NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
481823 | 1hry | cing | 4-filtered-FRED | STAR | entry | full | 1455 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1hry # This FRED archive file contains, for PDB entry <1hry>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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_1hry _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1hry _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 13961.69 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 $DNA__5__D__GP_CP_AP_CP_AP_AP_AP_C__3__ A . 1 1 2 . 2 $DNA__5__D__GP_TP_TP_TP_GP_TP_GP_C__3__ B . 1 1 3 . 3 $HUMAN_SRY C . 1 1 stop_ save_ save_DNA__5__D__GP_CP_AP_CP_AP_AP_AP_C__3__ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "DNA 5 D GP CP AP CP AP AP AP C 3 " _Entity.Type polymer _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_seq_one_letter_code GCACAAAC _Entity.Number_of_monomers 8 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 DG . 1 1 2 DC . 1 1 3 DA . 1 1 4 DC . 1 1 5 DA . 1 1 6 DA . 1 1 7 DA . 1 1 8 DC . 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 DG 1 1 1 1 DC 2 2 1 1 DA 3 3 1 1 DC 4 4 1 1 DA 5 5 1 1 DA 6 6 1 1 DA 7 7 1 1 DC 8 8 1 1 stop_ save_ save_DNA__5__D__GP_TP_TP_TP_GP_TP_GP_C__3__ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "DNA 5 D GP TP TP TP GP TP GP C 3 " _Entity.Type polymer _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_seq_one_letter_code GTTTGTGC _Entity.Number_of_monomers 8 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 DG . 1 2 2 DT . 1 2 3 DT . 1 2 4 DT . 1 2 5 DG . 1 2 6 DT . 1 2 7 DG . 1 2 8 DC . 1 2 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 DG 1 1 1 2 DT 2 2 1 2 DT 3 3 1 2 DT 4 4 1 2 DG 5 5 1 2 DT 6 6 1 2 DG 7 7 1 2 DC 8 8 1 2 stop_ save_ save_HUMAN_SRY _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 3 _Entity.Name "HUMAN SRY" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VQDRVKRPMNAFIVWSRDQRRKMALENPRMRNSEISKQLGYQWKMLTEAEKWPFFQEAQKLQAMHREKYPNYKYRP _Entity.Number_of_monomers 76 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 VAL . 1 3 2 GLN . 1 3 3 ASP . 1 3 4 ARG . 1 3 5 VAL . 1 3 6 LYS . 1 3 7 ARG . 1 3 8 PRO . 1 3 9 MET . 1 3 10 ASN . 1 3 11 ALA . 1 3 12 PHE . 1 3 13 ILE . 1 3 14 VAL . 1 3 15 TRP . 1 3 16 SER . 1 3 17 ARG . 1 3 18 ASP . 1 3 19 GLN . 1 3 20 ARG . 1 3 21 ARG . 1 3 22 LYS . 1 3 23 MET . 1 3 24 ALA . 1 3 25 LEU . 1 3 26 GLU . 1 3 27 ASN . 1 3 28 PRO . 1 3 29 ARG . 1 3 30 MET . 1 3 31 ARG . 1 3 32 ASN . 1 3 33 SER . 1 3 34 GLU . 1 3 35 ILE . 1 3 36 SER . 1 3 37 LYS . 1 3 38 GLN . 1 3 39 LEU . 1 3 40 GLY . 1 3 41 TYR . 1 3 42 GLN . 1 3 43 TRP . 1 3 44 LYS . 1 3 45 MET . 1 3 46 LEU . 1 3 47 THR . 1 3 48 GLU . 1 3 49 ALA . 1 3 50 GLU . 1 3 51 LYS . 1 3 52 TRP . 1 3 53 PRO . 1 3 54 PHE . 1 3 55 PHE . 1 3 56 GLN . 1 3 57 GLU . 1 3 58 ALA . 1 3 59 GLN . 1 3 60 LYS . 1 3 61 LEU . 1 3 62 GLN . 1 3 63 ALA . 1 3 64 MET . 1 3 65 HIS . 1 3 66 ARG . 1 3 67 GLU . 1 3 68 LYS . 1 3 69 TYR . 1 3 70 PRO . 1 3 71 ASN . 1 3 72 TYR . 1 3 73 LYS . 1 3 74 TYR . 1 3 75 ARG . 1 3 76 PRO . 1 3 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 VAL 1 1 1 3 GLN 2 2 1 3 ASP 3 3 1 3 ARG 4 4 1 3 VAL 5 5 1 3 LYS 6 6 1 3 ARG 7 7 1 3 PRO 8 8 1 3 MET 9 9 1 3 ASN 10 10 1 3 ALA 11 11 1 3 PHE 12 12 1 3 ILE 13 13 1 3 VAL 14 14 1 3 TRP 15 15 1 3 SER 16 16 1 3 ARG 17 17 1 3 ASP 18 18 1 3 GLN 19 19 1 3 ARG 20 20 1 3 ARG 21 21 1 3 LYS 22 22 1 3 MET 23 23 1 3 ALA 24 24 1 3 LEU 25 25 1 3 GLU 26 26 1 3 ASN 27 27 1 3 PRO 28 28 1 3 ARG 29 29 1 3 MET 30 30 1 3 ARG 31 31 1 3 ASN 32 32 1 3 SER 33 33 1 3 GLU 34 34 1 3 ILE 35 35 1 3 SER 36 36 1 3 LYS 37 37 1 3 GLN 38 38 1 3 LEU 39 39 1 3 GLY 40 40 1 3 TYR 41 41 1 3 GLN 42 42 1 3 TRP 43 43 1 3 LYS 44 44 1 3 MET 45 45 1 3 LEU 46 46 1 3 THR 47 47 1 3 GLU 48 48 1 3 ALA 49 49 1 3 GLU 50 50 1 3 LYS 51 51 1 3 TRP 52 52 1 3 PRO 53 53 1 3 PHE 54 54 1 3 PHE 55 55 1 3 GLN 56 56 1 3 GLU 57 57 1 3 ALA 58 58 1 3 GLN 59 59 1 3 LYS 60 60 1 3 LEU 61 61 1 3 GLN 62 62 1 3 ALA 63 63 1 3 MET 64 64 1 3 HIS 65 65 1 3 ARG 66 66 1 3 GLU 67 67 1 3 LYS 68 68 1 3 TYR 69 69 1 3 PRO 70 70 1 3 ASN 71 71 1 3 TYR 72 72 1 3 LYS 73 73 1 3 TYR 74 74 1 3 ARG 75 75 1 3 PRO 76 76 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 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 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 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 3 3 4 ARG HA . 4 . HA 1 1 1 1 2 3 3 4 ARG QG . 4 . HG# 1 1 2 1 1 3 3 5 VAL HA . 5 . HA 1 1 2 1 2 3 3 5 VAL MG1 . 5 . HG1# 1 1 3 1 1 3 3 5 VAL HA . 5 . HA 1 1 3 1 2 3 3 5 VAL MG2 . 5 . HG2# 1 1 4 1 1 3 3 5 VAL H . 5 . HN 1 1 4 1 2 3 3 5 VAL HB . 5 . HB 1 1 5 1 1 3 3 6 LYS HA . 6 . HA 1 1 5 1 2 3 3 6 LYS QD . 6 . HD# 1 1 6 1 1 3 3 6 LYS HA . 6 . HA 1 1 6 1 2 3 3 6 LYS QE . 6 . HE# 1 1 7 1 1 3 3 6 LYS H . 6 . HN 1 1 7 1 2 3 3 6 LYS QB . 6 . HB# 1 1 8 1 1 3 3 6 LYS H . 6 . HN 1 1 8 1 2 3 3 6 LYS QG . 6 . HG# 1 1 9 1 1 3 3 8 PRO QB . 8 . HB# 1 1 9 1 2 3 3 8 PRO QD . 8 . HD# 1 1 10 1 1 3 3 9 MET H . 9 . HN 1 1 10 1 2 3 3 9 MET QG . 9 . HG# 1 1 11 1 1 3 3 13 ILE H . 13 . HN 1 1 11 1 2 3 3 13 ILE QG . 13 . HG1# 1 1 12 1 1 3 3 14 VAL HA . 14 . HA 1 1 12 1 2 3 3 14 VAL MG2 . 14 . HG2# 1 1 13 1 1 3 3 14 VAL HA . 14 . HA 1 1 13 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 14 1 1 3 3 14 VAL H . 14 . HN 1 1 14 1 2 3 3 14 VAL HB . 14 . HB 1 1 15 1 1 3 3 15 TRP H . 15 . HN 1 1 15 1 2 3 3 15 TRP QB . 15 . HB# 1 1 16 1 1 3 3 15 TRP HA . 15 . HA 1 1 16 1 2 3 3 15 TRP HE1 . 15 . HE1 1 1 17 1 1 3 3 16 SER H . 16 . HN 1 1 17 1 2 3 3 16 SER QB . 16 . HB# 1 1 18 1 1 3 3 17 ARG H . 17 . HN 1 1 18 1 2 3 3 17 ARG QB . 17 . HB# 1 1 19 1 1 3 3 17 ARG H . 17 . HN 1 1 19 1 2 3 3 17 ARG QD . 17 . HD# 1 1 20 1 1 3 3 17 ARG QB . 17 . HB# 1 1 20 1 2 3 3 17 ARG QD . 17 . HD# 1 1 21 1 1 3 3 17 ARG H . 17 . HN 1 1 21 1 2 3 3 17 ARG QG . 17 . HG# 1 1 22 1 1 3 3 18 ASP H . 18 . HN 1 1 22 1 2 3 3 18 ASP QB . 18 . HB# 1 1 23 1 1 3 3 19 GLN H . 19 . HN 1 1 23 1 2 3 3 19 GLN QG . 19 . HG# 1 1 24 1 1 3 3 20 ARG H . 20 . HN 1 1 24 1 2 3 3 20 ARG QB . 20 . HB# 1 1 25 1 1 3 3 20 ARG H . 20 . HN 1 1 25 1 2 3 3 20 ARG QG . 20 . HG# 1 1 26 1 1 3 3 21 ARG H . 21 . HN 1 1 26 1 2 3 3 21 ARG QB . 21 . HB# 1 1 27 1 1 3 3 22 LYS H . 22 . HN 1 1 27 1 2 3 3 22 LYS QB . 22 . HB# 1 1 28 1 1 3 3 22 LYS QB . 22 . HB# 1 1 28 1 2 3 3 22 LYS QD . 22 . HD# 1 1 29 1 1 3 3 22 LYS H . 22 . HN 1 1 29 1 2 3 3 22 LYS QD . 22 . HD# 1 1 30 1 1 3 3 22 LYS H . 22 . HN 1 1 30 1 2 3 3 22 LYS QG . 22 . HG# 1 1 31 1 1 3 3 23 MET HA . 23 . HA 1 1 31 1 2 3 3 23 MET ME . 23 . HE# 1 1 32 1 1 3 3 23 MET H . 23 . HN 1 1 32 1 2 3 3 23 MET QB . 23 . HB# 1 1 33 1 1 3 3 25 LEU HA . 25 . HA 1 1 33 1 2 3 3 25 LEU QD . 25 . HD* 1 1 34 1 1 3 3 25 LEU H . 25 . HN 1 1 34 1 2 3 3 25 LEU QB . 25 . HB# 1 1 35 1 1 3 3 26 GLU H . 26 . HN 1 1 35 1 2 3 3 26 GLU QB . 26 . HB# 1 1 36 1 1 3 3 26 GLU HA . 26 . HA 1 1 36 1 2 3 3 26 GLU QG . 26 . HG# 1 1 37 1 1 3 3 26 GLU H . 26 . HN 1 1 37 1 2 3 3 26 GLU QG . 26 . HG# 1 1 38 1 1 3 3 27 ASN H . 27 . HN 1 1 38 1 2 3 3 27 ASN QB . 27 . HB# 1 1 39 1 1 3 3 28 PRO HA . 28 . HA 1 1 39 1 2 3 3 28 PRO QG . 28 . HG# 1 1 40 1 1 3 3 29 ARG HA . 29 . HA 1 1 40 1 2 3 3 29 ARG QG . 29 . HG# 1 1 41 1 1 3 3 29 ARG H . 29 . HN 1 1 41 1 2 3 3 29 ARG QB . 29 . HB# 1 1 42 1 1 3 3 29 ARG HA . 29 . HA 1 1 42 1 2 3 3 29 ARG QD . 29 . HD# 1 1 43 1 1 3 3 30 MET H . 30 . HN 1 1 43 1 2 3 3 30 MET QB . 30 . HB# 1 1 44 1 1 3 3 30 MET H . 30 . HN 1 1 44 1 2 3 3 30 MET QG . 30 . HG# 1 1 45 1 1 3 3 31 ARG HA . 31 . HA 1 1 45 1 2 3 3 31 ARG QD . 31 . HD# 1 1 46 1 1 3 3 31 ARG HA . 31 . HA 1 1 46 1 2 3 3 31 ARG QG . 31 . HG# 1 1 47 1 1 3 3 34 GLU HA . 34 . HA 1 1 47 1 2 3 3 34 GLU QG . 34 . HG# 1 1 48 1 1 3 3 34 GLU H . 34 . HN 1 1 48 1 2 3 3 34 GLU QB . 34 . HB# 1 1 49 1 1 3 3 35 ILE H . 35 . HN 1 1 49 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 50 1 1 3 3 36 SER H . 36 . HN 1 1 50 1 2 3 3 36 SER QB . 36 . HB# 1 1 51 1 1 3 3 37 LYS H . 37 . HN 1 1 51 1 2 3 3 37 LYS QD . 37 . HD# 1 1 52 1 1 3 3 37 LYS QB . 37 . HB# 1 1 52 1 2 3 3 37 LYS QD . 37 . HD# 1 1 53 1 1 3 3 37 LYS H . 37 . HN 1 1 53 1 2 3 3 37 LYS QG . 37 . HG# 1 1 54 1 1 3 3 38 GLN H . 38 . HN 1 1 54 1 2 3 3 38 GLN QB . 38 . HB# 1 1 55 1 1 3 3 38 GLN H . 38 . HN 1 1 55 1 2 3 3 38 GLN QG . 38 . HG# 1 1 56 1 1 3 3 39 LEU HA . 39 . HA 1 1 56 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 57 1 1 3 3 39 LEU HA . 39 . HA 1 1 57 1 2 3 3 39 LEU MD2 . 39 . HD2# 1 1 58 1 1 3 3 39 LEU H . 39 . HN 1 1 58 1 2 3 3 39 LEU HG . 39 . HG 1 1 59 1 1 3 3 41 TYR HA . 41 . HA 1 1 59 1 2 3 3 41 TYR QD . 41 . HD# 1 1 60 1 1 3 3 41 TYR HA . 41 . HA 1 1 60 1 2 3 3 41 TYR QE . 41 . HE# 1 1 61 1 1 3 3 41 TYR H . 41 . HN 1 1 61 1 2 3 3 41 TYR QB . 41 . HB# 1 1 62 1 1 3 3 42 GLN H . 42 . HN 1 1 62 1 2 3 3 42 GLN QB . 42 . HB# 1 1 63 1 1 3 3 42 GLN H . 42 . HN 1 1 63 1 2 3 3 42 GLN QG . 42 . HG# 1 1 64 1 1 3 3 42 GLN HA . 42 . HA 1 1 64 1 2 3 3 42 GLN QE . 42 . HE2# 1 1 65 1 1 3 3 43 TRP H . 43 . HN 1 1 65 1 2 3 3 43 TRP QB . 43 . HB# 1 1 66 1 1 3 3 43 TRP QB . 43 . HB# 1 1 66 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 67 1 1 3 3 43 TRP QB . 43 . HB# 1 1 67 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 68 1 1 3 3 44 LYS H . 44 . HN 1 1 68 1 2 3 3 44 LYS QB . 44 . HB# 1 1 69 1 1 3 3 44 LYS H . 44 . HN 1 1 69 1 2 3 3 44 LYS QD . 44 . HD# 1 1 70 1 1 3 3 44 LYS QE . 44 . HE# 1 1 70 1 2 3 3 44 LYS QG . 44 . HG# 1 1 71 1 1 3 3 44 LYS H . 44 . HN 1 1 71 1 2 3 3 44 LYS QG . 44 . HG# 1 1 72 1 1 3 3 45 MET HA . 45 . HA 1 1 72 1 2 3 3 45 MET ME . 45 . HE# 1 1 73 1 1 3 3 45 MET H . 45 . HN 1 1 73 1 2 3 3 45 MET QB . 45 . HB# 1 1 74 1 1 3 3 45 MET H . 45 . HN 1 1 74 1 2 3 3 45 MET QG . 45 . HG# 1 1 75 1 1 3 3 46 LEU HA . 46 . HA 1 1 75 1 2 3 3 46 LEU MD1 . 46 . HD1# 1 1 76 1 1 3 3 46 LEU HA . 46 . HA 1 1 76 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 77 1 1 3 3 46 LEU H . 46 . HN 1 1 77 1 2 3 3 46 LEU HG . 46 . HG 1 1 78 1 1 3 3 46 LEU H . 46 . HN 1 1 78 1 2 3 3 46 LEU QB . 46 . HB# 1 1 79 1 1 3 3 46 LEU H . 46 . HN 1 1 79 1 2 3 3 46 LEU MD1 . 46 . HD1# 1 1 80 1 1 3 3 46 LEU H . 46 . HN 1 1 80 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 81 1 1 3 3 47 THR HA . 47 . HA 1 1 81 1 2 3 3 47 THR MG . 47 . HG2# 1 1 82 1 1 3 3 48 GLU H . 48 . HN 1 1 82 1 2 3 3 48 GLU QB . 48 . HB# 1 1 83 1 1 3 3 48 GLU H . 48 . HN 1 1 83 1 2 3 3 48 GLU QG . 48 . HG# 1 1 84 1 1 3 3 50 GLU H . 50 . HN 1 1 84 1 2 3 3 51 LYS H . 51 . HN 1 1 85 1 1 3 3 50 GLU H . 50 . HN 1 1 85 1 2 3 3 50 GLU QB . 50 . HB# 1 1 86 1 1 3 3 51 LYS H . 51 . HN 1 1 86 1 2 3 3 52 TRP H . 52 . HN 1 1 87 1 1 3 3 51 LYS H . 51 . HN 1 1 87 1 2 3 3 51 LYS QB . 51 . HB# 1 1 88 1 1 3 3 51 LYS QB . 51 . HB# 1 1 88 1 2 3 3 51 LYS QD . 51 . HD# 1 1 89 1 1 3 3 52 TRP HA . 52 . HA 1 1 89 1 2 3 3 52 TRP HD1 . 52 . HD1 1 1 90 1 1 3 3 52 TRP H . 52 . HN 1 1 90 1 2 3 3 52 TRP QB . 52 . HB# 1 1 91 1 1 3 3 52 TRP HA . 52 . HA 1 1 91 1 2 3 3 52 TRP HE1 . 52 . HE1 1 1 92 1 1 3 3 54 PHE H . 54 . HN 1 1 92 1 2 3 3 54 PHE QB . 54 . HB# 1 1 93 1 1 3 3 55 PHE H . 55 . HN 1 1 93 1 2 3 3 55 PHE QB . 55 . HB# 1 1 94 1 1 3 3 56 GLN H . 56 . HN 1 1 94 1 2 3 3 56 GLN QB . 56 . HB# 1 1 95 1 1 3 3 56 GLN H . 56 . HN 1 1 95 1 2 3 3 56 GLN QG . 56 . HG# 1 1 96 1 1 3 3 57 GLU H . 57 . HN 1 1 96 1 2 3 3 57 GLU QB . 57 . HB# 1 1 97 1 1 3 3 57 GLU H . 57 . HN 1 1 97 1 2 3 3 57 GLU QG . 57 . HG# 1 1 98 1 1 3 3 59 GLN H . 59 . HN 1 1 98 1 2 3 3 59 GLN QB . 59 . HB# 1 1 99 1 1 3 3 59 GLN H . 59 . HN 1 1 99 1 2 3 3 59 GLN QG . 59 . HG# 1 1 100 1 1 3 3 60 LYS H . 60 . HN 1 1 100 1 2 3 3 60 LYS QB . 60 . HB# 1 1 101 1 1 3 3 60 LYS QB . 60 . HB# 1 1 101 1 2 3 3 60 LYS QD . 60 . HD# 1 1 102 1 1 3 3 60 LYS H . 60 . HN 1 1 102 1 2 3 3 60 LYS QG . 60 . HG# 1 1 103 1 1 3 3 61 LEU HA . 61 . HA 1 1 103 1 2 3 3 61 LEU QD . 61 . HD* 1 1 104 1 1 3 3 61 LEU H . 61 . HN 1 1 104 1 2 3 3 61 LEU HG . 61 . HG 1 1 105 1 1 3 3 61 LEU H . 61 . HN 1 1 105 1 2 3 3 61 LEU QB . 61 . HB# 1 1 106 1 1 3 3 62 GLN H . 62 . HN 1 1 106 1 2 3 3 62 GLN QB . 62 . HB# 1 1 107 1 1 3 3 62 GLN H . 62 . HN 1 1 107 1 2 3 3 62 GLN QG . 62 . HG# 1 1 108 1 1 3 3 64 MET H . 64 . HN 1 1 108 1 2 3 3 64 MET QB . 64 . HB# 1 1 109 1 1 3 3 64 MET QB . 64 . HB# 1 1 109 1 2 3 3 64 MET ME . 64 . HE# 1 1 110 1 1 3 3 64 MET H . 64 . HN 1 1 110 1 2 3 3 64 MET QG . 64 . HG# 1 1 111 1 1 3 3 65 HIS HA . 65 . HA 1 1 111 1 2 3 3 65 HIS HE1 . 65 . HE1 1 1 112 1 1 3 3 65 HIS H . 65 . HN 1 1 112 1 2 3 3 65 HIS QB . 65 . HB# 1 1 113 1 1 3 3 66 ARG H . 66 . HN 1 1 113 1 2 3 3 66 ARG QB . 66 . HB# 1 1 114 1 1 3 3 66 ARG H . 66 . HN 1 1 114 1 2 3 3 66 ARG QD . 66 . HD# 1 1 115 1 1 3 3 67 GLU H . 67 . HN 1 1 115 1 2 3 3 67 GLU QB . 67 . HB# 1 1 116 1 1 3 3 67 GLU H . 67 . HN 1 1 116 1 2 3 3 67 GLU QG . 67 . HG# 1 1 117 1 1 3 3 68 LYS H . 68 . HN 1 1 117 1 2 3 3 68 LYS QB . 68 . HB# 1 1 118 1 1 3 3 69 TYR H . 69 . HN 1 1 118 1 2 3 3 69 TYR QB . 69 . HB# 1 1 119 1 1 3 3 73 LYS HA . 