -0.478 -3.209 13.593 1.00 . A A . 11 ALA CA 1 1 12 13914 1 1 11 ALA CB C -1.153 -2.016 12.910 1.00 . A A . 11 ALA CB 1 1 12 13915 1 1 11 ALA H H -0.639 -2.099 15.418 1.00 . A A . 11 ALA H 1 1 12 13916 1 1 11 ALA HA H -1.210 -4.013 13.674 1.00 . A A . 11 ALA HA 1 1 12 13917 1 1 11 ALA HB1 H -1.082 -1.122 13.530 1.00 . A A . 11 ALA HB1 1 1 12 13918 1 1 11 ALA HB2 H -0.699 -1.799 11.944 1.00 . A A . 11 ALA HB2 1 1 12 13919 1 1 11 ALA HB3 H -2.213 -2.215 12.748 1.00 . A A . 11 ALA HB3 1 1 12 13920 1 1 11 ALA N N -0.149 -2.832 14.957 1.00 . A A . 11 ALA N 1 1 12 13921 1 1 11 ALA O O 0.632 -4.433 11.835 1.00 . A A . 11 ALA O 1 1 12 13922 1 1 12 ASN C C 2.642 -2.750 10.950 1.00 . A A . 12 ASN C 1 1 12 13923 1 1 12 ASN CA C 2.711 -2.314 12.417 1.00 . A A . 12 ASN CA 1 1 12 13924 1 1 12 ASN CB C 4.164 -2.314 12.894 1.00 . A A . 12 ASN CB 1 1 12 13925 1 1 12 ASN CG C 4.555 -0.916 13.377 1.00 . A A . 12 ASN CG 1 1 12 13926 1 1 12 ASN H H 2.267 -3.475 14.156 1.00 . A A . 12 ASN H 1 1 12 13927 1 1 12 ASN HA H 2.262 -1.327 12.524 1.00 . A A . 12 ASN HA 1 1 12 13928 1 1 12 ASN HB2 H 4.298 -3.020 13.713 1.00 . A A . 12 ASN HB2 1 1 12 13929 1 1 12 ASN HB3 H 4.834 -2.611 12.087 1.00 . A A . 12 ASN HB3 1 1 12 13930 1 1 12 ASN HD21 H 4.808 0.024 11.591 1.00 . A A . 12 ASN HD21 1 1 12 13931 1 1 12 ASN HD22 H 6.200 0.044 12.659 1.00 . A A . 12 ASN HD22 1 1 12 13932 1 1 12 ASN N N 1.935 -3.216 13.249 1.00 . A A . 12 ASN N 1 1 12 13933 1 1 12 ASN ND2 N 5.250 -0.220 12.461 1.00 . A A . 12 ASN ND2 1 1 12 13934 1 1 12 ASN O O 3.488 -3.483 10.453 1.00 . A A . 12 ASN O 1 1 12 13935 1 1 12 ASN OD1 O 4.250 -0.507 14.491 1.00 . A A . 12 ASN OD1 1 1 12 13936 1 1 13 CYS C C 3.050 -0.412 9.496 1.00 . A A . 13 CYS C 1 1 12 13937 1 1 13 CYS CA C 1.660 -1.060 9.455 1.00 . A A . 13 CYS CA 1 1 12 13938 1 1 13 CYS CB C 0.570 -0.072 9.871 1.00 . A A . 13 CYS CB 1 1 12 13939 1 1 13 CYS H H 0.691 -2.702 10.371 1.00 . A A . 13 CYS H 1 1 12 13940 1 1 13 CYS HA H 1.474 -1.409 8.438 1.00 . A A . 13 CYS HA 1 1 12 13941 1 1 13 CYS HB2 H 0.727 0.267 10.898 1.00 . A A . 13 CYS HB2 1 1 12 13942 1 1 13 CYS HB3 H 0.599 0.805 9.221 1.00 . A A . 13 CYS HB3 1 1 12 13943 1 1 13 CYS N N 1.576 -2.245 10.298 1.00 . A A . 13 CYS N 1 1 12 13944 1 1 13 CYS O O 3.456 0.213 10.467 1.00 . A A . 13 CYS O 1 1 12 13945 1 1 13 CYS SG S -1.066 -0.835 9.752 1.00 . A A . 13 CYS SG 1 1 12 13946 1 1 14 GLU C C 4.467 1.700 8.308 1.00 . A A . 14 GLU C 1 1 12 13947 1 1 14 GLU CA C 4.838 0.245 8.011 1.00 . A A . 14 GLU CA 1 1 12 13948 1 1 14 GLU CB C 5.184 0.076 6.534 1.00 . A A . 14 GLU CB 1 1 12 13949 1 1 14 GLU CD C 6.892 0.787 4.846 1.00 . A A . 14 GLU CD 1 1 12 13950 1 1 14 GLU CG C 5.998 1.254 5.997 1.00 . A A . 14 GLU CG 1 1 12 13951 1 1 14 GLU H H 3.476 -1.407 7.784 1.00 . A A . 14 GLU H 1 1 12 13952 1 1 14 GLU HA H 5.680 -0.050 8.631 1.00 . A A . 14 GLU HA 1 1 12 13953 1 1 14 GLU HB2 H 5.741 -0.850 6.390 1.00 . A A . 14 GLU HB2 1 1 12 13954 1 1 14 GLU HB3 H 4.261 -0.025 5.967 1.00 . A A . 14 GLU HB3 1 1 12 13955 1 1 14 GLU HG2 H 5.340 2.044 5.637 1.00 . A A . 14 GLU HG2 1 1 12 13956 1 1 14 GLU HG3 H 6.626 1.675 6.782 1.00 . A A . 14 GLU HG3 1 1 12 13957 1 1 14 GLU N N 3.737 -0.634 8.362 1.00 . A A . 14 GLU N 1 1 12 13958 1 1 14 GLU O O 4.903 2.288 9.291 1.00 . A A . 14 GLU O 1 1 12 13959 1 1 14 GLU OE1 O 6.772 -0.368 4.440 1.00 . A A . 14 GLU OE1 1 1 12 13960 1 1 14 GLU OE2 O 7.697 1.585 4.368 1.00 . A A . 14 GLU OE2 1 1 12 13961 1 1 15 TYR C C 1.899 2.859 8.961 1.00 . A A . 15 TYR C 1 1 12 13962 1 1 15 TYR CA C 2.796 3.339 7.818 1.00 . A A . 15 TYR CA 1 1 12 13963 1 1 15 TYR CB C 2.004 3.873 6.613 1.00 . A A . 15 TYR CB 1 1 12 13964 1 1 15 TYR CD1 C 2.860 6.212 6.093 1.00 . A A . 15 TYR CD1 1 1 12 13965 1 1 15 TYR CD2 C 0.701 5.966 7.305 1.00 . A A . 15 TYR CD2 1 1 12 13966 1 1 15 TYR CE1 C 2.725 7.643 6.137 1.00 . A A . 15 TYR CE1 1 1 12 13967 1 1 15 TYR CE2 C 0.562 7.397 7.350 1.00 . A A . 15 TYR CE2 1 1 12 13968 1 1 15 TYR CG C 1.850 5.366 6.674 1.00 . A A . 15 TYR CG 1 1 12 13969 1 1 15 TYR CZ C 1.575 8.235 6.766 1.00 . A A . 15 TYR CZ 1 1 12 13970 1 1 15 TYR H H 3.540 1.863 6.475 1.00 . A A . 15 TYR H 1 1 12 13971 1 1 15 TYR HA H 3.464 4.108 8.201 1.00 . A A . 15 TYR HA 1 1 12 13972 1 1 15 TYR HB2 H 2.550 3.639 5.709 1.00 . A A . 15 TYR HB2 1 1 12 13973 1 1 15 TYR HB3 H 1.022 3.394 6.526 1.00 . A A . 15 TYR HB3 1 1 12 13974 1 1 15 TYR HD1 H 3.725 5.769 5.621 1.00 . A A . 15 TYR HD1 1 1 12 13975 1 1 15 TYR HD2 H -0.063 5.347 7.749 1.00 . A A . 15 TYR HD2 1 1 12 13976 1 1 15 TYR HE1 H 3.485 8.271 5.696 1.00 . A A . 15 TYR HE1 1 1 12 13977 1 1 15 TYR HE2 H -0.302 7.842 7.821 1.00 . A A . 15 TYR HE2 1 1 12 13978 1 1 15 TYR HH H 0.598 9.833 7.176 1.00 . A A . 15 TYR HH 1 1 12 13979 1 1 15 TYR N N 3.634 2.236 7.397 1.00 . A A . 15 TYR N 1 1 12 13980 1 1 15 TYR O O 2.320 2.143 9.861 1.00 . A A . 15 TYR O 1 1 12 13981 1 1 15 TYR OH O 1.443 9.609 6.810 1.00 . A A . 15 TYR OH 1 1 12 13982 1 1 16 GLN C C -1.455 2.197 9.445 1.00 . A A . 16 GLN C 1 1 12 13983 1 1 16 GLN CA C -0.278 3.035 9.940 1.00 . A A . 16 GLN CA 1 1 12 13984 1 1 16 GLN CB C -0.738 4.355 10.556 1.00 . A A . 16 GLN CB 1 1 12 13985 1 1 16 GLN CD C -1.342 5.555 12.672 1.00 . A A . 16 GLN CD 1 1 12 13986 1 1 16 GLN CG C -0.909 4.217 12.067 1.00 . A A . 16 GLN CG 1 1 12 13987 1 1 16 GLN H H 0.452 3.880 8.064 1.00 . A A . 16 GLN H 1 1 12 13988 1 1 16 GLN HA H 0.264 2.443 10.666 1.00 . A A . 16 GLN HA 1 1 12 13989 1 1 16 GLN HB2 H -0.012 5.127 10.332 1.00 . A A . 16 GLN HB2 1 1 12 13990 1 1 16 GLN HB3 H -1.685 4.646 10.090 1.00 . A A . 16 GLN HB3 1 1 12 13991 1 1 16 GLN HE21 H -2.696 5.724 11.161 1.00 . A A . 16 GLN HE21 1 1 12 13992 1 1 16 GLN HE22 H -2.450 7.170 12.121 1.00 . A A . 16 GLN HE22 1 1 12 13993 1 1 16 GLN HG2 H -1.656 3.457 12.297 1.00 . A A . 16 GLN HG2 1 1 12 13994 1 1 16 GLN HG3 H 0.028 3.900 12.526 1.00 . A A . 16 GLN HG3 1 1 12 13995 1 1 16 GLN N N 0.643 3.309 8.861 1.00 . A A . 16 GLN N 1 1 12 13996 1 1 16 GLN NE2 N -2.243 6.208 11.917 1.00 . A A . 16 GLN NE2 1 1 12 13997 1 1 16 GLN O O -1.351 1.406 8.517 1.00 . A A . 16 GLN O 1 1 12 13998 1 1 16 GLN OE1 O -0.891 5.959 13.737 1.00 . A A . 16 GLN OE1 1 1 12 13999 1 1 17 CYS C C -4.813 2.183 9.216 1.00 . A A . 17 CYS C 1 1 12 14000 1 1 17 CYS CA C -3.712 1.558 10.078 1.00 . A A . 17 CYS CA 1 1 12 14001 1 1 17 CYS CB C -4.221 1.311 11.496 1.00 . A A . 17 CYS CB 1 1 12 14002 1 1 17 CYS H H -2.450 3.192 10.812 1.00 . A A . 17 CYS H 1 1 12 14003 1 1 17 CYS HA H -3.355 0.625 9.643 1.00 . A A . 17 CYS HA 1 1 12 14004 1 1 17 CYS HB2 H -4.775 2.180 11.851 1.00 . A A . 17 CYS HB2 1 1 12 14005 1 1 17 CYS HB3 H -4.911 0.467 11.499 1.00 . A A . 17 CYS HB3 1 1 12 14006 1 1 17 CYS N N -2.574 2.453 10.144 1.00 . A A . 17 CYS N 1 1 12 14007 1 1 17 CYS O O -5.127 3.361 9.329 1.00 . A A . 17 CYS O 1 1 12 14008 1 1 17 CYS SG S -2.865 0.969 12.646 1.00 . A A . 17 CYS SG 1 1 12 14009 1 1 18 GLN C C -7.352 0.034 9.114 1.00 . A A . 18 GLN C 1 1 12 14010 1 1 18 GLN CA C -6.825 1.229 8.300 1.00 . A A . 18 GLN CA 1 1 12 14011 1 1 18 GLN CB C -7.255 1.045 6.848 1.00 . A A . 18 GLN CB 1 1 12 14012 1 1 18 GLN CD C -8.481 2.916 5.703 1.00 . A A . 18 GLN CD 1 1 12 14013 1 1 18 GLN CG C -8.626 1.665 6.575 1.00 . A A . 18 GLN CG 1 1 12 14014 1 1 18 GLN H H -4.787 0.886 7.662 1.00 . A A . 18 GLN H 1 1 12 14015 1 1 18 GLN HA H -7.212 2.167 8.691 1.00 . A A . 18 GLN HA 1 1 12 14016 1 1 18 GLN HB2 H -6.504 1.484 6.188 1.00 . A A . 18 GLN HB2 1 1 12 14017 1 1 18 GLN HB3 H -7.298 -0.024 6.634 1.00 . A A . 18 GLN HB3 1 1 12 14018 1 1 18 GLN HE21 H -7.181 3.822 6.987 1.00 . A A . 18 GLN HE21 1 1 12 14019 1 1 18 GLN HE22 H -6.848 4.052 5.281 1.00 . A A . 18 GLN HE22 1 1 12 14020 1 1 18 GLN HG2 H -9.270 0.950 6.063 1.00 . A A . 18 GLN HG2 1 1 12 14021 1 1 18 GLN HG3 H -9.115 1.938 7.510 1.00 . A A . 18 GLN HG3 1 1 12 14022 1 1 18 GLN N N -5.372 1.316 8.352 1.00 . A A . 18 GLN N 1 1 12 14023 1 1 18 GLN NE2 N -7.408 3.664 6.020 1.00 . A A . 18 GLN NE2 1 1 12 14024 1 1 18 GLN O O -7.385 -1.086 8.623 1.00 . A A . 18 GLN O 1 1 12 14025 1 1 18 GLN OE1 O -9.282 3.178 4.814 1.00 . A A . 18 GLN OE1 1 1 12 14026 1 1 19 PRO C C -9.674 -1.314 10.832 1.00 . A A . 19 PRO C 1 1 12 14027 1 1 19 PRO CA C -8.407 -0.602 11.300 1.00 . A A . 19 PRO CA 1 1 12 14028 1 1 19 PRO CB C -8.816 0.244 12.494 1.00 . A A . 19 PRO CB 1 1 12 14029 1 1 19 PRO CD C -7.554 1.658 10.949 1.00 . A A . 19 PRO CD 1 1 12 14030 1 1 19 PRO CG C -7.999 1.529 12.401 1.00 . A A . 19 PRO CG 1 1 12 14031 1 1 19 PRO HA H -7.684 -1.340 11.640 1.00 . A A . 19 PRO HA 1 1 12 14032 1 1 19 PRO HB2 H -9.884 0.463 12.430 1.00 . A A . 19 PRO HB2 1 1 12 14033 1 1 19 PRO HB3 H -8.635 -0.288 13.424 1.00 . A A . 19 PRO HB3 1 1 12 14034 1 1 19 PRO HD2 H -8.152 2.404 10.425 1.00 . A A . 19 PRO HD2 1 1 12 14035 1 1 19 PRO HD3 H -6.504 1.934 10.886 1.00 . A A . 19 PRO HD3 1 1 12 14036 1 1 19 PRO HG2 H -8.591 2.386 12.704 1.00 . A A . 19 PRO HG2 1 1 12 14037 1 1 19 PRO HG3 H -7.123 1.447 13.043 1.00 . A A . 19 PRO HG3 1 1 12 14038 1 1 19 PRO N N -7.770 0.343 10.372 1.00 . A A . 19 PRO N 1 1 12 14039 1 1 19 PRO O O -10.561 -1.622 11.618 1.00 . A A . 19 PRO O 1 1 12 14040 1 1 20 LEU C C -10.764 -2.375 7.557 1.00 . A A . 20 LEU C 1 1 12 14041 1 1 20 LEU CA C -10.391 -2.704 8.997 1.00 . A A . 20 LEU CA 1 1 12 14042 1 1 20 LEU CB C -11.621 -3.044 9.848 1.00 . A A . 20 LEU CB 1 1 12 14043 1 1 20 LEU CD1 C -12.779 -5.278 9.804 1.00 . A A . 20 LEU CD1 1 1 12 14044 1 1 20 LEU CD2 C -14.011 -3.209 9.073 1.00 . A A . 20 LEU CD2 1 1 12 14045 1 1 20 LEU CG C -12.654 -3.911 9.129 1.00 . A A . 20 LEU CG 1 1 12 14046 1 1 20 LEU H H -9.240 -0.913 8.891 1.00 . A A . 20 LEU H 1 1 12 14047 1 1 20 LEU HA H -9.698 -3.515 9.066 1.00 . A A . 20 LEU HA 1 1 12 14048 1 1 20 LEU HB2 H -11.291 -3.586 10.735 1.00 . A A . 20 LEU HB2 1 1 12 14049 1 1 20 LEU HB3 H -12.100 -2.131 10.190 1.00 . A A . 20 LEU HB3 1 1 12 14050 1 1 20 LEU HD11 H -13.002 -6.054 9.072 1.00 . A A . 