73 . HA 1 1 119 1 2 3 3 73 LYS QE . 73 . HE# 1 1 120 1 1 3 3 75 ARG H . 75 . HN 1 1 120 1 2 3 3 75 ARG QG . 75 . HG# 1 1 121 1 1 3 3 4 ARG HA . 4 . HA 1 1 121 1 2 3 3 5 VAL H . 5 . HN 1 1 122 1 1 3 3 4 ARG HA . 4 . HA 1 1 122 1 2 3 3 5 VAL MG2 . 5 . HG2# 1 1 123 1 1 3 3 4 ARG QG . 4 . HG# 1 1 123 1 2 3 3 5 VAL H . 5 . HN 1 1 124 1 1 3 3 5 VAL HA . 5 . HA 1 1 124 1 2 3 3 6 LYS H . 6 . HN 1 1 125 1 1 3 3 5 VAL HA . 5 . HA 1 1 125 1 2 3 3 6 LYS QG . 6 . HG# 1 1 126 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 126 1 2 3 3 6 LYS H . 6 . HN 1 1 127 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 127 1 2 3 3 6 LYS H . 6 . HN 1 1 128 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 128 1 2 3 3 6 LYS QG . 6 . HG# 1 1 129 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 129 1 2 3 3 6 LYS QG . 6 . HG# 1 1 130 1 1 3 3 6 LYS HA . 6 . HA 1 1 130 1 2 3 3 7 ARG H . 7 . HN 1 1 131 1 1 3 3 6 LYS QE . 6 . HE# 1 1 131 1 2 3 3 7 ARG QB . 7 . HB# 1 1 132 1 1 3 3 7 ARG HA . 7 . HA 1 1 132 1 2 3 3 8 PRO QD . 8 . HD# 1 1 133 1 1 3 3 8 PRO HA . 8 . HA 1 1 133 1 2 3 3 9 MET H . 9 . HN 1 1 134 1 1 3 3 8 PRO QB . 8 . HB# 1 1 134 1 2 3 3 9 MET HA . 9 . HA 1 1 135 1 1 3 3 8 PRO QB . 8 . HB# 1 1 135 1 2 3 3 9 MET H . 9 . HN 1 1 136 1 1 3 3 8 PRO QB . 8 . HB# 1 1 136 1 2 3 3 9 MET QG . 9 . HG# 1 1 137 1 1 3 3 8 PRO QG . 8 . HG# 1 1 137 1 2 3 3 9 MET H . 9 . HN 1 1 138 1 1 3 3 10 ASN QB . 10 . HB# 1 1 138 1 2 3 3 11 ALA H . 11 . HN 1 1 139 1 1 3 3 10 ASN QB . 10 . HB# 1 1 139 1 2 3 3 11 ALA MB . 11 . HB# 1 1 140 1 1 3 3 11 ALA H . 11 . HN 1 1 140 1 2 3 3 12 PHE H . 12 . HN 1 1 141 1 1 3 3 12 PHE H . 12 . HN 1 1 141 1 2 3 3 13 ILE H . 13 . HN 1 1 142 1 1 3 3 12 PHE QB . 12 . HB# 1 1 142 1 2 3 3 13 ILE HB . 13 . HB 1 1 143 1 1 3 3 12 PHE QD . 12 . HD# 1 1 143 1 2 3 3 13 ILE HB . 13 . HB 1 1 144 1 1 3 3 12 PHE QD . 12 . HD# 1 1 144 1 2 3 3 13 ILE H . 13 . HN 1 1 145 1 1 3 3 12 PHE QD . 12 . HD# 1 1 145 1 2 3 3 13 ILE MG . 13 . HG2# 1 1 146 1 1 3 3 54 PHE QE . 54 . HE# 1 1 146 1 2 3 3 55 PHE QE . 55 . HE# 1 1 147 1 1 3 3 13 ILE HB . 13 . HB 1 1 147 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 148 1 1 3 3 13 ILE H . 13 . HN 1 1 148 1 2 3 3 14 VAL H . 14 . HN 1 1 149 1 1 3 3 13 ILE MD . 13 . HD1# 1 1 149 1 2 3 3 14 VAL H . 14 . HN 1 1 150 1 1 3 3 13 ILE QG . 13 . HG1# 1 1 150 1 2 3 3 14 VAL H . 14 . HN 1 1 151 1 1 3 3 13 ILE QG . 13 . HG1# 1 1 151 1 2 3 3 14 VAL MG2 . 14 . HG2# 1 1 152 1 1 3 3 13 ILE MG . 13 . HG2# 1 1 152 1 2 3 3 14 VAL HA . 14 . HA 1 1 153 1 1 3 3 13 ILE MG . 13 . HG2# 1 1 153 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 154 1 1 3 3 13 ILE MG . 13 . HG2# 1 1 154 1 2 3 3 14 VAL MG2 . 14 . HG2# 1 1 155 1 1 3 3 14 VAL HA . 14 . HA 1 1 155 1 2 3 3 15 TRP H . 15 . HN 1 1 156 1 1 3 3 14 VAL HB . 14 . HB 1 1 156 1 2 3 3 15 TRP H . 15 . HN 1 1 157 1 1 3 3 14 VAL H . 14 . HN 1 1 157 1 2 3 3 15 TRP H . 15 . HN 1 1 158 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 158 1 2 3 3 15 TRP HA . 15 . HA 1 1 159 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 159 1 2 3 3 15 TRP H . 15 . HN 1 1 160 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 160 1 2 3 3 15 TRP HE1 . 15 . HE1 1 1 161 1 1 3 3 15 TRP HA . 15 . HA 1 1 161 1 2 3 3 16 SER H . 16 . HN 1 1 162 1 1 3 3 15 TRP H . 15 . HN 1 1 162 1 2 3 3 16 SER H . 16 . HN 1 1 163 1 1 3 3 16 SER HA . 16 . HA 1 1 163 1 2 3 3 17 ARG H . 17 . HN 1 1 164 1 1 3 3 16 SER H . 16 . HN 1 1 164 1 2 3 3 17 ARG H . 17 . HN 1 1 165 1 1 3 3 16 SER QB . 16 . HB# 1 1 165 1 2 3 3 17 ARG H . 17 . HN 1 1 166 1 1 3 3 17 ARG HA . 17 . HA 1 1 166 1 2 3 3 18 ASP H . 18 . HN 1 1 167 1 1 3 3 17 ARG H . 17 . HN 1 1 167 1 2 3 3 18 ASP H . 18 . HN 1 1 168 1 1 3 3 17 ARG QB . 17 . HB# 1 1 168 1 2 3 3 18 ASP H . 18 . HN 1 1 169 1 1 3 3 18 ASP HA . 18 . HA 1 1 169 1 2 3 3 19 GLN H . 19 . HN 1 1 170 1 1 3 3 18 ASP H . 18 . HN 1 1 170 1 2 3 3 19 GLN H . 19 . HN 1 1 171 1 1 3 3 18 ASP QB . 18 . HB# 1 1 171 1 2 3 3 19 GLN H . 19 . HN 1 1 172 1 1 3 3 19 GLN HA . 19 . HA 1 1 172 1 2 3 3 20 ARG H . 20 . HN 1 1 173 1 1 3 3 19 GLN H . 19 . HN 1 1 173 1 2 3 3 20 ARG H . 20 . HN 1 1 174 1 1 3 3 19 GLN QB . 19 . HB# 1 1 174 1 2 3 3 20 ARG H . 20 . HN 1 1 175 1 1 3 3 19 GLN QB . 19 . HB# 1 1 175 1 2 3 3 20 ARG QB . 20 . HB# 1 1 176 1 1 3 3 19 GLN QG . 19 . HG# 1 1 176 1 2 3 3 20 ARG H . 20 . HN 1 1 177 1 1 3 3 19 GLN QG . 19 . HG# 1 1 177 1 2 3 3 20 ARG QB . 20 . HB# 1 1 178 1 1 3 3 20 ARG HA . 20 . HA 1 1 178 1 2 3 3 21 ARG H . 21 . HN 1 1 179 1 1 3 3 20 ARG H . 20 . HN 1 1 179 1 2 3 3 21 ARG H . 21 . HN 1 1 180 1 1 3 3 20 ARG QB . 20 . HB# 1 1 180 1 2 3 3 21 ARG H . 21 . HN 1 1 181 1 1 3 3 21 ARG H . 21 . HN 1 1 181 1 2 3 3 22 LYS H . 22 . HN 1 1 182 1 1 3 3 21 ARG QB . 21 . HB# 1 1 182 1 2 3 3 22 LYS HA . 22 . HA 1 1 183 1 1 3 3 21 ARG QB . 21 . HB# 1 1 183 1 2 3 3 22 LYS H . 22 . HN 1 1 184 1 1 3 3 22 LYS HA . 22 . HA 1 1 184 1 2 3 3 23 MET H . 23 . HN 1 1 185 1 1 3 3 22 LYS H . 22 . HN 1 1 185 1 2 3 3 23 MET H . 23 . HN 1 1 186 1 1 3 3 22 LYS QB . 22 . HB# 1 1 186 1 2 3 3 23 MET H . 23 . HN 1 1 187 1 1 3 3 22 LYS QB . 22 . HB# 1 1 187 1 2 3 3 23 MET ME . 23 . HE# 1 1 188 1 1 3 3 22 LYS QE . 22 . HE# 1 1 188 1 2 3 3 23 MET QG . 23 . HG# 1 1 189 1 1 3 3 22 LYS QG . 22 . HG# 1 1 189 1 2 3 3 23 MET H . 23 . HN 1 1 190 1 1 3 3 22 LYS QG . 22 . HG# 1 1 190 1 2 3 3 23 MET QB . 23 . HB# 1 1 191 1 1 3 3 23 MET HA . 23 . HA 1 1 191 1 2 3 3 24 ALA HA . 24 . HA 1 1 192 1 1 3 3 23 MET HA . 23 . HA 1 1 192 1 2 3 3 24 ALA MB . 24 . HB# 1 1 193 1 1 3 3 23 MET QB . 23 . HB# 1 1 193 1 2 3 3 24 ALA H . 24 . HN 1 1 194 1 1 3 3 24 ALA HA . 24 . HA 1 1 194 1 2 3 3 25 LEU QD . 25 . HD* 1 1 195 1 1 3 3 24 ALA H . 24 . HN 1 1 195 1 2 3 3 25 LEU H . 25 . HN 1 1 196 1 1 3 3 24 ALA H . 24 . HN 1 1 196 1 2 3 3 25 LEU QD . 25 . HD* 1 1 197 1 1 3 3 24 ALA MB . 24 . HB# 1 1 197 1 2 3 3 25 LEU HA . 25 . HA 1 1 198 1 1 3 3 24 ALA MB . 24 . HB# 1 1 198 1 2 3 3 25 LEU QD . 25 . HD* 1 1 199 1 1 3 3 25 LEU HG . 25 . HG 1 1 199 1 2 3 3 26 GLU QB . 26 . HB# 1 1 200 1 1 3 3 25 LEU HG . 25 . HG 1 1 200 1 2 3 3 26 GLU QG . 26 . HG# 1 1 201 1 1 3 3 25 LEU QD . 25 . HD* 1 1 201 1 2 3 3 26 GLU QB . 26 . HB# 1 1 202 1 1 3 3 26 GLU HA . 26 . HA 1 1 202 1 2 3 3 27 ASN H . 27 . HN 1 1 203 1 1 3 3 26 GLU QG . 26 . HG# 1 1 203 1 2 3 3 27 ASN QB . 27 . HB# 1 1 204 1 1 3 3 27 ASN HA . 27 . HA 1 1 204 1 2 3 3 28 PRO QD . 28 . HD# 1 1 205 1 1 3 3 27 ASN HA . 27 . HA 1 1 205 1 2 3 3 28 PRO QG . 28 . HG# 1 1 206 1 1 3 3 27 ASN H . 27 . HN 1 1 206 1 2 3 3 28 PRO QD . 28 . HD# 1 1 207 1 1 3 3 28 PRO QD . 28 . HD# 1 1 207 1 2 3 3 29 ARG H . 29 . HN 1 1 208 1 1 3 3 28 PRO QG . 28 . HG# 1 1 208 1 2 3 3 29 ARG QB . 29 . HB# 1 1 209 1 1 3 3 29 ARG HA . 29 . HA 1 1 209 1 2 3 3 30 MET H . 30 . HN 1 1 210 1 1 3 3 29 ARG QB . 29 . HB# 1 1 210 1 2 3 3 30 MET H . 30 . HN 1 1 211 1 1 3 3 29 ARG QB . 29 . HB# 1 1 211 1 2 3 3 30 MET QB . 30 . HB# 1 1 212 1 1 3 3 29 ARG QB . 29 . HB# 1 1 212 1 2 3 3 30 MET QG . 30 . HG# 1 1 213 1 1 3 3 29 ARG QG . 29 . HG# 1 1 213 1 2 3 3 30 MET H . 30 . HN 1 1 214 1 1 3 3 30 MET HA . 30 . HA 1 1 214 1 2 3 3 31 ARG H . 31 . HN 1 1 215 1 1 3 3 30 MET HA . 30 . HA 1 1 215 1 2 3 3 31 ARG QB . 31 . HB# 1 1 216 1 1 3 3 30 MET HA . 30 . HA 1 1 216 1 2 3 3 31 ARG QG . 31 . HG# 1 1 217 1 1 3 3 30 MET H . 30 . HN 1 1 217 1 2 3 3 31 ARG H . 31 . HN 1 1 218 1 1 3 3 30 MET QB . 30 . HB# 1 1 218 1 2 3 3 31 ARG H . 31 . HN 1 1 219 1 1 3 3 30 MET ME . 30 . HE# 1 1 219 1 2 3 3 31 ARG QB . 31 . HB# 1 1 220 1 1 3 3 30 MET QG . 30 . HG# 1 1 220 1 2 3 3 31 ARG H . 31 . HN 1 1 221 1 1 3 3 30 MET QG . 30 . HG# 1 1 221 1 2 3 3 31 ARG QB . 31 . HB# 1 1 222 1 1 3 3 34 GLU HA . 34 . HA 1 1 222 1 2 3 3 35 ILE H . 35 . HN 1 1 223 1 1 3 3 34 GLU H . 34 . HN 1 1 223 1 2 3 3 35 ILE H . 35 . HN 1 1 224 1 1 3 3 34 GLU QG . 34 . HG# 1 1 224 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 225 1 1 3 3 35 ILE HA . 35 . HA 1 1 225 1 2 3 3 36 SER H . 36 . HN 1 1 226 1 1 3 3 35 ILE H . 35 . HN 1 1 226 1 2 3 3 36 SER HA . 36 . HA 1 1 227 1 1 3 3 35 ILE H . 35 . HN 1 1 227 1 2 3 3 36 SER H . 36 . HN 1 1 228 1 1 3 3 35 ILE MD . 35 . HD1# 1 1 228 1 2 3 3 36 SER H . 36 . HN 1 1 229 1 1 3 3 35 ILE MG . 35 . HG2# 1 1 229 1 2 3 3 36 SER H . 36 . HN 1 1 230 1 1 3 3 36 SER H . 36 . HN 1 1 230 1 2 3 3 37 LYS H . 37 . HN 1 1 231 1 1 3 3 36 SER H . 36 . HN 1 1 231 1 2 3 3 37 LYS QD . 37 . HD# 1 1 232 1 1 3 3 36 SER QB . 36 . HB# 1 1 232 1 2 3 3 37 LYS H . 37 . HN 1 1 233 1 1 3 3 36 SER QB . 36 . HB# 1 1 233 1 2 3 3 37 LYS QB . 37 . HB# 1 1 234 1 1 3 3 36 SER QB . 36 . HB# 1 1 234 1 2 3 3 37 LYS QD . 37 . HD# 1 1 235 1 1 3 3 36 SER QB . 36 . HB# 1 1 235 1 2 3 3 37 LYS QG . 37 . HG# 1 1 236 1 1 3 3 37 LYS HA . 37 . HA 1 1 236 1 2 3 3 38 GLN H . 38 . HN 1 1 237 1 1 3 3 37 LYS H . 37 . HN 1 1 237 1 2 3 3 38 GLN H . 38 . HN 1 1 238 1 1 3 3 37 LYS H . 37 . HN 1 1 238 1 2 3 3 38 GLN QB . 38 . HB# 1 1 239 1 1 3 3 37 LYS QB . 37 . HB# 1 1 239 1 2 3 3 38 GLN H . 38 . HN 1 1 240 1 1 3 3 37 LYS QD . 37 . HD# 1 1 240 1 2 3 3 38 GLN H . 38 . HN 1 1 241 1 1 3 3 38 GLN HA . 38 . HA 1 1 241 1 2 3 3 39 LEU H . 39 . HN 1 1 242 1 1 3 3 38 GLN HA . 38 . HA 1 1 242 1 2 3 3 39 LEU QB . 39 . HB# 1 1 243 1 1 3 3 38 GLN H . 38 . HN 1 1 243 1 2 3 3 39 LEU H . 39 . HN 1 1 244 1 1 3 3 38 GLN QB . 38 . HB# 1 1 244 1 2 3 3 39 LEU H . 39 . HN 1 1 245 1 1 3 3 38 GLN QB . 38 . HB# 1 1 245 1 2 3 3 39 LEU QD . 39 . HD* 1 1 246 1 1 3 3 38 GLN QG . 38 . HG# 1 1 246 1 2 3 3 39 LEU QB . 39 . HB# 1 1 247 1 1 3 3 39 LEU H . 39 . HN 1 1 247 1 2 3 3 40 GLY H . 40 . HN 1 1 248 1 1 3 3 39 LEU QB . 39 . HB# 1 1 248 1 2 3 3 40 GLY HA3 . 40 . HA1 1 1 249 1 1 3 3 39 LEU QB . 39 . HB# 1 1 249 1 2 3 3 40 GLY H . 40 . HN 1 1 250 1 1 3 3 40 GLY HA3 . 40 . HA1 1 1 250 1 2 3 3 41 TYR H . 41 . HN 1 1 251 1 1 3 3 40 GLY HA2 . 40 . HA2 1 1 251 1 2 3 3 41 TYR QB . 41 . HB# 1 1 252 1 1 3 3 41 TYR HA . 41 . HA 1 1 252 1 2 3 3 42 GLN H . 42 . HN 1 1 253 1 1 3 3 41 TYR H . 41 . HN 1 1 253 1 2 3 3 42 GLN H . 42 . HN 1 1 254 1 1 3 3 41 TYR H . 41 . HN 1 1 254 1 2 3 3 42 GLN QG . 42 . HG# 1 1 255 1 1 3 3 41 TYR QB . 41 . HB# 1 1 255 1 2 3 3 42 GLN H . 42 . HN 1 1 256 1 1 3 3 41 TYR QD . 41 . HD# 1 1 256 1 2 3 3 42 GLN QB . 42 . HB# 1 1 257 1 1 3 3 41 TYR QD . 41 . HD# 1 1 257 1 2 3 3 42 GLN QG . 42 . HG# 1 1 258 1 1 3 3 42 GLN HA . 42 . HA 1 1 258 1 2 3 3 43 TRP H . 43 . HN 1 1 259 1 1 3 3 42 GLN H . 42 . HN 1 1 259 1 2 3 3 43 TRP H . 43 . HN 1 1 260 1 1 3 3 42 GLN QB . 42 . HB# 1 1 260 1 2 3 3 43 TRP H . 43 . HN 1 1 261 1 1 3 3 42 GLN QB . 42 . HB# 1 1 261 1 2 3 3 43 TRP HD1 . 43 . HD1 1 1 262 1 1 3 3 42 GLN QB . 42 . HB# 1 1 262 1 2 3 3 43 TRP HE3 . 43 . HE3 1 1 263 1 1 3 3 42 GLN QB . 42 . HB# 1 1 263 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 264 1 1 3 3 42 GLN QB . 42 . HB# 1 1 264 1 2 3 3 43 TRP HZ3 . 43 . HZ3 1 1 265 1 1 3 3 42 GLN QG . 42 . HG# 1 1 265 1 2 3 3 43 TRP HA . 43 . HA 1 1 266 1 1 3 3 42 GLN QG . 42 . HG# 1 1 266 1 2 3 3 43 TRP H . 43 . HN 1 1 267 1 1 3 3 42 GLN QG . 42 . HG# 1 1 267 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 268 1 1 3 3 42 GLN QE . 42 . HE2# 1 1 268 1 2 3 3 43 TRP H . 43 . HN 1 1 269 1 1 3 3 43 TRP H . 43 . HN 1 1 269 1 2 3 3 44 LYS H . 44 . HN 1 1 270 1 1 3 3 43 TRP QB . 43 . HB# 1 1 270 1 2 3 3 44 LYS HA . 44 . HA 1 1 271 1 1 3 3 43 TRP QB . 43 . HB# 1 1 271 1 2 3 3 44 LYS H . 44 . HN 1 1 272 1 1 3 3 43 TRP QB . 43 . HB# 1 1 272 1 2 3 3 44 LYS QE . 44 . HE# 1 1 273 1 1 3 3 43 TRP HD1 . 43 . HD1 1 1 273 1 2 3 3 44 LYS H . 44 . HN 1 1 274 1 1 3 3 43 TRP HD1 . 43 . HD1 1 1 274 1 2 3 3 44 LYS QE . 44 . HE# 1 1 275 1 1 3 3 44 LYS HA . 44 . HA 1 1 275 1 2 3 3 45 MET H . 45 . HN 1 1 276 1 1 3 3 44 LYS HA . 44 . HA 1 1 276 1 2 3 3 45 MET QB . 45 . HB# 1 1 277 1 1 3 3 44 LYS HA . 44 . HA 1 1 277 1 2 3 3 45 MET ME . 45 . HE# 1 1 278 1 1 3 3 44 LYS H . 44 . HN 1 1 278 1 2 3 3 45 MET H . 45 . HN 1 1 279 1 1 3 3 44 LYS QB . 44 . HB# 1 1 279 1 2 3 3 45 MET ME . 45 . HE# 1 1 280 1 1 3 3 44 LYS QB . 44 . HB# 1 1 280 1 2 3 3 45 MET QG . 45 . HG# 1 1 281 1 1 3 3 44 LYS QD . 44 . HD# 1 1 281 1 2 3 3 45 MET H . 45 . HN 1 1 282 1 1 3 3 44 LYS QD . 44 . HD# 1 1 282 1 2 3 3 45 MET ME . 45 . HE# 1 1 283 1 1 3 3 44 LYS QG . 44 . HG# 1 1 283 1 2 3 3 45 MET QB . 45 . HB# 1 1 284 1 1 3 3 45 MET HA . 45 . HA 1 1 284 1 2 3 3 46 LEU H . 46 . HN 1 1 285 1 1 3 3 45 MET QB . 45 . HB# 1 1 285 1 2 3 3 46 LEU HG . 46 . HG 1 1 286 1 1 3 3 45 MET QB . 45 . HB# 1 1 286 1 2 3 3 46 LEU H . 46 . HN 1 1 287 1 1 3 3 45 MET QB . 45 . HB# 1 1 287 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 288 1 1 3 3 45 MET ME . 45 . HE# 1 1 288 1 2 3 3 46 LEU MD1 . 46 . HD1# 1 1 289 1 1 3 3 46 LEU H . 46 . HN 1 1 289 1 2 3 3 47 THR H . 47 . HN 1 1 290 1 1 3 3 46 LEU QB . 46 . HB# 1 1 290 1 2 3 3 47 THR HA . 47 . HA 1 1 291 1 1 3 3 46 LEU QB . 46 . HB# 1 1 291 1 2 3 3 47 THR H . 47 . HN 1 1 292 1 1 3 3 46 LEU QB . 46 . HB# 1 1 292 1 2 3 3 47 THR MG . 47 . HG2# 1 1 293 1 1 3 3 47 THR HA . 47 . HA 1 1 293 1 2 3 3 48 GLU H . 48 . HN 1 1 294 1 1 3 3 47 THR HA . 47 . HA 1 1 294 1 2 3 3 48 GLU QB . 48 . HB# 1 1 295 1 1 3 3 47 THR HB . 47 . HB 1 1 295 1 2 3 3 48 GLU QG . 48 . HG# 1 1 296 1 1 3 3 47 THR H . 47 . HN 1 1 296 1 2 3 3 48 GLU QG . 48 . HG# 1 1 297 1 1 3 3 48 GLU HA . 48 . HA 1 1 297 1 2 3 3 49 ALA H . 49 . HN 1 1 298 1 1 3 3 48 GLU HA . 48 . HA 1 1 298 1 2 3 3 49 ALA MB . 49 . HB# 1 1 299 1 1 3 3 48 GLU H . 48 . HN 1 1 299 1 2 3 3 49 ALA H . 49 . HN 1 1 300 1 1 3 3 48 GLU QB . 48 . HB# 1 1 300 1 2 3 3 49 ALA H . 49 . HN 1 1 301 1 1 3 3 48 GLU QB . 48 . HB# 1 1 301 1 2 3 3 49 ALA MB . 49 . HB# 1 1 302 1 1 3 3 48 GLU QG . 48 . HG# 1 1 302 1 2 3 3 49 ALA H . 49 . HN 1 1 303 1 1 3 3 49 ALA HA . 49 . HA 1 1 303 1 2 3 3 50 GLU QB . 50 . HB# 1 1 304 1 1 3 3 49 ALA H . 49 . HN 1 1 304 1 2 3 3 50 GLU H . 50 . HN 1 1 305 1 1 3 3 49 ALA H . 49 . HN 1 1 305 1 2 3 3 50 GLU QG . 50 . HG# 1 1 306 1 1 3 3 49 ALA MB . 49 . HB# 1 1 306 1 2 3 3 50 GLU QB . 50 . HB# 1 1 307 1 1 3 3 49 ALA MB . 49 . HB# 1 1 307 1 2 3 3 50 GLU QG . 50 . HG# 1 1 308 1 1 3 3 50 GLU QB . 50 . HB# 1 1 308 1 2 3 3 51 LYS H . 51 . HN 1 1 309 1 1 3 3 51 LYS HA . 51 . HA 1 1 309 1 2 3 3 52 TRP H . 52 . HN 1 1 310 1 1 3 3 51 LYS QB . 51 . HB# 1 1 310 1 2 3 3 52 TRP H . 52 . HN 1 1 311 1 1 3 3 52 TRP H . 52 . HN 1 1 311 1 2 3 3 53 PRO QB . 53 . HB# 1 1 312 1 1 3 3 52 TRP QB . 52 . HB# 1 1 312 1 2 3 3 53 PRO HA . 53 . HA 1 1 313 1 1 3 3 52 TRP QB . 52 . HB# 1 1 313 1 2 3 3 53 PRO QD . 53 . HD# 1 1 314 1 1 3 3 52 TRP HD1 . 52 . HD1 1 1 314 1 2 3 3 53 PRO QD . 53 . HD# 1 1 315 1 1 3 3 53 PRO QB . 53 . HB# 1 1 315 1 2 3 3 54 PHE H . 54 . HN 1 1 316 1 1 3 3 53 PRO QG . 53 . HG# 1 1 316 1 2 3 3 54 PHE HA . 54 . HA 1 1 317 1 1 3 3 53 PRO QG . 53 . HG# 1 1 317 1 2 3 3 54 PHE H . 54 . HN 1 1 318 1 1 3 3 53 PRO QG . 53 . HG# 1 1 318 1 2 3 3 54 PHE QB . 54 . HB# 1 1 319 1 1 3 3 53 PRO QG . 53 . HG# 1 1 319 1 2 3 3 54 PHE QE . 54 . HE# 1 1 320 1 1 3 3 54 PHE HA . 54 . HA 1 1 320 1 2 3 3 55 PHE H . 55 . HN 1 1 321 1 1 3 3 54 PHE H . 54 . HN 1 1 321 1 2 3 3 55 PHE H . 55 . HN 1 1 322 1 1 3 3 54 PHE QB . 54 . HB# 1 1 322 1 2 3 3 55 PHE H . 55 . HN 1 1 323 1 1 3 3 54 PHE QB . 54 . HB# 1 1 323 1 2 3 3 55 PHE QB . 55 . HB# 1 1 324 1 1 3 3 54 PHE QD . 54 . HD# 1 1 324 1 2 3 3 55 PHE H . 55 . HN 1 1 325 1 1 3 3 54 PHE QD . 54 . HD# 1 1 325 1 2 3 3 55 PHE QB . 55 . HB# 1 1 326 1 1 3 3 55 PHE HA . 55 . HA 1 1 326 1 2 3 3 56 GLN H . 56 . HN 1 1 327 1 1 3 3 55 PHE H . 55 . HN 1 1 327 1 2 3 3 56 GLN H . 56 . HN 1 1 328 1 1 3 3 55 PHE H . 55 . HN 1 1 328 1 2 3 3 56 GLN QG . 56 . HG# 1 1 329 1 1 3 3 55 PHE QB . 55 . HB# 1 1 329 1 2 3 3 56 GLN H . 56 . HN 1 1 330 1 1 3 3 55 PHE QB . 55 . HB# 1 1 330 1 2 3 3 56 GLN QG . 56 . HG# 1 1 331 1 1 3 3 55 PHE QB . 55 . HB# 1 1 331 1 2 3 3 56 GLN QE . 56 . HE2# 1 1 332 1 1 3 3 56 GLN HA . 56 . HA 1 1 332 1 2 3 3 57 GLU H . 57 . HN 1 1 333 1 1 3 3 56 GLN H . 56 . HN 1 1 333 1 2 3 3 57 GLU H . 57 . HN 1 1 334 1 1 3 3 56 GLN QB . 56 . HB# 1 1 334 1 2 3 3 57 GLU H . 57 . HN 1 1 335 1 1 3 3 56 GLN QB . 56 . HB# 1 1 335 1 2 3 3 57 GLU QG . 57 . HG# 1 1 336 1 1 3 3 56 GLN QG . 56 . HG# 1 1 336 1 2 3 3 57 GLU H . 57 . HN 1 1 337 1 1 3 3 57 GLU H . 57 . HN 1 1 337 1 2 3 3 58 ALA H . 58 . HN 1 1 338 1 1 3 3 57 GLU QB . 57 . HB# 1 1 338 1 2 3 3 58 ALA H . 58 . HN 1 1 339 1 1 3 3 57 GLU QB . 57 . HB# 1 1 339 1 2 3 3 58 ALA MB . 58 . HB# 1 1 340 1 1 3 3 57 GLU QG . 57 . HG# 1 1 340 1 2 3 3 58 ALA H . 58 . HN 1 1 341 1 1 3 3 58 ALA HA . 58 . HA 1 1 341 1 2 3 3 59 GLN H . 59 . HN 1 1 342 1 1 3 3 58 ALA H . 58 . HN 1 1 342 1 2 3 3 59 GLN H . 59 . HN 1 1 343 1 1 3 3 58 ALA MB . 58 . HB# 1 1 343 1 2 3 3 59 GLN H . 59 . HN 1 1 344 1 1 3 3 58 ALA MB . 58 . HB# 1 1 344 1 2 3 3 59 GLN QB . 59 . HB# 1 1 345 1 1 3 3 58 ALA MB . 58 . HB# 1 1 345 1 2 3 3 59 GLN QG . 59 . HG# 1 1 346 1 1 3 3 59 GLN H . 59 . HN 1 1 346 1 2 3 3 60 LYS H . 60 . HN 1 1 347 1 1 3 3 59 GLN QB . 59 . HB# 1 1 347 1 2 3 3 60 LYS H . 60 . HN 1 1 348 1 1 3 3 59 GLN QG . 59 . HG# 1 1 348 1 2 3 3 60 LYS H . 60 . HN 1 1 349 1 1 3 3 60 LYS H . 60 . HN 1 1 349 1 2 3 3 61 LEU H . 61 . HN 1 1 350 1 1 3 3 60 LYS H . 60 . HN 1 1 350 1 2 3 3 61 LEU QD . 61 . HD* 1 1 351 1 1 3 3 60 LYS QB . 60 . HB# 1 1 351 1 2 3 3 61 LEU MD2 . 61 . HD2# 1 1 352 1 1 3 3 60 LYS QD . 60 . HD# 1 1 352 1 2 3 3 61 LEU QB . 61 . HB# 1 1 353 1 1 3 3 60 LYS QD . 60 . HD# 1 1 353 1 2 3 3 61 LEU QD . 61 . HD* 1 1 354 1 1 3 3 60 LYS QE . 60 . HE# 1 1 354 1 2 3 3 61 LEU QD . 61 . HD* 1 1 355 1 1 3 3 60 LYS QG . 60 . HG# 1 1 355 1 2 3 3 61 LEU QB . 61 . HB# 1 1 356 1 1 3 3 61 LEU HA . 61 . HA 1 1 356 1 2 3 3 62 GLN H . 62 . HN 1 1 357 1 1 3 3 61 LEU HG . 61 . HG 1 1 357 1 2 3 3 62 GLN H . 62 . HN 1 1 358 1 1 3 3 61 LEU QB . 61 . HB# 1 1 358 1 2 3 3 62 GLN H . 62 . HN 1 1 359 1 1 3 3 61 LEU QB . 61 . HB# 1 1 359 1 2 3 3 62 GLN QG . 62 . HG# 1 1 360 1 1 3 3 61 LEU QD . 61 . HD* 1 1 360 1 2 3 3 62 GLN H . 62 . HN 1 1 361 1 1 3 3 62 GLN HA . 62 . HA 1 1 361 1 2 3 3 63 ALA H . 63 . HN 1 1 362 1 1 3 3 62 GLN H . 62 . HN 1 1 362 1 2 3 3 63 ALA H . 63 . HN 1 1 363 1 1 3 3 62 GLN QB . 62 . HB# 1 1 363 1 2 3 3 63 ALA H . 63 . HN 1 1 364 1 1 3 3 62 GLN QG . 62 . HG# 1 1 364 1 2 3 3 63 ALA H . 63 . HN 1 1 365 1 1 3 3 63 ALA MB . 63 . HB# 1 1 365 1 2 3 3 64 MET QB . 64 . HB# 1 1 366 1 1 3 3 63 ALA MB . 63 . HB# 1 1 366 1 2 3 3 64 MET QG . 64 . HG# 1 1 367 1 1 3 3 64 MET QB . 64 . HB# 1 1 367 1 2 3 3 65 HIS H . 65 . HN 1 1 368 1 1 3 3 64 MET QG . 64 . HG# 1 1 368 1 2 3 3 65 HIS HE1 . 65 . HE1 1 1 369 1 1 3 3 64 MET QG . 64 . HG# 1 1 369 1 2 3 3 65 HIS QB . 65 . HB# 1 1 370 1 1 3 3 65 HIS QB . 65 . HB# 1 1 370 1 2 3 3 66 ARG H . 66 . HN 1 1 371 1 1 3 3 65 HIS QB . 65 . HB# 1 1 371 1 2 3 3 66 ARG QB . 66 . HB# 1 1 372 1 1 3 3 66 ARG HA . 66 . HA 1 1 372 1 2 3 3 67 GLU QG . 67 . HG# 1 1 373 1 1 3 3 66 ARG H . 66 . HN 1 1 373 1 2 3 3 67 GLU H . 67 . HN 1 1 374 1 1 3 3 66 ARG QG . 66 . HG# 1 1 374 1 2 3 3 67 GLU QG . 67 . HG# 1 1 375 1 1 3 3 67 GLU HA . 67 . HA 1 1 375 1 2 3 3 68 LYS H . 68 . HN 1 1 376 1 1 3 3 67 GLU HA . 67 . HA 1 1 376 1 2 3 3 68 LYS QB . 68 . HB# 1 1 377 1 1 3 3 67 GLU HA . 67 . HA 1 1 377 1 2 3 3 68 LYS QG . 68 . HG# 1 1 378 1 1 3 3 67 GLU H . 67 . HN 1 1 378 1 2 3 3 68 LYS H . 68 . HN 1 1 379 1 1 3 3 67 GLU QB . 67 . HB# 1 1 379 1 2 3 3 68 LYS H . 68 . HN 1 1 380 1 1 3 3 67 GLU QG . 67 . HG# 1 1 380 1 2 3 3 68 LYS QB . 68 . HB# 1 1 381 1 1 3 3 68 LYS HA . 68 . HA 1 1 381 1 2 3 3 69 TYR H . 69 . HN 1 1 382 1 1 3 3 68 LYS H . 68 . HN 1 1 382 1 2 3 3 69 TYR QE . 69 . HE# 1 1 383 1 1 3 3 68 LYS H . 68 . HN 1 1 383 1 2 3 3 69 TYR H . 69 . HN 1 1 384 1 1 3 3 68 LYS QB . 68 . HB# 1 1 384 1 2 3 3 69 TYR H . 69 . HN 1 1 385 1 1 3 3 69 TYR HA . 69 . HA 1 1 385 1 2 3 3 70 PRO QD . 70 . HD# 1 1 386 1 1 3 3 69 TYR QE . 69 . HE# 1 1 386 1 2 3 3 70 PRO QD . 70 . HD# 1 1 387 1 1 3 3 68 LYS QB . 68 . HB# 1 1 387 1 2 3 3 69 TYR QE . 69 . HE# 1 1 388 1 1 3 3 68 LYS QB . 68 . HB# 1 1 388 1 2 3 3 69 TYR QD . 69 . HD# 1 1 389 1 1 3 3 68 LYS QD . 68 . HD# 1 1 389 1 2 3 3 69 TYR QE . 69 . HE# 1 1 390 1 1 3 3 68 LYS QE . 68 . HE# 1 1 390 1 2 3 3 69 TYR QE . 69 . HE# 1 1 391 1 1 3 3 70 PRO QB . 70 . HB# 1 1 391 1 2 3 3 71 ASN H . 71 . HN 1 1 392 1 1 3 3 70 PRO QD . 70 . HD# 1 1 392 1 2 3 3 71 ASN HA . 71 . HA 1 1 393 1 1 3 3 71 ASN HA . 71 . HA 1 1 393 1 2 3 3 72 TYR H . 72 . HN 1 1 394 1 1 3 3 71 ASN HA . 71 . HA 1 1 394 1 2 3 3 72 TYR QB . 72 . HB# 1 1 395 1 1 3 3 72 TYR HA . 72 . HA 1 1 395 1 2 3 3 73 LYS H . 73 . HN 1 1 396 1 1 3 3 72 TYR QB . 72 . HB# 1 1 396 1 2 3 3 73 LYS QB . 73 . HB# 1 1 397 1 1 3 3 72 TYR QD . 72 . HD# 1 1 397 1 2 3 3 73 LYS H . 73 . HN 1 1 398 1 1 3 3 73 LYS HA . 73 . HA 1 1 398 1 2 3 3 74 TYR H . 74 . HN 1 1 399 1 1 3 3 73 LYS QB . 73 . HB# 1 1 399 1 2 3 3 74 TYR H . 74 . HN 1 1 400 1 1 3 3 73 LYS QG . 73 . HG# 1 1 400 1 2 3 3 74 TYR H . 74 . HN 1 1 401 1 1 3 3 73 LYS QG . 73 . HG# 1 1 401 1 2 3 3 74 TYR HA . 74 . HA 1 1 402 1 1 3 3 74 TYR HA . 74 . HA 1 1 402 1 2 3 3 75 ARG H . 75 . HN 1 1 403 1 1 3 3 74 TYR QB . 74 . HB# 1 1 403 1 2 3 3 75 ARG H . 75 . HN 1 1 404 1 1 3 3 74 TYR QB . 74 . HB# 1 1 404 1 2 3 3 75 ARG HA . 75 . HA 1 1 405 1 1 3 3 74 TYR QD . 74 . HD# 1 1 405 1 2 3 3 75 ARG HA . 75 . HA 1 1 406 1 1 3 3 74 TYR QD . 74 . HD# 1 1 406 1 2 3 3 75 ARG H . 75 . HN 1 1 407 1 1 3 3 9 MET HA . 9 . HA 1 1 407 1 2 3 3 13 ILE MG . 13 . HG2# 1 1 408 1 1 3 3 9 MET QB . 9 . HB# 1 1 408 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 409 1 1 3 3 10 ASN H . 10 . HN 1 1 409 1 2 3 3 13 ILE MD . 13 . HD1# 1 1 410 1 1 3 3 10 ASN H . 10 . HN 1 1 410 1 2 3 3 13 ILE QG . 13 . HG1# 1 1 411 1 1 3 3 10 ASN H . 10 . HN 1 1 411 1 2 3 3 13 ILE MG . 13 . HG2# 1 1 412 1 1 3 3 11 ALA HA . 11 . HA 1 1 412 1 2 3 3 14 VAL HB . 14 . HB 1 1 413 1 1 3 3 11 ALA HA . 11 . HA 1 1 413 1 2 3 3 14 VAL H . 14 . HN 1 1 414 1 1 3 3 11 ALA HA . 11 . HA 1 1 414 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 415 1 1 3 3 11 ALA MB . 11 . HB# 1 1 415 1 2 3 3 14 VAL HB . 14 . HB 1 1 416 1 1 3 3 11 ALA MB . 11 . HB# 1 1 416 1 2 3 3 14 VAL MG1 . 14 . HG1# 1 1 417 1 1 3 3 11 ALA MB . 11 . HB# 1 1 417 1 2 3 3 14 VAL MG2 . 14 . HG2# 1 1 418 1 1 3 3 11 ALA MB . 11 . HB# 1 1 418 1 2 3 3 15 TRP HH2 . 15 . HH2 1 1 419 1 1 3 3 12 PHE HA . 12 . HA 1 1 419 1 2 3 3 15 TRP H . 15 . HN 1 1 420 1 1 3 3 12 PHE QB . 12 . HB# 1 1 420 1 2 3 3 14 VAL HB . 14 . HB 1 1 421 1 1 3 3 12 PHE QB . 12 . HB# 1 1 421 1 2 3 3 14 VAL MG2 . 14 . HG2# 1 1 422 1 1 3 3 12 PHE QD . 12 . HD# 1 1 422 1 2 3 3 15 TRP HZ3 . 15 . HZ3 1 1 423 1 1 3 3 14 VAL HA . 14 . HA 1 1 423 1 2 3 3 17 ARG H . 17 . HN 1 1 424 1 1 3 3 14 VAL HA . 14 . HA 1 1 424 1 2 3 3 17 ARG QD . 17 . HD# 1 1 425 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 425 1 2 3 3 16 SER QB . 16 . HB# 1 1 426 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 426 1 2 3 3 17 ARG QD . 17 . HD# 1 1 427 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 427 1 2 3 3 17 ARG QG . 17 . HG# 1 1 428 1 1 3 3 15 TRP HA . 15 . HA 1 1 428 1 2 3 3 18 ASP H . 18 . HN 1 1 429 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 429 1 2 3 3 19 GLN QG . 19 . HG# 1 1 430 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 430 1 2 3 3 19 GLN QE . 19 . HE2# 1 1 431 1 1 3 3 16 SER H . 16 . HN 1 1 431 1 2 3 3 19 GLN H . 19 . HN 1 1 432 1 1 3 3 16 SER QB . 16 . HB# 1 1 432 1 2 3 3 19 GLN H . 19 . HN 1 1 433 1 1 3 3 16 SER QB . 16 . HB# 1 1 433 1 2 3 3 20 ARG H . 20 . HN 1 1 434 1 1 3 3 16 SER QB . 16 . HB# 1 1 434 1 2 3 3 20 ARG QD . 20 . HD# 1 1 435 1 1 3 3 17 ARG HA . 17 . HA 1 1 435 1 2 3 3 21 ARG QB . 21 . HB# 1 1 436 1 1 3 3 17 ARG H . 17 . HN 1 1 436 1 2 3 3 20 ARG QB . 20 . HB# 1 1 437 1 1 3 3 18 ASP HA . 18 . HA 1 1 437 1 2 3 3 21 ARG H . 21 . HN 1 1 438 1 1 3 3 18 ASP HA . 18 . HA 1 1 438 1 2 3 3 21 ARG QB . 21 . HB# 1 1 439 1 1 3 3 18 ASP HA . 18 . HA 1 1 439 1 2 3 3 22 LYS H . 22 . HN 1 1 440 1 1 3 3 18 ASP QB . 18 . HB# 1 1 440 1 2 3 3 22 LYS H . 22 . HN 1 1 441 1 1 3 3 19 GLN HA . 19 . HA 1 1 441 1 2 3 3 22 LYS H . 22 . HN 1 1 442 1 1 3 3 19 GLN HA . 19 . HA 1 1 442 1 2 3 3 22 LYS QB . 22 . HB# 1 1 443 1 1 3 3 19 GLN HA . 19 . HA 1 1 443 1 2 3 3 22 LYS QD . 22 . HD# 1 1 444 1 1 3 3 19 GLN HA . 19 . HA 1 1 444 1 2 3 3 23 MET H . 23 . HN 1 1 445 1 1 3 3 19 GLN QB . 19 . HB# 1 1 445 1 2 3 3 21 ARG H . 21 . HN 1 1 446 1 1 3 3 19 GLN QG . 19 . HG# 1 1 446 1 2 3 3 22 LYS H . 22 . HN 1 1 447 1 1 3 3 19 GLN QG . 19 . HG# 1 1 447 1 2 3 3 22 LYS QG . 22 . HG# 1 1 448 1 1 3 3 19 GLN QE . 19 . HE2# 1 1 448 1 2 3 3 22 LYS H . 22 . HN 1 1 449 1 1 3 3 20 ARG HA . 20 . HA 1 1 449 1 2 3 3 23 MET H . 23 . HN 1 1 450 1 1 3 3 20 ARG HA . 20 . HA 1 1 450 1 2 3 3 24 ALA H . 24 . HN 1 1 451 1 1 3 3 20 ARG HA . 20 . HA 1 1 451 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 452 1 1 3 3 20 ARG HA . 20 . HA 1 1 452 1 2 3 3 39 LEU MD2 . 39 . HD2# 1 1 453 1 1 3 3 20 ARG H . 20 . HN 1 1 453 1 2 3 3 22 LYS H . 22 . HN 1 1 454 1 1 3 3 20 ARG QB . 20 . HB# 1 1 454 1 2 3 3 23 MET QB . 23 . HB# 1 1 455 1 1 3 3 20 ARG QB . 20 . HB# 1 1 455 1 2 3 3 24 ALA H . 24 . HN 1 1 456 1 1 3 3 20 ARG QB . 20 . HB# 1 1 456 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 457 1 1 3 3 20 ARG QG . 20 . HG# 1 1 457 1 2 3 3 23 MET QB . 23 . HB# 1 1 458 1 1 3 3 21 ARG HA . 21 . HA 1 1 458 1 2 3 3 23 MET H . 23 . HN 1 1 459 1 1 3 3 21 ARG HA . 21 . HA 1 1 459 1 2 3 3 24 ALA H . 24 . HN 1 1 460 1 1 3 3 21 ARG HA . 21 . HA 1 1 460 1 2 3 3 24 ALA MB . 24 . HB# 1 1 461 1 1 3 3 21 ARG HA . 21 . HA 1 1 461 1 2 3 3 25 LEU QD . 25 . HD* 1 1 462 1 1 3 3 21 ARG QD . 21 . HD# 1 1 462 1 2 3 3 25 LEU QD . 25 . HD* 1 1 463 1 1 3 3 21 ARG QG . 21 . HG# 1 1 463 1 2 3 3 25 LEU QB . 25 . HB# 1 1 464 1 1 3 3 21 ARG QG . 21 . HG# 1 1 464 1 2 3 3 25 LEU QD . 25 . HD* 1 1 465 1 1 3 3 22 LYS HA . 22 . HA 1 1 465 1 2 3 3 25 LEU HG . 25 . HG 1 1 466 1 1 3 3 22 LYS HA . 22 . HA 1 1 466 1 2 3 3 25 LEU H . 25 . HN 1 1 467 1 1 3 3 22 LYS HA . 22 . HA 1 1 467 1 2 3 3 25 LEU QB . 25 . HB# 1 1 468 1 1 3 3 22 LYS HA . 