20 LEU HD11 1 1 12 14051 1 1 20 LEU HD12 H -11.853 -5.548 10.311 1.00 . A A . 20 LEU HD12 1 1 12 14052 1 1 20 LEU HD13 H -13.579 -5.273 10.545 1.00 . A A . 20 LEU HD13 1 1 12 14053 1 1 20 LEU HD21 H -13.889 -2.134 8.943 1.00 . A A . 20 LEU HD21 1 1 12 14054 1 1 20 LEU HD22 H -14.609 -3.584 8.243 1.00 . A A . 20 LEU HD22 1 1 12 14055 1 1 20 LEU HD23 H -14.572 -3.376 9.993 1.00 . A A . 20 LEU HD23 1 1 12 14056 1 1 20 LEU HG H -12.317 -4.076 8.110 1.00 . A A . 20 LEU HG 1 1 12 14057 1 1 20 LEU N N -9.696 -1.545 9.517 1.00 . A A . 20 LEU N 1 1 12 14058 1 1 20 LEU O O -10.269 -2.884 6.561 1.00 . A A . 20 LEU O 1 1 12 14059 1 1 21 ASN C C -12.270 -1.481 5.251 1.00 . A A . 21 ASN C 1 1 12 14060 1 1 21 ASN CA C -12.743 -1.199 6.675 1.00 . A A . 21 ASN CA 1 1 12 14061 1 1 21 ASN CB C -13.244 0.241 6.783 1.00 . A A . 21 ASN CB 1 1 12 14062 1 1 21 ASN CG C -14.645 0.254 7.399 1.00 . A A . 21 ASN CG 1 1 12 14063 1 1 21 ASN H H -11.587 -1.098 8.570 1.00 . A A . 21 ASN H 1 1 12 14064 1 1 21 ASN HA H -13.532 -1.904 6.939 1.00 . A A . 21 ASN HA 1 1 12 14065 1 1 21 ASN HB2 H -12.577 0.830 7.417 1.00 . A A . 21 ASN HB2 1 1 12 14066 1 1 21 ASN HB3 H -13.292 0.703 5.794 1.00 . A A . 21 ASN HB3 1 1 12 14067 1 1 21 ASN HD21 H -14.440 2.206 7.984 1.00 . A A . 21 ASN HD21 1 1 12 14068 1 1 21 ASN N N -11.670 -1.412 7.629 1.00 . A A . 21 ASN N 1 1 12 14069 1 1 21 ASN ND2 N -14.864 1.323 8.186 1.00 . A A . 21 ASN ND2 1 1 12 14070 1 1 21 ASN O O -11.143 -1.190 4.868 1.00 . A A . 21 ASN O 1 1 12 14071 1 1 21 ASN OD1 O -15.458 -0.635 7.178 1.00 . A A . 21 ASN OD1 1 1 12 14072 1 1 22 GLN C C -12.425 -4.337 4.151 1.00 . A A . 22 GLN C 1 1 12 14073 1 1 22 GLN CA C -13.512 -3.461 4.774 1.00 . A A . 22 GLN CA 1 1 12 14074 1 1 22 GLN CB C -14.891 -3.829 4.227 1.00 . A A . 22 GLN CB 1 1 12 14075 1 1 22 GLN CD C -16.479 -3.393 2.346 1.00 . A A . 22 GLN CD 1 1 12 14076 1 1 22 GLN CG C -15.007 -3.577 2.723 1.00 . A A . 22 GLN CG 1 1 12 14077 1 1 22 GLN H H -13.706 -1.561 3.789 1.00 . A A . 22 GLN H 1 1 12 14078 1 1 22 GLN HA H -13.482 -3.577 5.858 1.00 . A A . 22 GLN HA 1 1 12 14079 1 1 22 GLN HB2 H -15.098 -4.878 4.437 1.00 . A A . 22 GLN HB2 1 1 12 14080 1 1 22 GLN HB3 H -15.654 -3.252 4.750 1.00 . A A . 22 GLN HB3 1 1 12 14081 1 1 22 GLN HE21 H -15.961 -3.144 0.394 1.00 . A A . 22 GLN HE21 1 1 12 14082 1 1 22 GLN HE22 H -17.457 -2.371 0.883 1.00 . A A . 22 GLN HE22 1 1 12 14083 1 1 22 GLN HG2 H -14.454 -2.683 2.437 1.00 . A A . 22 GLN HG2 1 1 12 14084 1 1 22 GLN HG3 H -14.599 -4.416 2.160 1.00 . A A . 22 GLN HG3 1 1 12 14085 1 1 22 GLN N N -13.221 -2.067 4.502 1.00 . A A . 22 GLN N 1 1 12 14086 1 1 22 GLN NE2 N -16.647 -2.928 1.095 1.00 . A A . 22 GLN NE2 1 1 12 14087 1 1 22 GLN O O -12.691 -5.323 3.475 1.00 . A A . 22 GLN O 1 1 12 14088 1 1 22 GLN OE1 O -17.385 -3.654 3.128 1.00 . A A . 22 GLN OE1 1 1 12 14089 1 1 23 THR C C -10.033 -5.880 5.428 1.00 . A A . 23 THR C 1 1 12 14090 1 1 23 THR CA C -10.079 -4.836 4.311 1.00 . A A . 23 THR CA 1 1 12 14091 1 1 23 THR CB C -8.753 -4.081 4.221 1.00 . A A . 23 THR CB 1 1 12 14092 1 1 23 THR CG2 C -7.677 -4.904 3.511 1.00 . A A . 23 THR CG2 1 1 12 14093 1 1 23 THR H H -11.024 -2.955 4.720 1.00 . A A . 23 THR H 1 1 12 14094 1 1 23 THR HA H -10.315 -5.383 3.422 1.00 . A A . 23 THR HA 1 1 12 14095 1 1 23 THR HB H -8.414 -3.825 5.227 1.00 . A A . 23 THR HB 1 1 12 14096 1 1 23 THR HG1 H -8.109 -2.625 3.170 1.00 . A A . 23 THR HG1 1 1 12 14097 1 1 23 THR HG21 H -7.966 -5.116 2.482 1.00 . A A . 23 THR HG21 1 1 12 14098 1 1 23 THR HG22 H -6.728 -4.368 3.491 1.00 . A A . 23 THR HG22 1 1 12 14099 1 1 23 THR HG23 H -7.518 -5.855 4.019 1.00 . A A . 23 THR HG23 1 1 12 14100 1 1 23 THR N N -11.184 -3.899 4.433 1.00 . A A . 23 THR N 1 1 12 14101 1 1 23 THR O O -9.614 -7.017 5.248 1.00 . A A . 23 THR O 1 1 12 14102 1 1 23 THR OG1 O -8.950 -2.873 3.530 1.00 . A A . 23 THR OG1 1 1 12 14103 1 1 24 SER C C -8.487 -5.856 7.848 1.00 . A A . 24 SER C 1 1 12 14104 1 1 24 SER CA C -10.013 -5.910 7.828 1.00 . A A . 24 SER CA 1 1 12 14105 1 1 24 SER CB C -10.612 -7.275 8.084 1.00 . A A . 24 SER CB 1 1 12 14106 1 1 24 SER H H -11.007 -4.554 6.497 1.00 . A A . 24 SER H 1 1 12 14107 1 1 24 SER HA H -10.416 -5.251 8.588 1.00 . A A . 24 SER HA 1 1 12 14108 1 1 24 SER HB2 H -10.510 -7.539 9.134 1.00 . A A . 24 SER HB2 1 1 12 14109 1 1 24 SER HB3 H -11.674 -7.200 7.862 1.00 . A A . 24 SER HB3 1 1 12 14110 1 1 24 SER HG H -9.758 -8.968 7.873 1.00 . A A . 24 SER HG 1 1 12 14111 1 1 24 SER N N -10.493 -5.398 6.579 1.00 . A A . 24 SER N 1 1 12 14112 1 1 24 SER O O -7.780 -6.368 6.989 1.00 . A A . 24 SER O 1 1 12 14113 1 1 24 SER OG O -10.033 -8.276 7.286 1.00 . A A . 24 SER OG 1 1 12 14114 1 1 25 TYR C C -6.048 -4.021 8.147 1.00 . A A . 25 TYR C 1 1 12 14115 1 1 25 TYR CA C -7.406 -3.887 8.812 1.00 . A A . 25 TYR CA 1 1 12 14116 1 1 25 TYR CB C -7.214 -3.317 10.229 1.00 . A A . 25 TYR CB 1 1 12 14117 1 1 25 TYR CD1 C -6.867 -5.472 11.552 1.00 . A A . 25 TYR CD1 1 1 12 14118 1 1 25 TYR CD2 C -4.986 -3.857 11.343 1.00 . A A . 25 TYR CD2 1 1 12 14119 1 1 25 TYR CE1 C -6.031 -6.347 12.331 1.00 . A A . 25 TYR CE1 1 1 12 14120 1 1 25 TYR CE2 C -4.146 -4.730 12.120 1.00 . A A . 25 TYR CE2 1 1 12 14121 1 1 25 TYR CG C -6.348 -4.225 11.053 1.00 . A A . 25 TYR CG 1 1 12 14122 1 1 25 TYR CZ C -4.670 -5.976 12.613 1.00 . A A . 25 TYR CZ 1 1 12 14123 1 1 25 TYR H H -8.605 -5.397 9.739 1.00 . A A . 25 TYR H 1 1 12 14124 1 1 25 TYR HA H -8.013 -3.226 8.163 1.00 . A A . 25 TYR HA 1 1 12 14125 1 1 25 TYR HB2 H -6.743 -2.328 10.233 1.00 . A A . 25 TYR HB2 1 1 12 14126 1 1 25 TYR HB3 H -8.187 -3.221 10.714 1.00 . A A . 25 TYR HB3 1 1 12 14127 1 1 25 TYR HD1 H -7.888 -5.753 11.340 1.00 . A A . 25 TYR HD1 1 1 12 14128 1 1 25 TYR HD2 H -4.592 -2.921 10.973 1.00 . A A . 25 TYR HD2 1 1 12 14129 1 1 25 TYR HE1 H -6.425 -7.281 12.704 1.00 . A A . 25 TYR HE1 1 1 12 14130 1 1 25 TYR HE2 H -3.125 -4.450 12.332 1.00 . A A . 25 TYR HE2 1 1 12 14131 1 1 25 TYR HH H -3.241 -7.242 12.784 1.00 . A A . 25 TYR HH 1 1 12 14132 1 1 25 TYR N N -8.072 -5.180 8.925 1.00 . A A . 25 TYR N 1 1 12 14133 1 1 25 TYR O O -5.361 -5.034 8.184 1.00 . A A . 25 TYR O 1 1 12 14134 1 1 25 TYR OH O -3.865 -6.816 13.356 1.00 . A A . 25 TYR OH 1 1 12 14135 1 1 26 LEU C C -3.691 -1.925 6.885 1.00 . A A . 26 LEU C 1 1 12 14136 1 1 26 LEU CA C -4.835 -2.835 6.438 1.00 . A A . 26 LEU CA 1 1 12 14137 1 1 26 LEU CB C -5.627 -2.351 5.213 1.00 . A A . 26 LEU CB 1 1 12 14138 1 1 26 LEU CD1 C -4.226 -0.849 3.750 1.00 . A A . 26 LEU CD1 1 1 12 14139 1 1 26 LEU CD2 C -6.610 -0.264 4.227 1.00 . A A . 26 LEU CD2 1 1 12 14140 1 1 26 LEU CG C -5.343 -0.908 4.793 1.00 . A A . 26 LEU CG 1 1 12 14141 1 1 26 LEU H H -6.467 -2.163 7.591 1.00 . A A . 26 LEU H 1 1 12 14142 1 1 26 LEU HA H -4.501 -3.859 6.274 1.00 . A A . 26 LEU HA 1 1 12 14143 1 1 26 LEU HB2 H -5.413 -3.012 4.370 1.00 . A A . 26 LEU HB2 1 1 12 14144 1 1 26 LEU HB3 H -6.700 -2.448 5.437 1.00 . A A . 26 LEU HB3 1 1 12 14145 1 1 26 LEU HD11 H -3.507 -0.070 3.999 1.00 . A A . 26 LEU HD11 1 1 12 14146 1 1 26 LEU HD12 H -3.694 -1.799 3.694 1.00 . A A . 26 LEU HD12 1 1 12 14147 1 1 26 LEU HD13 H -4.630 -0.631 2.762 1.00 . A A . 26 LEU HD13 1 1 12 14148 1 1 26 LEU HD21 H -6.724 -0.507 3.171 1.00 . A A . 26 LEU HD21 1 1 12 14149 1 1 26 LEU HD22 H -7.498 -0.622 4.747 1.00 . A A . 26 LEU HD22 1 1 12 14150 1 1 26 LEU HD23 H -6.574 0.821 4.315 1.00 . A A . 26 LEU HD23 1 1 12 14151 1 1 26 LEU HG H -5.031 -0.346 5.674 1.00 . A A . 26 LEU HG 1 1 12 14152 1 1 26 LEU N N -5.762 -2.867 7.539 1.00 . A A . 26 LEU N 1 1 12 14153 1 1 26 LEU O O -3.622 -1.555 8.051 1.00 . A A . 26 LEU O 1 1 12 14154 1 1 27 CYS C C -1.490 0.428 5.331 1.00 . A A . 27 CYS C 1 1 12 14155 1 1 27 CYS CA C -1.781 -0.634 6.394 1.00 . A A . 27 CYS CA 1 1 12 14156 1 1 27 CYS CB C -0.520 -1.376 6.824 1.00 . A A . 27 CYS CB 1 1 12 14157 1 1 27 CYS H H -2.817 -1.942 5.017 1.00 . A A . 27 CYS H 1 1 12 14158 1 1 27 CYS HA H -2.188 -0.125 7.262 1.00 . A A . 27 CYS HA 1 1 12 14159 1 1 27 CYS HB2 H -0.233 -2.076 6.042 1.00 . A A . 27 CYS HB2 1 1 12 14160 1 1 27 CYS HB3 H 0.295 -0.662 6.971 1.00 . A A . 27 CYS HB3 1 1 12 14161 1 1 27 CYS N N -2.798 -1.571 5.945 1.00 . A A . 27 CYS N 1 1 12 14162 1 1 27 CYS O O -1.367 0.159 4.142 1.00 . A A . 27 CYS O 1 1 12 14163 1 1 27 CYS SG S -0.768 -2.301 8.362 1.00 . A A . 27 CYS SG 1 1 12 14164 1 1 28 VAL C C -1.295 3.388 4.035 1.00 . A A . 28 VAL C 1 1 12 14165 1 1 28 VAL CA C -2.029 2.805 5.256 1.00 . A A . 28 VAL CA 1 1 12 14166 1 1 28 VAL CB C -2.090 3.923 6.281 1.00 . A A . 28 VAL CB 1 1 12 14167 1 1 28 VAL CG1 C -2.595 5.207 5.633 1.00 . A A . 28 VAL CG1 1 1 12 14168 1 1 28 VAL CG2 C -2.942 3.569 7.497 1.00 . A A . 28 VAL CG2 1 1 12 14169 1 1 28 VAL H H -0.968 1.750 6.782 1.00 . A A . 28 VAL H 1 1 12 14170 1 1 28 VAL HA H -2.997 2.454 4.928 1.00 . A A . 28 VAL HA 1 1 12 14171 1 1 28 VAL HB H -1.055 4.063 6.595 1.00 . A A . 28 VAL HB 1 1 12 14172 1 1 28 VAL HG11 H -1.763 5.796 5.248 1.00 . A A . 28 VAL HG11 1 1 12 14173 1 1 28 VAL HG12 H -3.263 4.974 4.803 1.00 . A A . 28 VAL HG12 1 1 12 14174 1 1 28 VAL HG13 H -3.145 5.810 6.355 1.00 . A A . 28 VAL HG13 1 1 12 14175 1 1 28 VAL HG21 H -2.992 2.491 7.643 1.00 . A A . 28 VAL HG21 1 1 12 14176 1 1 28 VAL HG22 H -2.535 4.042 8.391 1.00 . A A . 28 VAL HG22 1 1 12 14177 1 1 28 VAL HG23 H -3.961 3.933 7.378 1.00 . A A . 28 VAL HG23 1 1 12 14178 1 1 28 VAL N N -1.385 1.653 5.879 1.00 . A A . 28 VAL N 1 1 12 14179 1 1 28 VAL O O -1.846 4.176 3.278 1.00 . A A . 28 VAL O 1 1 12 14180 1 1 29 CYS C C 0.718 4.429 2.084 1.00 . A A . 29 CYS C 1 1 12 14181 1 1 29 CYS CA C 1.085 3.628 3.327 1.00 . A A . 29 CYS CA 1 1 12 14182 1 1 29 CYS CB C 2.140 2.597 2.898 1.00 . A A . 29 CYS CB 1 1 12 14183 1 1 29 CYS H H 0.089 2.118 4.460 1.00 . A A . 29 CYS H 1 1 12 14184 1 1 29 CYS HA H 1.462 4.324 4.076 1.00 . A A . 29 CYS HA 1 1 12 14185 1 1 29 CYS HB2 H 1.651 1.631 2.868 1.00 . A A . 29 CYS HB2 1 1 12 14186 1 1 29 CYS HB3 H 2.465 2.801 1.876 1.00 . A A . 29 CYS HB3 1 1 12 14187 1 1 29 CYS N N -0.037 2.944 3.930 1.00 . A A . 29 CYS N 1 1 12 14188 1 1 29 CYS O O -0.375 4.449 1.533 1.00 . A A . 29 CYS O 1 1 12 14189 1 1 29 CYS SG S 3.631 2.440 3.919 1.00 . A A . 29 CYS SG 1 1 12 14190 1 1 30 ALA C C 0.961 6.396 -0.129 1.00 . A A . 30 ALA C 1 1 12 14191 1 1 30 ALA CA C 1.825 6.374 1.134 1.00 . A A . 30 ALA CA 1 1 12 14192 1 1 30 ALA CB C 3.257 6.777 0.782 1.00 . A A . 30 ALA CB 1 1 12 14193 1 1 30 ALA H H 2.559 4.557 2.206 1.00 . A A . 30 ALA H 1 1 12 14194 1 1 30 ALA HA H 1.427 7.043 1.896 1.00 . A A . 30 ALA HA 1 1 12 14195 1 1 30 ALA HB1 H 3.272 7.457 -0.070 1.00 . A A . 30 ALA HB1 1 1 12 14196 1 1 30 ALA HB2 H 3.737 7.279 1.622 1.00 . A A . 30 ALA HB2 1 1 12 14197 1 1 30 ALA HB3 H 3.856 5.903 0.526 1.00 . A A . 30 ALA HB3 1 1 12 14198 1 1 30 ALA N N 1.836 5.042 1.707 1.00 . A A . 30 ALA N 1 1 12 14199 1 1 30 ALA O O 1.451 6.243 -1.241 1.00 . A A . 30 ALA O 1 1 12 14200 1 1 31 GLU C C -0.913 5.896 -2.162 1.00 . A A . 31 GLU C 1 1 12 14201 1 1 31 GLU CA C -1.342 5.942 -0.696 1.00 . A A . 31 GLU CA 1 1 12 14202 1 1 31 GLU CB C -2.654 6.703 -0.566 1.00 . A A . 31 GLU CB 1 1 12 14203 1 1 31 GLU CD C -4.988 6.530 -1.457 1.00 . A A . 31 GLU CD 1 1 12 14204 1 1 31 GLU CG C -3.862 5.787 -0.734 1.00 . A A . 31 GLU CG 1 1 12 14205 1 1 31 GLU H H -0.665 7.102 0.924 1.00 . A A . 31 GLU H 1 1 12 14206 1 1 31 GLU HA H -1.456 4.933 -0.307 1.00 . A A . 31 GLU HA 1 1 12 14207 1 1 31 GLU HB2 H -2.695 7.172 0.412 1.00 . A A . 31 GLU HB2 1 1 12 14208 1 1 31 GLU HB3 H -2.675 7.504 -1.300 1.00 . A A . 31 GLU HB3 1 1 12 14209 1 1 31 GLU HG2 H -3.586 4.903 -1.307 1.00 . A A . 31 GLU HG2 1 1 12 14210 1 1 31 GLU HG3 H -4.218 5.459 0.242 1.00 . A A . 31 GLU HG3 1 1 12 14211 1 1 31 GLU N N -0.346 6.598 0.123 1.00 . A A . 31 GLU N 1 1 12 14212 1 1 31 GLU O O -0.270 6.794 -2.692 1.00 . A A . 31 GLU O 1 1 12 14213 1 1 31 GLU OE1 O -4.908 7.752 -1.570 1.00 . A A . 31 GLU OE1 1 1 12 14214 1 1 31 GLU OE2 O -5.933 5.877 -1.897 1.00 . A A . 31 GLU OE2 1 1 12 14215 1 1 32 GLY C C 0.897 3.834 -3.096 1.00 . A A . 32 GLY C 1 1 12 14216 1 1 32 GLY CA C -0.470 4.122 -3.724 1.00 . A A . 32 GLY CA 1 1 12 14217 1 1 32 GLY H H -2.246 4.423 -2.524 1.00 . A A . 32 GLY H 1 1 12 14218 1 1 32 GLY HA2 H -0.954 3.190 -4.019 1.00 . A A . 32 GLY HA2 1 1 12 14219 1 1 32 GLY HA3 H -0.365 4.783 -4.585 1.00 . A A . 32 GLY HA3 1 1 12 14220 1 1 32 GLY N N -1.344 4.780 -2.770 1.00 . A A . 32 GLY N 1 1 12 14221 1 1 32 GLY O O 1.944 4.028 -3.702 1.00 . A A . 32 GLY O 1 1 12 14222 1 1 33 PHE C C 1.013 1.412 -0.411 1.00 . A A . 33 PHE C 1 1 12 14223 1 1 33 PHE CA C 1.736 2.342 -1.392 1.00 . A A . 33 PHE CA 1 1 12 14224 1 1 33 PHE CB C 2.932 2.990 -0.706 1.00 . A A . 33 PHE CB 1 1 12 14225 1 1 33 PHE CD1 C 4.854 1.961 -2.028 1.00 . A A . 33 PHE CD1 1 1 12 14226 1 1 33 PHE CD2 C 4.588 4.434 -1.992 1.00 . A A . 33 PHE CD2 1 1 12 14227 1 1 33 PHE CE1 C 6.046 2.099 -2.824 1.00 . A A . 33 PHE CE1 1 1 12 14228 1 1 33 PHE CE2 C 5.782 4.576 -2.784 1.00 . A A . 33 PHE CE2 1 1 12 14229 1 1 33 PHE CG C 4.129 3.129 -1.598 1.00 . A A . 33 PHE CG 1 1 12 14230 1 1 33 PHE CZ C 6.511 3.408 -3.198 1.00 . A A . 33 PHE CZ 1 1 12 14231 1 1 33 PHE H H 0.076 3.668 -1.234 1.00 . A A . 33 PHE H 1 1 12 14232 1 1 33 PHE HA H 2.056 1.773 -2.261 1.00 . A A . 33 PHE HA 1 1 12 14233 1 1 33 PHE HB2 H 2.664 3.969 -0.300 1.00 . A A . 33 PHE HB2 1 1 12 14234 1 1 33 PHE HB3 H 3.227 2.334 0.104 1.00 . A A . 33 PHE HB3 1 1 12 14235 1 1 33 PHE HD1 H 4.501 0.975 -1.759 1.00 . A A . 33 PHE HD1 1 1 12 14236 1 1 33 PHE HD2 H 4.031 5.307 -1.689 1.00 . A A . 33 PHE HD2 1 1 12 14237 1 1 33 PHE HE1 H 6.588 1.221 -3.141 1.00 . A A . 33 PHE HE1 1 1 12 14238 1 1 33 PHE HE2 H 6.130 5.560 -3.062 1.00 . A A . 33 PHE HE2 1 1 12 14239 1 1 33 PHE HZ H 7.410 3.513 -3.788 1.00 . A A . 33 PHE HZ 1 1 12 14240 1 1 33 PHE N N 0.807 3.359 -1.842 1.00 . A A . 33 PHE N 1 1 12 14241 1 1 33 PHE O O 1.031 1.599 0.800 1.00 . A A . 33 PHE O 1 1 12 14242 1 1 34 ALA C C 0.196 -1.833 -0.137 1.00 . A A . 34 ALA C 1 1 12 14243 1 1 34 ALA CA C -0.503 -0.477 -0.288 1.00 . A A . 34 ALA CA 1 1 12 14244 1 1 34 ALA CB C -1.812 -0.610 -1.066 1.00 . A A . 34 ALA CB 1 1 12 14245 1 1 34 ALA H H 0.515 0.271 -2.011 1.00 . A A . 34 ALA H 1 1 12 14246 1 1 34 ALA HA H -0.658 -0.025 0.691 1.00 . A A . 34 ALA HA 1 1 12 14247 1 1 34 ALA HB1 H -1.994 -1.647 -1.349 1.00 . A A . 34 ALA HB1 1 1 12 14248 1 1 34 ALA HB2 H -2.656 -0.272 -0.465 1.00 . A A . 34 ALA HB2 1 1 12 14249 1 1 34 ALA HB3 H -1.782 -0.009 -1.974 1.00 . A A . 34 ALA HB3 1 1 12 14250 1 1 34 ALA N N 0.376 0.406 -1.032 1.00 . A A . 34 ALA N 1 1 12 14251 1 1 34 ALA O O 1.322 -2.009 -0.577 1.00 . A A . 34 ALA O 1 1 12 14252 1 1 35 PRO C C 0.290 -4.665 -0.924 1.00 . A A . 35 PRO C 1 1 12 14253 1 1 35 PRO CA C -0.076 -4.182 0.482 1.00 . A A . 35 PRO CA 1 1 12 14254 1 1 35 PRO CB C -1.241 -4.977 1.074 1.00 . A A . 35 PRO CB 1 1 12 14255 1 1 35 PRO CD C -1.738 -2.561 1.247 1.00 . A A . 35 PRO CD 1 1 12 14256 1 1 35 PRO CG C -2.233 -3.954 1.650 1.00 . A A . 35 PRO CG 1 1 12 14257 1 1 35 PRO HA H 0.803 -4.291 1.117 1.00 . A A . 35 PRO HA 1 1 12 14258 1 1 35 PRO HB2 H -1.720 -5.585 0.306 1.00 . A A . 35 PRO HB2 1 1 12 14259 1 1 35 PRO HB3 H -0.888 -5.650 1.855 1.00 . A A . 35 PRO HB3 1 1 12 14260 1 1 35 PRO HD2 H -2.481 -2.059 0.632 1.00 . A A . 35 PRO HD2 1 1 12 14261 1 1 35 PRO HD3 H -1.530 -1.943 2.120 1.00 . A A . 35 PRO HD3 1 1 12 14262 1 1 35 PRO HG2 H -3.235 -4.132 1.257 1.00 . A A . 35 PRO HG2 1 1 12 14263 1 1 35 PRO HG3 H -2.284 -4.041 2.735 1.00 . A A . 35 PRO HG3 1 1 12 14264 1 1 35 PRO N N -0.512 -2.795 0.499 1.00 . A A . 35 PRO N 1 1 12 14265 1 1 35 PRO O O -0.528 -5.197 -1.666 1.00 . A A . 35 PRO O 1 1 12 14266 1 1 36 ILE C C 1.921 -6.838 -1.583 1.00 . A A . 36 ILE C 1 1 12 14267 1 1 36 ILE CA C 2.374 -5.411 -1.954 1.00 . A A . 36 ILE CA 1 1 12 14268 1 1 36 ILE CB C 3.822 -5.093 -1.585 1.00 . A A . 36 ILE CB 1 1 12 14269 1 1 36 ILE CD1 C 5.698 -6.740 -1.242 1.00 . A A . 36 ILE CD1 1 1 12 14270 1 1 36 ILE CG1 C 4.860 -5.988 -2.262 1.00 . A A . 36 ILE CG1 1 1 12 14271 1 1 36 ILE CG2 C 3.971 -5.037 -0.067 1.00 . A A . 36 ILE CG2 1 1 12 14272 1 1 36 ILE H H 2.040 -3.579 -0.963 1.00 . A A . 36 ILE H 1 1 12 14273 1 1 36 ILE HA H 2.228 -5.207 -3.010 1.00 . A A . 36 ILE HA 1 1 12 14274 1 1 36 ILE HB H 4.008 -4.087 -1.948 1.00 . A A . 36 ILE HB 1 1 12 14275 1 1 36 ILE HD11 H 5.069 -7.079 -0.421 1.00 . A A . 36 ILE HD11 1 1 12 14276 1 1 36 ILE HD12 H 6.175 -7.603 -1.702 1.00 . A A . 36 ILE HD12 1 1 12 14277 1 1 36 ILE HD13 H 6.464 -6.081 -0.835 1.00 . A A . 36 ILE HD13 1 1 12 14278 1 1 36 ILE HG12 H 4.393 -6.695 -2.936 1.00 . A A . 36 ILE HG12 1 1 12 14279 1 1 36 ILE HG13 H 5.515 -5.379 -2.884 1.00 . A A . 36 ILE HG13 1 1 12 14280 1 1 36 ILE HG21 H 5.013 -5.076 0.250 1.00 . A A . 36 ILE HG21 1 1 12 14281 1 1 36 ILE HG22 H 3.540 -4.113 0.317 1.00 . A A . 36 ILE HG22 1 1 12 14282 1 1 36 ILE HG23 H 3.431 -5.864 0.386 1.00 . A A . 36 ILE HG23 1 1 12 14283 1 1 36 ILE N N 1.584 -4.435 -1.226 1.00 . A A . 36 ILE N 1 1 12 14284 1 1 36 ILE O O 1.193 -7.043 -0.619 1.00 . A A . 36 ILE O 1 1 12 14285 1 1 37 PRO C C 3.502 -8.946 -0.451 1.00 . A A . 37 PRO C 1 1 12 14286 1 1 37 PRO CA C 2.927 -9.059 -1.861 1.00 . A A . 37 PRO CA 1 1 12 14287 1 1 37 PRO CB C 3.990 -9.450 -2.884 1.00 . A A . 37 PRO CB 1 1 12 14288 1 1 37 PRO CD C 2.511 -7.719 -3.837 1.00 . A A . 37 PRO CD 1 1 12 14289 1 1 37 PRO CG C 3.602 -8.738 -4.192 1.00 . A A . 37 PRO CG 1 1 12 14290 1 1 37 PRO HA H 2.136 -9.809 -1.845 1.00 . A A . 37 PRO HA 1 1 12 14291 1 1 37 PRO HB2 H 4.973 -9.120 -2.546 1.00 . A A . 37 PRO HB2 1 1 12 14292 1 1 37 PRO HB3 H 4.035 -10.529 -3.012 1.00 . A A . 37 PRO HB3 1 1 12 14293 1 1 37 PRO HD2 H 2.806 -6.717 -4.140 1.00 . A A . 37 PRO HD2 1 1 12 14294 1 1 37 PRO HD3 H 1.561 -7.966 -4.312 1.00 . A A . 37 PRO HD3 1 1 12 14295 1 1 37 PRO HG2 H 4.466 -8.236 -4.626 1.00 . A A . 37 PRO HG2 1 1 12 14296 1 1 37 PRO HG3 H 3.233 -9.455 -4.925 1.00 . A A . 37 PRO HG3 1 1 12 14297 1 1 37 PRO N N 2.388 -7.821 -2.390 1.00 . A A . 37 PRO N 1 1 12 14298 1 1 37 PRO O O 3.248 -7.997 0.279 1.00 . A A . 37 PRO O 1 1 12 14299 1 1 38 HIS C C 2.885 -10.188 1.956 1.00 . A A . 38 HIS C 1 1 12 14300 1 1 38 HIS CA C 3.917 -10.838 1.033 1.00 . A A . 38 HIS CA 1 1 12 14301 1 1 38 HIS CB C 5.160 -11.302 1.812 1.00 . A A . 38 HIS CB 1 1 12 14302 1 1 38 HIS CD2 C 6.283 -9.001 1.622 1.00 . A A . 38 HIS CD2 1 1 12 14303 1 1 38 HIS CE1 C 8.403 -9.544 2.048 1.00 . A A . 38 HIS CE1 1 1 12 14304 1 1 38 HIS CG C 6.308 -10.329 1.836 1.00 . A A . 38 HIS CG 1 1 12 14305 1 1 38 HIS H H 5.088 -10.208 -0.644 1.00 . A A . 38 HIS H 1 1 12 14306 1 1 38 HIS HA H 3.434 -11.701 0.624 1.00 . A A . 38 HIS HA 1 1 12 14307 1 1 38 HIS HB2 H 4.859 -11.503 2.845 1.00 . A A . 38 HIS HB2 1 1 12 14308 1 1 38 HIS HB3 H 5.512 -12.242 1.377 1.00 . A A . 38 HIS HB3 1 1 12 14309 1 1 38 HIS HD1 H 8.025 -11.610 2.332 1.00 . A A . 38 HIS HD1 1 1 12 14310 1 1 38 HIS HD2 H 5.405 -8.429 1.382 1.00 . A A . 38 HIS HD2 1 1 12 14311 1 1 38 HIS HE1 H 9.478 -9.493 2.200 1.00 . A A . 38 HIS HE1 1 1 12 14312 1 1 38 HIS N N 4.271 -9.996 -0.107 1.00 . A A . 38 HIS N 1 1 12 14313 1 1 38 HIS ND1 N 7.705 -10.688 2.113 1.00 . A A . 38 HIS ND1 1 1 12 14314 1 1 38 HIS NE2 N 7.648 -8.469 1.764 1.00 . A A . 38 HIS NE2 1 1 12 14315 1 1 38 HIS O O 1.677 -10.361 1.848 1.00 . A A . 38 HIS O 1 1 12 14316 1 1 39 GLU C C 1.545 -8.527 4.009 1.00 . A A . 39 GLU C 1 1 12 14317 1 1 39 GLU CA C 2.893 -9.240 4.162 1.00 . A A . 39 GLU CA 1 1 12 14318 1 1 39 GLU CB C 3.815 -8.433 5.071 1.00 . A A . 39 GLU CB 1 1 12 14319 1 1 39 GLU CD C 5.483 -9.704 6.441 1.00 . A A . 39 GLU CD 1 1 12 14320 1 1 39 GLU CG C 5.231 -9.007 5.102 1.00 . A A . 39 GLU CG 1 1 12 14321 1 1 39 GLU H H 4.450 -9.326 2.571 1.00 . A A . 39 GLU H 1 1 12 14322 1 1 39 GLU HA H 2.745 -10.236 4.570 1.00 . A A . 39 GLU HA 1 1 12 14323 1 1 39 GLU HB2 H 3.842 -7.404 4.710 1.00 . A A . 