22 . HA 1 1 468 1 2 3 3 25 LEU QD . 25 . HD* 1 1 469 1 1 3 3 22 LYS H . 22 . HN 1 1 469 1 2 3 3 24 ALA H . 24 . HN 1 1 470 1 1 3 3 22 LYS QB . 22 . HB# 1 1 470 1 2 3 3 25 LEU QB . 25 . HB# 1 1 471 1 1 3 3 22 LYS QE . 22 . HE# 1 1 471 1 2 3 3 25 LEU QB . 25 . HB# 1 1 472 1 1 3 3 22 LYS QG . 22 . HG# 1 1 472 1 2 3 3 25 LEU QB . 25 . HB# 1 1 473 1 1 3 3 22 LYS QG . 22 . HG# 1 1 473 1 2 3 3 25 LEU QD . 25 . HD* 1 1 474 1 1 3 3 23 MET HA . 23 . HA 1 1 474 1 2 3 3 25 LEU QD . 25 . HD* 1 1 475 1 1 3 3 23 MET HA . 23 . HA 1 1 475 1 2 3 3 27 ASN QD . 27 . HD2# 1 1 476 1 1 3 3 23 MET H . 23 . HN 1 1 476 1 2 3 3 25 LEU QD . 25 . HD* 1 1 477 1 1 3 3 23 MET ME . 23 . HE# 1 1 477 1 2 3 3 25 LEU QD . 25 . HD* 1 1 478 1 1 3 3 23 MET ME . 23 . HE# 1 1 478 1 2 3 3 27 ASN QB . 27 . HB# 1 1 479 1 1 3 3 23 MET QG . 23 . HG# 1 1 479 1 2 3 3 25 LEU QD . 25 . HD* 1 1 480 1 1 3 3 24 ALA MB . 24 . HB# 1 1 480 1 2 3 3 28 PRO QB . 28 . HB# 1 1 481 1 1 3 3 25 LEU HG . 25 . HG 1 1 481 1 2 3 3 28 PRO QD . 28 . HD# 1 1 482 1 1 3 3 25 LEU QD . 25 . HD* 1 1 482 1 2 3 3 28 PRO QB . 28 . HB# 1 1 483 1 1 3 3 26 GLU HA . 26 . HA 1 1 483 1 2 3 3 28 PRO QD . 28 . HD# 1 1 484 1 1 3 3 27 ASN QB . 27 . HB# 1 1 484 1 2 3 3 30 MET HA . 30 . HA 1 1 485 1 1 3 3 27 ASN QB . 27 . HB# 1 1 485 1 2 3 3 30 MET H . 30 . HN 1 1 486 1 1 3 3 27 ASN QB . 27 . HB# 1 1 486 1 2 3 3 30 MET QB . 30 . HB# 1 1 487 1 1 3 3 27 ASN QD . 27 . HD2# 1 1 487 1 2 3 3 30 MET QB . 30 . HB# 1 1 488 1 1 3 3 28 PRO HA . 28 . HA 1 1 488 1 2 3 3 30 MET H . 30 . HN 1 1 489 1 1 3 3 28 PRO HA . 28 . HA 1 1 489 1 2 3 3 30 MET QG . 30 . HG# 1 1 490 1 1 3 3 29 ARG QB . 29 . HB# 1 1 490 1 2 3 3 31 ARG QB . 31 . HB# 1 1 491 1 1 3 3 29 ARG QD . 29 . HD# 1 1 491 1 2 3 3 31 ARG QD . 31 . HD# 1 1 492 1 1 3 3 30 MET QB . 30 . HB# 1 1 492 1 2 3 3 34 GLU QB . 34 . HB# 1 1 493 1 1 3 3 30 MET QB . 30 . HB# 1 1 493 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 494 1 1 3 3 30 MET QG . 30 . HG# 1 1 494 1 2 3 3 34 GLU QG . 34 . HG# 1 1 495 1 1 3 3 30 MET QG . 30 . HG# 1 1 495 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 496 1 1 3 3 34 GLU H . 34 . HN 1 1 496 1 2 3 3 36 SER H . 36 . HN 1 1 497 1 1 3 3 34 GLU QB . 34 . HB# 1 1 497 1 2 3 3 38 GLN QG . 38 . HG# 1 1 498 1 1 3 3 34 GLU QG . 34 . HG# 1 1 498 1 2 3 3 37 LYS QB . 37 . HB# 1 1 499 1 1 3 3 34 GLU QG . 34 . HG# 1 1 499 1 2 3 3 38 GLN QB . 38 . HB# 1 1 500 1 1 3 3 35 ILE HA . 35 . HA 1 1 500 1 2 3 3 38 GLN H . 38 . HN 1 1 501 1 1 3 3 35 ILE HA . 35 . HA 1 1 501 1 2 3 3 38 GLN QB . 38 . HB# 1 1 502 1 1 3 3 35 ILE HA . 35 . HA 1 1 502 1 2 3 3 38 GLN QG . 38 . HG# 1 1 503 1 1 3 3 35 ILE HA . 35 . HA 1 1 503 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 504 1 1 3 3 35 ILE MD . 35 . HD1# 1 1 504 1 2 3 3 39 LEU HG . 39 . HG 1 1 505 1 1 3 3 35 ILE MG . 35 . HG2# 1 1 505 1 2 3 3 39 LEU MD2 . 39 . HD2# 1 1 506 1 1 3 3 36 SER HA . 36 . HA 1 1 506 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 507 1 1 3 3 37 LYS HA . 37 . HA 1 1 507 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 508 1 1 3 3 37 LYS QD . 37 . HD# 1 1 508 1 2 3 3 39 LEU H . 39 . HN 1 1 509 1 1 3 3 38 GLN HA . 38 . HA 1 1 509 1 2 3 3 41 TYR H . 41 . HN 1 1 510 1 1 3 3 38 GLN HA . 38 . HA 1 1 510 1 2 3 3 41 TYR QB . 41 . HB# 1 1 511 1 1 3 3 38 GLN HA . 38 . HA 1 1 511 1 2 3 3 41 TYR QD . 41 . HD# 1 1 512 1 1 3 3 38 GLN H . 38 . HN 1 1 512 1 2 3 3 41 TYR H . 41 . HN 1 1 513 1 1 3 3 39 LEU HA . 39 . HA 1 1 513 1 2 3 3 41 TYR QD . 41 . HD# 1 1 514 1 1 3 3 39 LEU HA . 39 . HA 1 1 514 1 2 3 3 42 GLN H . 42 . HN 1 1 515 1 1 3 3 39 LEU HA . 39 . HA 1 1 515 1 2 3 3 42 GLN QE . 42 . HE2# 1 1 516 1 1 3 3 39 LEU HA . 39 . HA 1 1 516 1 2 3 3 43 TRP QB . 43 . HB# 1 1 517 1 1 3 3 39 LEU HA . 39 . HA 1 1 517 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 518 1 1 3 3 39 LEU HG . 39 . HG 1 1 518 1 2 3 3 42 GLN QE . 42 . HE2# 1 1 519 1 1 3 3 39 LEU HG . 39 . HG 1 1 519 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 520 1 1 3 3 39 LEU QB . 39 . HB# 1 1 520 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 521 1 1 3 3 39 LEU QB . 39 . HB# 1 1 521 1 2 3 3 43 TRP HE3 . 43 . HE3 1 1 522 1 1 3 3 39 LEU MD1 . 39 . HD1# 1 1 522 1 2 3 3 42 GLN QG . 42 . HG# 1 1 523 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 523 1 2 3 3 42 GLN QE . 42 . HE2# 1 1 524 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 524 1 2 3 3 43 TRP QB . 43 . HB# 1 1 525 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 525 1 2 3 3 43 TRP HD1 . 43 . HD1 1 1 526 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 526 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 527 1 1 3 3 39 LEU MD1 . 39 . HD1# 1 1 527 1 2 3 3 43 TRP HE3 . 43 . HE3 1 1 528 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 528 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 529 1 1 3 3 39 LEU MD2 . 39 . HD2# 1 1 529 1 2 3 3 43 TRP HZ3 . 43 . HZ3 1 1 530 1 1 3 3 40 GLY HA3 . 40 . HA1 1 1 530 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 531 1 1 3 3 41 TYR HA . 41 . HA 1 1 531 1 2 3 3 44 LYS H . 44 . HN 1 1 532 1 1 3 3 41 TYR HA . 41 . HA 1 1 532 1 2 3 3 44 LYS QB . 44 . HB# 1 1 533 1 1 3 3 41 TYR HA . 41 . HA 1 1 533 1 2 3 3 44 LYS QD . 44 . HD# 1 1 534 1 1 3 3 41 TYR H . 41 . HN 1 1 534 1 2 3 3 44 LYS QD . 44 . HD# 1 1 535 1 1 3 3 41 TYR QB . 41 . HB# 1 1 535 1 2 3 3 44 LYS QE . 44 . HE# 1 1 536 1 1 3 3 41 TYR QB . 41 . HB# 1 1 536 1 2 3 3 45 MET ME . 45 . HE# 1 1 537 1 1 3 3 41 TYR QD . 41 . HD# 1 1 537 1 2 3 3 44 LYS QE . 44 . HE# 1 1 538 1 1 3 3 41 TYR QE . 41 . HE# 1 1 538 1 2 3 3 44 LYS QB . 44 . HB# 1 1 539 1 1 3 3 41 TYR QE . 41 . HE# 1 1 539 1 2 3 3 44 LYS QD . 44 . HD# 1 1 540 1 1 3 3 41 TYR QE . 41 . HE# 1 1 540 1 2 3 3 45 MET QB . 45 . HB# 1 1 541 1 1 3 3 42 GLN HA . 42 . HA 1 1 541 1 2 3 3 45 MET HA . 45 . HA 1 1 542 1 1 3 3 42 GLN HA . 42 . HA 1 1 542 1 2 3 3 45 MET QB . 45 . HB# 1 1 543 1 1 3 3 42 GLN HA . 42 . HA 1 1 543 1 2 3 3 45 MET H . 45 . HN 1 1 544 1 1 3 3 42 GLN QG . 42 . HG# 1 1 544 1 2 3 3 45 MET QB . 45 . HB# 1 1 545 1 1 3 3 42 GLN QE . 42 . HE2# 1 1 545 1 2 3 3 47 THR HB . 47 . HB 1 1 546 1 1 3 3 43 TRP QB . 43 . HB# 1 1 546 1 2 3 3 46 LEU HG . 46 . HG# 1 1 547 1 1 3 3 43 TRP HZ2 . 43 . HZ2 1 1 547 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 548 1 1 3 3 43 TRP HZ3 . 43 . HZ3 1 1 548 1 2 3 3 46 LEU QB . 46 . HB# 1 1 549 1 1 3 3 43 TRP HZ3 . 43 . HZ3 1 1 549 1 2 3 3 46 LEU MD1 . 46 . HD1# 1 1 550 1 1 3 3 44 LYS HA . 44 . HA 1 1 550 1 2 3 3 46 LEU HG . 46 . HG 1 1 551 1 1 3 3 44 LYS QE . 44 . HE# 1 1 551 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 552 1 1 3 3 45 MET HA . 45 . HA 1 1 552 1 2 3 3 48 GLU QG . 48 . HG# 1 1 553 1 1 3 3 45 MET QB . 45 . HB# 1 1 553 1 2 3 3 47 THR H . 47 . HN 1 1 554 1 1 3 3 45 MET QB . 45 . HB# 1 1 554 1 2 3 3 48 GLU QG . 48 . HG# 1 1 555 1 1 3 3 46 LEU HG . 46 . HG 1 1 555 1 2 3 3 51 LYS QD . 51 . HD# 1 1 556 1 1 3 3 46 LEU MD2 . 46 . HD2# 1 1 556 1 2 3 3 50 GLU QB . 50 . HB# 1 1 557 1 1 3 3 46 LEU MD2 . 46 . HD2# 1 1 557 1 2 3 3 50 GLU QG . 50 . HG# 1 1 558 1 1 3 3 46 LEU MD2 . 46 . HD2# 1 1 558 1 2 3 3 51 LYS H . 51 . HN 1 1 559 1 1 3 3 46 LEU MD2 . 46 . HD2# 1 1 559 1 2 3 3 51 LYS QB . 51 . HB# 1 1 560 1 1 3 3 47 THR HA . 47 . HA 1 1 560 1 2 3 3 49 ALA H . 49 . HN 1 1 561 1 1 3 3 47 THR HB . 47 . HB 1 1 561 1 2 3 3 49 ALA MB . 49 . HB# 1 1 562 1 1 3 3 47 THR H . 47 . HN 1 1 562 1 2 3 3 50 GLU H . 50 . HN 1 1 563 1 1 3 3 47 THR MG . 47 . HG2# 1 1 563 1 2 3 3 49 ALA MB . 49 . HB# 1 1 564 1 1 3 3 47 THR MG . 47 . HG2# 1 1 564 1 2 3 3 50 GLU QB . 50 . HB# 1 1 565 1 1 3 3 48 GLU HA . 48 . HA 1 1 565 1 2 3 3 50 GLU H . 50 . HN 1 1 566 1 1 3 3 48 GLU HA . 48 . HA 1 1 566 1 2 3 3 51 LYS H . 51 . HN 1 1 567 1 1 3 3 48 GLU HA . 48 . HA 1 1 567 1 2 3 3 52 TRP H . 52 . HN 1 1 568 1 1 3 3 48 GLU HA . 48 . HA 1 1 568 1 2 3 3 53 PRO QD . 53 . HD# 1 1 569 1 1 3 3 48 GLU H . 48 . HN 1 1 569 1 2 3 3 52 TRP H . 52 . HN 1 1 570 1 1 3 3 48 GLU QG . 48 . HG# 1 1 570 1 2 3 3 51 LYS QB . 51 . HB# 1 1 571 1 1 3 3 49 ALA HA . 49 . HA 1 1 571 1 2 3 3 52 TRP QB . 52 . HB# 1 1 572 1 1 3 3 49 ALA MB . 49 . HB# 1 1 572 1 2 3 3 52 TRP QB . 52 . HB# 1 1 573 1 1 3 3 50 GLU QB . 50 . HB# 1 1 573 1 2 3 3 53 PRO QG . 53 . HG# 1 1 574 1 1 3 3 50 GLU QG . 50 . HG# 1 1 574 1 2 3 3 54 PHE HZ . 54 . HZ 1 1 575 1 1 3 3 51 LYS HA . 51 . HA 1 1 575 1 2 3 3 54 PHE QD . 54 . HD# 1 1 576 1 1 3 3 51 LYS H . 51 . HN 1 1 576 1 2 3 3 53 PRO QB . 53 . HB# 1 1 577 1 1 3 3 51 LYS QB . 51 . HB# 1 1 577 1 2 3 3 53 PRO QG . 53 . HG# 1 1 578 1 1 3 3 51 LYS QB . 51 . HB# 1 1 578 1 2 3 3 54 PHE HZ . 54 . HZ 1 1 579 1 1 3 3 52 TRP HA . 52 . HA 1 1 579 1 2 3 3 54 PHE H . 54 . HN 1 1 580 1 1 3 3 52 TRP HD1 . 52 . HD1 1 1 580 1 2 3 3 56 GLN QE . 56 . HE2# 1 1 581 1 1 3 3 52 TRP HE1 . 52 . HE1 1 1 581 1 2 3 3 56 GLN QE . 56 . HE2# 1 1 582 1 1 3 3 52 TRP HE1 . 52 . HE1 1 1 582 1 2 3 3 56 GLN HA . 56 . HA 1 1 583 1 1 3 3 52 TRP HE1 . 52 . HE1 1 1 583 1 2 3 3 56 GLN QG . 56 . HG# 1 1 584 1 1 3 3 53 PRO HA . 53 . HA 1 1 584 1 2 3 3 56 GLN QB . 56 . HB# 1 1 585 1 1 3 3 53 PRO HA . 53 . HA 1 1 585 1 2 3 3 56 GLN QG . 56 . HG# 1 1 586 1 1 3 3 54 PHE HA . 54 . HA 1 1 586 1 2 3 3 57 GLU H . 57 . HN 1 1 587 1 1 3 3 54 PHE H . 54 . HN 1 1 587 1 2 3 3 56 GLN H . 56 . HN 1 1 588 1 1 3 3 54 PHE H . 54 . HN 1 1 588 1 2 3 3 56 GLN QE . 56 . HE2# 1 1 589 1 1 3 3 54 PHE QB . 54 . HB# 1 1 589 1 2 3 3 58 ALA MB . 58 . HB# 1 1 590 1 1 3 3 54 PHE QD . 54 . HD# 1 1 590 1 2 3 3 58 ALA MB . 58 . HB# 1 1 591 1 1 3 3 55 PHE HA . 55 . HA 1 1 591 1 2 3 3 58 ALA H . 58 . HN 1 1 592 1 1 3 3 55 PHE HA . 55 . HA 1 1 592 1 2 3 3 57 GLU QG . 57 . HG# 1 1 593 1 1 3 3 55 PHE HA . 55 . HA 1 1 593 1 2 3 3 58 ALA MB . 58 . HB# 1 1 594 1 1 3 3 56 GLN HA . 56 . HA 1 1 594 1 2 3 3 59 GLN QB . 59 . HB# 1 1 595 1 1 3 3 56 GLN HA . 56 . HA 1 1 595 1 2 3 3 59 GLN QG . 59 . HG# 1 1 596 1 1 3 3 56 GLN HA . 56 . HA 1 1 596 1 2 3 3 60 LYS H . 60 . HN 1 1 597 1 1 3 3 57 GLU HA . 57 . HA 1 1 597 1 2 3 3 60 LYS QB . 60 . HB# 1 1 598 1 1 3 3 57 GLU HA . 57 . HA 1 1 598 1 2 3 3 60 LYS QD . 60 . HD# 1 1 599 1 1 3 3 57 GLU QG . 57 . HG# 1 1 599 1 2 3 3 60 LYS QD . 60 . HD# 1 1 600 1 1 3 3 57 GLU QG . 57 . HG# 1 1 600 1 2 3 3 60 LYS QE . 60 . HE# 1 1 601 1 1 3 3 57 GLU QG . 57 . HG# 1 1 601 1 2 3 3 61 LEU QD . 61 . HD* 1 1 602 1 1 3 3 58 ALA HA . 58 . HA 1 1 602 1 2 3 3 61 LEU MD2 . 61 . HD2# 1 1 603 1 1 3 3 58 ALA HA . 58 . HA 1 1 603 1 2 3 3 61 LEU MD1 . 61 . HD1# 1 1 604 1 1 3 3 58 ALA H . 58 . HN 1 1 604 1 2 3 3 61 LEU QD . 61 . HD* 1 1 605 1 1 3 3 58 ALA MB . 58 . HB# 1 1 605 1 2 3 3 61 LEU QD . 61 . HD* 1 1 606 1 1 3 3 58 ALA MB . 58 . HB# 1 1 606 1 2 3 3 62 GLN QB . 62 . HB# 1 1 607 1 1 3 3 60 LYS HA . 60 . HA 1 1 607 1 2 3 3 63 ALA MB . 63 . HB# 1 1 608 1 1 3 3 60 LYS QB . 60 . HB# 1 1 608 1 2 3 3 63 ALA MB . 63 . HB# 1 1 609 1 1 3 3 61 LEU QB . 61 . HB# 1 1 609 1 2 3 3 64 MET ME . 64 . HE# 1 1 610 1 1 3 3 61 LEU QD . 61 . HD* 1 1 610 1 2 3 3 64 MET QB . 64 . HB# 1 1 611 1 1 3 3 61 LEU QD . 61 . HD* 1 1 611 1 2 3 3 64 MET ME . 64 . HE# 1 1 612 1 1 3 3 62 GLN HA . 62 . HA 1 1 612 1 2 3 3 65 HIS H . 65 . HN 1 1 613 1 1 3 3 62 GLN HA . 62 . HA 1 1 613 1 2 3 3 66 ARG H . 66 . HN 1 1 614 1 1 3 3 62 GLN HA . 62 . HA 1 1 614 1 2 3 3 66 ARG QB . 66 . HB# 1 1 615 1 1 3 3 62 GLN HA . 62 . HA 1 1 615 1 2 3 3 66 ARG QD . 66 . HD# 1 1 616 1 1 3 3 62 GLN HA . 62 . HA 1 1 616 1 2 3 3 66 ARG QG . 66 . HG# 1 1 617 1 1 3 3 63 ALA HA . 63 . HA 1 1 617 1 2 3 3 67 GLU H . 67 . HN 1 1 618 1 1 3 3 64 MET QG . 64 . HG# 1 1 618 1 2 3 3 67 GLU QB . 67 . HB# 1 1 619 1 1 3 3 64 MET QG . 64 . HG# 1 1 619 1 2 3 3 67 GLU QG . 67 . HG# 1 1 620 1 1 3 3 65 HIS HA . 65 . HA 1 1 620 1 2 3 3 68 LYS H . 68 . HN 1 1 621 1 1 3 3 65 HIS HA . 65 . HA 1 1 621 1 2 3 3 68 LYS QB . 68 . HB# 1 1 622 1 1 3 3 70 PRO QB . 70 . HB# 1 1 622 1 2 3 3 72 TYR H . 72 . HN 1 1 623 1 1 3 3 64 MET H . 64 . HN 1 1 623 1 2 3 3 66 ARG H . 66 . HN 1 1 624 1 1 3 3 60 LYS H . 60 . HN 1 1 624 1 2 3 3 63 ALA H . 63 . HN 1 1 625 1 1 3 3 35 ILE H . 35 . HN 1 1 625 1 2 3 3 38 GLN H . 38 . HN 1 1 626 1 1 3 3 33 SER H . 33 . HN 1 1 626 1 2 3 3 36 SER H . 36 . HN 1 1 627 1 1 3 3 5 VAL HA . 5 . HA 1 1 627 1 2 3 3 69 TYR QD . 69 . HD# 1 1 628 1 1 3 3 5 VAL HB . 5 . HB 1 1 628 1 2 3 3 72 TYR QD . 72 . HD# 1 1 629 1 1 3 3 5 VAL HB . 5 . HB 1 1 629 1 2 3 3 72 TYR QE . 72 . HE# 1 1 630 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 630 1 2 3 3 69 TYR QE . 69 . HE# 1 1 631 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 631 1 2 3 3 69 TYR QE . 69 . HE# 1 1 632 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 632 1 2 3 3 69 TYR QD . 69 . HD# 1 1 633 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 633 1 2 3 3 69 TYR QD . 69 . HD# 1 1 634 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 634 1 2 3 3 72 TYR QD . 72 . HD# 1 1 635 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 635 1 2 3 3 72 TYR QD . 72 . HD# 1 1 636 1 1 3 3 5 VAL MG1 . 5 . HG1# 1 1 636 1 2 3 3 72 TYR QE . 