39 GLU HB2 1 1 12 14324 1 1 39 GLU HB3 H 3.406 -8.427 6.087 1.00 . A A . 39 GLU HB3 1 1 12 14325 1 1 39 GLU HG2 H 5.370 -9.727 4.297 1.00 . A A . 39 GLU HG2 1 1 12 14326 1 1 39 GLU HG3 H 5.969 -8.215 4.972 1.00 . A A . 39 GLU HG3 1 1 12 14327 1 1 39 GLU N N 3.501 -9.433 2.858 1.00 . A A . 39 GLU N 1 1 12 14328 1 1 39 GLU O O 1.366 -7.658 3.165 1.00 . A A . 39 GLU O 1 1 12 14329 1 1 39 GLU OE1 O 4.850 -10.726 6.699 1.00 . A A . 39 GLU OE1 1 1 12 14330 1 1 39 GLU OE2 O 6.310 -9.216 7.210 1.00 . A A . 39 GLU OE2 1 1 12 14331 1 1 40 PRO C C -0.008 -6.949 6.213 1.00 . A A . 40 PRO C 1 1 12 14332 1 1 40 PRO CA C -0.491 -8.099 5.326 1.00 . A A . 40 PRO CA 1 1 12 14333 1 1 40 PRO CB C -1.413 -9.016 6.134 1.00 . A A . 40 PRO CB 1 1 12 14334 1 1 40 PRO CD C 0.557 -10.307 5.401 1.00 . A A . 40 PRO CD 1 1 12 14335 1 1 40 PRO CG C -0.742 -10.396 6.205 1.00 . A A . 40 PRO CG 1 1 12 14336 1 1 40 PRO HA H -1.009 -7.688 4.460 1.00 . A A . 40 PRO HA 1 1 12 14337 1 1 40 PRO HB2 H -1.568 -8.617 7.136 1.00 . A A . 40 PRO HB2 1 1 12 14338 1 1 40 PRO HB3 H -2.390 -9.093 5.656 1.00 . A A . 40 PRO HB3 1 1 12 14339 1 1 40 PRO HD2 H 1.423 -10.494 6.035 1.00 . A A . 40 PRO HD2 1 1 12 14340 1 1 40 PRO HD3 H 0.565 -11.022 4.578 1.00 . A A . 40 PRO HD3 1 1 12 14341 1 1 40 PRO HG2 H -0.531 -10.665 7.240 1.00 . A A . 40 PRO HG2 1 1 12 14342 1 1 40 PRO HG3 H -1.397 -11.162 5.791 1.00 . A A . 40 PRO HG3 1 1 12 14343 1 1 40 PRO N N 0.602 -8.950 4.882 1.00 . A A . 40 PRO N 1 1 12 14344 1 1 40 PRO O O -0.384 -6.828 7.373 1.00 . A A . 40 PRO O 1 1 12 14345 1 1 41 HIS C C 0.935 -3.897 4.431 1.00 . A A . 41 HIS C 1 1 12 14346 1 1 41 HIS CA C 0.594 -4.686 5.700 1.00 . A A . 41 HIS CA 1 1 12 14347 1 1 41 HIS CB C 1.341 -4.106 6.905 1.00 . A A . 41 HIS CB 1 1 12 14348 1 1 41 HIS CD2 C 3.877 -3.803 7.009 1.00 . A A . 41 HIS CD2 1 1 12 14349 1 1 41 HIS CE1 C 4.553 -5.929 7.058 1.00 . A A . 41 HIS CE1 1 1 12 14350 1 1 41 HIS CG C 2.770 -4.566 6.974 1.00 . A A . 41 HIS CG 1 1 12 14351 1 1 41 HIS H H 1.659 -6.483 5.138 1.00 . A A . 41 HIS H 1 1 12 14352 1 1 41 HIS HA H -0.476 -4.614 5.796 1.00 . A A . 41 HIS HA 1 1 12 14353 1 1 41 HIS HB2 H 1.328 -3.016 6.842 1.00 . A A . 41 HIS HB2 1 1 12 14354 1 1 41 HIS HB3 H 0.828 -4.392 7.826 1.00 . A A . 41 HIS HB3 1 1 12 14355 1 1 41 HIS HD1 H 2.603 -6.759 6.992 1.00 . A A . 41 HIS HD1 1 1 12 14356 1 1 41 HIS HD2 H 3.892 -2.730 6.995 1.00 . A A . 41 HIS HD2 1 1 12 14357 1 1 41 HIS HE1 H 5.173 -6.822 7.043 1.00 . A A . 41 HIS HE1 1 1 12 14358 1 1 41 HIS N N 0.845 -6.119 5.589 1.00 . A A . 41 HIS N 1 1 12 14359 1 1 41 HIS ND1 N 3.212 -5.967 7.011 1.00 . A A . 41 HIS ND1 1 1 12 14360 1 1 41 HIS NE2 N 5.056 -4.683 7.068 1.00 . A A . 41 HIS NE2 1 1 12 14361 1 1 41 HIS O O 0.351 -2.864 4.127 1.00 . A A . 41 HIS O 1 1 12 14362 1 1 42 ARG C C 2.681 -2.540 2.443 1.00 . A A . 42 ARG C 1 1 12 14363 1 1 42 ARG CA C 3.068 -3.657 3.399 1.00 . A A . 42 ARG CA 1 1 12 14364 1 1 42 ARG CB C 4.170 -4.483 2.749 1.00 . A A . 42 ARG CB 1 1 12 14365 1 1 42 ARG CD C 5.961 -6.176 3.315 1.00 . A A . 42 ARG CD 1 1 12 14366 1 1 42 ARG CG C 5.235 -4.904 3.755 1.00 . A A . 42 ARG CG 1 1 12 14367 1 1 42 ARG CZ C 8.092 -5.393 4.092 1.00 . A A . 42 ARG CZ 1 1 12 14368 1 1 42 ARG H H 1.791 -5.450 3.685 1.00 . A A . 42 ARG H 1 1 12 14369 1 1 42 ARG HA H 3.410 -3.222 4.338 1.00 . A A . 42 ARG HA 1 1 12 14370 1 1 42 ARG HB2 H 3.727 -5.348 2.268 1.00 . A A . 42 ARG HB2 1 1 12 14371 1 1 42 ARG HB3 H 4.641 -3.897 1.961 1.00 . A A . 42 ARG HB3 1 1 12 14372 1 1 42 ARG HD2 H 5.346 -7.065 3.451 1.00 . A A . 42 ARG HD2 1 1 12 14373 1 1 42 ARG HD3 H 6.272 -6.120 2.273 1.00 . A A . 42 ARG HD3 1 1 12 14374 1 1 42 ARG HE H 7.298 -7.195 4.645 1.00 . A A . 42 ARG HE 1 1 12 14375 1 1 42 ARG HG2 H 5.963 -4.095 3.856 1.00 . A A . 42 ARG HG2 1 1 12 14376 1 1 42 ARG HG3 H 4.760 -5.053 4.728 1.00 . A A . 42 ARG HG3 1 1 12 14377 1 1 42 ARG HH11 H 9.324 -5.542 2.493 1.00 . A A . 42 ARG HH11 1 1 12 14378 1 1 42 ARG HH12 H 8.307 -4.140 2.515 1.00 . A A . 42 ARG HH12 1 1 12 14379 1 1 42 ARG HH21 H 7.806 -4.525 5.898 1.00 . A A . 42 ARG HH21 1 1 12 14380 1 1 42 ARG HH22 H 9.460 -4.729 5.428 1.00 . A A . 42 ARG HH22 1 1 12 14381 1 1 42 ARG N N 1.907 -4.462 3.720 1.00 . A A . 42 ARG N 1 1 12 14382 1 1 42 ARG NE N 7.162 -6.365 4.105 1.00 . A A . 42 ARG NE 1 1 12 14383 1 1 42 ARG NH1 N 8.618 -4.992 2.938 1.00 . A A . 42 ARG NH1 1 1 12 14384 1 1 42 ARG NH2 N 8.486 -4.836 5.234 1.00 . A A . 42 ARG NH2 1 1 12 14385 1 1 42 ARG O O 1.572 -2.451 1.933 1.00 . A A . 42 ARG O 1 1 12 14386 1 1 43 CYS C C 4.918 -1.384 0.162 1.00 . A A . 43 CYS C 1 1 12 14387 1 1 43 CYS CA C 3.786 -0.900 1.069 1.00 . A A . 43 CYS CA 1 1 12 14388 1 1 43 CYS CB C 3.970 0.542 1.507 1.00 . A A . 43 CYS CB 1 1 12 14389 1 1 43 CYS H H 4.244 -1.423 3.049 1.00 . A A . 43 CYS H 1 1 12 14390 1 1 43 CYS HA H 2.830 -0.993 0.557 1.00 . A A . 43 CYS HA 1 1 12 14391 1 1 43 CYS HB2 H 4.590 1.083 0.792 1.00 . A A . 43 CYS HB2 1 1 12 14392 1 1 43 CYS HB3 H 2.968 0.938 1.485 1.00 . A A . 43 CYS HB3 1 1 12 14393 1 1 43 CYS N N 3.702 -1.694 2.264 1.00 . A A . 43 CYS N 1 1 12 14394 1 1 43 CYS O O 6.073 -1.493 0.556 1.00 . A A . 43 CYS O 1 1 12 14395 1 1 43 CYS SG S 4.605 0.780 3.190 1.00 . A A . 43 CYS SG 1 1 12 14396 1 1 44 GLN C C 4.628 -1.471 -3.494 1.00 . A A . 44 GLN C 1 1 12 14397 1 1 44 GLN CA C 5.405 -1.511 -2.192 1.00 . A A . 44 GLN CA 1 1 12 14398 1 1 44 GLN CB C 6.423 -2.632 -2.238 1.00 . A A . 44 GLN CB 1 1 12 14399 1 1 44 GLN CD C 7.661 -4.023 -3.925 1.00 . A A . 44 GLN CD 1 1 12 14400 1 1 44 GLN CG C 7.286 -2.601 -3.504 1.00 . A A . 44 GLN CG 1 1 12 14401 1 1 44 GLN H H 3.514 -1.812 -1.247 1.00 . A A . 44 GLN H 1 1 12 14402 1 1 44 GLN HA H 5.908 -0.560 -2.043 1.00 . A A . 44 GLN HA 1 1 12 14403 1 1 44 GLN HB2 H 7.061 -2.519 -1.374 1.00 . A A . 44 GLN HB2 1 1 12 14404 1 1 44 GLN HB3 H 5.909 -3.582 -2.136 1.00 . A A . 44 GLN HB3 1 1 12 14405 1 1 44 GLN HE21 H 8.454 -4.470 -2.104 1.00 . A A . 44 GLN HE21 1 1 12 14406 1 1 44 GLN HE22 H 7.583 -5.772 -2.893 1.00 . A A . 44 GLN HE22 1 1 12 14407 1 1 44 GLN HG2 H 6.767 -2.120 -4.332 1.00 . A A . 44 GLN HG2 1 1 12 14408 1 1 44 GLN HG3 H 8.200 -2.036 -3.324 1.00 . A A . 44 GLN HG3 1 1 12 14409 1 1 44 GLN N N 4.487 -1.663 -1.081 1.00 . A A . 44 GLN N 1 1 12 14410 1 1 44 GLN NE2 N 7.924 -4.826 -2.880 1.00 . A A . 44 GLN NE2 1 1 12 14411 1 1 44 GLN O O 4.203 -2.474 -4.054 1.00 . A A . 44 GLN O 1 1 12 14412 1 1 44 GLN OE1 O 7.709 -4.359 -5.102 1.00 . A A . 44 GLN OE1 1 1 12 14413 1 1 45 MET C C 2.099 -0.350 -3.358 1.00 . A A . 45 MET C 1 1 12 14414 1 1 45 MET CA C 3.176 0.358 -4.199 1.00 . A A . 45 MET CA 1 1 12 14415 1 1 45 MET CB C 2.853 0.210 -5.693 1.00 . A A . 45 MET CB 1 1 12 14416 1 1 45 MET CE C 3.520 2.536 -8.930 1.00 . A A . 45 MET CE 1 1 12 14417 1 1 45 MET CG C 3.716 1.070 -6.615 1.00 . A A . 45 MET CG 1 1 12 14418 1 1 45 MET H H 5.355 0.301 -3.893 1.00 . A A . 45 MET H 1 1 12 14419 1 1 45 MET HA H 3.214 1.398 -3.862 1.00 . A A . 45 MET HA 1 1 12 14420 1 1 45 MET HB2 H 2.963 -0.836 -5.979 1.00 . A A . 45 MET HB2 1 1 12 14421 1 1 45 MET HB3 H 1.813 0.471 -5.880 1.00 . A A . 45 MET HB3 1 1 12 14422 1 1 45 MET HE1 H 4.328 3.267 -8.906 1.00 . A A . 45 MET HE1 1 1 12 14423 1 1 45 MET HE2 H 3.933 1.573 -9.233 1.00 . A A . 45 MET HE2 1 1 12 14424 1 1 45 MET HE3 H 2.791 2.850 -9.676 1.00 . A A . 45 MET HE3 1 1 12 14425 1 1 45 MET HG2 H 4.579 1.476 -6.086 1.00 . A A . 45 MET HG2 1 1 12 14426 1 1 45 MET HG3 H 4.084 0.454 -7.433 1.00 . A A . 45 MET HG3 1 1 12 14427 1 1 45 MET N N 4.494 -0.208 -3.915 1.00 . A A . 45 MET N 1 1 12 14428 1 1 45 MET O O 2.393 -0.933 -2.322 1.00 . A A . 45 MET O 1 1 12 14429 1 1 45 MET SD S 2.741 2.418 -7.308 1.00 . A A . 45 MET SD 1 1 12 14430 1 1 46 PHE C C -0.449 -1.148 -5.728 1.00 . A A . 46 PHE C 1 1 12 14431 1 1 46 PHE CA C 0.295 -1.481 -4.432 1.00 . A A . 46 PHE CA 1 1 12 14432 1 1 46 PHE CB C -0.664 -2.127 -3.434 1.00 . A A . 46 PHE CB 1 1 12 14433 1 1 46 PHE CD1 C -0.167 -4.413 -4.450 1.00 . A A . 46 PHE CD1 1 1 12 14434 1 1 46 PHE CD2 C -2.510 -3.838 -3.841 1.00 . A A . 46 PHE CD2 1 1 12 14435 1 1 46 PHE CE1 C -0.602 -5.707 -4.907 1.00 . A A . 46 PHE CE1 1 1 12 14436 1 1 46 PHE CE2 C -2.948 -5.131 -4.296 1.00 . A A . 46 PHE CE2 1 1 12 14437 1 1 46 PHE CG C -1.118 -3.474 -3.914 1.00 . A A . 46 PHE CG 1 1 12 14438 1 1 46 PHE CZ C -1.992 -6.065 -4.829 1.00 . A A . 46 PHE CZ 1 1 12 14439 1 1 46 PHE H H 0.331 0.578 -3.797 1.00 . A A . 46 PHE H 1 1 12 14440 1 1 46 PHE HA H 1.137 -2.144 -4.631 1.00 . A A . 46 PHE HA 1 1 12 14441 1 1 46 PHE HB2 H -0.174 -2.244 -2.469 1.00 . A A . 46 PHE HB2 1 1 12 14442 1 1 46 PHE HB3 H -1.535 -1.490 -3.283 1.00 . A A . 46 PHE HB3 1 1 12 14443 1 1 46 PHE HD1 H 0.878 -4.147 -4.507 1.00 . A A . 46 PHE HD1 1 1 12 14444 1 1 46 PHE HD2 H -3.229 -3.136 -3.443 1.00 . A A . 46 PHE HD2 1 1 12 14445 1 1 46 PHE HE1 H 0.115 -6.407 -5.309 1.00 . A A . 46 PHE HE1 1 1 12 14446 1 1 46 PHE HE2 H -3.992 -5.400 -4.237 1.00 . A A . 46 PHE HE2 1 1 12 14447 1 1 46 PHE HZ H -2.320 -7.036 -5.170 1.00 . A A . 46 PHE HZ 1 1 12 14448 1 1 46 PHE N N 0.856 -0.271 -3.862 1.00 . A A . 46 PHE N 1 1 12 14449 1 1 46 PHE O O -1.653 -0.919 -5.736 1.00 . A A . 46 PHE O 1 1 12 14450 1 1 47 CYS C C -1.272 -0.393 -8.584 1.30 . A A . 47 CYS C 1 1 12 14451 1 1 47 CYS CA C 0.067 -0.146 -7.849 0.80 . A A . 47 CYS CA 1 1 12 14452 1 1 47 CYS CB C 1.221 -0.125 -8.853 0.60 . A A . 47 CYS CB 1 1 12 14453 1 1 47 CYS H H 1.093 -1.789 -6.914 1.00 . A A . 47 CYS H 1 1 12 14454 1 1 47 CYS HA H 0.008 0.813 -7.335 1.10 . A A . 47 CYS HA 1 1 12 14455 1 1 47 CYS HB2 H 1.368 0.891 -9.221 0.90 . A A . 47 CYS HB2 1 1 12 14456 1 1 47 CYS HB3 H 2.146 -0.411 -8.354 0.90 . A A . 47 CYS HB3 1 1 12 14457 1 1 47 CYS N N 0.343 -1.134 -6.816 0.60 . A A . 47 CYS N 1 1 12 14458 1 1 47 CYS O O -1.644 0.369 -9.468 1.90 . A A . 47 CYS O 1 1 12 14459 1 1 47 CYS SG S 0.975 -1.214 -10.275 1.30 . A A . 47 CYS SG 1 1 12 14460 1 1 48 ASN C C -4.063 -1.597 -9.440 1.90 . A A . 48 ASN C 1 1 12 14461 1 1 48 ASN CA C -3.417 -1.372 -8.070 2.30 . A A . 48 ASN CA 1 1 12 14462 1 1 48 ASN CB C -3.799 0.005 -7.521 3.00 . A A . 48 ASN CB 1 1 12 14463 1 1 48 ASN CG C -5.197 -0.057 -6.899 3.70 . A A . 48 ASN CG 1 1 12 14464 1 1 48 ASN H H -1.506 -2.334 -7.970 2.00 . A A . 48 ASN H 1 1 12 14465 1 1 48 ASN HA H -3.731 -2.165 -7.391 2.70 . A A . 48 ASN HA 1 1 12 14466 1 1 48 ASN HB2 H -3.087 0.328 -6.761 3.30 . A A . 48 ASN HB2 1 1 12 14467 1 1 48 ASN HB3 H -3.797 0.750 -8.317 3.20 . A A . 48 ASN HB3 1 1 12 14468 1 1 48 ASN HD21 H -4.653 1.446 -5.612 1.00 . A A . 48 ASN HD21 1 1 12 14469 1 1 48 ASN N N -1.973 -1.477 -8.186 1.70 . A A . 48 ASN N 1 1 12 14470 1 1 48 ASN ND2 N -5.366 0.796 -5.874 4.10 . A A . 48 ASN ND2 1 1 12 14471 1 1 48 ASN O O -3.478 -1.325 -10.480 2.30 . A A . 48 ASN O 1 1 12 14472 1 1 48 ASN OD1 O -6.056 -0.822 -7.319 4.40 . A A . 48 ASN OD1 1 1 12 14473 1 1 49 GLN C C -4.915 -3.833 -11.042 1.80 . A A . 49 GLN C 1 1 12 14474 1 1 49 GLN CA C -5.498 -3.512 -9.665 2.00 . A A . 49 GLN CA 1 1 12 14475 1 1 49 GLN CB C -6.990 -3.847 -9.636 2.20 . A A . 49 GLN CB 1 1 12 14476 1 1 49 GLN CD C -9.136 -3.989 -10.922 3.40 . A A . 49 GLN CD 1 1 12 14477 1 1 49 GLN CG C -7.663 -3.583 -10.985 2.70 . A A . 49 GLN CG 1 1 12 14478 1 1 49 GLN H H -6.083 -1.527 -9.112 2.50 . A A . 49 GLN H 1 1 12 14479 1 1 49 GLN HA H -4.955 -4.069 -8.902 2.50 . A A . 49 GLN HA 1 1 12 14480 1 1 49 GLN HB2 H -7.124 -4.892 -9.359 2.60 . A A . 49 GLN HB2 1 1 12 14481 1 1 49 GLN HB3 H -7.480 -3.256 -8.863 2.10 . A A . 49 GLN HB3 1 1 12 14482 1 1 49 GLN HE21 H -9.597 -2.043 -11.295 4.10 . A A . 49 GLN HE21 1 1 12 14483 1 1 49 GLN HE22 H -10.960 -3.145 -11.240 4.50 . A A . 49 GLN HE22 1 1 12 14484 1 1 49 GLN HG2 H -7.597 -2.527 -11.246 2.70 . A A . 49 GLN HG2 1 1 12 14485 1 1 49 GLN HG3 H -7.175 -4.151 -11.777 2.80 . A A . 49 GLN HG3 1 1 12 14486 1 1 49 GLN N N -5.307 -2.106 -9.366 2.00 . A A . 49 GLN N 1 1 12 14487 1 1 49 GLN NE2 N -9.973 -2.967 -11.174 4.00 . A A . 49 GLN NE2 1 1 12 14488 1 1 49 GLN O O -5.213 -3.184 -12.037 2.20 . A A . 49 GLN O 1 1 12 14489 1 1 49 GLN OE1 O -9.482 -5.136 -10.667 3.70 . A A . 49 GLN OE1 1 1 12 14490 1 1 50 THR C C -2.219 -3.426 -11.679 1.50 . A A . 50 THR C 1 1 12 14491 1 1 50 THR CA C -2.655 -4.622 -10.826 1.80 . A A . 50 THR CA 1 1 12 14492 1 1 50 THR CB C -1.850 -5.863 -11.213 1.90 . A A . 50 THR CB 1 1 12 14493 1 1 50 THR CG2 C -1.791 -6.887 -10.079 2.30 . A A . 50 THR CG2 1 1 12 14494 1 1 50 THR H H -4.406 -5.812 -11.157 2.00 . A A . 50 THR H 1 1 12 14495 1 1 50 THR HA H -2.528 -4.383 -9.770 2.10 . A A . 50 THR HA 1 1 12 14496 1 1 50 THR HB H -0.837 -5.567 -11.486 2.20 . A A . 50 THR HB 1 1 12 14497 1 1 50 THR HG1 H -2.510 -5.773 -13.000 2.50 . A A . 50 THR HG1 1 1 12 14498 1 1 50 THR HG21 H -2.762 -6.989 -9.594 2.40 . A A . 50 THR HG21 1 1 12 14499 1 1 50 THR HG22 H -1.066 -6.589 -9.322 2.60 . A A . 50 THR HG22 1 1 12 14500 1 1 50 THR HG23 H -1.499 -7.868 -10.457 2.80 . A A . 50 THR HG23 1 1 12 14501 1 1 50 THR N N -4.069 -4.879 -11.026 1.70 . A A . 50 THR N 1 1 12 14502 1 1 50 THR O O -1.600 -2.481 -11.204 2.20 . A A . 50 THR O 1 1 12 14503 1 1 50 THR OG1 O -2.426 -6.457 -12.348 2.20 . A A . 50 THR OG1 1 1 12 14504 1 1 51 ALA C C -1.968 -1.210 -13.399 0.60 . A A . 51 ALA C 1 1 12 14505 1 1 51 ALA CA C -2.006 -2.642 -13.942 0.60 . A A . 51 ALA CA 1 1 12 14506 1 1 51 ALA CB C -2.821 -2.688 -15.234 0.70 . A A . 51 ALA CB 1 1 12 14507 1 1 51 ALA H H -3.093 -4.355 -13.267 0.90 . A A . 51 ALA H 1 1 12 14508 1 1 51 ALA HA H -0.993 -2.999 -14.130 0.70 . A A . 51 ALA HA 1 1 12 14509 1 1 51 ALA HB1 H -2.953 -3.717 -15.570 1.20 . A A . 51 ALA HB1 1 1 12 14510 1 1 51 ALA HB2 H -2.319 -2.137 -16.028 1.00 . A A . 51 ALA HB2 1 1 12 14511 1 1 51 ALA HB3 H -3.807 -2.248 -15.087 1.30 . A A . 51 ALA HB3 1 1 12 14512 1 1 51 ALA N N -2.583 -3.549 -12.969 0.80 . A A . 51 ALA N 1 1 12 14513 1 1 51 ALA O O -2.818 -0.775 -12.633 1.10 . A A . 51 ALA O 1 1 12 14514 1 1 52 CYS C C -0.163 1.699 -13.083 0.80 . A A . 52 CYS C 1 1 12 14515 1 1 52 CYS CA C -0.060 0.174 -12.926 0.80 . A A . 52 CYS CA 1 1 12 14516 1 1 52 CYS CB C 1.376 -0.294 -13.141 0.90 . A A . 52 CYS CB 1 1 12 14517 1 1 52 CYS H H -0.571 -0.741 -14.782 0.90 . A A . 52 CYS H 1 1 12 14518 1 1 52 CYS HA H -0.396 -0.128 -11.935 0.80 . A A . 52 CYS HA 1 1 12 14519 1 1 52 CYS HB2 H 1.352 -1.258 -13.647 1.10 . A A . 52 CYS HB2 1 1 12 14520 1 1 52 CYS HB3 H 1.898 0.400 -13.798 1.00 . A A . 52 CYS HB3 1 1 12 14521 1 1 52 CYS N N -0.916 -0.520 -13.870 0.70 . A A . 52 CYS N 1 1 12 14522 1 1 52 CYS O O -0.515 2.406 -12.147 1.20 . A A . 52 CYS O 1 1 12 14523 1 1 52 CYS SG S 2.328 -0.474 -11.612 1.00 . A A . 52 CYS SG 1 1 12 14524 1 1 53 PRO C C -0.010 4.639 -14.137 0.80 . A A . 53 PRO C 1 1 12 14525 1 1 53 PRO CA C 0.851 3.447 -14.510 0.70 . A A . 53 PRO CA 1 1 12 14526 1 1 53 PRO CB C 1.182 3.524 -15.993 0.90 . A A . 53 PRO CB 1 1 12 14527 1 1 53 PRO CD C -0.077 1.444 -15.537 0.80 . A A . 53 PRO CD 1 1 12 14528 1 1 53 PRO CG C 0.492 2.327 -16.643 0.90 . A A . 53 PRO CG 1 1 12 14529 1 1 53 PRO HA H 1.749 3.484 -13.898 0.80 . A A . 53 PRO HA 1 1 12 14530 1 1 53 PRO HB2 H 0.820 4.459 -16.421 1.00 . A A . 53 PRO HB2 1 1 12 14531 1 1 53 PRO HB3 H 2.259 3.481 -16.149 1.10 . A A . 53 PRO HB3 1 1 12 14532 1 1 53 PRO HD2 H -1.148 1.280 -15.663 0.80 . A A . 53 PRO HD2 1 1 12 14533 1 1 53 PRO HD3 H 0.436 0.482 -15.522 0.90 . A A . 53 PRO HD3 1 1 12 14534 1 1 53 PRO HG2 H -0.318 2.678 -17.276 0.90 . A A . 53 PRO HG2 1 1 12 14535 1 1 53 PRO HG3 H 1.213 1.763 -17.225 1.00 . A A . 53 PRO HG3 1 1 12 14536 1 1 53 PRO N N 0.176 2.170 -14.309 0.60 . A A . 53 PRO N 1 1 12 14537 1 1 53 PRO O O -0.672 5.288 -14.938 1.60 . A A . 53 PRO O 1 1 12 14538 1 1 54 ALA C C -0.394 7.233 -12.676 0.90 . A A . 54 ALA C 1 1 12 14539 1 1 54 ALA CA C 0.606 6.107 -12.357 0.80 . A A . 54 ALA CA 1 1 12 14540 1 1 54 ALA CB C 1.985 6.317 -12.999 0.80 . A A . 54 ALA CB 1 1 12 14541 1 1 54 ALA H H 0.241 3.960 -12.376 1.40 . A A . 54 ALA H 1 1 12 14542 1 1 54 ALA HA H 0.687 6.017 -11.274 0.70 . A A . 54 ALA HA 1 1 12 14543 1 1 54 ALA HB1 H 2.597 7.014 -12.431 1.20 . A A . 54 ALA HB1 1 1 12 14544 1 1 54 ALA HB2 H 1.911 6.668 -14.027 1.40 . A A . 54 ALA HB2 1 1 12 14545 1 1 54 ALA HB3 H 2.532 5.375 -13.029 1.30 . A A . 54 ALA HB3 1 1 12 14546 1 1 54 ALA N N 0.090 4.836 -12.826 0.80 . A A . 54 ALA N 1 1 12 14547 1 1 54 ALA O O -1.486 6.995 -13.174 1.50 . A A . 54 ALA O 1 1 12 14548 1 1 55 ASP C C -0.579 10.838 -13.065 1.10 . A A . 55 ASP C 1 1 12 14549 1 1 55 ASP CA C -0.866 9.602 -12.194 1.20 . A A . 55 ASP CA 1 1 12 14550 1 1 55 ASP CB C -0.976 10.092 -10.747 1.40 . A A . 55 ASP CB 1 1 12 14551 1 1 55 ASP CG C -2.017 11.209 -10.655 2.10 . A A . 55 ASP CG 1 1 12 14552 1 1 55 ASP H H 0.965 8.511 -11.925 1.40 . A A . 55 ASP H 1 1 12 14553 1 1 55 ASP HA H -1.771 9.189 -12.567 1.30 . A A . 55 ASP HA 1 1 12 14554 1 1 55 ASP HB2 H -1.271 9.310 -10.056 1.50 . A A . 55 ASP HB2 1 1 12 14555 1 1 55 ASP HB3 H -0.017 10.493 -10.420 1.80 . A A . 55 ASP HB3 1 1 12 14556 1 1 55 ASP N N 0.060 8.470 -12.337 1.00 . A A . 55 ASP N 1 1 12 14557 1 1 55 ASP O O -1.279 11.843 -13.025 1.50 . A A . 55 ASP O 1 1 12 14558 1 1 55 ASP OD1 O -3.035 11.122 -11.339 2.80 . A A . 55 ASP OD1 1 1 12 14559 1 1 55 ASP OD2 O -1.796 12.153 -9.897 2.60 . A A . 55 ASP OD2 1 1 12 14560 1 1 56 CYS C C -0.936 9.906 -15.677 0.80 . A A . 56 CYS C 1 1 12 14561 1 1 56 CYS CA C 0.473 10.130 -15.128 0.80 . A A . 56 CYS CA 1 1 12 14562 1 1 56 CYS CB C 1.256 8.838 -14.931 0.90 . A A . 56 CYS CB 1 1 12 14563 1 1 56 CYS H H 1.256 10.329 -13.334 1.10 . A A . 56 CYS H 1 1 12 14564 1 1 56 CYS HA H 1.016 10.790 -15.769 0.70 . A A . 56 CYS HA 1 1 12 14565 1 1 56 CYS HB2 H 0.588 8.039 -14.599 0.90 . A A . 56 CYS HB2 1 1 12 14566 1 1 56 CYS HB3 H 1.561 8.577 -15.930 1.00 . A A . 56 CYS HB3 1 1 12 14567 1 1 56 CYS N N 0.495 10.694 -13.820 0.90 . A A . 56 CYS N 1 1 12 14568 1 1 56 CYS O O -1.391 10.484 -16.656 1.10 . A A . 56 CYS O 1 1 12 14569 1 1 56 CYS SG S 2.793 8.909 -13.895 1.30 . A A . 56 CYS SG 1 1 12 14570 1 1 57 ASP C C -3.577 8.554 -16.268 0.90 . A A . 57 ASP C 1 1 12 14571 1 1 57 ASP CA C -2.962 8.770 -14.880 1.00 . A A . 57 ASP CA 1 1 12 14572 1 1 57 ASP CB C -3.590 9.900 -14.083 1.10 . A A . 57 ASP CB 1 1 12 14573 1 1 57 ASP CG C -4.409 10.869 -14.956 1.60 . A A . 57 ASP CG 1 1 12 14574 1 1 57 ASP H H -0.980 8.841 -14.115 1.10 . A A . 57 ASP H 1 1 12 14575 1 1 57 ASP HA H -3.087 7.849 -14.312 1.20 . A A . 57 ASP HA 1 1 12 14576 1 1 57 ASP HB2 H -4.122 9.418 -13.281 1.20 . A A . 57 ASP HB2 1 1 12 14577 1 1 57 ASP HB3 H -2.855 10.481 -13.547 1.10 . A A . 57 ASP HB3 1 1 12 14578 1 1 57 ASP N N -1.542 9.007 -14.912 0.80 . A A . 57 ASP N 1 1 12 14579 1 1 57 ASP O O -3.141 9.096 -17.276 1.00 . A A . 57 ASP O 1 1 12 14580 1 1 57 ASP OD1 O -3.973 11.159 -16.069 2.20 . A A . 57 ASP OD1 1 1 12 14581 1 1 57 ASP OD2 O -5.460 11.332 -14.523 2.00 . A A . 57 ASP OD2 1 1 12 14582 1 1 58 PRO C C -6.611 9.149 -15.655 1.20 . A A . 58 PRO C 1 1 12 14583 1 1 58 PRO CA C -5.987 8.109 -16.597 1.20 . A A . 58 PRO CA 1 1 12 14584 1 1 58 PRO CB C -6.813 6.819 -16.545 1.40 . A A . 58 PRO CB 1 1 12 14585 1 1 58 PRO CD C -4.492 6.311 -15.877 1.30 . A A . 58 PRO CD 1 1 12 14586 1 1 58 PRO CG C -5.874 5.691 -16.094 1.50 . A A . 58 PRO CG 1 1 12 14587 1 1 58 PRO HA H -5.982 8.514 -17.609 1.30 . A A . 58 PRO HA 1 1 12 14588 1 1 58 PRO HB2 H -7.645 6.926 -15.849 1.50 . A A . 58 PRO HB2 1 1 12 14589 1 1 58 PRO HB3 H -7.233 6.596 -17.526 1.70 . A A . 58 PRO HB3 1 1 12 14590 1 1 58 PRO HD2 H -4.176 6.223 -14.838 1.30 . A A . 58 PRO HD2 1 1 12 14591 1 1 58 PRO HD3 H -3.741 5.839 -16.511 1.40 . A A . 58 PRO HD3 1 1 12 14592 1 1 58 PRO HG2 H -6.238 5.235 -15.173 1.50 . A A . 58 PRO HG2 1 1 12 14593 1 1 58 PRO HG3 H -5.826 4.910 -16.853 1.70 . A A . 58 PRO HG3 1 1 12 14594 1 1 58 PRO N N -4.633 7.712 -16.235 1.00 . A A . 58 PRO N 1 1 12 14595 1 1 58 PRO O O -6.944 10.255 -16.062 1.50 . A A . 