72 . HE# 1 1 637 1 1 3 3 5 VAL MG2 . 5 . HG2# 1 1 637 1 2 3 3 72 TYR QE . 72 . HE# 1 1 638 1 1 3 3 6 LYS QE . 6 . HE# 1 1 638 1 2 3 3 68 LYS QD . 68 . HD# 1 1 639 1 1 3 3 6 LYS QE . 6 . HE# 1 1 639 1 2 3 3 68 LYS QB . 68 . HB# 1 1 640 1 1 3 3 8 PRO HA . 8 . HA 1 1 640 1 2 3 3 61 LEU QD . 61 . HD* 1 1 641 1 1 3 3 8 PRO QB . 8 . HB# 1 1 641 1 2 3 3 61 LEU QB . 61 . HB# 1 1 642 1 1 3 3 8 PRO QB . 8 . HB# 1 1 642 1 2 3 3 65 HIS QB . 65 . HB# 1 1 643 1 1 3 3 8 PRO QD . 8 . HD# 1 1 643 1 2 3 3 65 HIS QB . 65 . HB# 1 1 644 1 1 3 3 8 PRO QD . 8 . HD# 1 1 644 1 2 3 3 65 HIS HE1 . 65 . HE1 1 1 645 1 1 3 3 8 PRO QG . 8 . HG# 1 1 645 1 2 3 3 64 MET QG . 64 . HG# 1 1 646 1 1 3 3 8 PRO QG . 8 . HG# 1 1 646 1 2 3 3 65 HIS QB . 65 . HB# 1 1 647 1 1 3 3 9 MET HA . 9 . HA 1 1 647 1 2 3 3 61 LEU QD . 61 . HD* 1 1 648 1 1 3 3 9 MET H . 9 . HN 1 1 648 1 2 3 3 61 LEU QD . 61 . HD* 1 1 649 1 1 3 3 9 MET QG . 9 . HG# 1 1 649 1 2 3 3 17 ARG QG . 17 . HG# 1 1 650 1 1 3 3 11 ALA HA . 11 . HA 1 1 650 1 2 3 3 58 ALA MB . 58 . HB# 1 1 651 1 1 3 3 11 ALA MB . 11 . HB# 1 1 651 1 2 3 3 55 PHE QE . 55 . HE# 1 1 652 1 1 3 3 11 ALA MB . 11 . HB# 1 1 652 1 2 3 3 54 PHE QB . 54 . HB# 1 1 653 1 1 3 3 11 ALA MB . 11 . HB# 1 1 653 1 2 3 3 54 PHE QD . 54 . HD# 1 1 654 1 1 3 3 11 ALA MB . 11 . HB# 1 1 654 1 2 3 3 54 PHE QE . 54 . HE# 1 1 655 1 1 3 3 11 ALA MB . 11 . HB# 1 1 655 1 2 3 3 55 PHE HA . 55 . HA 1 1 656 1 1 3 3 11 ALA MB . 11 . HB# 1 1 656 1 2 3 3 55 PHE H . 55 . HN 1 1 657 1 1 3 3 11 ALA MB . 11 . HB# 1 1 657 1 2 3 3 55 PHE HZ . 55 . HZ 1 1 658 1 1 3 3 11 ALA MB . 11 . HB# 1 1 658 1 2 3 3 55 PHE QD . 55 . HD# 1 1 659 1 1 3 3 11 ALA MB . 11 . HB# 1 1 659 1 2 3 3 58 ALA HA . 58 . HA 1 1 660 1 1 3 3 11 ALA MB . 11 . HB# 1 1 660 1 2 3 3 58 ALA H . 58 . HN 1 1 661 1 1 3 3 11 ALA MB . 11 . HB# 1 1 661 1 2 3 3 58 ALA MB . 58 . HB# 1 1 662 1 1 3 3 12 PHE HA . 12 . HA 1 1 662 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 663 1 1 3 3 12 PHE QB . 12 . HB# 1 1 663 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 664 1 1 3 3 12 PHE QB . 12 . HB# 1 1 664 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 665 1 1 3 3 12 PHE HZ . 12 . HZ 1 1 665 1 2 3 3 39 LEU MD2 . 39 . HD2# 1 1 666 1 1 3 3 12 PHE QE . 12 . HE# 1 1 666 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 667 1 1 3 3 12 PHE QE . 12 . HE# 1 1 667 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 668 1 1 3 3 14 VAL HB . 14 . HB 1 1 668 1 2 3 3 54 PHE QD . 54 . HD# 1 1 669 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 669 1 2 3 3 50 GLU QG . 50 . HG# 1 1 670 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 670 1 2 3 3 53 PRO QG . 53 . HG# 1 1 671 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 671 1 2 3 3 54 PHE HA . 54 . HA 1 1 672 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 672 1 2 3 3 54 PHE HZ . 54 . HZ 1 1 673 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 673 1 2 3 3 54 PHE QD . 54 . HD# 1 1 674 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 674 1 2 3 3 54 PHE QE . 54 . HE# 1 1 675 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 675 1 2 3 3 57 GLU QB . 57 . HB# 1 1 676 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 676 1 2 3 3 57 GLU QG . 57 . HG# 1 1 677 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 677 1 2 3 3 57 GLU QG . 57 . HG# 1 1 678 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 678 1 2 3 3 58 ALA H . 58 . HN 1 1 679 1 1 3 3 14 VAL MG1 . 14 . HG1# 1 1 679 1 2 3 3 58 ALA MB . 58 . HB# 1 1 680 1 1 3 3 14 VAL MG2 . 14 . HG2# 1 1 680 1 2 3 3 58 ALA MB . 58 . HB# 1 1 681 1 1 3 3 15 TRP HD1 . 15 . HD1 1 1 681 1 2 3 3 50 GLU QG . 50 . HG# 1 1 682 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 682 1 2 3 3 39 LEU MD2 . 39 . HD2# 1 1 683 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 683 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 684 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 684 1 2 3 3 54 PHE QD . 54 . HD# 1 1 685 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 685 1 2 3 3 55 PHE HZ . 55 . HZ 1 1 686 1 1 3 3 15 TRP HE1 . 15 . HE1 1 1 686 1 2 3 3 55 PHE QE . 55 . HE# 1 1 687 1 1 3 3 15 TRP HH2 . 15 . HH2 1 1 687 1 2 3 3 43 TRP HA . 43 . HA 1 1 688 1 1 3 3 15 TRP HH2 . 15 . HH2 1 1 688 1 2 3 3 43 TRP HH2 . 43 . HH2 1 1 689 1 1 3 3 15 TRP HZ2 . 15 . HZ2 1 1 689 1 2 3 3 46 LEU MD2 . 46 . HD2# 1 1 690 1 1 3 3 15 TRP HZ2 . 15 . HZ2 1 1 690 1 2 3 3 54 PHE HZ . 54 . HZ 1 1 691 1 1 3 3 15 TRP HZ3 . 15 . HZ3 1 1 691 1 2 3 3 43 TRP HE1 . 43 . HE1 1 1 692 1 1 3 3 15 TRP HZ3 . 15 . HZ3 1 1 692 1 2 3 3 43 TRP HZ2 . 43 . HZ2 1 1 693 1 1 3 3 15 TRP HZ3 . 15 . HZ3 1 1 693 1 2 3 3 43 TRP HZ3 . 43 . HZ3 1 1 694 1 1 3 3 19 GLN QB . 19 . HB# 1 1 694 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 695 1 1 3 3 19 GLN QB . 19 . HB# 1 1 695 1 2 3 3 43 TRP HH2 . 43 . HH2 1 1 696 1 1 3 3 19 GLN QG . 19 . HG# 1 1 696 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 697 1 1 3 3 19 GLN QG . 19 . HG# 1 1 697 1 2 3 3 42 GLN QG . 42 . HG# 1 1 698 1 1 3 3 19 GLN QG . 19 . HG# 1 1 698 1 2 3 3 43 TRP HZ3 . 43 . HZ3 1 1 699 1 1 3 3 19 GLN QE . 19 . HE2# 1 1 699 1 2 3 3 43 TRP HH2 . 43 . HH2 1 1 700 1 1 3 3 20 ARG QG . 20 . HG# 1 1 700 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 701 1 1 3 3 21 ARG QD . 21 . HD# 1 1 701 1 2 3 3 28 PRO QD . 28 . HD# 1 1 702 1 1 3 3 22 LYS QE . 22 . HE# 1 1 702 1 2 3 3 35 ILE HB . 35 . HB 1 1 703 1 1 3 3 22 LYS QE . 22 . HE# 1 1 703 1 2 3 3 39 LEU MD1 . 39 . HD1# 1 1 704 1 1 3 3 23 MET QB . 23 . HB# 1 1 704 1 2 3 3 30 MET QG . 30 . HG# 1 1 705 1 1 3 3 23 MET ME . 23 . HE# 1 1 705 1 2 3 3 30 MET HA . 30 . HA 1 1 706 1 1 3 3 23 MET ME . 23 . HE# 1 1 706 1 2 3 3 34 GLU HA . 34 . HA 1 1 707 1 1 3 3 23 MET ME . 23 . HE# 1 1 707 1 2 3 3 34 GLU QB . 34 . HB# 1 1 708 1 1 3 3 23 MET ME . 23 . HE# 1 1 708 1 2 3 3 34 GLU QG . 34 . HG# 1 1 709 1 1 3 3 23 MET ME . 23 . HE# 1 1 709 1 2 3 3 35 ILE HA . 35 . HA 1 1 710 1 1 3 3 23 MET ME . 23 . HE# 1 1 710 1 2 3 3 35 ILE H . 35 . HN 1 1 711 1 1 3 3 23 MET ME . 23 . HE# 1 1 711 1 2 3 3 35 ILE MD . 35 . HD1# 1 1 712 1 1 3 3 23 MET ME . 23 . HE# 1 1 712 1 2 3 3 38 GLN QB . 38 . HB# 1 1 713 1 1 3 3 23 MET ME . 23 . HE# 1 1 713 1 2 3 3 38 GLN QG . 38 . HG# 1 1 714 1 1 3 3 23 MET QG . 23 . HG# 1 1 714 1 2 3 3 28 PRO HA . 28 . HA 1 1 715 1 1 3 3 23 MET QG . 23 . HG# 1 1 715 1 2 3 3 28 PRO QD . 28 . HD# 1 1 716 1 1 3 3 23 MET QG . 23 . HG# 1 1 716 1 2 3 3 30 MET QB . 30 . HB# 1 1 717 1 1 3 3 23 MET QG . 23 . HG# 1 1 717 1 2 3 3 34 GLU QB . 34 . HB# 1 1 718 1 1 3 3 23 MET QG . 23 . HG# 1 1 718 1 2 3 3 35 ILE HB . 35 . HB 1 1 719 1 1 3 3 23 MET QG . 23 . HG# 1 1 719 1 2 3 3 35 ILE H . 35 . HN 1 1 720 1 1 3 3 23 MET QG . 23 . HG# 1 1 720 1 2 3 3 35 ILE MD . 35 . HD# 1 1 721 1 1 3 3 24 ALA HA . 24 . HA 1 1 721 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 722 1 1 3 3 27 ASN QB . 27 . HB# 1 1 722 1 2 3 3 35 ILE MG . 35 . HG2# 1 1 723 1 1 3 3 27 ASN QD . 27 . HD2# 1 1 723 1 2 3 3 34 GLU QB . 34 . HB# 1 1 724 1 1 3 3 43 TRP HH2 . 43 . HH2 1 1 724 1 2 3 3 54 PHE HZ . 54 . HZ 1 1 725 1 1 3 3 43 TRP HZ3 . 43 . HZ3 1 1 725 1 2 3 3 50 GLU QB . 50 . HB# 1 1 726 1 1 3 3 46 LEU MD1 . 46 . HD1# 1 1 726 1 2 3 3 55 PHE HZ . 55 . HZ 1 1 727 1 1 3 3 46 LEU MD2 . 46 . HD2# 1 1 727 1 2 3 3 55 PHE HZ . 55 . HZ 1 1 728 1 1 3 3 57 GLU QB . 57 . HB# 1 1 728 1 2 3 3 64 MET ME . 64 . HE# 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 . . . . . 2.8 1.7 3.3 1 1 2 1 . . . . . 2.8 1.1 4.3 1 1 3 1 . . . . . 2.8 1.1 4.3 1 1 4 1 . . . . . 2.4 1.7 2.9 1 1 5 1 . . . . . 4.5 0.7 5.0 1 1 6 1 . . . . . 4.5 0.7 5.0 1 1 7 1 . . . . . 2.4 1.1 2.9 1 1 8 1 . . . . . 4.5 1.7 5.0 1 1 9 1 . . . . . 2.8 -0.3 3.3 1 1 10 1 . . . . . 3.5 1.7 4.0 1 1 11 1 . . . . . 4.5 0.7 5.0 1 1 12 1 . . . . . 3.0 1.3 4.0 1 1 13 1 . . . . . 3.0 1.3 4.0 1 1 14 1 . . . . . 2.4 1.7 2.9 1 1 15 1 . . . . . 2.4 1.1 2.9 1 1 16 1 . . . . . 5.5 1.7 6.0 1 1 17 1 . . . . . 2.4 1.1 2.9 1 1 18 1 . . . . . 2.4 1.1 2.9 1 1 19 1 . . . . . 4.5 0.7 5.0 1 1 20 1 . . . . . 2.8 -0.3 3.3 1 1 21 1 . . . . . 3.0 0.7 3.5 1 1 22 1 . . . . . 2.4 1.1 2.9 1 1 23 1 . . . . . 4.5 1.7 5.0 1 1 24 1 . . . . . 2.4 1.1 2.9 1 1 25 1 . . . . . 4.5 0.7 5.0 1 1 26 1 . . . . . 2.4 1.1 2.9 1 1 27 1 . . . . . 2.4 1.1 2.9 1 1 28 1 . . . . . 3.0 -0.1 3.5 1 1 29 1 . . . . . 4.5 1.7 5.0 1 1 30 1 . . . . . 4.5 0.7 5.0 1 1 31 1 . . . . . 3.0 1.0 4.0 1 1 32 1 . . . . . 2.4 1.1 2.9 1 1 33 1 . . . . . 3.0 0.2 3.5 1 1 34 1 . . . . . 2.4 1.1 2.9 1 1 35 1 . . . . . 2.4 1.1 2.9 1 1 36 1 . . . . . 2.8 1.1 3.3 1 1 37 1 . . . . . 4.5 1.7 5.0 1 1 38 1 . . . . . 2.4 1.1 2.9 1 1 39 1 . . . . . 2.8 1.1 3.8 1 1 40 1 . . . . . 3.0 1.3 3.5 1 1 41 1 . . . . . 2.4 1.1 2.9 1 1 42 1 . . . . . 4.5 2.4 5.0 1 1 43 1 . . . . . 2.4 1.1 2.9 1 1 44 1 . . . . . 2.4 0.7 2.9 1 1 45 1 . . . . . 2.8 1.7 3.3 1 1 46 1 . . . . . 2.2 1.1 2.7 1 1 47 1 . . . . . 2.2 1.1 2.7 1 1 48 1 . . . . . 2.4 1.1 2.9 1 1 49 1 . . . . . 2.4 0.2 3.4 1 1 50 1 . . . . . 3.0 1.1 3.5 1 1 51 1 . . . . . 2.4 0.7 2.9 1 1 52 1 . . . . . 2.8 -0.3 3.3 1 1 53 1 . . . . . 4.5 0.7 5.0 1 1 54 1 . . . . . 2.4 1.1 2.9 1 1 55 1 . . . . . 4.5 1.7 5.0 1 1 56 1 . . . . . 4.5 -1.0 5.5 1 1 57 1 . . . . . 2.8 1.7 3.3 1 1 58 1 . . . . . 4.5 1.7 5.0 1 1 59 1 . . . . . 2.8 -0.3 3.3 1 1 60 1 . . . . . 5.5 -0.3 6.0 1 1 61 1 . . . . . 2.4 1.1 2.9 1 1 62 1 . . . . . 2.4 1.1 2.9 1 1 63 1 . . . . . 4.5 1.7 5.0 1 1 64 1 . . . . . 5.5 0.7 6.0 1 1 65 1 . . . . . 2.4 1.1 2.9 1 1 66 1 . . . . . 5.5 0.7 6.0 1 1 67 1 . . . . . 4.5 0.7 5.0 1 1 68 1 . . . . . 2.4 1.1 2.9 1 1 69 1 . . . . . 2.4 0.7 2.9 1 1 70 1 . . . . . 3.0 -0.1 3.5 1 1 71 1 . . . . . 4.5 0.7 5.0 1 1 72 1 . . . . . 5.5 0.2 6.5 1 1 73 1 . . . . . 2.4 1.1 2.9 1 1 74 1 . . . . . 4.5 1.7 5.0 1 1 75 1 . . . . . 4.5 0.0 5.0 1 1 76 1 . . . . . 2.8 1.7 3.8 1 1 77 1 . . . . . 2.4 1.7 2.9 1 1 78 1 . . . . . 2.8 1.5 3.3 1 1 79 1 . . . . . 4.5 1.7 5.5 1 1 80 1 . . . . . 2.8 1.5 3.8 1 1 81 1 . . . . . 3.0 0.8 3.5 1 1 82 1 . . . . . 2.4 1.1 2.9 1 1 83 1 . . . . . 4.5 0.7 5.0 1 1 84 1 . . . . . 2.2 1.7 2.7 1 1 85 1 . . . . . 2.4 1.1 2.9 1 1 86 1 . . . . . . 1.7 3.5 1 1 87 1 . . . . . 2.4 1.1 2.9 1 1 88 1 . . . . . 2.8 -0.3 3.3 1 1 89 1 . . . . . 4.5 1.7 5.0 1 1 90 1 . . . . . 2.4 1.1 2.9 1 1 91 1 . . . . . 5.5 1.7 6.0 1 1 92 1 . . . . . 3.0 1.1 3.5 1 1 93 1 . . . . . 2.8 1.5 3.3 1 1 94 1 . . . . . 2.8 1.7 3.3 1 1 95 1 . . . . . 3.5 1.8 4.0 1 1 96 1 . . . . . 2.4 1.1 2.9 1 1 97 1 . . . . . 4.5 0.7 5.0 1 1 98 1 . . . . . 2.4 1.1 2.9 1 1 99 1 . . . . . 4.5 1.7 5.0 1 1 100 1 . . . . . 2.4 1.1 2.9 1 1 101 1 . . . . . 3.0 -0.1 3.5 1 1 102 1 . . . . . 2.4 0.7 2.9 1 1 103 1 . . . . . 3.0 0.2 3.5 1 1 104 1 . . . . . 4.5 1.7 5.0 1 1 105 1 . . . . . 2.4 1.1 2.9 1 1 106 1 . . . . . 2.4 1.1 2.9 1 1 107 1 . . . . . 4.5 0.7 5.0 1 1 108 1 . . . . . 2.4 1.1 2.9 1 1 109 1 . . . . . 2.8 -0.2 3.8 1 1 110 1 . . . . . 3.0 0.7 3.5 1 1 111 1 . . . . . 5.5 1.7 6.0 1 1 112 1 . . . . . 2.4 1.1 2.9 1 1 113 1 . . . . . 2.4 1.1 2.9 1 1 114 1 . . . . . 5.5 2.7 6.0 1 1 115 1 . . . . . 2.4 1.1 2.9 1 1 116 1 . . . . . 2.4 0.7 2.9 1 1 117 1 . . . . . 2.4 1.1 2.9 1 1 118 1 . . . . . 2.4 1.1 2.9 1 1 119 1 . . . . . 5.5 0.7 6.0 1 1 120 1 . . . . . 4.5 0.7 5.0 1 1 121 1 . . . . . 2.4 1.7 2.9 1 1 122 1 . . . . . 4.5 -1.7 5.5 1 1 123 1 . . . . . 4.5 0.7 5.0 1 1 124 1 . . . . . 2.8 1.7 3.3 1 1 125 1 . . . . . 4.5 0.7 5.0 1 1 126 1 . . . . . 4.5 1.8 5.5 1 1 127 1 . . . . . 4.5 1.7 5.5 1 1 128 1 . . . . . 5.5 -1.7 6.5 1 1 129 1 . . . . . 5.5 -1.7 6.5 1 1 130 1 . . . . . 2.8 1.7 3.3 1 1 131 1 . . . . . 5.5 2.7 6.0 1 1 132 1 . . . . . 4.5 0.7 5.0 1 1 133 1 . . . . . 2.4 1.7 2.9 1 1 134 1 . . . . . 4.5 1.7 5.0 1 1 135 1 . . . . . 2.4 0.7 2.9 1 1 136 1 . . . . . 4.5 -0.3 5.0 1 1 137 1 . . . . . 4.5 1.7 5.0 1 1 138 1 . . . . . 2.4 0.7 2.9 1 1 139 1 . . . . . 4.5 -0.8 5.0 1 1 140 1 . . . . . 4.5 1.7 5.0 1 1 141 1 . . . . . 2.4 1.7 2.9 1 1 142 1 . . . . . 4.5 1.7 5.0 1 1 143 1 . . . . . 4.5 -1.3 5.0 1 1 144 1 . . . . . 4.5 -1.3 5.0 1 1 145 1 . . . . . 5.5 -1.8 6.0 1 1 146 1 . . . . . 5.5 -2.3 6.0 1 1 147 1 . . . . . 5.5 -0.7 6.5 1 1 148 1 . . . . . 3.0 1.7 3.5 1 1 149 1 . . . . . 4.5 0.2 5.5 1 1 150 1 . . . . . 4.5 1.7 5.5 1 1 151 1 . . . . . 6.5 -0.7 7.5 1 1 152 1 . . . . . 4.5 0.2 5.5 1 1 153 1 . . . . . 5.5 -2.2 6.5 1 1 154 1 . . . . . 5.5 -2.2 6.5 1 1 155 1 . . . . . 4.5 0.7 5.0 1 1 156 1 . . . . . 3.0 1.7 3.5 1 1 157 1 . . . . . 2.8 1.7 3.3 1 1 158 1 . . . . . 4.5 -0.7 5.5 1 1 159 1 . . . . . 4.5 -0.7 5.5 1 1 160 1 . . . . . 4.5 -0.7 5.5 1 1 161 1 . . . . . 4.5 1.7 5.0 1 1 162 1 . . . . . 3.0 1.7 3.5 1 1 163 1 . . . . . 3.0 1.7 3.5 1 1 164 1 . . . . . 3.0 1.7 3.5 1 1 165 1 . . . . . 4.5 0.7 5.0 1 1 166 1 . . . . . 4.5 1.7 5.0 1 1 167 1 . . . . . 3.0 1.7 3.5 1 1 168 1 . . . . . 2.8 1.7 3.3 1 1 169 1 . . . . . 4.5 0.7 5.0 1 1 170 1 . . . . . 2.4 1.7 2.9 1 1 171 1 . . . . . 3.0 0.7 3.5 1 1 172 1 . . . . . 4.5 1.7 5.0 1 1 173 1 . . . . . 2.4 1.7 2.9 1 1 174 1 . . . . . 4.5 0.7 5.0 1 1 175 1 . . . . . 5.5 -0.3 6.0 1 1 176 1 . . . . . 4.5 0.7 5.0 1 1 177 1 . . . . . 5.5 -0.3 6.0 1 1 178 1 . . . . . 4.5 1.7 5.0 1 1 179 1 . . . . . 2.4 1.7 2.9 1 1 180 1 . . . . . 3.0 1.3 3.5 1 1 181 1 . . . . . 2.4 1.7 2.9 1 1 182 1 . . . . . 4.5 -0.3 5.0 1 1 183 1 . . . . . 2.4 0.7 2.9 1 1 184 1 . . . . . 3.0 1.7 3.5 1 1 185 1 . . . . . 2.4 1.7 2.9 1 1 186 1 . . . . . 2.8 1.7 3.3 1 1 187 1 . . . . . 5.5 -0.8 6.5 1 1 188 1 . . . . . 5.5 -0.3 6.0 1 1 189 1 . . . . . 4.5 0.7 5.0 1 1 190 1 . . . . . 4.5 -1.3 5.0 1 1 191 1 . . . . . 4.5 0.7 5.0 1 1 192 1 . . . . . 5.5 0.2 6.5 1 1 193 1 . . . . . 2.4 0.7 2.9 1 1 194 1 . . . . . 4.5 -1.7 6.0 1 1 195 1 . . . . . 2.4 1.7 2.9 1 1 196 1 . . . . . 4.5 1.7 6.0 1 1 197 1 . . . . . 4.5 -0.8 5.5 1 1 198 1 . . . . . 2.8 1.7 4.8 1 1 199 1 . . . . . 5.5 1.7 6.0 1 1 200 1 . . . . . 6.5 1.7 7.0 1 1 201 1 . . . . . 4.5 0.6 6.0 1 1 202 1 . . . . . 3.0 1.7 3.5 1 1 203 1 . . . . . 5.5 -0.3 6.0 1 1 204 1 . . . . . 4.5 -0.3 5.0 1 1 205 1 . . . . . 4.5 0.7 5.0 1 1 206 1 . . . . . 3.0 0.7 3.5 1 1 207 1 . . . . . 4.5 0.7 5.0 1 1 208 1 . . . . . 4.5 1.7 5.0 1 1 209 1 . . . . . 2.4 1.7 2.9 1 1 210 1 . . . . . 4.5 0.7 5.0 1 1 211 1 . . . . . 5.5 -0.3 6.0 1 1 212 1 . . . . . 5.5 -0.3 6.0 1 1 213 1 . . . . . 4.5 0.7 5.0 1 1 214 1 . . . . . 3.0 1.7 3.5 1 1 215 1 . . . . . 4.5 -0.3 5.0 1 1 216 1 . . . . . 5.5 0.7 6.0 1 1 217 1 . . . . . 4.5 0.7 5.0 1 1 218 1 . . . . . 3.0 1.9 3.5 1 1 219 1 . . . . . 4.5 1.7 5.5 1 1 220 1 . . . . . 4.5 1.7 5.0 1 1 221 1 . . . . . 6.5 2.7 7.0 1 1 222 1 . . . . . 4.5 1.7 5.0 1 1 223 1 . . . . . 2.4 1.7 2.9 1 1 224 1 . . . . . 4.5 -0.8 5.5 1 1 225 1 . . . . . 4.5 1.7 5.0 1 1 226 1 . . . . . 5.5 1.7 6.0 1 1 227 1 . . . . . 4.5 1.7 5.0 1 1 228 1 . . . . . 4.5 -0.8 5.5 1 1 229 1 . . . . . 3.0 0.2 4.0 1 1 230 1 . . . . . 3.0 1.7 3.5 1 1 231 1 . . . . . 4.5 0.7 5.0 1 1 232 1 . . . . . 2.4 0.7 2.9 1 1 233 1 . . . . . 4.5 -1.3 5.0 1 1 234 1 . . . . . 4.5 -0.3 5.0 1 1 235 1 . . . . . 4.5 -1.3 5.0 1 1 236 1 . . . . . 4.5 1.7 5.0 1 1 237 1 . . . . . 2.4 1.7 2.9 1 1 238 1 . . . . . 4.5 0.7 5.0 1 1 239 1 . . . . . 3.0 1.9 3.5 1 1 240 1 . . . . . 4.5 1.7 5.0 1 1 241 1 . . . . . 3.0 1.7 3.5 1 1 242 1 . . . . . 5.5 0.7 6.0 1 1 243 1 . . . . . 2.4 1.7 2.9 1 1 244 1 . . . . . 3.0 1.7 3.5 1 1 245 1 . . . . . 4.5 -1.7 6.0 1 1 246 1 . . . . . 5.5 -0.3 6.0 1 1 247 1 . . . . . 2.4 1.7 2.9 1 1 248 1 . . . . . 4.5 -1.3 5.0 1 1 249 1 . . . . . 4.5 0.7 5.0 1 1 250 1 . . . . . 4.5 0.7 5.0 1 1 251 1 . . . . . 5.5 -0.3 6.0 1 1 252 1 . . . . . 4.5 1.7 5.0 1 1 253 1 . . . . . 2.4 1.7 2.9 1 1 254 1 . . . . . 5.5 0.7 6.0 1 1 255 1 . . . . . 2.4 0.7 2.9 1 1 256 1 . . . . . 4.5 -2.3 5.0 1 1 257 1 . . . . . 4.5 -2.3 5.0 1 1 258 1 . . . . . 4.5 0.7 5.0 1 1 259 1 . . . . . 3.0 1.7 3.5 1 1 260 1 . . . . . 3.0 0.7 3.5 1 1 261 1 . . . . . 5.5 1.7 6.0 1 1 262 1 . . . . . 4.5 -0.3 5.0 1 1 263 1 . . . . . 4.5 0.7 5.0 1 1 264 1 . . . . . 4.5 -0.3 5.0 1 1 265 1 . . . . . 5.5 1.7 6.0 1 1 266 1 . . . . . 4.5 0.7 5.0 1 1 267 1 . . . . . 5.5 1.7 6.0 1 1 268 1 . . . . . 5.5 1.7 6.0 1 1 269 1 . . . . . 2.4 1.7 2.9 1 1 270 1 . . . . . 4.5 -0.3 5.0 1 1 271 1 . . . . . 2.4 0.7 2.9 1 1 272 1 . . . . . 3.0 -0.1 3.5 1 1 273 1 . . . . . 5.5 2.7 6.0 1 1 274 1 . . . . . 4.5 -0.3 5.0 1 1 275 1 . . . . . 4.5 1.7 5.0 1 1 276 1 . . . . . 5.5 1.7 6.0 1 1 277 1 . . . . . 5.5 0.2 6.0 1 1 278 1 . . . . . 2.4 1.7 2.9 1 1 279 1 . . . . . 4.5 -1.8 5.5 1 1 280 1 . . . . . 4.5 1.7 5.0 1 1 281 1 . . . . . 4.5 0.7 5.0 1 1 282 1 . . . . . 5.5 -0.8 6.5 1 1 283 1 . . . . . 5.5 -0.3 6.0 1 1 284 1 . . . . . 4.5 1.7 5.0 1 1 285 1 . . . . . 5.5 0.7 6.0 1 1 286 1 . . . . . 3.5 1.7 4.0 1 1 287 1 . . . . . 5.5 -1.7 6.5 1 1 288 1 . . . . . 5.5 -2.2 7.5 1 1 289 1 . . . . . 5.5 1.7 6.0 1 1 290 1 . . . . . 4.5 -0.3 5.0 1 1 291 1 . . . . . 3.0 0.7 3.5 1 1 292 1 . . . . . 4.5 -1.8 5.5 1 1 293 1 . . . . . 2.4 1.7 2.9 1 1 294 1 . . . . . 5.5 0.7 6.0 1 1 295 1 . . . . . 5.5 0.7 6.0 1 1 296 1 . . . . . 5.5 1.7 6.0 1 1 297 1 . . . . . 4.5 1.7 5.0 1 1 298 1 . . . . . 5.5 0.2 6.0 1 1 299 1 . . . . . 4.5 1.7 5.0 1 1 300 1 . . . . . 3.0 1.3 3.5 1 1 301 1 . . . . . 5.5 -0.8 6.5 1 1 302 1 . . . . . 4.5 0.7 5.0 1 1 303 1 . . . . . 5.5 1.7 6.0 1 1 304 1 . . . . . 2.4 1.7 2.9 1 1 305 1 . . . . . 5.5 1.7 6.0 1 1 306 1 . . . . . 2.8 -0.8 3.8 1 1 307 1 . . . . . 4.5 1.7 5.5 1 1 308 1 . . . . . 4.5 0.7 5.0 1 1 309 1 . . . . . 3.0 1.7 3.5 1 1 310 1 . . . . . 3.0 0.7 3.5 1 1 311 1 . . . . . 5.5 0.7 6.0 1 1 312 1 . . . . . 4.5 -0.3 5.0 1 1 313 1 . . . . . 4.5 -1.3 5.0 1 1 314 1 . . . . . 4.5 0.7 5.0 1 1 315 1 . . . . . 5.5 0.7 6.0 1 1 316 1 . . . . . 5.5 0.7 6.0 1 1 317 1 . . . . . 4.5 0.7 5.0 1 1 318 1 . . . . . 5.5 -0.3 6.0 1 1 319 1 . . . . . 5.5 -1.3 6.0 1 1 320 1 . . . . . 4.5 1.7 5.0 1 1 321 1 . . . . . 2.4 1.7 2.9 1 1 322 1 . . . . . 3.5 1.7 4.0 1 1 323 1 . . . . . 5.5 -0.3 6.0 1 1 324 1 . . . . . 4.5 1.7 5.0 1 1 325 1 . . . . . 4.5 -1.3 5.0 1 1 326 1 . . . . . 4.5 1.7 5.0 1 1 327 1 . . . . . 2.4 1.7 2.9 1 1 328 1 . . . . . 5.5 0.2 6.5 1 1 329 1 . . . . . 2.4 0.7 2.9 1 1 330 1 . . . . . 5.5 0.7 6.0 1 1 331 1 . . . . . 5.5 -0.3 6.0 1 1 332 1 . . . . . 3.0 1.7 3.5 1 1 333 1 . . . . . 2.4 1.7 2.9 1 1 334 1 . . . . . 4.5 0.7 5.0 1 1 335 1 . . . . . 5.5 -0.3 6.0 1 1 336 1 . . . . . 4.5 1.7 5.0 1 1 337 1 . . . . . 2.4 1.7 2.9 1 1 338 1 . . . . . 2.4 0.7 2.9 1 1 339 1 . . . . . 4.5 0.9 5.5 1 1 340 1 . . . . . 4.5 0.7 5.0 1 1 341 1 . . . . . 3.0 1.7 3.5 1 1 342 1 . . . . . 2.4 1.7 2.9 1 1 343 1 . . . . . 2.4 0.2 3.4 1 1 344 1 . . . . . 5.5 -0.8 6.5 1 1 345 1 . . . . . 4.5 -1.8 5.5 1 1 346 1 . . . . . 2.4 1.7 2.9 1 1 347 1 . . . . . 2.4 0.7 2.9 1 1 348 1 . . . . . 5.5 0.7 6.0 1 1 349 1 . . . . . 2.4 1.7 2.9 1 1 350 1 . . . . . 5.5 -0.7 6.0 1 1 351 1 . . . . . 4.5 -2.7 5.0 1 1 352 1 . . . . . 5.5 2.7 6.0 1 1 353 1 . . . . . 2.8 -1.7 4.3 1 1 354 1 . . . . . 5.5 -1.7 7.0 1 1 355 1 . . . . . 5.5 -0.3 6.0 1 1 356 1 . . . . . 3.0 1.7 3.5 1 1 357 1 . . . . . 4.5 1.7 5.0 1 1 358 1 . . . . . 3.0 0.7 3.5 1 1 359 1 . . . . . 4.5 -1.3 5.0 1 1 360 1 . . . . . 3.0 -0.7 4.5 1 1 361 1 . . . . . 3.0 1.7 3.5 1 1 362 1 . . . . . 2.4 1.7 2.9 1 1 363 1 . . . . . 2.4 0.7 2.9 1 1 364 1 . . . . . 4.5 0.7 5.0 1 1 365 1 . . . . . 5.5 -0.8 6.5 1 1 366 1 . . . . . 4.5 -1.8 5.5 1 1 367 1 . . . . . 2.4 0.7 2.9 1 1 368 1 . . . . . 5.5 1.7 6.0 1 1 369 1 . . . . . 5.5 1.7 6.0 1 1 370 1 . . . . . 3.0 0.7 3.5 1 1 371 1 . . . . . 5.5 -0.3 6.0 1 1 372 1 . . . . . 5.5 0.7 6.0 1 1 373 1 . . . . . 2.4 1.7 2.9 1 1 374 1 . . . . . 5.5 -0.3 6.0 1 1 375 1 . . . . . 3.0 1.7 3.5 1 1 376 1 . . . . . 5.5 0.7 6.0 1 1 377 1 . . . . . 5.5 0.7 6.0 1 1 378 1 . . . . . 2.4 1.7 2.9 1 1 379 1 . . . . . 3.0 1.7 3.5 1 1 380 1 . . . . . 5.5 -0.3 6.0 1 1 381 1 . . . . . 3.0 1.7 3.5 1 1 382 1 . . . . . 4.5 1.7 5.0 1 1 383 1 . . . . . 2.4 1.7 2.9 1 1 384 1 . . . . . 3.0 1.3 3.5 1 1 385 1 . . . . . 2.8 -2.0 3.3 1 1 386 1 . . . . . 5.5 -1.3 6.0 1 1 387 1 . . . . . 4.5 -0.3 5.0 1 1 388 1 . . . . . 4.5 0.7 5.0 1 1 389 1 . . . . . 4.5 0.7 5.0 1 1 390 1 . . . . . 5.5 0.7 6.0 1 1 391 1 . . . . . 5.5 0.7 6.0 1 1 392 1 . . . . . 5.5 0.7 6.0 1 1 393 1 . . . . . 4.5 1.7 5.0 1 1 394 1 . . . . . 4.5 -0.3 5.0 1 1 395 1 . . . . . 2.8 1.7 3.3 1 1 396 1 . . . . . 5.5 1.7 6.0 1 1 397 1 . . . . . 5.5 0.7 6.0 1 1 398 1 . . . . . 3.0 1.7 3.5 1 1 399 1 . . . . . 4.5 0.7 5.0 1 1 400 1 . . . . . 5.5 0.7 6.0 1 1 401 1 . . . . . 5.5 0.7 6.0 1 1 402 1 . . . . . 3.0 1.7 3.5 1 1 403 1 . . . . . 4.5 0.7 5.0 1 1 404 1 . . . . . 4.5 0.7 5.0 1 1 405 1 . . . . . 5.5 -0.3 6.0 1 1 406 1 . . . . . 3.0 -0.3 3.5 1 1 407 1 . . . . . 2.8 0.2 3.8 1 1 408 1 . . . . . 4.5 -2.7 5.5 1 1 409 1 . . . . . 4.5 0.2 5.5 1 1 410 1 . . . . . 4.5 -0.3 5.0 1 1 411 1 . . . . . 4.5 -0.8 5.5 1 1 412 1 . . . . . 4.5 1.7 5.0 1 1 413 1 . . . . . 4.5 1.7 5.0 1 1 414 1 . . . . . 4.5 -1.7 5.5 1 1 415 1 . . . . . 4.5 0.2 5.5 1 1 416 1 . . . . . 5.5 -2.2 6.5 1 1 417 1 . . . . . 5.5 -2.2 6.5 1 1 418 1 . . . . . 5.5 0.2 6.5 1 1 419 1 . . . . . 4.5 0.7 5.0 1 1 420 1 . . . . . 5.5 1.7 6.0 1 1 421 1 . . . . . 5.5 -1.7 6.5 1 1 422 1 . . . . . 4.5 -1.3 5.0 1 1 423 1 . . . . . 4.5 0.7 5.0 1 1 424 1 . . . . . 4.5 0.7 5.0 1 1 425 1 . . . . . 5.5 -1.7 6.5 1 1 426 1 . . . . . 5.5 -1.7 6.5 1 1 427 1 . . . . . 2.8 -1.1 3.8 1 1 428 1 . . . . . 4.5 1.7 5.0 1 1 429 1 . . . . . 5.5 1.7 6.0 1 1 430 1 . . . . . 6.5 2.7 7.0 1 1 431 1 . . . . . 4.5 0.7 5.0 1 1 432 1 . . . . . 5.5 0.7 6.0 1 1 433 1 . . . . . 4.5 0.7 5.0 1 1 434 1 . . . . . 5.5 -0.3 6.0 1 1 435 1 . . . . . 5.5 0.7 6.0 1 1 436 1 . . . . . 4.5 1.7 5.0 1 1 437 1 . . . . . 4.5 1.7 5.0 1 1 438 1 . . . . . 5.5 0.7 6.0 1 1 439 1 . . . . . 4.5 0.7 5.0 1 1 440 1 . . . . . 5.5 0.7 6.0 1 1 441 1 . . . . . 3.0 1.7 3.5 1 1 442 1 . . . . . 4.5 -0.3 5.0 1 1 443 1 . . . . . 4.5 0.7 5.0 1 1 444 1 . . . . . 4.5 0.7 5.0 1 1 445 1 . . . . . 5.5 0.7 6.0 1 1 446 1 . . . . . 5.5 0.7 6.0 1 1 447 1 . . . . . 5.5 -0.3 6.0 1 1 448 1 . . . . . 5.5 1.7 6.0 1 1 449 1 . . . . . 4.5 1.7 5.0 1 1 450 1 . . . . . 4.5 1.7 5.0 1 1 451 1 . . . . . 5.5 0.2 6.0 1 1 452 1 . . . . . 5.5 -0.7 6.0 1 1 453 1 . . . . . 4.5 1.7 5.0 1 1 454 1 . . . . . 5.5 -0.3 6.0 1 1 455 1 . . . . . 4.5 0.7 5.0 1 1 456 1 . . . . . 2.8 -1.7 4.3 1 1 457 1 . . . . . 5.5 -0.3 6.0 1 1 458 1 . . . . . 4.5 0.7 5.0 1 1 459 1 . . . . . 3.0 1.7 3.5 1 1 460 1 . . . . . 2.8 0.2 3.8 1 1 461 1 . . . . . 4.5 -1.7 6.0 1 1 462 1 . . . . . 4.5 -2.7 6.0 1 1 463 1 . . . . . 5.5 1.7 6.0 1 1 464 1 . . . . . 4.5 -1.7 6.0 1 1 465 1 . . . . . 4.5 1.7 5.0 1 1 466 1 . . . . . 3.0 1.7 3.5 1 1 467 1 . . . . . 4.5 0.7 5.0 1 1 468 1 . . . . . 4.5 -1.7 6.0 1 1 469 1 . . . . . 4.5 0.7 5.0 1 1 470 1 . . . . . 5.5 2.7 6.0 1 1 471 1 . . . . . 5.5 -0.3 6.0 1 1 472 1 . . . . . 5.5 -0.3 6.0 1 1 473 1 . . . . . 3.0 -1.5 4.5 1 1 474 1 . . . . . 5.5 -0.7 7.0 1 1 475 1 . . . . . 5.5 2.7 6.0 1 1 476 1 . . . . . 5.5 -0.7 7.0 1 1 477 1 . . . . . 5.5 1.7 7.5 1 1 478 1 . . . . . 5.5 -0.8 6.5 1 1 479 1 . . . . . 5.5 -1.7 7.0 1 1 480 1 . . . . . 4.5 -1.8 5.5 1 1 481 1 . . . . . 5.5 0.7 6.0 1 1 482 1 . . . . . 5.5 -1.7 7.0 1 1 483 1 . . . . . 4.5 -0.3 5.0 1 1 484 1 . . . . . 4.5 -0.3 5.0 1 1 485 1 . . . . . 4.5 0.7 5.0 1 1 486 1 . . . . . 5.5 -0.3 6.0 1 1 487 1 . . . . . 5.5 1.7 6.0 1 1 488 1 . . . . . 4.5 1.7 5.0 1 1 489 1 . . . . . 5.5 0.7 6.0 1 1 490 1 . . . . . 6.5 2.7 7.0 1 1 491 1 . . . . . 5.5 1.7 6.0 1 1 492 1 . . . . . 5.5 -0.3 6.0 1 1 493 1 . . . . . 4.5 -1.8 5.5 1 1 494 1 . . . . . 5.5 -0.3 6.0 1 1 495 1 . . . . . 4.5 1.7 5.0 1 1 496 1 . . . . . 4.5 0.7 5.0 1 1 497 1 . . . . . 2.2 -0.3 2.7 1 1 498 1 . . . . . 5.5 -0.3 6.0 1 1 499 1 . . . . . 5.5 -0.3 6.0 1 1 500 1 . . . . . 4.5 1.7 5.0 1 1 501 1 . . . . . 4.5 0.7 5.0 1 1 502 1 . . . . . 4.5 -0.3 5.0 1 1 503 1 . . . . . 4.5 -1.7 5.0 1 1 504 1 . . . . . 4.5 -0.8 5.5 1 1 505 1 . . . . . 4.5 1.7 6.0 1 1 506 1 . . . . . 4.5 -0.7 5.5 1 1 507 1 . . . . . 5.5 -0.7 6.5 1 1 508 1 . . . . . 5.5 1.7 6.0 1 1 509 1 . . . . . 3.0 1.7 3.5 1 1 510 1 . . . . . 2.8 0.7 3.3 1 1 511 1 . . . . . 4.5 -0.3 5.0 1 1 512 1 . . . . . 5.5 1.7 6.0 1 1 513 1 . . . . . 4.5 -0.3 5.0 1 1 514 1 . . . . . 4.5 1.7 5.0 1 1 515 1 . . . . . 5.5 0.7 6.0 1 1 516 1 . . . . . 5.5 0.7 6.0 1 1 517 1 . . . . . 4.5 0.7 5.0 1 1 518 1 . . . . . 5.5 1.7 6.0 1 1 519 1 . . . . . 5.5 1.7 6.0 1 1 520 1 . . . . . 4.5 -0.3 5.0 1 1 521 1 . . . . . 5.5 0.7 6.0 1 1 522 1 . . . . . 4.5 -1.7 5.5 1 1 523 1 . . . . . 4.5 1.7 6.0 1 1 524 1 . . . . . 5.5 -0.7 6.5 1 1 525 1 . . . . . 5.5 -0.7 6.5 1 1 526 1 . . . . . 4.5 -1.7 5.5 1 1 527 1 . . . . . 5.5 -0.7 6.5 1 1 528 1 . . . . . 4.5 -1.7 5.5 1 1 529 1 . . . . . 2.8 -0.7 4.3 1 1 530 1 . . . . . 4.5 -0.3 5.0 1 1 531 1 . . . . . 4.5 1.7 5.0 1 1 532 1 . . . . . 4.5 -0.3 5.0 1 1 533 1 . . . . . 4.5 0.7 5.0 1 1 534 1 . . . . . 4.5 1.7 5.0 1 1 535 1 . . . . . 5.5 -0.3 6.0 1 1 536 1 . . . . . 4.5 1.7 5.5 1 1 537 1 . . . . . 5.5 -1.3 6.0 1 1 538 1 . . . . . 5.5 -1.3 6.0 1 1 539 1 . . . . . 5.5 -1.3 6.0 1 1 540 1 . . . . . 4.5 -2.3 5.0 1 1 541 1 . . . . . 5.5 1.7 6.0 1 1 542 1 . . . . . 4.5 0.7 5.0 1 1 543 1 . . . . . 3.0 1.7 3.5 1 1 544 1 . . . . . 4.5 -0.3 5.0 1 1 545 1 . . . . . 3.5 1.7 4.0 1 1 546 1 . . . . . 4.5 1.7 5.0 1 1 547 1 . . . . . 4.5 -0.7 5.5 1 1 548 1 . . . . . 4.5 1.7 5.0 1 1 549 1 . . . . . 4.5 -1.7 5.5 1 1 550 1 . . . . . 4.5 0.7 5.0 1 1 551 1 . . . . . 6.5 -0.7 7.5 1 1 552 1 . . . . . 6.5 2.7 7.0 1 1 553 1 . . . . . 5.5 1.7 6.0 1 1 554 1 . . . . . 6.5 0.7 7.0 1 1 555 1 . . . . . 5.5 1.7 6.0 1 1 556 1 . . . . . 5.5 -1.7 6.5 1 1 557 1 . . . . . 5.5 -1.7 6.5 1 1 558 1 . . . . . 5.5 -0.7 6.5 1 1 559 1 . . . . . 5.5 1.7 6.5 1 1 560 1 . . . . . 4.5 1.7 5.0 1 1 561 1 . . . . . 4.5 -0.8 5.5 1 1 562 1 . . . . . 4.5 1.7 5.0 1 1 563 1 . . . . . 3.5 0.7 4.5 1 1 564 1 . . . . . 4.5 -1.8 5.5 1 1 565 1 . . . . . 4.5 1.7 5.0 1 1 566 1 . . . . . 3.0 1.7 3.5 1 1 567 1 . . . . . 3.0 1.7 3.5 1 1 568 1 . . . . . 4.5 1.7 5.0 1 1 569 1 . . . . . 6.5 2.7 7.0 1 1 570 1 . . . . . 4.5 1.7 5.0 1 1 571 1 . . . . . 5.5 0.7 6.0 1 1 572 1 . . . . . 5.5 1.7 6.5 1 1 573 1 . . . . . 