58 PRO O 1 1 12 14596 1 1 59 ASN C C -6.310 9.948 -12.322 1.30 . A A . 59 ASN C 1 1 12 14597 1 1 59 ASN CA C -7.340 9.574 -13.381 1.30 . A A . 59 ASN CA 1 1 12 14598 1 1 59 ASN CB C -8.536 8.868 -12.722 1.50 . A A . 59 ASN CB 1 1 12 14599 1 1 59 ASN CG C -8.638 7.344 -12.932 1.90 . A A . 59 ASN CG 1 1 12 14600 1 1 59 ASN H H -6.959 7.773 -14.103 1.10 . A A . 59 ASN H 1 1 12 14601 1 1 59 ASN HA H -7.662 10.477 -13.860 1.50 . A A . 59 ASN HA 1 1 12 14602 1 1 59 ASN HB2 H -8.475 9.033 -11.653 1.70 . A A . 59 ASN HB2 1 1 12 14603 1 1 59 ASN HB3 H -9.449 9.310 -13.112 1.70 . A A . 59 ASN HB3 1 1 12 14604 1 1 59 ASN HD21 H -6.990 7.110 -11.758 2.10 . A A . 59 ASN HD21 1 1 12 14605 1 1 59 ASN HD22 H -7.933 5.659 -12.042 2.50 . A A . 59 ASN HD22 1 1 12 14606 1 1 59 ASN N N -6.775 8.710 -14.388 1.10 . A A . 59 ASN N 1 1 12 14607 1 1 59 ASN ND2 N -7.776 6.643 -12.176 2.00 . A A . 59 ASN ND2 1 1 12 14608 1 1 59 ASN O O -5.830 11.066 -12.190 1.70 . A A . 59 ASN O 1 1 12 14609 1 1 59 ASN OD1 O -9.438 6.855 -13.720 2.70 . A A . 59 ASN OD1 1 1 12 14610 1 1 60 THR C C -4.132 8.097 -10.321 0.90 . A A . 60 THR C 1 1 12 14611 1 1 60 THR CA C -5.265 9.120 -10.367 1.20 . A A . 60 THR CA 1 1 12 14612 1 1 60 THR CB C -6.168 9.090 -9.128 1.40 . A A . 60 THR CB 1 1 12 14613 1 1 60 THR CG2 C -6.573 10.501 -8.716 1.40 . A A . 60 THR CG2 1 1 12 14614 1 1 60 THR H H -6.867 8.297 -11.623 1.00 . A A . 60 THR H 1 1 12 14615 1 1 60 THR HA H -4.849 10.112 -10.429 1.40 . A A . 60 THR HA 1 1 12 14616 1 1 60 THR HB H -5.648 8.605 -8.302 1.90 . A A . 60 THR HB 1 1 12 14617 1 1 60 THR HG1 H -8.021 8.698 -8.890 2.30 . A A . 60 THR HG1 1 1 12 14618 1 1 60 THR HG21 H -5.691 11.097 -8.481 1.90 . A A . 60 THR HG21 1 1 12 14619 1 1 60 THR HG22 H -7.217 10.479 -7.838 1.80 . A A . 60 THR HG22 1 1 12 14620 1 1 60 THR HG23 H -7.109 10.997 -9.524 1.70 . A A . 60 THR HG23 1 1 12 14621 1 1 60 THR N N -6.083 8.902 -11.540 1.10 . A A . 60 THR N 1 1 12 14622 1 1 60 THR O O -3.025 8.297 -10.804 1.10 . A A . 60 THR O 1 1 12 14623 1 1 60 THR OG1 O -7.316 8.326 -9.403 2.10 . A A . 60 THR OG1 1 1 12 14624 1 1 61 GLN C C -3.383 5.145 -8.492 0.90 . A A . 61 GLN C 1 1 12 14625 1 1 61 GLN CA C -4.017 5.665 -9.806 0.80 . A A . 61 GLN CA 1 1 12 14626 1 1 61 GLN CB C -3.133 5.496 -11.065 1.00 . A A . 61 GLN CB 1 1 12 14627 1 1 61 GLN CD C -2.902 3.306 -12.240 1.90 . A A . 61 GLN CD 1 1 12 14628 1 1 61 GLN CG C -2.434 4.136 -11.043 1.40 . A A . 61 GLN CG 1 1 12 14629 1 1 61 GLN H H -5.390 7.252 -9.183 1.20 . A A . 61 GLN H 1 1 12 14630 1 1 61 GLN HA H -4.917 5.079 -9.899 0.70 . A A . 61 GLN HA 1 1 12 14631 1 1 61 GLN HB2 H -3.726 5.575 -11.977 1.60 . A A . 61 GLN HB2 1 1 12 14632 1 1 61 GLN HB3 H -2.392 6.290 -11.191 1.60 . A A . 61 GLN HB3 1 1 12 14633 1 1 61 GLN HE21 H -2.958 4.823 -13.595 2.60 . A A . 61 GLN HE21 1 1 12 14634 1 1 61 GLN HE22 H -2.106 3.380 -14.112 2.80 . A A . 61 GLN HE22 1 1 12 14635 1 1 61 GLN HG2 H -1.353 4.249 -11.059 1.80 . A A . 61 GLN HG2 1 1 12 14636 1 1 61 GLN HG3 H -2.657 3.590 -10.130 1.90 . A A . 61 GLN HG3 1 1 12 14637 1 1 61 GLN N N -4.552 7.011 -9.671 0.90 . A A . 61 GLN N 1 1 12 14638 1 1 61 GLN NE2 N -2.631 3.888 -13.422 2.40 . A A . 61 GLN NE2 1 1 12 14639 1 1 61 GLN O O -3.413 3.962 -8.173 1.50 . A A . 61 GLN O 1 1 12 14640 1 1 61 GLN OE1 O -3.459 2.224 -12.099 2.40 . A A . 61 GLN OE1 1 1 12 14641 1 1 62 ALA C C -0.516 5.515 -7.120 0.90 . A A . 62 ALA C 1 1 12 14642 1 1 62 ALA CA C -1.947 5.828 -6.657 1.00 . A A . 62 ALA CA 1 1 12 14643 1 1 62 ALA CB C -2.511 4.763 -5.717 1.30 . A A . 62 ALA CB 1 1 12 14644 1 1 62 ALA H H -3.493 6.881 -7.709 1.50 . A A . 62 ALA H 1 1 12 14645 1 1 62 ALA HA H -1.852 6.798 -6.209 1.20 . A A . 62 ALA HA 1 1 12 14646 1 1 62 ALA HB1 H -2.642 5.162 -4.712 1.70 . A A . 62 ALA HB1 1 1 12 14647 1 1 62 ALA HB2 H -1.844 3.903 -5.656 1.60 . A A . 62 ALA HB2 1 1 12 14648 1 1 62 ALA HB3 H -3.483 4.411 -6.064 1.70 . A A . 62 ALA HB3 1 1 12 14649 1 1 62 ALA N N -2.860 6.118 -7.744 1.00 . A A . 62 ALA N 1 1 12 14650 1 1 62 ALA O O -0.126 4.368 -7.300 1.80 . A A . 62 ALA O 1 1 12 14651 1 1 63 SER C C 1.219 8.409 -8.676 0.60 . A A . 63 SER C 1 1 12 14652 1 1 63 SER CA C 0.530 7.045 -8.648 0.50 . A A . 63 SER CA 1 1 12 14653 1 1 63 SER CB C -0.781 7.072 -9.409 0.60 . A A . 63 SER CB 1 1 12 14654 1 1 63 SER H H 0.378 7.295 -6.566 1.20 . A A . 63 SER H 1 1 12 14655 1 1 63 SER HA H 1.206 6.295 -9.058 0.50 . A A . 63 SER HA 1 1 12 14656 1 1 63 SER HB2 H -1.579 7.662 -8.956 1.20 . A A . 63 SER HB2 1 1 12 14657 1 1 63 SER HB3 H -0.672 7.487 -10.383 0.90 . A A . 63 SER HB3 1 1 12 14658 1 1 63 SER HG H -0.518 5.219 -9.086 1.60 . A A . 63 SER HG 1 1 12 14659 1 1 63 SER N N 0.230 6.633 -7.296 0.60 . A A . 63 SER N 1 1 12 14660 1 1 63 SER O O 0.588 9.458 -8.638 1.60 . A A . 63 SER O 1 1 12 14661 1 1 63 SER OG O -1.154 5.736 -9.563 1.30 . A A . 63 SER OG 1 1 12 14662 1 1 64 CYS C C 4.462 7.037 -9.552 0.50 . A A . 64 CYS C 1 1 12 14663 1 1 64 CYS CA C 3.221 7.849 -9.941 0.50 . A A . 64 CYS CA 1 1 12 14664 1 1 64 CYS CB C 3.706 9.006 -10.839 0.50 . A A . 64 CYS CB 1 1 12 14665 1 1 64 CYS H H 3.012 8.328 -7.831 1.40 . A A . 64 CYS H 1 1 12 14666 1 1 64 CYS HA H 2.508 7.207 -10.455 0.60 . A A . 64 CYS HA 1 1 12 14667 1 1 64 CYS HB2 H 4.077 9.808 -10.201 0.70 . A A . 64 CYS HB2 1 1 12 14668 1 1 64 CYS HB3 H 4.567 8.664 -11.412 0.70 . A A . 64 CYS HB3 1 1 12 14669 1 1 64 CYS N N 2.559 8.310 -8.722 0.60 . A A . 64 CYS N 1 1 12 14670 1 1 64 CYS O O 5.581 7.378 -9.912 1.10 . A A . 64 CYS O 1 1 12 14671 1 1 64 CYS SG S 2.511 9.730 -12.004 1.30 . A A . 64 CYS SG 1 1 12 14672 1 1 65 GLU C C 6.295 5.762 -7.527 1.00 . A A . 65 GLU C 1 1 12 14673 1 1 65 GLU CA C 4.784 5.931 -7.461 1.10 . A A . 65 GLU CA 1 1 12 14674 1 1 65 GLU CB C 4.080 4.889 -6.588 1.30 . A A . 65 GLU CB 1 1 12 14675 1 1 65 GLU CD C 2.885 6.288 -4.897 1.90 . A A . 65 GLU CD 1 1 12 14676 1 1 65 GLU CG C 4.045 5.316 -5.122 1.50 . A A . 65 GLU CG 1 1 12 14677 1 1 65 GLU H H 3.625 5.215 -9.122 1.60 . A A . 65 GLU H 1 1 12 14678 1 1 65 GLU HA H 4.629 6.894 -7.041 1.30 . A A . 65 GLU HA 1 1 12 14679 1 1 65 GLU HB2 H 3.056 4.775 -6.942 1.50 . A A . 65 GLU HB2 1 1 12 14680 1 1 65 GLU HB3 H 4.549 3.910 -6.669 1.30 . A A . 65 GLU HB3 1 1 12 14681 1 1 65 GLU HG2 H 3.912 4.450 -4.475 1.70 . A A . 65 GLU HG2 1 1 12 14682 1 1 65 GLU HG3 H 4.978 5.804 -4.840 1.70 . A A . 65 GLU HG3 1 1 12 14683 1 1 65 GLU N N 4.200 5.962 -8.789 1.00 . A A . 65 GLU N 1 1 12 14684 1 1 65 GLU O O 7.090 6.684 -7.394 1.10 . A A . 65 GLU O 1 1 12 14685 1 1 65 GLU OE1 O 2.461 6.926 -5.859 2.40 . A A . 65 GLU OE1 1 1 12 14686 1 1 65 GLU OE2 O 2.421 6.398 -3.763 1.90 . A A . 65 GLU OE2 1 1 12 14687 1 1 66 CYS C C 8.980 4.523 -8.282 0.90 . A A . 66 CYS C 1 1 12 14688 1 1 66 CYS CA C 7.847 3.885 -7.469 1.00 . A A . 66 CYS CA 1 1 12 14689 1 1 66 CYS CB C 7.687 2.429 -7.865 1.20 . A A . 66 CYS CB 1 1 12 14690 1 1 66 CYS H H 5.801 3.901 -7.893 1.10 . A A . 66 CYS H 1 1 12 14691 1 1 66 CYS HA H 8.036 3.998 -6.402 1.10 . A A . 66 CYS HA 1 1 12 14692 1 1 66 CYS HB2 H 8.197 2.273 -8.812 1.20 . A A . 66 CYS HB2 1 1 12 14693 1 1 66 CYS HB3 H 8.160 1.852 -7.093 1.50 . A A . 66 CYS HB3 1 1 12 14694 1 1 66 CYS N N 6.580 4.490 -7.744 1.00 . A A . 66 CYS N 1 1 12 14695 1 1 66 CYS O O 8.924 5.674 -8.696 1.10 . A A . 66 CYS O 1 1 12 14696 1 1 66 CYS SG S 6.010 1.781 -8.020 1.70 . A A . 66 CYS SG 1 1 12 14697 1 1 67 PRO C C 11.645 4.252 -6.744 0.90 . A A . 67 PRO C 1 1 12 14698 1 1 67 PRO CA C 10.803 3.139 -7.381 0.90 . A A . 67 PRO CA 1 1 12 14699 1 1 67 PRO CB C 11.632 2.000 -8.000 0.90 . A A . 67 PRO CB 1 1 12 14700 1 1 67 PRO CD C 10.355 3.136 -9.783 0.80 . A A . 67 PRO CD 1 1 12 14701 1 1 67 PRO CG C 11.368 2.022 -9.513 0.80 . A A . 67 PRO CG 1 1 12 14702 1 1 67 PRO HA H 10.129 2.740 -6.623 1.10 . A A . 67 PRO HA 1 1 12 14703 1 1 67 PRO HB2 H 12.703 2.093 -7.808 1.00 . A A . 67 PRO HB2 1 1 12 14704 1 1 67 PRO HB3 H 11.295 1.044 -7.588 0.80 . A A . 67 PRO HB3 1 1 12 14705 1 1 67 PRO HD2 H 10.779 3.919 -10.410 0.70 . A A . 67 PRO HD2 1 1 12 14706 1 1 67 PRO HD3 H 9.462 2.750 -10.273 0.90 . A A . 67 PRO HD3 1 1 12 14707 1 1 67 PRO HG2 H 12.292 2.200 -10.063 0.80 . A A . 67 PRO HG2 1 1 12 14708 1 1 67 PRO HG3 H 10.975 1.059 -9.839 1.00 . A A . 67 PRO HG3 1 1 12 14709 1 1 67 PRO N N 10.017 3.676 -8.477 0.80 . A A . 67 PRO N 1 1 12 14710 1 1 67 PRO O O 11.226 5.400 -6.678 1.30 . A A . 67 PRO O 1 1 12 14711 1 1 68 GLU C C 13.986 4.488 -8.321 1.10 . A A . 68 GLU C 1 1 12 14712 1 1 68 GLU CA C 14.085 4.299 -6.805 1.20 . A A . 68 GLU CA 1 1 12 14713 1 1 68 GLU CB C 15.176 3.274 -6.495 1.50 . A A . 68 GLU CB 1 1 12 14714 1 1 68 GLU CD C 17.191 4.485 -5.633 2.80 . A A . 68 GLU CD 1 1 12 14715 1 1 68 GLU CG C 15.967 3.653 -5.245 2.10 . A A . 68 GLU CG 1 1 12 14716 1 1 68 GLU H H 12.811 3.259 -5.436 1.60 . A A . 68 GLU H 1 1 12 14717 1 1 68 GLU HA H 14.310 5.252 -6.326 1.30 . A A . 68 GLU HA 1 1 12 14718 1 1 68 GLU HB2 H 14.727 2.291 -6.358 1.90 . A A . 68 GLU HB2 1 1 12 14719 1 1 68 GLU HB3 H 15.853 3.191 -7.346 1.90 . A A . 68 GLU HB3 1 1 12 14720 1 1 68 GLU HG2 H 15.345 4.234 -4.565 2.40 . A A . 68 GLU HG2 1 1 12 14721 1 1 68 GLU HG3 H 16.296 2.759 -4.716 2.50 . A A . 68 GLU HG3 1 1 12 14722 1 1 68 GLU N N 12.823 3.839 -6.247 1.20 . A A . 68 GLU N 1 1 12 14723 1 1 68 GLU O O 13.589 3.598 -9.061 1.20 . A A . 68 GLU O 1 1 12 14724 1 1 68 GLU OE1 O 18.160 3.908 -6.125 3.40 . A A . 68 GLU OE1 1 1 12 14725 1 1 68 GLU OE2 O 17.160 5.699 -5.441 3.30 . A A . 68 GLU OE2 1 1 12 14726 1 1 69 GLY C C 12.428 5.812 -10.222 1.20 . A A . 69 GLY C 1 1 12 14727 1 1 69 GLY CA C 13.896 6.198 -10.009 1.50 . A A . 69 GLY CA 1 1 12 14728 1 1 69 GLY H H 14.998 6.260 -8.170 1.40 . A A . 69 GLY H 1 1 12 14729 1 1 69 GLY HA2 H 14.006 7.284 -10.004 1.70 . A A . 69 GLY HA2 1 1 12 14730 1 1 69 GLY HA3 H 14.522 5.759 -10.788 1.80 . A A . 69 GLY HA3 1 1 12 14731 1 1 69 GLY N N 14.385 5.705 -8.733 1.20 . A A . 