5.5 -0.3 6.0 1 1 574 1 . . . . . 5.5 1.7 6.0 1 1 575 1 . . . . . 5.5 2.0 6.0 1 1 576 1 . . . . . 5.5 1.7 6.0 1 1 577 1 . . . . . 5.5 -0.3 6.0 1 1 578 1 . . . . . 5.5 0.7 6.0 1 1 579 1 . . . . . 5.5 1.7 6.0 1 1 580 1 . . . . . 4.5 -0.3 5.0 1 1 581 1 . . . . . 4.5 -0.3 5.0 1 1 582 1 . . . . . 5.5 1.7 6.0 1 1 583 1 . . . . . 5.5 0.7 6.0 1 1 584 1 . . . . . 5.5 0.7 6.0 1 1 585 1 . . . . . 5.5 0.7 6.0 1 1 586 1 . . . . . 4.5 1.7 5.0 1 1 587 1 . . . . . 4.5 1.7 5.0 1 1 588 1 . . . . . 4.5 0.7 5.0 1 1 589 1 . . . . . 4.5 -0.8 5.5 1 1 590 1 . . . . . 4.5 -1.8 5.5 1 1 591 1 . . . . . 3.0 1.7 3.5 1 1 592 1 . . . . . 5.5 2.7 6.0 1 1 593 1 . . . . . 4.5 -0.8 5.0 1 1 594 1 . . . . . 4.5 -0.3 5.0 1 1 595 1 . . . . . 4.5 -0.3 5.0 1 1 596 1 . . . . . 5.5 2.7 6.0 1 1 597 1 . . . . . 4.5 -0.3 5.0 1 1 598 1 . . . . . 5.5 0.7 6.0 1 1 599 1 . . . . . 5.5 -0.3 6.0 1 1 600 1 . . . . . 5.5 -0.3 6.0 1 1 601 1 . . . . . 5.5 -1.7 7.0 1 1 602 1 . . . . . 3.5 0.7 4.5 1 1 603 1 . . . . . 4.5 0.7 5.5 1 1 604 1 . . . . . 3.0 -0.7 4.5 1 1 605 1 . . . . . 2.2 -2.2 4.2 1 1 606 1 . . . . . 5.5 -0.8 6.5 1 1 607 1 . . . . . 3.0 0.4 3.5 1 1 608 1 . . . . . 5.5 -0.8 6.5 1 1 609 1 . . . . . 5.5 -0.8 6.5 1 1 610 1 . . . . . 5.5 -1.7 7.0 1 1 611 1 . . . . . 3.0 -2.0 5.0 1 1 612 1 . . . . . 4.5 1.7 5.0 1 1 613 1 . . . . . 5.5 1.7 6.0 1 1 614 1 . . . . . 4.5 -0.3 5.0 1 1 615 1 . . . . . 5.5 0.7 6.0 1 1 616 1 . . . . . 5.5 0.7 6.0 1 1 617 1 . . . . . 4.5 1.7 5.0 1 1 618 1 . . . . . 5.5 -0.3 6.0 1 1 619 1 . . . . . 5.5 -0.3 6.0 1 1 620 1 . . . . . 3.0 1.7 3.5 1 1 621 1 . . . . . 4.5 -0.3 5.0 1 1 622 1 . . . . . 5.5 0.7 6.0 1 1 623 1 . . . . . 4.5 1.7 5.0 1 1 624 1 . . . . . 4.5 1.7 5.0 1 1 625 1 . . . . . 4.5 1.7 5.0 1 1 626 1 . . . . . 5.5 1.7 6.0 1 1 627 1 . . . . . 5.5 1.7 6.0 1 1 628 1 . . . . . 5.0 0.2 5.5 1 1 629 1 . . . . . 5.0 -0.8 5.5 1 1 630 1 . . . . . 2.5 1.4 3.5 1 1 631 1 . . . . . 3.5 1.3 4.5 1 1 632 1 . . . . . 3.5 1.3 4.5 1 1 633 1 . . . . . 3.5 1.3 4.5 1 1 634 1 . . . . . 3.5 2.2 4.5 1 1 635 1 . . . . . 4.5 2.3 5.5 1 1 636 1 . . . . . 4.5 2.3 5.5 1 1 637 1 . . . . . 4.5 2.3 5.5 1 1 638 1 . . . . . 4.5 0.7 5.0 1 1 639 1 . . . . . 5.5 1.7 6.0 1 1 640 1 . . . . . 5.5 -0.7 7.0 1 1 641 1 . . . . . 4.5 0.7 5.0 1 1 642 1 . . . . . 5.5 -0.3 6.0 1 1 643 1 . . . . . 4.5 -0.3 5.0 1 1 644 1 . . . . . 4.5 -0.3 5.0 1 1 645 1 . . . . . 6.5 0.7 7.0 1 1 646 1 . . . . . 4.5 -1.3 5.0 1 1 647 1 . . . . . 5.5 -0.7 7.0 1 1 648 1 . . . . . 3.0 -0.7 4.5 1 1 649 1 . . . . . 5.5 1.7 6.0 1 1 650 1 . . . . . 4.5 -0.8 5.5 1 1 651 1 . . . . . 4.5 -1.8 5.5 1 1 652 1 . . . . . 5.5 1.7 6.5 1 1 653 1 . . . . . 5.5 -1.8 6.5 1 1 654 1 . . . . . 4.5 0.7 5.5 1 1 655 1 . . . . . 4.5 1.7 5.5 1 1 656 1 . . . . . 5.5 1.2 6.5 1 1 657 1 . . . . . 5.5 1.2 6.5 1 1 658 1 . . . . . 5.5 -1.8 6.5 1 1 659 1 . . . . . 5.5 0.2 6.5 1 1 660 1 . . . . . 5.5 0.2 6.5 1 1 661 1 . . . . . 3.0 -1.1 4.0 1 1 662 1 . . . . . 5.5 1.7 6.0 1 1 663 1 . . . . . 5.5 1.7 6.0 1 1 664 1 . . . . . 5.5 1.7 6.0 1 1 665 1 . . . . . 4.5 -2.7 5.5 1 1 666 1 . . . . . 4.5 -0.3 5.0 1 1 667 1 . . . . . 5.5 -0.3 6.0 1 1 668 1 . . . . . 4.5 -1.3 5.0 1 1 669 1 . . . . . 5.5 -1.7 6.5 1 1 670 1 . . . . . 5.5 -1.7 6.5 1 1 671 1 . . . . . 5.5 0.3 6.5 1 1 672 1 . . . . . 5.5 -0.7 6.5 1 1 673 1 . . . . . 3.0 -1.9 4.0 1 1 674 1 . . . . . 5.5 -2.7 6.5 1 1 675 1 . . . . . 5.5 -1.7 6.5 1 1 676 1 . . . . . 5.5 -1.7 6.5 1 1 677 1 . . . . . 5.5 -1.7 6.5 1 1 678 1 . . . . . 4.5 -0.7 5.5 1 1 679 1 . . . . . 3.0 -2.0 4.5 1 1 680 1 . . . . . 4.5 -0.5 5.5 1 1 681 1 . . . . . 4.5 0.7 5.0 1 1 682 1 . . . . . 5.5 -0.7 6.5 1 1 683 1 . . . . . 4.5 -0.7 5.5 1 1 684 1 . . . . . 4.5 -0.3 5.0 1 1 685 1 . . . . . 5.5 -0.3 6.0 1 1 686 1 . . . . . 5.5 0.7 6.0 1 1 687 1 . . . . . 4.5 0.7 5.0 1 1 688 1 . . . . . 5.5 1.7 6.0 1 1 689 1 . . . . . 4.5 -1.7 5.5 1 1 690 1 . . . . . 4.5 1.7 5.0 1 1 691 1 . . . . . 4.5 0.7 5.0 1 1 692 1 . . . . . 4.5 0.7 5.0 1 1 693 1 . . . . . 4.5 0.7 5.0 1 1 694 1 . . . . . 4.5 -2.7 6.0 1 1 695 1 . . . . . 5.5 0.7 6.0 1 1 696 1 . . . . . 4.5 -1.7 6.0 1 1 697 1 . . . . . 4.5 -0.3 5.0 1 1 698 1 . . . . . 5.5 1.7 6.0 1 1 699 1 . . . . . 4.5 0.7 5.0 1 1 700 1 . . . . . 5.5 -0.8 6.5 1 1 701 1 . . . . . 6.5 0.7 7.0 1 1 702 1 . . . . . 6.5 1.7 7.0 1 1 703 1 . . . . . 5.5 -1.7 7.0 1 1 704 1 . . . . . 4.5 1.7 5.0 1 1 705 1 . . . . . 5.5 0.2 6.5 1 1 706 1 . . . . . 5.5 0.2 6.5 1 1 707 1 . . . . . 4.5 -1.8 5.5 1 1 708 1 . . . . . 4.5 0.9 5.5 1 1 709 1 . . . . . 4.5 -0.8 5.5 1 1 710 1 . . . . . 4.5 0.2 5.5 1 1 711 1 . . . . . 5.5 -1.3 7.0 1 1 712 1 . . . . . 5.5 -0.8 6.5 1 1 713 1 . . . . . 3.0 -0.6 4.0 1 1 714 1 . . . . . 5.5 1.7 6.0 1 1 715 1 . . . . . 5.5 -0.3 6.0 1 1 716 1 . . . . . 4.5 -1.3 5.0 1 1 717 1 . . . . . 5.5 -0.3 6.0 1 1 718 1 . . . . . 4.5 -0.3 5.0 1 1 719 1 . . . . . 4.5 0.7 5.0 1 1 720 1 . . . . . 4.5 0.7 5.0 1 1 721 1 . . . . . 6.5 1.2 7.0 1 1 722 1 . . . . . 5.5 0.2 6.5 1 1 723 1 . . . . . 5.5 -0.3 6.0 1 1 724 1 . . . . . 5.5 1.7 6.0 1 1 725 1 . . . . . 5.5 0.7 6.0 1 1 726 1 . . . . . 5.5 1.7 6.5 1 1 727 1 . . . . . 5.5 -2.7 6.5 1 1 728 1 . . . . . 5.5 2.7 6.5 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_8_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 174 1 . . . 1 2 175 1 . . . 1 2 176 1 . . . 1 2 177 1 . . . 1 2 178 1 . . . 1 2 179 1 . . . 1 2 180 1 . . . 1 2 181 1 . . . 1 2 182 1 . . . 1 2 183 1 . . . 1 2 184 1 . . . 1 2 185 1 . . . 1 2 186 1 . . . 1 2 187 1 . . . 1 2 188 1 . . . 1 2 189 1 . . . 1 2 190 1 . . . 1 2 191 1 . . . 1 2 192 1 . . . 1 2 193 1 . . . 1 2 194 1 . . . 1 2 195 1 . . . 1 2 196 1 . . . 1 2 197 1 . . . 1 2 198 1 . . . 1 2 199 1 . . . 1 2 200 1 . . . 1 2 201 1 . . . 1 2 202 1 . . . 1 2 203 1 . . . 1 2 204 1 . . . 1 2 205 1 . . . 1 2 206 1 . . . 1 2 207 1 . . . 1 2 208 1 . . . 1 2 209 1 . . . 1 2 210 1 . . . 1 2 211 1 . . . 1 2 212 1 . . . 1 2 213 1 . . . 1 2 214 1 . . . 1 2 215 1 . . . 1 2 216 1 . . . 1 2 217 1 . . . 1 2 218 1 . . . 1 2 219 1 . . . 1 2 220 1 . . . 1 2 221 1 . . . 1 2 222 1 . . . 1 2 223 1 . . . 1 2 224 1 . . . 1 2 225 1 . . . 1 2 226 1 . . . 1 2 227 1 . . . 1 2 228 1 . . . 1 2 229 1 . . . 1 2 230 1 . . . 1 2 231 1 . . . 1 2 232 1 . . . 1 2 233 1 . . . 1 2 234 1 . . . 1 2 235 1 . . . 1 2 236 1 . . . 1 2 237 1 . . . 1 2 238 1 . . . 1 2 239 1 . . . 1 2 240 1 . . . 1 2 241 1 . . . 1 2 242 1 . . . 1 2 243 1 . . . 1 2 244 1 . . . 1 2 245 1 . . . 1 2 246 1 . . . 1 2 247 1 . . . 1 2 248 1 . . . 1 2 249 1 . . . 1 2 250 1 . . . 1 2 251 1 . . . 1 2 252 1 . . . 1 2 253 1 . . . 1 2 254 1 . . . 1 2 255 1 . . . 1 2 256 1 . . . 1 2 257 1 . . . 1 2 258 1 . . . 1 2 259 1 . . . 1 2 260 1 . . . 1 2 261 1 . . . 1 2 262 1 . . . 1 2 263 1 . . . 1 2 264 1 . . . 1 2 265 1 . . . 1 2 266 1 . . . 1 2 267 1 . . . 1 2 268 1 . . . 1 2 269 1 . . . 1 2 270 1 . . . 1 2 271 1 . . . 1 2 272 1 . . . 1 2 273 1 . . . 1 2 274 1 . . . 1 2 275 1 . . . 1 2 276 1 . . . 1 2 277 1 . . . 1 2 278 1 . . . 1 2 279 1 . . . 1 2 280 1 . . . 1 2 281 1 . . . 1 2 282 1 . . . 1 2 283 1 . . . 1 2 284 1 . . . 1 2 285 1 . . . 1 2 286 1 . . . 1 2 287 1 . . . 1 2 288 1 . . . 1 2 289 1 . . . 1 2 290 1 . . . 1 2 291 1 . . . 1 2 292 1 . . . 1 2 293 1 . . . 1 2 294 1 . . . 1 2 295 1 . . . 1 2 296 1 . . . 1 2 297 1 . . . 1 2 298 1 . . . 1 2 299 1 . . . 1 2 300 1 . . . 1 2 301 1 . . . 1 2 302 1 . . . 1 2 303 1 . . . 1 2 304 1 . . . 1 2 305 1 . . . 1 2 306 1 . . . 1 2 307 1 . . . 1 2 308 1 . . . 1 2 309 1 . . . 1 2 310 1 . . . 1 2 311 1 . . . 1 2 312 1 . . . 1 2 313 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 DG H2'' . 201 . H2'' 1 2 1 1 2 1 1 1 DG H5' . 201 . H5' 1 2 2 1 1 1 1 1 DG H4' . 201 . H4' 1 2 2 1 2 1 1 1 DG H5' . 201 . H5' 1 2 3 1 1 1 1 1 DG H3' . 201 . H3' 1 2 3 1 2 1 1 1 DG H5' . 201 . H5' 1 2 4 1 1 1 1 1 DG H1' . 201 . H1' 1 2 4 1 2 1 1 1 DG H3' . 201 . H3' 1 2 5 1 1 1 1 1 DG H2' . 201 . H2' 1 2 5 1 2 1 1 1 DG H3' . 201 . H3' 1 2 6 1 1 1 1 1 DG H2'' . 201 . H2'' 1 2 6 1 2 1 1 1 DG H3' . 201 . H3' 1 2 7 1 1 1 1 1 DG H1' . 201 . H1' 1 2 7 1 2 1 1 1 DG H2' . 201 . H2' 1 2 8 1 1 1 1 1 DG H2' . 201 . H2' 1 2 8 1 2 1 1 2 DC H1' . 202 . H1' 1 2 9 1 1 1 1 1 DG H2' . 201 . H2' 1 2 9 1 2 1 1 2 DC H5 . 202 . H5 1 2 10 1 1 1 1 1 DG H1' . 201 . H1' 1 2 10 1 2 1 1 2 DC H6 . 202 . H6 1 2 11 1 1 1 1 1 DG H2' . 201 . H2' 1 2 11 1 2 1 1 2 DC H6 . 202 . H6 1 2 12 1 1 1 1 1 DG H2'' . 201 . H2'' 1 2 12 1 2 1 1 2 DC H6 . 202 . H6 1 2 13 1 1 1 1 1 DG H2' . 201 . H2' 1 2 13 1 2 1 1 1 DG H4' . 201 . H4' 1 2 14 1 1 1 1 1 DG H2'' . 201 . H2'' 1 2 14 1 2 1 1 1 DG H8 . 201 . H8 1 2 15 1 1 1 1 1 DG H2' . 201 . H2' 1 2 15 1 2 1 1 1 DG H8 . 201 . H8 1 2 16 1 1 1 1 1 DG H1' . 201 . H1' 1 2 16 1 2 1 1 1 DG H2'' . 201 . H2'' 1 2 17 1 1 1 1 1 DG H1' . 201 . H1' 1 2 17 1 2 1 1 1 DG H8 . 201 . H8 1 2 18 1 1 1 1 1 DG H3' . 201 . H3' 1 2 18 1 2 1 1 1 DG H8 . 201 . H8 1 2 19 1 1 1 1 1 DG H4' . 201 . H4' 1 2 19 1 2 1 1 1 DG H8 . 201 . H8 1 2 20 1 1 1 1 1 DG H2' . 201 . H2' 1 2 20 1 2 1 1 1 DG H5' . 201 . H5' 1 2 21 1 1 1 1 1 DG H1' . 201 . H1' 1 2 21 1 2 1 1 2 DC H5 . 202 . H5 1 2 22 1 1 1 1 1 DG H8 . 201 . H8 1 2 22 1 2 1 1 2 DC H6 . 202 . H6 1 2 23 1 1 1 1 1 DG H3' . 201 . H3' 1 2 23 1 2 1 1 1 DG H4' . 201 . H4' 1 2 24 1 1 1 1 2 DC H3' . 202 . H3' 1 2 24 1 2 1 1 2 DC H4' . 202 . H4' 1 2 25 1 1 1 1 2 DC H1' . 202 . H1' 1 2 25 1 2 1 1 2 DC H3' . 202 . H3' 1 2 26 1 1 1 1 2 DC H1' . 202 . H1' 1 2 26 1 2 1 1 2 DC H4' . 202 . H4' 1 2 27 1 1 1 1 2 DC H2'' . 202 . H2'' 1 2 27 1 2 1 1 2 DC H3' . 202 . H3' 1 2 28 1 1 1 1 2 DC H5 . 202 . H5 1 2 28 1 2 1 1 2 DC H6 . 202 . H6 1 2 29 1 1 1 1 2 DC H1' . 202 . H1' 1 2 29 1 2 1 1 2 DC H2'' . 202 . H2'' 1 2 30 1 1 1 1 2 DC H1' . 202 . H1' 1 2 30 1 2 1 1 2 DC H2' . 202 . H2' 1 2 31 1 1 1 1 2 DC H3' . 202 . H3' 1 2 31 1 2 1 1 2 DC H6 . 202 . H6 1 2 32 1 1 1 1 2 DC H2' . 202 . H2' 1 2 32 1 2 1 1 2 DC H6 . 202 . H6 1 2 33 1 1 1 1 2 DC H2'' . 202 . H2'' 1 2 33 1 2 1 1 2 DC H6 . 202 . H6 1 2 34 1 1 1 1 2 DC H2'' . 202 . H2'' 1 2 34 1 2 1 1 3 DA H8 . 203 . H8 1 2 35 1 1 1 1 2 DC H2'' . 202 . H2'' 1 2 35 1 2 1 1 2 DC H4' . 202 . H4' 1 2 36 1 1 1 1 2 DC H2' . 202 . H2' 1 2 36 1 2 1 1 2 DC H3' . 202 . H3' 1 2 37 1 1 1 1 2 DC H2' . 202 . H2' 1 2 37 1 2 1 1 2 DC H5 . 202 . H5 1 2 38 1 1 1 1 2 DC H4' . 202 . H4' 1 2 38 1 2 1 1 2 DC H6 . 202 . H6 1 2 39 1 1 1 1 2 DC H2' . 202 . H2' 1 2 39 1 2 1 1 3 DA H8 . 203 . H8 1 2 40 1 1 1 1 2 DC H3' . 202 . H3' 1 2 40 1 2 1 1 3 DA H8 . 203 . H8 1 2 41 1 1 1 1 2 DC H6 . 202 . H6 1 2 41 1 2 1 1 3 DA H8 . 203 . H8 1 2 42 1 1 1 1 3 DA H3' . 203 . H3' 1 2 42 1 2 1 1 3 DA H5'' . 203 . H5'' 1 2 43 1 1 1 1 3 DA H3' . 203 . H3' 1 2 43 1 2 1 1 3 DA H5' . 203 . H5' 1 2 44 1 1 1 1 3 DA H3' . 203 . H3' 1 2 44 1 2 1 1 3 DA H4' . 203 . H4' 1 2 45 1 1 1 1 3 DA H1' . 203 . H1' 1 2 45 1 2 1 1 3 DA H3' . 203 . H3' 1 2 46 1 1 1 1 3 DA H1' . 203 . H1' 1 2 46 1 2 1 1 3 DA H4' . 203 . H4' 1 2 47 1 1 1 1 3 DA H2' . 203 . H2' 1 2 47 1 2 1 1 3 DA H3' . 203 . H3' 1 2 48 1 1 1 1 3 DA H2'' . 203 . H2'' 1 2 48 1 2 1 1 3 DA H3' . 203 . H3' 1 2 49 1 1 1 1 3 DA H1' . 203 . H1' 1 2 49 1 2 1 1 3 DA H2' . 203 . H2' 1 2 50 1 1 1 1 3 DA H1' . 203 . H1' 1 2 50 1 2 1 1 3 DA H2'' . 203 . H2'' 1 2 51 1 1 1 1 3 DA H1' . 203 . H1' 1 2 51 1 2 1 1 3 DA H8 . 203 . H8 1 2 52 1 1 1 1 3 DA H3' . 203 . H3' 1 2 52 1 2 1 1 3 DA H8 . 203 . H8 1 2 53 1 1 1 1 3 DA H2' . 203 . H2' 1 2 53 1 2 1 1 3 DA H8 . 203 . H8 1 2 54 1 1 1 1 3 DA H2'' . 203 . H2'' 1 2 54 1 2 1 1 3 DA H8 . 203 . H8 1 2 55 1 1 1 1 3 DA H4' . 203 . H4' 1 2 55 1 2 1 1 3 DA H8 . 203 . H8 1 2 56 1 1 1 1 3 DA H2'' . 203 . H2'' 1 2 56 1 2 1 1 4 DC H6 . 204 . H6 1 2 57 1 1 1 1 3 DA H8 . 203 . H8 1 2 57 1 2 1 1 4 DC H5 . 204 . H5 1 2 58 1 1 1 1 3 DA H3' . 203 . H3' 1 2 58 1 2 1 1 4 DC H5 . 204 . H5 1 2 59 1 1 1 1 3 DA H3' . 203 . H3' 1 2 59 1 2 1 1 4 DC H6 . 204 . H6 1 2 60 1 1 1 1 3 DA H2' . 203 . H2' 1 2 60 1 2 1 1 4 DC H5 . 204 . H5 1 2 61 1 1 1 1 3 DA H1' . 203 . H1' 1 2 61 1 2 1 1 4 DC H6 . 204 . H6 1 2 62 1 1 1 1 3 DA H8 . 203 . H8 1 2 62 1 2 1 1 4 DC H6 . 204 . H6 1 2 63 1 1 1 1 4 DC H3' . 204 . H3' 1 2 63 1 2 1 1 4 DC H4' . 204 . H4' 1 2 64 1 1 1 1 4 DC H1' . 204 . H1' 1 2 64 1 2 1 1 4 DC H4' . 204 . H4' 1 2 65 1 1 1 1 4 DC H2' . 204 . H2' 1 2 65 1 2 1 1 4 DC H3' . 204 . H3' 1 2 66 1 1 1 1 4 DC H5 . 204 . H5 1 2 66 1 2 1 1 4 DC H6 . 204 . H6 1 2 67 1 1 1 1 4 DC H2'' . 204 . H2'' 1 2 67 1 2 1 1 4 DC H3' . 204 . H3' 1 2 68 1 1 1 1 4 DC H1' . 204 . H1' 1 2 68 1 2 1 1 4 DC H2'' . 204 . H2'' 1 2 69 1 1 1 1 4 DC H2'' . 204 . H2'' 1 2 69 1 2 1 1 4 DC H6 . 204 . H6 1 2 70 1 1 1 1 4 DC H2'' . 204 . H2'' 1 2 70 1 2 1 1 5 DA H8 . 205 . H8 1 2 71 1 1 1 1 4 DC H3' . 204 . H3' 1 2 71 1 2 1 1 4 DC H5 . 204 . H5 1 2 72 1 1 1 1 4 DC H1' . 204 . H1' 1 2 72 1 2 1 1 4 DC H5 . 204 . H5 1 2 73 1 1 1 1 4 DC H1' . 204 . H1' 1 2 73 1 2 1 1 4 DC H3' . 204 . H3' 1 2 74 1 1 1 1 4 DC H1' . 204 . H1' 1 2 74 1 2 1 1 4 DC H2' . 204 . H2' 1 2 75 1 1 1 1 4 DC H2' . 204 . H2' 1 2 75 1 2 1 1 4 DC H5 . 204 . H5 1 2 76 1 1 1 1 4 DC H3' . 204 . H3' 1 2 76 1 2 1 1 4 DC H6 . 204 . H6 1 2 77 1 1 1 1 4 DC H1' . 