69 GLY N 1 1 12 14732 1 1 69 GLY O O 12.012 5.439 -11.312 1.40 . A A . 69 GLY O 1 1 12 14733 1 1 70 TYR C C 11.500 8.371 -9.528 0.80 . A A . 70 TYR C 1 1 12 14734 1 1 70 TYR CA C 11.513 7.240 -8.487 0.80 . A A . 70 TYR CA 1 1 12 14735 1 1 70 TYR CB C 12.628 7.497 -7.467 0.60 . A A . 70 TYR CB 1 1 12 14736 1 1 70 TYR CD1 C 10.909 8.164 -5.695 1.30 . A A . 70 TYR CD1 1 1 12 14737 1 1 70 TYR CD2 C 13.006 9.483 -5.916 1.50 . A A . 70 TYR CD2 1 1 12 14738 1 1 70 TYR CE1 C 10.477 9.024 -4.625 1.40 . A A . 70 TYR CE1 1 1 12 14739 1 1 70 TYR CE2 C 12.578 10.346 -4.847 1.70 . A A . 70 TYR CE2 1 1 12 14740 1 1 70 TYR CG C 12.173 8.390 -6.348 0.70 . A A . 70 TYR CG 1 1 12 14741 1 1 70 TYR CZ C 11.313 10.117 -4.203 1.10 . A A . 70 TYR CZ 1 1 12 14742 1 1 70 TYR H H 11.251 5.120 -8.698 1.00 . A A . 70 TYR H 1 1 12 14743 1 1 70 TYR HA H 10.539 7.210 -7.999 0.90 . A A . 70 TYR HA 1 1 12 14744 1 1 70 TYR HB2 H 12.990 6.565 -7.036 0.60 . A A . 70 TYR HB2 1 1 12 14745 1 1 70 TYR HB3 H 13.479 7.965 -7.963 0.60 . A A . 70 TYR HB3 1 1 12 14746 1 1 70 TYR HD1 H 10.281 7.343 -6.008 2.10 . A A . 70 TYR HD1 1 1 12 14747 1 1 70 TYR HD2 H 13.958 9.654 -6.397 2.30 . A A . 70 TYR HD2 1 1 12 14748 1 1 70 TYR HE1 H 9.529 8.850 -4.139 2.10 . A A . 70 TYR HE1 1 1 12 14749 1 1 70 TYR HE2 H 13.206 11.166 -4.530 2.50 . A A . 70 TYR HE2 1 1 12 14750 1 1 70 TYR HH H 11.195 10.599 -2.351 1.50 . A A . 70 TYR HH 1 1 12 14751 1 1 70 TYR N N 11.678 5.931 -9.109 0.90 . A A . 70 TYR N 1 1 12 14752 1 1 70 TYR O O 11.604 8.166 -10.732 1.10 . A A . 70 TYR O 1 1 12 14753 1 1 70 TYR OH O 10.898 10.947 -3.182 1.30 . A A . 70 TYR OH 1 1 12 14754 1 1 71 ILE C C 9.184 9.871 -10.092 0.90 . A A . 71 ILE C 1 1 12 14755 1 1 71 ILE CA C 10.004 10.127 -8.823 1.00 . A A . 71 ILE CA 1 1 12 14756 1 1 71 ILE CB C 10.078 11.638 -8.580 1.20 . A A . 71 ILE CB 1 1 12 14757 1 1 71 ILE CD1 C 11.746 13.309 -7.666 1.80 . A A . 71 ILE CD1 1 1 12 14758 1 1 71 ILE CG1 C 11.016 11.987 -7.424 1.40 . A A . 71 ILE CG1 1 1 12 14759 1 1 71 ILE CG2 C 8.682 12.216 -8.340 1.80 . A A . 71 ILE CG2 1 1 12 14760 1 1 71 ILE H H 12.142 10.112 -8.671 1.10 . A A . 71 ILE H 1 1 12 14761 1 1 71 ILE HA H 9.548 9.610 -7.980 1.20 . A A . 71 ILE HA 1 1 12 14762 1 1 71 ILE HB H 10.477 12.100 -9.483 1.70 . A A . 71 ILE HB 1 1 12 14763 1 1 71 ILE HD11 H 12.816 13.202 -7.489 2.20 . A A . 71 ILE HD11 1 1 12 14764 1 1 71 ILE HD12 H 11.371 14.088 -7.002 2.30 . A A . 71 ILE HD12 1 1 12 14765 1 1 71 ILE HD13 H 11.606 13.647 -8.693 2.10 . A A . 71 ILE HD13 1 1 12 14766 1 1 71 ILE HG12 H 10.447 12.049 -6.497 1.60 . A A . 71 ILE HG12 1 1 12 14767 1 1 71 ILE HG13 H 11.748 11.193 -7.284 1.70 . A A . 71 ILE HG13 1 1 12 14768 1 1 71 ILE HG21 H 8.426 12.945 -9.109 2.30 . A A . 71 ILE HG21 1 1 12 14769 1 1 71 ILE HG22 H 8.629 12.715 -7.373 2.20 . A A . 71 ILE HG22 1 1 12 14770 1 1 71 ILE HG23 H 7.927 11.430 -8.358 2.20 . A A . 71 ILE HG23 1 1 12 14771 1 1 71 ILE N N 11.346 9.587 -8.972 0.90 . A A . 71 ILE N 1 1 12 14772 1 1 71 ILE O O 8.889 10.785 -10.853 0.90 . A A . 71 ILE O 1 1 12 14773 1 1 72 LEU C C 7.140 9.033 -11.961 0.80 . A A . 72 LEU C 1 1 12 14774 1 1 72 LEU CA C 8.376 8.217 -11.596 0.80 . A A . 72 LEU CA 1 1 12 14775 1 1 72 LEU CB C 8.003 6.729 -11.639 0.80 . A A . 72 LEU CB 1 1 12 14776 1 1 72 LEU CD1 C 6.856 5.725 -13.637 0.70 . A A . 72 LEU CD1 1 1 12 14777 1 1 72 LEU CD2 C 9.060 6.835 -13.931 0.60 . A A . 72 LEU CD2 1 1 12 14778 1 1 72 LEU CG C 8.198 6.027 -12.980 0.70 . A A . 72 LEU CG 1 1 12 14779 1 1 72 LEU H H 9.294 7.893 -9.698 0.90 . A A . 72 LEU H 1 1 12 14780 1 1 72 LEU HA H 9.192 8.445 -12.275 0.80 . A A . 72 LEU HA 1 1 12 14781 1 1 72 LEU HB2 H 8.532 6.166 -10.879 1.00 . A A . 72 LEU HB2 1 1 12 14782 1 1 72 LEU HB3 H 6.954 6.654 -11.399 1.00 . A A . 72 LEU HB3 1 1 12 14783 1 1 72 LEU HD11 H 6.026 5.866 -12.948 1.40 . A A . 72 LEU HD11 1 1 12 14784 1 1 72 LEU HD12 H 6.831 4.698 -13.992 1.20 . A A . 72 LEU HD12 1 1 12 14785 1 1 72 LEU HD13 H 6.701 6.388 -14.486 1.20 . A A . 72 LEU HD13 1 1 12 14786 1 1 72 LEU HD21 H 10.022 7.050 -13.468 1.10 . A A . 72 LEU HD21 1 1 12 14787 1 1 72 LEU HD22 H 8.567 7.780 -14.154 1.10 . A A . 72 LEU HD22 1 1 12 14788 1 1 72 LEU HD23 H 9.217 6.290 -14.859 1.20 . A A . 72 LEU HD23 1 1 12 14789 1 1 72 LEU HG H 8.704 5.082 -12.783 0.70 . A A . 72 LEU HG 1 1 12 14790 1 1 72 LEU N N 8.852 8.578 -10.275 0.80 . A A . 72 LEU N 1 1 12 14791 1 1 72 LEU O O 6.759 9.999 -11.310 0.90 . A A . 72 LEU O 1 1 12 14792 1 1 73 ASP C C 6.110 8.580 -15.434 1.20 . A A . 73 ASP C 1 1 12 14793 1 1 73 ASP CA C 6.343 9.419 -14.186 1.00 . A A . 73 ASP CA 1 1 12 14794 1 1 73 ASP CB C 7.583 10.264 -14.395 1.50 . A A . 73 ASP CB 1 1 12 14795 1 1 73 ASP CG C 7.411 11.639 -13.746 2.00 . A A . 73 ASP CG 1 1 12 14796 1 1 73 ASP H H 6.393 7.553 -13.115 0.80 . A A . 73 ASP H 1 1 12 14797 1 1 73 ASP HA H 5.464 10.027 -13.971 1.20 . A A . 73 ASP HA 1 1 12 14798 1 1 73 ASP HB2 H 8.436 9.754 -13.952 1.90 . A A . 73 ASP HB2 1 1 12 14799 1 1 73 ASP HB3 H 7.752 10.374 -15.464 1.90 . A A . 73 ASP HB3 1 1 12 14800 1 1 73 ASP N N 6.543 8.540 -13.054 0.90 . A A . 73 ASP N 1 1 12 14801 1 1 73 ASP O O 6.857 8.604 -16.405 1.70 . A A . 73 ASP O 1 1 12 14802 1 1 73 ASP OD1 O 6.378 12.269 -13.968 2.30 . A A . 73 ASP OD1 1 1 12 14803 1 1 73 ASP OD2 O 8.313 12.065 -13.026 2.80 . A A . 73 ASP OD2 1 1 12 14804 1 1 74 ASP C C 5.133 6.870 -17.510 1.40 . A A . 74 ASP C 1 1 12 14805 1 1 74 ASP CA C 4.232 7.573 -16.500 1.80 . A A . 74 ASP CA 1 1 12 14806 1 1 74 ASP CB C 3.683 8.878 -17.079 2.60 . A A . 74 ASP CB 1 1 12 14807 1 1 74 ASP CG C 2.582 8.581 -18.099 3.20 . A A . 74 ASP CG 1 1 12 14808 1 1 74 ASP H H 4.670 7.774 -14.371 1.40 . A A . 74 ASP H 1 1 12 14809 1 1 74 ASP HA H 3.459 6.861 -16.214 2.30 . A A . 74 ASP HA 1 1 12 14810 1 1 74 ASP HB2 H 3.281 9.512 -16.289 3.00 . A A . 74 ASP HB2 1 1 12 14811 1 1 74 ASP HB3 H 4.477 9.437 -17.574 3.10 . A A . 74 ASP HB3 1 1 12 14812 1 1 74 ASP N N 5.007 7.839 -15.306 1.30 . A A . 74 ASP N 1 1 12 14813 1 1 74 ASP O O 5.288 7.275 -18.655 1.80 . A A . 74 ASP O 1 1 12 14814 1 1 74 ASP OD1 O 1.934 7.543 -17.979 3.70 . A A . 74 ASP OD1 1 1 12 14815 1 1 74 ASP OD2 O 2.384 9.394 -19.001 3.60 . A A . 74 ASP OD2 1 1 12 14816 1 1 75 GLY C C 6.334 3.484 -17.395 1.10 . A A . 75 GLY C 1 1 12 14817 1 1 75 GLY CA C 5.192 4.481 -17.322 1.10 . A A . 75 GLY CA 1 1 12 14818 1 1 75 GLY H H 6.305 5.861 -16.172 1.30 . A A . 75 GLY H 1 1 12 14819 1 1 75 GLY HA2 H 4.489 4.203 -16.534 1.30 . A A . 75 GLY HA2 1 1 12 14820 1 1 75 GLY HA3 H 4.671 4.529 -18.266 1.50 . A A . 75 GLY HA3 1 1 12 14821 1 1 75 GLY N N 5.709 5.783 -16.972 1.00 . A A . 75 GLY N 1 1 12 14822 1 1 75 GLY O O 7.038 3.315 -18.384 1.40 . A A . 75 GLY O 1 1 12 14823 1 1 76 PHE C C 7.639 1.427 -14.546 0.80 . A A . 76 PHE C 1 1 12 14824 1 1 76 PHE CA C 7.721 2.424 -15.722 0.90 . A A . 76 PHE CA 1 1 12 14825 1 1 76 PHE CB C 8.503 3.660 -15.285 1.00 . A A . 76 PHE CB 1 1 12 14826 1 1 76 PHE CD1 C 10.110 3.924 -17.244 2.00 . A A . 76 PHE CD1 1 1 12 14827 1 1 76 PHE CD2 C 11.020 3.365 -14.996 1.80 . A A . 76 PHE CD2 1 1 12 14828 1 1 76 PHE CE1 C 11.441 3.907 -17.790 2.70 . A A . 76 PHE CE1 1 1 12 14829 1 1 76 PHE CE2 C 12.353 3.348 -15.538 2.50 . A A . 76 PHE CE2 1 1 12 14830 1 1 76 PHE CG C 9.893 3.651 -15.846 1.20 . A A . 76 PHE CG 1 1 12 14831 1 1 76 PHE CZ C 12.563 3.619 -16.936 2.80 . A A . 76 PHE CZ 1 1 12 14832 1 1 76 PHE H H 5.590 2.982 -15.690 1.00 . A A . 76 PHE H 1 1 12 14833 1 1 76 PHE HA H 8.188 1.908 -16.554 0.80 . A A . 76 PHE HA 1 1 12 14834 1 1 76 PHE HB2 H 7.985 4.563 -15.613 1.60 . A A . 76 PHE HB2 1 1 12 14835 1 1 76 PHE HB3 H 8.546 3.700 -14.197 1.30 . A A . 76 PHE HB3 1 1 12 14836 1 1 76 PHE HD1 H 9.269 4.140 -17.886 2.50 . A A . 76 PHE HD1 1 1 12 14837 1 1 76 PHE HD2 H 10.864 3.160 -13.948 2.30 . A A . 76 PHE HD2 1 1 12 14838 1 1 76 PHE HE1 H 11.598 4.109 -18.839 3.50 . A A . 76 PHE HE1 1 1 12 14839 1 1 76 PHE HE2 H 13.195 3.130 -14.897 3.20 . A A . 76 PHE HE2 1 1 12 14840 1 1 76 PHE HZ H 13.562 3.605 -17.344 3.50 . A A . 76 PHE HZ 1 1 12 14841 1 1 76 PHE N N 6.423 2.858 -16.226 0.90 . A A . 76 PHE N 1 1 12 14842 1 1 76 PHE O O 8.622 0.802 -14.165 0.80 . A A . 76 PHE O 1 1 12 14843 1 1 77 ILE C C 6.762 1.312 -11.593 0.70 . A A . 77 ILE C 1 1 12 14844 1 1 77 ILE CA C 6.221 2.075 -12.784 0.80 . A A . 77 ILE CA 1 1 12 14845 1 1 77 ILE CB C 4.769 2.447 -12.615 0.90 . A A . 77 ILE CB 1 1 12 14846 1 1 77 ILE CD1 C 3.737 2.075 -14.906 1.20 . A A . 77 ILE CD1 1 1 12 14847 1 1 77 ILE CG1 C 4.340 3.077 -13.916 1.10 . A A . 77 ILE CG1 1 1 12 14848 1 1 77 ILE CG2 C 4.649 3.527 -11.550 0.90 . A A . 77 ILE CG2 1 1 12 14849 1 1 77 ILE H H 5.745 1.305 -14.748 0.80 . A A . 77 ILE H 1 1 12 14850 1 1 77 ILE HA H 6.667 3.036 -12.921 0.80 . A A . 77 ILE HA 1 1 12 14851 1 1 77 ILE HB H 4.147 1.585 -12.375 0.90 . A A . 77 ILE HB 1 1 12 14852 1 1 77 ILE HD11 H 4.177 1.088 -14.776 1.50 . A A . 77 ILE HD11 1 1 12 14853 1 1 77 ILE HD12 H 3.917 2.390 -15.934 1.60 . A A . 77 ILE HD12 1 1 12 14854 1 1 77 ILE HD13 H 2.663 1.964 -14.772 1.70 . A A . 77 ILE HD13 1 1 12 14855 1 1 77 ILE HG12 H 3.674 3.875 -13.644 1.30 . A A . 77 ILE HG12 1 1 12 14856 1 1 77 ILE HG13 H 5.202 3.588 -14.337 1.10 . A A . 77 ILE HG13 1 1 12 14857 1 1 77 ILE HG21 H 3.608 3.691 -11.279 1.10 . A A . 77 ILE HG21 1 1 12 14858 1 1 77 ILE HG22 H 5.025 4.467 -11.954 1.40 . A A . 77 ILE HG22 1 1 12 14859 1 1 77 ILE HG23 H 5.238 3.280 -10.671 1.40 . A A . 77 ILE HG23 1 1 12 14860 1 1 77 ILE N N 6.415 1.328 -14.011 0.80 . A A . 77 ILE N 1 1 12 14861 1 1 77 ILE O O 7.706 1.673 -10.900 0.80 . A A . 77 ILE O 1 1 12 14862 1 1 78 CYS C C 6.271 -2.202 -11.374 0.70 . A A . 78 CYS C 1 1 12 14863 1 1 78 CYS CA C 6.399 -0.884 -10.601 0.50 . A A . 78 CYS CA 1 1 12 14864 1 1 78 CYS CB C 5.500 -0.886 -9.364 0.40 . A A . 78 CYS CB 1 1 12 14865 1 1 78 CYS H H 5.285 0.245 -12.131 0.50 . A A . 78 CYS H 1 1 12 14866 1 1 78 CYS HA H 7.439 -0.720 -10.319 0.60 . A A . 78 CYS HA 1 1 12 14867 1 1 78 CYS HB2 H 4.610 -0.286 -9.555 0.70 . A A . 78 CYS HB2 1 1 12 14868 1 1 78 CYS HB3 H 5.161 -1.900 -9.151 0.70 . A A . 78 CYS HB3 1 1 12 14869 1 1 78 CYS N N 6.027 0.215 -11.466 0.50 . A A . 78 CYS N 1 1 12 14870 1 1 78 CYS O O 7.147 -3.058 -11.337 1.70 . A A . 78 CYS O 1 1 12 14871 1 1 78 CYS SG S 6.341 -0.232 -7.901 1.00 . A A . 78 CYS SG 1 1 12 14872 1 1 79 THR C C 3.935 -2.869 -14.135 0.90 . A A . 79 THR C 1 1 12 14873 1 1 79 THR CA C 5.172 -2.203 -13.523 0.70 . A A . 79 THR CA 1 1 12 14874 1 1 79 THR CB C 6.437 -2.881 -14.050 0.90 . A A . 79 THR CB 1 1 12 14875 1 1 79 THR CG2 C 6.399 -4.395 -13.842 1.60 . A A . 79 THR CG2 1 1 12 14876 1 1 79 THR H H 4.257 -2.463 -11.602 1.30 . A A . 79 THR H 1 1 12 14877 1 1 79 THR HA H 5.166 -1.140 -13.762 0.80 . A A . 79 THR HA 1 1 12 14878 1 1 79 THR HB H 7.311 -2.465 -13.550 0.70 . A A . 79 THR HB 1 1 12 14879 1 1 79 THR HG1 H 6.849 -3.415 -15.835 2.00 . A A . 79 THR HG1 1 1 12 14880 1 1 79 THR HG21 H 5.619 -4.851 -14.452 2.00 . A A . 79 THR HG21 1 1 12 14881 1 1 79 THR HG22 H 6.198 -4.639 -12.799 2.20 . A A . 79 THR HG22 1 1 12 14882 1 1 79 THR HG23 H 7.350 -4.850 -14.119 2.10 . A A . 79 THR HG23 1 1 12 14883 1 1 79 THR N N 5.124 -2.304 -12.073 0.70 . A A . 79 THR N 1 1 12 14884 1 1 79 THR O O 3.670 -4.047 -13.931 1.50 . A A . 79 THR O 1 1 12 14885 1 1 79 THR OG1 O 6.575 -2.607 -15.421 1.70 . A A . 79 THR OG1 1 1 12 14886 1 1 80 ASP C C 3.868 -3.392 -16.869 1.10 . A A . 80 ASP C 1 1 12 14887 1 1 80 ASP CA C 3.003 -2.245 -16.327 1.20 . A A . 80 ASP CA 1 1 12 14888 1 1 80 ASP CB C 3.305 -0.950 -17.083 1.70 . A A . 80 ASP CB 1 1 12 14889 1 1 80 ASP CG C 4.806 -0.654 -17.048 2.40 . A A . 80 ASP CG 1 1 12 14890 1 1 80 ASP H H 2.720 -1.270 -14.464 0.80 . A A . 80 ASP H 1 1 12 14891 1 1 80 ASP HA H 1.950 -2.504 -16.449 1.50 . A A . 80 ASP HA 1 1 12 14892 1 1 80 ASP HB2 H 2.985 -1.033 -18.124 1.80 . A A . 80 ASP HB2 1 1 12 14893 1 1 80 ASP HB3 H 2.772 -0.114 -16.625 2.10 . A A . 80 ASP HB3 1 1 12 14894 1 1 80 ASP N N 3.201 -2.031 -14.898 0.80 . A A . 80 ASP N 1 1 12 14895 1 1 80 ASP O O 4.983 -3.195 -17.337 1.90 . A A . 80 ASP O 1 1 12 14896 1 1 80 ASP OD1 O 5.364 -0.578 -15.955 2.90 . A A . 80 ASP OD1 1 1 12 14897 1 1 80 ASP OD2 O 5.398 -0.500 -18.115 2.90 . A A . 80 ASP OD2 1 1 12 14898 1 1 81 ILE C C 5.069 -5.651 -18.036 1.60 . A A . 81 ILE C 1 1 12 14899 1 1 81 ILE CA C 4.026 -5.818 -16.928 1.30 . A A . 81 ILE CA 1 1 12 14900 1 1 81 ILE CB C 3.122 -7.017 -17.261 1.70 . A A . 81 ILE CB 1 1 12 14901 1 1 81 ILE CD1 C 0.781 -7.847 -17.787 3.00 . A A . 81 ILE CD1 1 1 12 14902 1 1 81 ILE CG1 C 1.626 -6.679 -17.278 2.50 . A A . 81 ILE CG1 1 1 12 14903 1 1 81 ILE CG2 C 3.394 -8.174 -16.299 1.90 . A A . 81 ILE CG2 1 1 12 14904 1 1 81 ILE H H 2.316 -4.634 -16.437 1.50 . A A . 81 ILE H 1 1 12 14905 1 1 81 ILE HA H 4.531 -5.987 -15.977 1.50 . A A . 81 ILE HA 1 1 12 14906 1 1 81 ILE HB H 3.389 -7.356 -18.262 2.20 . A A . 81 ILE HB 1 1 12 14907 1 1 81 ILE HD11 H 0.495 -8.507 -16.968 3.20 . A A . 81 ILE HD11 1 1 12 14908 1 1 81 ILE HD12 H 1.332 -8.437 -18.519 3.40 . A A . 81 ILE HD12 1 1 12 14909 1 1 81 ILE HD13 H -0.131 -7.488 -18.264 3.30 . A A . 81 ILE HD13 1 1 12 14910 1 1 81 ILE HG12 H 1.302 -6.405 -16.273 2.70 . A A . 81 ILE HG12 1 1 12 14911 1 1 81 ILE HG13 H 1.458 -5.805 -17.907 3.00 . A A . 81 ILE HG13 1 1 12 14912 1 1 81 ILE HG21 H 2.485 -8.466 -15.775 2.20 . A A . 81 ILE HG21 1 1 12 14913 1 1 81 ILE HG22 H 4.138 -7.894 -15.553 2.30 . A A . 81 ILE HG22 1 1 12 14914 1 1 81 ILE HG23 H 3.768 -9.046 -16.835 2.30 . A A . 81 ILE HG23 1 1 12 14915 1 1 81 ILE N N 3.261 -4.590 -16.761 1.00 . A A . 81 ILE N 1 1 12 14916 1 1 81 ILE O O 4.750 -5.401 -19.192 2.40 . A A . 81 ILE O 1 1 12 14917 1 1 82 ASP C C 6.553 -8.145 -18.242 2.70 . A A . 82 ASP C 1 1 12 14918 1 1 82 ASP CA C 7.182 -6.752 -18.298 2.60 . A A . 82 ASP CA 1 1 12 14919 1 1 82 ASP CB C 8.569 -6.776 -17.654 3.50 . A A . 82 ASP CB 1 1 12 14920 1 1 82 ASP CG C 9.544 -7.539 -18.552 3.90 . A A . 82 ASP CG 1 1 12 14921 1 1 82 ASP H H 6.675 -5.284 -16.819 2.10 . A A . 82 ASP H 1 1 12 14922 1 1 82 ASP HA H 7.234 -6.418 -19.334 3.00 . A A . 82 ASP HA 1 1 12 14923 1 1 82 ASP HB2 H 8.941 -5.763 -17.506 3.90 . A A . 82 ASP HB2 1 1 12 14924 1 1 82 ASP HB3 H 8.531 -7.262 -16.679 3.90 . A A . 82 ASP HB3 1 1 12 14925 1 1 82 ASP N N 6.332 -5.807 -17.600 1.90 . A A . 82 ASP N 1 1 12 14926 1 1 82 ASP O O 6.405 -8.829 -19.247 3.30 . A A . 82 ASP O 1 1 12 14927 1 1 82 ASP OD1 O 9.542 -8.768 -18.510 4.50 . A A . 82 ASP OD1 1 1 12 14928 1 1 82 ASP OD2 O 10.296 -6.895 -19.283 4.20 . A A . 82 ASP OD2 1 1 12 14929 1 1 83 GLU C C 6.408 -10.658 -15.874 1.00 . A A . 83 GLU C 1 1 12 14930 1 1 83 GLU CA C 7.104 -9.346 -16.241 1.00 . A A . 83 GLU CA 1 1 12 14931 1 1 83 GLU CB C 7.551 -8.613 -14.976 1.00 . A A . 83 GLU CB 1 1 12 14932 1 1 83 GLU CD C 9.227 -9.942 -13.678 1.00 . A A . 83 GLU CD 1 1 12 14933 1 1 83 GLU CG C 9.040 -8.815 -14.695 1.00 . A A . 83 GLU CG 1 1 12 14934 1 1 83 GLU H H 5.328 -8.202 -16.604 1.00 . A A . 83 GLU H 1 1 12 14935 1 1 83 GLU HA H 7.951 -9.555 -16.894 1.00 . A A . 83 GLU HA 1 1 12 14936 1 1 83 GLU HB2 H 7.338 -7.548 -15.076 1.00 . A A . 83 GLU HB2 1 1 12 14937 1 1 83 GLU HB3 H 6.968 -8.966 -14.125 1.00 . A A . 83 GLU HB3 1 1 12 14938 1 1 83 GLU HG2 H 9.572 -9.072 -15.611 1.00 . A A . 83 GLU HG2 1 1 12 14939 1 1 83 GLU HG3 H 9.484 -7.902 -14.298 1.00 . A A . 83 GLU HG3 1 1 12 14940 1 1 83 GLU N N 6.194 -8.508 -16.998 1.00 . A A . 83 GLU N 1 1 12 14941 1 1 83 GLU O O 6.718 -11.679 -16.486 1.00 . A A . 83 GLU O 1 1 12 14942 1 1 83 GLU OXT O 5.564 -10.643 -14.979 1.00 . A A . 83 GLU OXT 1 1 12 14943 1 1 83 GLU OE1 O 9.215 -11.104 -14.081 1.00 . A A . 83 GLU OE1 1 1 12 14944 1 1 83 GLU OE2 O 9.383 -9.645 -12.495 1.00 . A A . 83 GLU OE2 1 1 12 14945 2 2 1 NAG C1 C -15.736 1.157 9.332 1.00 . B A . 121 NAG C1 1 1 12 14946 2 2 1 NAG C2 C -15.585 2.346 10.276 1.00 . B A . 121 NAG C2 1 1 12 14947 2 2 1 NAG C3 C -16.831 2.520 11.141 1.00 . B A . 121 NAG C3 1 1 12 14948 2 2 1 NAG C4 C -17.625 1.215 11.257 1.00 . B A . 121 NAG C4 1 1 12 14949 2 2 1 NAG C5 C -17.944 0.584 9.897 1.00 . B A . 121 NAG C5 1 1 12 14950 2 2 1 NAG C6 C -19.386 0.868 9.474 1.00 . B A . 121 NAG C6 1 1 12 14951 2 2 1 NAG C7 C -14.295 0.988 11.783 1.00 . B A . 121 NAG C7 1 1 12 14952 2 2 1 NAG C8 C -13.448 -0.036 11.024 1.00 . B A . 121 NAG C8 1 1 12 14953 2 2 1 NAG H1 H -15.444 0.225 9.816 1.00 . B A . 121 NAG H1 1 1 12 14954 2 2 1 NAG H2 H -15.390 3.256 9.708 1.00 . B A . 121 NAG H2 1 1 12 14955 2 2 1 NAG H3 H -16.539 2.858 12.135 1.00 . B A . 121 NAG H3 1 1 12 14956 2 2 1 NAG H4 H -18.557 1.411 11.787 1.00 . B A . 121 NAG H4 1 1 12 14957 2 2 1 NAG H5 H -17.805 -0.495 9.969 1.00 . B A . 121 NAG H5 1 1 12 14958 2 2 1 NAG H61 H -20.062 0.106 9.862 1.00 . B A . 121 NAG H61 1 1 12 14959 2 2 1 NAG H62 H -19.479 0.878 8.388 1.00 . B A . 121 NAG H62 1 1 12 14960 2 2 1 NAG H81 H -13.153 0.369 10.056 1.00 . B A . 121 NAG H81 1 1 12 14961 2 2 1 NAG H82 H -12.552 -0.274 11.597 1.00 . B A . 121 NAG H82 1 1 12 14962 2 2 1 NAG H83 H -14.021 -0.950 10.867 1.00 . B A . 121 NAG H83 1 1 12 14963 2 2 1 NAG HN2 H -13.735 2.871 11.219 1.00 . B A . 121 NAG HN2 1 1 12 14964 2 2 1 NAG HO3 H -18.061 3.968 11.312 1.00 . B A . 121 NAG HO3 1 1 12 14965 2 2 1 NAG HO4 H -17.355 -0.533 11.969 1.00 . B A . 121 NAG HO4 1 1 12 14966 2 2 1 NAG HO6 H -19.125 2.737 9.752 1.00 . B A . 121 NAG HO6 1 1 12 14967 2 2 1 NAG N2 N -14.425 2.153 11.125 1.00 . B A . 121 NAG N2 1 1 12 14968 2 2 1 NAG O3 O -17.649 3.518 10.586 1.00 . B A . 121 NAG O3 1 1 12 14969 2 2 1 NAG O4 O -16.899 0.296 12.032 1.00 . B A . 121 NAG O4 1 1 12 14970 2 2 1 NAG O5 O -17.074 1.076 8.904 1.00 . B A . 121 NAG O5 1 1 12 14971 2 2 1 NAG O6 O -19.810 2.116 9.961 1.00 . B A . 121 NAG O6 1 1 12 14972 2 2 1 NAG O7 O -14.782 0.739 12.879 1.00 . B A . 121 NAG O7 1 1 12 14973 3 2 1 NAG C1 C -6.635 0.736 -5.173 1.00 . C A . 148 NAG C1 1 1 12 14974 3 2 1 NAG C2 C -6.644 1.728 -4.009 1.00 . C A . 148 NAG C2 1 1 12 14975 3 2 1 NAG C3 C -8.023 1.839 -3.354 1.00 . C A . 148 NAG C3 1 1 12 14976 3 2 1 NAG C4 C -9.149 1.874 -4.389 1.00 . C A . 148 NAG C4 1 1 12 14977 3 2 1 NAG C5 C -8.946 0.830 -5.487 1.00 . C A . 148 NAG C5 1 1 12 14978 3 2 1 NAG C6 C -10.017 0.929 -6.573 1.00 . C A . 148 NAG C6 1 1 12 14979 3 2 1 NAG C7 C -4.740 2.167 -2.613 1.00 . C A . 148 NAG C7 1 1 12 14980 3 2 1 NAG C8 C -3.320 1.634 -2.807 1.00 . C A . 148 NAG C8 1 1 12 14981 3 2 1 NAG H1 H -6.736 -0.287 -4.810 1.00 . C A . 148 NAG H1 1 1 12 14982 3 2 1 NAG H2 H -6.307 2.708 -4.345 1.00 . C A . 148 NAG H2 1 1 12 14983 3 2 1 NAG H3 H -8.175 0.991 -2.686 1.00 . C A . 148 NAG H3 1 1 12 14984 3 2 1 NAG H4 H -9.198 2.867 -4.837 1.00 . C A . 148 NAG H4 1 1 12 14985 3 2 1 NAG H5 H -8.974 -0.165 -5.044 1.00 . C A . 148 NAG H5 1 1 12 14986 3 2 1 NAG H61 H -10.470 -0.045 -6.761 1.00 . C A . 148 NAG H61 1 1 12 14987 3 2 1 NAG H62 H -9.591 1.288 -7.509 1.00 . C A . 148 NAG H62 1 1 12 14988 3 2 1 NAG H81 H -2.830 2.168 -3.621 1.00 . C A . 148 NAG H81 1 1 12 14989 3 2 1 NAG H82 H -2.743 1.773 -1.892 1.00 . C A . 148 NAG H82 1 1 12 14990 3 2 1 NAG H83 H -3.355 0.572 -3.049 1.00 . C A . 148 NAG H83 1 1 12 14991 3 2 1 NAG HN2 H -5.724 0.373 -2.629 1.00 . C A . 148 NAG HN2 1 1 12 14992 3 2 1 NAG HO3 H -8.697 2.832 -1.871 1.00 . C A . 148 NAG HO3 1 1 12 14993 3 2 1 NAG HO4 H -10.875 2.453 -3.817 1.00 . C A . 148 NAG HO4 1 1 12 14994 3 2 1 NAG HO6 H -11.718 1.291 -5.788 1.00 . C A . 148 NAG HO6 1 1 12 14995 3 2 1 NAG N2 N -5.685 1.296 -3.011 1.00 . C A . 148 NAG N2 1 1 12 14996 3 2 1 NAG O3 O -8.075 3.001 -2.567 1.00 . C A . 148 NAG O3 1 1 12 14997 3 2 1 NAG O4 O -10.379 1.648 -3.750 1.00 . C A . 148 NAG O4 1 1 12 14998 3 2 1 NAG O5 O -7.680 1.024 -6.068 1.00 . C A . 148 NAG O5 1 1 12 14999 3 2 1 NAG O6 O -11.036 1.816 -6.187 1.00 . C A . 148 NAG O6 1 1 12 15000 3 2 1 NAG O7 O -4.958 3.276 -2.141 1.00 . C A . 148 NAG O7 1 1 stop_ save_
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