204 . H1' 1 2 77 1 2 1 1 4 DC H6 . 204 . H6 1 2 78 1 1 1 1 4 DC H3' . 204 . H3' 1 2 78 1 2 1 1 5 DA H8 . 205 . H8 1 2 79 1 1 1 1 4 DC H1' . 204 . H1' 1 2 79 1 2 1 1 5 DA H8 . 205 . H8 1 2 80 1 1 1 1 4 DC H6 . 204 . H6 1 2 80 1 2 1 1 5 DA H8 . 205 . H8 1 2 81 1 1 1 1 5 DA H2' . 205 . H2' 1 2 81 1 2 1 1 5 DA H2'' . 205 . H2'' 1 2 82 1 1 1 1 5 DA H1' . 205 . H1' 1 2 82 1 2 1 1 5 DA H4' . 205 . H4' 1 2 83 1 1 1 1 5 DA H2' . 205 . H2' 1 2 83 1 2 1 1 5 DA H3' . 205 . H3' 1 2 84 1 1 1 1 5 DA H2'' . 205 . H2'' 1 2 84 1 2 1 1 5 DA H3' . 205 . H3' 1 2 85 1 1 1 1 5 DA H1' . 205 . H1' 1 2 85 1 2 1 1 5 DA H2'' . 205 . H2'' 1 2 86 1 1 1 1 5 DA H1' . 205 . H1' 1 2 86 1 2 1 1 5 DA H2' . 205 . H2' 1 2 87 1 1 1 1 5 DA H1' . 205 . H1' 1 2 87 1 2 1 1 5 DA H2 . 205 . H2 1 2 88 1 1 1 1 5 DA H3' . 205 . H3' 1 2 88 1 2 1 1 5 DA H8 . 205 . H8 1 2 89 1 1 1 1 5 DA H2'' . 205 . H2'' 1 2 89 1 2 1 1 5 DA H8 . 205 . H8 1 2 90 1 1 1 1 5 DA H2' . 205 . H2' 1 2 90 1 2 1 1 5 DA H8 . 205 . H8 1 2 91 1 1 1 1 5 DA H1' . 205 . H1' 1 2 91 1 2 1 1 5 DA H3' . 205 . H3' 1 2 92 1 1 1 1 5 DA H4' . 205 . H4' 1 2 92 1 2 1 1 5 DA H8 . 205 . H8 1 2 93 1 1 1 1 5 DA H1' . 205 . H1' 1 2 93 1 2 1 1 5 DA H8 . 205 . H8 1 2 94 1 1 1 1 5 DA H1' . 205 . H1' 1 2 94 1 2 1 1 6 DA H5'' . 206 . H5'' 1 2 95 1 1 1 1 6 DA H1' . 206 . H1' 1 2 95 1 2 1 1 6 DA H3' . 206 . H3' 1 2 96 1 1 1 1 6 DA H1' . 206 . H1' 1 2 96 1 2 1 1 6 DA H4' . 206 . H4' 1 2 97 1 1 1 1 6 DA H1' . 206 . H1' 1 2 97 1 2 1 1 6 DA H5' . 206 . H5' 1 2 98 1 1 1 1 6 DA H2' . 206 . H2' 1 2 98 1 2 1 1 6 DA H3' . 206 . H3' 1 2 99 1 1 1 1 6 DA H2'' . 206 . H2'' 1 2 99 1 2 1 1 6 DA H3' . 206 . H3' 1 2 100 1 1 1 1 6 DA H1' . 206 . H1' 1 2 100 1 2 1 1 6 DA H2'' . 206 . H2'' 1 2 101 1 1 1 1 6 DA H1' . 206 . H1' 1 2 101 1 2 1 1 6 DA H2' . 206 . H2' 1 2 102 1 1 1 1 6 DA H1' . 206 . H1' 1 2 102 1 2 1 1 6 DA H8 . 206 . H8 1 2 103 1 1 1 1 6 DA H3' . 206 . H3' 1 2 103 1 2 1 1 6 DA H8 . 206 . H8 1 2 104 1 1 1 1 6 DA H2'' . 206 . H2'' 1 2 104 1 2 1 1 6 DA H8 . 206 . H8 1 2 105 1 1 1 1 6 DA H2' . 206 . H2' 1 2 105 1 2 1 1 6 DA H8 . 206 . H8 1 2 106 1 1 1 1 6 DA H3' . 206 . H3' 1 2 106 1 2 1 1 6 DA H4' . 206 . H4' 1 2 107 1 1 1 1 6 DA H1' . 206 . H1' 1 2 107 1 2 1 1 6 DA H2 . 206 . H2 1 2 108 1 1 1 1 6 DA H4' . 206 . H4' 1 2 108 1 2 1 1 6 DA H8 . 206 . H8 1 2 109 1 1 1 1 6 DA H2' . 206 . H2' 1 2 109 1 2 1 1 7 DA H3' . 207 . H3' 1 2 110 1 1 1 1 6 DA H2'' . 206 . H2'' 1 2 110 1 2 1 1 7 DA H8 . 207 . H8 1 2 111 1 1 1 1 6 DA H1' . 206 . H1' 1 2 111 1 2 1 1 7 DA H8 . 207 . H8 1 2 112 1 1 1 1 6 DA H8 . 206 . H8 1 2 112 1 2 1 1 7 DA H8 . 207 . H8 1 2 113 1 1 1 1 7 DA H3' . 207 . H3' 1 2 113 1 2 1 1 7 DA H5' . 207 . H5' 1 2 114 1 1 1 1 7 DA H1' . 207 . H1' 1 2 114 1 2 1 1 7 DA H3' . 207 . H3' 1 2 115 1 1 1 1 7 DA H1' . 207 . H1' 1 2 115 1 2 1 1 7 DA H5' . 207 . H5' 1 2 116 1 1 1 1 7 DA H2' . 207 . H2' 1 2 116 1 2 1 1 7 DA H3' . 207 . H3' 1 2 117 1 1 1 1 7 DA H1' . 207 . H1' 1 2 117 1 2 1 1 7 DA H2'' . 207 . H2'' 1 2 118 1 1 1 1 7 DA H3' . 207 . H3' 1 2 118 1 2 1 1 7 DA H8 . 207 . H8 1 2 119 1 1 1 1 7 DA H2' . 207 . H2' 1 2 119 1 2 1 1 7 DA H8 . 207 . H8 1 2 120 1 1 1 1 7 DA H2' . 207 . H2' 1 2 120 1 2 1 1 8 DC H5 . 208 . H5 1 2 121 1 1 1 1 7 DA H3' . 207 . H3' 1 2 121 1 2 1 1 8 DC H6 . 208 . H6 1 2 122 1 1 1 1 7 DA H1' . 207 . H1' 1 2 122 1 2 1 1 7 DA H2 . 207 . H2 1 2 123 1 1 1 1 7 DA H2'' . 207 . H2'' 1 2 123 1 2 1 1 7 DA H8 . 207 . H8 1 2 124 1 1 1 1 7 DA H1' . 207 . H1' 1 2 124 1 2 1 1 7 DA H8 . 207 . H8 1 2 125 1 1 1 1 7 DA H2 . 207 . H2 1 2 125 1 2 1 1 8 DC H1' . 208 . H1' 1 2 126 1 1 1 1 7 DA H2'' . 207 . H2'' 1 2 126 1 2 1 1 8 DC H2' . 208 . H2' 1 2 127 1 1 1 1 7 DA H3' . 207 . H3' 1 2 127 1 2 1 1 8 DC H5 . 208 . H5 1 2 128 1 1 1 1 7 DA H2'' . 207 . H2'' 1 2 128 1 2 1 1 8 DC H6 . 208 . H6 1 2 129 1 1 1 1 7 DA H1' . 207 . H1' 1 2 129 1 2 1 1 8 DC H6 . 208 . H6 1 2 130 1 1 1 1 7 DA H8 . 207 . H8 1 2 130 1 2 1 1 8 DC H5 . 208 . H5 1 2 131 1 1 1 1 7 DA H2' . 207 . H2' 1 2 131 1 2 1 1 7 DA H5' . 207 . H5' 1 2 132 1 1 1 1 7 DA H8 . 207 . H8 1 2 132 1 2 1 1 8 DC H6 . 208 . H6 1 2 133 1 1 1 1 8 DC H1' . 208 . H1' 1 2 133 1 2 1 1 8 DC H5' . 208 . H5' 1 2 134 1 1 1 1 8 DC H1' . 208 . H1' 1 2 134 1 2 1 1 8 DC H3' . 208 . H3' 1 2 135 1 1 1 1 8 DC H2' . 208 . H2' 1 2 135 1 2 1 1 8 DC H3' . 208 . H3' 1 2 136 1 1 1 1 8 DC H2'' . 208 . H2'' 1 2 136 1 2 1 1 8 DC H3' . 208 . H3' 1 2 137 1 1 1 1 8 DC H5 . 208 . H5 1 2 137 1 2 1 1 8 DC H6 . 208 . H6 1 2 138 1 1 1 1 8 DC H1' . 208 . H1' 1 2 138 1 2 1 1 8 DC H2' . 208 . H2' 1 2 139 1 1 1 1 8 DC H1' . 208 . H1' 1 2 139 1 2 1 1 8 DC H2'' . 208 . H2'' 1 2 140 1 1 1 1 8 DC H1' . 208 . H1' 1 2 140 1 2 1 1 8 DC H6 . 208 . H6 1 2 141 1 1 1 1 8 DC H3' . 208 . H3' 1 2 141 1 2 1 1 8 DC H6 . 208 . H6 1 2 142 1 1 1 1 8 DC H2' . 208 . H2' 1 2 142 1 2 1 1 8 DC H6 . 208 . H6 1 2 143 1 1 1 1 8 DC H2'' . 208 . H2'' 1 2 143 1 2 1 1 8 DC H6 . 208 . H6 1 2 144 1 1 1 1 8 DC H3' . 208 . H3' 1 2 144 1 2 1 1 8 DC H4' . 208 . H4' 1 2 145 1 1 1 1 8 DC H3' . 208 . H3' 1 2 145 1 2 1 1 8 DC H5 . 208 . H5 1 2 146 1 1 1 1 8 DC H1' . 208 . H1' 1 2 146 1 2 1 1 8 DC H4' . 208 . H4' 1 2 147 1 1 1 1 8 DC H2' . 208 . H2' 1 2 147 1 2 1 1 8 DC H5 . 208 . H5 1 2 148 1 1 1 1 8 DC H4' . 208 . H4' 1 2 148 1 2 1 1 8 DC H6 . 208 . H6 1 2 149 1 1 1 1 8 DC H2' . 208 . H2' 1 2 149 1 2 1 1 8 DC H5' . 208 . H5' 1 2 150 1 1 1 1 8 DC H2'' . 208 . H2'' 1 2 150 1 2 1 1 8 DC H5' . 208 . H5' 1 2 151 1 1 1 1 8 DC H3' . 208 . H3' 1 2 151 1 2 1 1 8 DC H5' . 208 . H5' 1 2 152 1 1 2 2 1 DG H3' . 209 . H3' 1 2 152 1 2 2 2 1 DG H5' . 209 . H5' 1 2 153 1 1 2 2 1 DG H1' . 209 . H1' 1 2 153 1 2 2 2 1 DG H3' . 209 . H3' 1 2 154 1 1 2 2 1 DG H1' . 209 . H1' 1 2 154 1 2 2 2 1 DG H4' . 209 . H4' 1 2 155 1 1 2 2 1 DG H2'' . 209 . H2'' 1 2 155 1 2 2 2 1 DG H4' . 209 . H4' 1 2 156 1 1 2 2 1 DG H2' . 209 . H2' 1 2 156 1 2 2 2 1 DG H3' . 209 . H3' 1 2 157 1 1 2 2 1 DG H2' . 209 . H2' 1 2 157 1 2 2 2 2 DT M7 . 210 . H5# 1 2 158 1 1 2 2 1 DG H3' . 209 . H3' 1 2 158 1 2 2 2 2 DT M7 . 210 . H5# 1 2 159 1 1 2 2 1 DG H1' . 209 . H1' 1 2 159 1 2 2 2 2 DT H6 . 210 . H6 1 2 160 1 1 2 2 1 DG H2' . 209 . H2' 1 2 160 1 2 2 2 2 DT H6 . 210 . H6 1 2 161 1 1 2 2 1 DG H2' . 209 . H2' 1 2 161 1 2 2 2 1 DG H4' . 209 . H4' 1 2 162 1 1 2 2 1 DG H3' . 209 . H3' 1 2 162 1 2 2 2 1 DG H4' . 209 . H4' 1 2 163 1 1 2 2 1 DG H2'' . 209 . H2'' 1 2 163 1 2 2 2 1 DG H8 . 209 . H8 1 2 164 1 1 2 2 1 DG H1' . 209 . H1' 1 2 164 1 2 2 2 1 DG H2'' . 209 . H2'' 1 2 165 1 1 2 2 1 DG H4' . 209 . H4' 1 2 165 1 2 2 2 1 DG H8 . 209 . H8 1 2 166 1 1 2 2 1 DG H3' . 209 . H3' 1 2 166 1 2 2 2 1 DG H8 . 209 . H8 1 2 167 1 1 2 2 1 DG H1' . 209 . H1' 1 2 167 1 2 2 2 1 DG H8 . 209 . H8 1 2 168 1 1 2 2 1 DG H2' . 209 . H2' 1 2 168 1 2 2 2 2 DT H3' . 210 . H3' 1 2 169 1 1 2 2 1 DG H2'' . 209 . H2'' 1 2 169 1 2 2 2 2 DT H6 . 210 . H6 1 2 170 1 1 2 2 1 DG H8 . 209 . H8 1 2 170 1 2 2 2 2 DT M7 . 210 . H5# 1 2 171 1 1 2 2 2 DT H1' . 210 . H1' 1 2 171 1 2 2 2 2 DT H5' . 210 . H5' 1 2 172 1 1 2 2 2 DT H3' . 210 . H3' 1 2 172 1 2 2 2 2 DT M7 . 210 . H5# 1 2 173 1 1 2 2 2 DT H2'' . 210 . H2'' 1 2 173 1 2 2 2 2 DT H3' . 210 . H3' 1 2 174 1 1 2 2 2 DT H1' . 210 . H1' 1 2 174 1 2 2 2 2 DT H2'' . 210 . H2'' 1 2 175 1 1 2 2 2 DT H1' . 210 . H1' 1 2 175 1 2 2 2 2 DT H2' . 210 . H2' 1 2 176 1 1 2 2 2 DT H1' . 210 . H1' 1 2 176 1 2 2 2 2 DT H6 . 210 . H6 1 2 177 1 1 2 2 2 DT H3' . 210 . H3' 1 2 177 1 2 2 2 2 DT H6 . 210 . H6 1 2 178 1 1 2 2 2 DT H4' . 210 . H4' 1 2 178 1 2 2 2 2 DT H6 . 210 . H6 1 2 179 1 1 2 2 2 DT H2'' . 210 . H2'' 1 2 179 1 2 2 2 2 DT H6 . 210 . H6 1 2 180 1 1 2 2 2 DT H6 . 210 . H6 1 2 180 1 2 2 2 2 DT M7 . 210 . H5# 1 2 181 1 1 2 2 2 DT H3' . 210 . H3' 1 2 181 1 2 2 2 3 DT M7 . 211 . H5# 1 2 182 1 1 2 2 2 DT H6 . 210 . H6 1 2 182 1 2 2 2 3 DT M7 . 211 . H5# 1 2 183 1 1 2 2 2 DT H2' . 210 . H2' 1 2 183 1 2 2 2 3 DT H6 . 211 . H6 1 2 184 1 1 2 2 2 DT H1' . 210 . H1' 1 2 184 1 2 2 2 2 DT H3' . 210 . H3' 1 2 185 1 1 2 2 2 DT H2' . 210 . H2' 1 2 185 1 2 2 2 2 DT H6 . 210 . H6 1 2 186 1 1 2 2 2 DT H2' . 210 . H2' 1 2 186 1 2 2 2 3 DT M7 . 211 . H5# 1 2 187 1 1 2 2 2 DT M7 . 210 . H5# 1 2 187 1 2 2 2 3 DT M7 . 211 . H5# 1 2 188 1 1 2 2 2 DT H1' . 210 . H1' 1 2 188 1 2 2 2 3 DT H6 . 211 . H6 1 2 189 1 1 2 2 3 DT H1' . 211 . H1' 1 2 189 1 2 2 2 3 DT H2'' . 211 . H2'' 1 2 190 1 1 2 2 3 DT H1' . 211 . H1' 1 2 190 1 2 2 2 3 DT H2' . 211 . H2' 1 2 191 1 1 2 2 3 DT H3' . 211 . H3' 1 2 191 1 2 2 2 3 DT H6 . 211 . H6 1 2 192 1 1 2 2 3 DT H6 . 211 . H6 1 2 192 1 2 2 2 3 DT M7 . 211 . H5# 1 2 193 1 1 2 2 3 DT H2' . 211 . H2' 1 2 193 1 2 2 2 3 DT H6 . 211 . H6 1 2 194 1 1 2 2 3 DT M7 . 211 . H5# 1 2 194 1 2 2 2 4 DT M7 . 212 . H5# 1 2 195 1 1 2 2 3 DT H3' . 211 . H3' 1 2 195 1 2 2 2 4 DT M7 . 212 . H5# 1 2 196 1 1 2 2 3 DT H6 . 211 . H6 1 2 196 1 2 2 2 4 DT M7 . 212 . H5# 1 2 197 1 1 2 2 3 DT H1' . 211 . H1' 1 2 197 1 2 2 2 3 DT H3' . 211 . H3' 1 2 198 1 1 2 2 3 DT H2'' . 211 . H2'' 1 2 198 1 2 2 2 3 DT H6 . 211 . H6 1 2 199 1 1 2 2 3 DT H2' . 211 . H2' 1 2 199 1 2 2 2 3 DT H3' . 211 . H3' 1 2 200 1 1 2 2 3 DT H2'' . 211 . H2'' 1 2 200 1 2 2 2 3 DT H3' . 211 . H3' 1 2 201 1 1 2 2 3 DT H1' . 211 . H1' 1 2 201 1 2 2 2 3 DT M7 . 211 . H5# 1 2 202 1 1 2 2 3 DT H1' . 211 . H1' 1 2 202 1 2 2 2 3 DT H6 . 211 . H6 1 2 203 1 1 2 2 3 DT H4' . 211 . H4' 1 2 203 1 2 2 2 3 DT H6 . 211 . H6 1 2 204 1 1 2 2 3 DT H2' . 211 . H2' 1 2 204 1 2 2 2 4 DT M7 . 212 . H5# 1 2 205 1 1 2 2 3 DT H1' . 211 . H1' 1 2 205 1 2 2 2 3 DT H5' . 211 . H5' 1 2 206 1 1 2 2 4 DT H2'' . 212 . H2'' 1 2 206 1 2 2 2 4 DT H3' . 212 . H3' 1 2 207 1 1 2 2 4 DT H1' . 212 . H1' 1 2 207 1 2 2 2 4 DT H2'' . 212 . H2'' 1 2 208 1 1 2 2 4 DT H1' . 212 . H1' 1 2 208 1 2 2 2 4 DT H6 . 212 . H6 1 2 209 1 1 2 2 4 DT H3' . 212 . H3' 1 2 209 1 2 2 2 4 DT H6 . 212 . H6 1 2 210 1 1 2 2 4 DT H6 . 212 . H6 1 2 210 1 2 2 2 4 DT M7 . 212 . H5# 1 2 211 1 1 2 2 4 DT H2'' . 212 . H2'' 1 2 211 1 2 2 2 4 DT H6 . 212 . H6 1 2 212 1 1 2 2 4 DT H3' . 212 . H3' 1 2 212 1 2 2 2 5 DG H8 . 213 . H8 1 2 213 1 1 2 2 4 DT H2'' . 212 . H2'' 1 2 213 1 2 2 2 5 DG H8 . 213 . H8 1 2 214 1 1 2 2 4 DT H2' . 212 . H2' 1 2 214 1 2 2 2 4 DT M7 . 212 . H5# 1 2 215 1 1 2 2 4 DT H1' . 212 . H1' 1 2 215 1 2 2 2 4 DT H3' . 212 . H3' 1 2 216 1 1 2 2 4 DT H1' . 212 . H1' 1 2 216 1 2 2 2 4 DT H4' . 212 . H4' 1 2 217 1 1 2 2 4 DT H2' . 212 . H2' 1 2 217 1 2 2 2 4 DT H6 . 212 . H6 1 2 218 1 1 2 2 4 DT H1' . 212 . H1' 1 2 218 1 2 2 2 4 DT H2' . 212 . H2' 1 2 219 1 1 2 2 4 DT H2' . 212 . H2' 1 2 219 1 2 2 2 5 DG H8 . 213 . H8 1 2 220 1 1 2 2 4 DT H1' . 212 . H1' 1 2 220 1 2 2 2 5 DG H8 . 213 . H8 1 2 221 1 1 2 2 4 DT H1' . 212 . H1' 1 2 221 1 2 2 2 4 DT H5' . 212 . H5' 1 2 222 1 1 2 2 4 DT H6 . 212 . H6 1 2 222 1 2 2 2 5 DG H8 . 213 . H8 1 2 223 1 1 2 2 5 DG H3' . 213 . H3' 1 2 223 1 2 2 2 5 DG H4' . 213 . H4' 1 2 224 1 1 2 2 5 DG H1' . 213 . H1' 1 2 224 1 2 2 2 5 DG H4' . 213 . H4' 1 2 225 1 1 2 2 5 DG H1' . 213 . H1' 1 2 225 1 2 2 2 5 DG H3' . 213 . H3' 1 2 226 1 1 2 2 5 DG H2' . 213 . H2' 1 2 226 1 2 2 2 5 DG H3' . 213 . H3' 1 2 227 1 1 2 2 5 DG H1' . 213 . H1' 1 2 227 1 2 2 2 5 DG H2'' . 213 . H2'' 1 2 228 1 1 2 2 5 DG H1' . 213 . H1' 1 2 228 1 2 2 2 5 DG H2' . 213 . H2' 1 2 229 1 1 2 2 5 DG H2' . 213 . H2' 1 2 229 1 2 2 2 5 DG H8 . 213 . H8 1 2 230 1 1 2 2 5 DG H2' . 213 . H2' 1 2 230 1 2 2 2 6 DT M7 . 214 . H5# 1 2 231 1 1 2 2 5 DG H8 . 213 . H8 1 2 231 1 2 2 2 6 DT M7 . 214 . H5# 1 2 232 1 1 2 2 5 DG H2'' . 213 . H2'' 1 2 232 1 2 2 2 5 DG H8 . 213 . H8 1 2 233 1 1 2 2 5 DG H3' . 213 . H3' 1 2 233 1 2 2 2 5 DG H8 . 213 . H8 1 2 234 1 1 2 2 5 DG H1' . 213 . H1' 1 2 234 1 2 2 2 5 DG H8 . 213 . H8 1 2 235 1 1 2 2 5 DG H2'' . 213 . H2'' 1 2 235 1 2 2 2 6 DT H6 . 214 . H6 1 2 236 1 1 2 2 5 DG H1' . 213 . H1' 1 2 236 1 2 2 2 6 DT H6 . 214 . H6 1 2 237 1 1 2 2 5 DG H1' . 213 . H1' 1 2 237 1 2 2 2 5 DG H5' . 213 . H5' 1 2 238 1 1 2 2 5 DG H8 . 213 . H8 1 2 238 1 2 2 2 6 DT H6 . 214 . H6 1 2 239 1 1 2 2 6 DT H1' . 214 . H1' 1 2 239 1 2 2 2 6 DT H3' . 214 . H3' 1 2 240 1 1 2 2 6 DT H1' . 214 . H1' 1 2 240 1 2 2 2 6 DT H4' . 214 . H4' 1 2 241 1 1 2 2 6 DT H2'' . 214 . H2'' 1 2 241 1 2 2 2 6 DT H3' . 214 . H3' 1 2 242 1 1 2 2 6 DT H1' . 214 . H1' 1 2 242 1 2 2 2 6 DT H2' . 214 . H2' 1 2 243 1 1 2 2 6 DT H1' . 214 . H1' 1 2 243 1 2 2 2 6 DT H2'' . 214 . H2'' 1 2 244 1 1 2 2 6 DT H3' . 214 . H3' 1 2 244 1 2 2 2 6 DT H6 . 214 . H6 1 2 245 1 1 2 2 6 DT H2'' . 214 . H2'' 1 2 245 1 2 2 2 6 DT H6 . 214 . H6 1 2 246 1 1 2 2 6 DT H2' . 214 . H2' 1 2 246 1 2 2 2 6 DT H6 . 214 . H6 1 2 247 1 1 2 2 6 DT H6 . 214 . H6 1 2 247 1 2 2 2 6 DT M7 . 214 . H5# 1 2 248 1 1 2 2 6 DT H1' . 214 . H1' 1 2 248 1 2 2 2 7 DG H8 . 215 . H8 1 2 249 1 1 2 2 6 DT H2'' . 214 . H2'' 1 2 249 1 2 2 2 7 DG H8 . 215 . H8 1 2 250 1 1 2 2 6 DT H2' . 214 . H2' 1 2 250 1 2 2 2 6 DT M7 . 214 . H5# 1 2 251 1 1 2 2 6 DT H3' . 214 . H3' 1 2 251 1 2 2 2 6 DT H4' . 214 . H4' 1 2 252 1 1 2 2 6 DT H2' . 214 . H2' 1 2 252 1 2 2 2 6 DT H3' . 214 . H3' 1 2 253 1 1 2 2 6 DT H3' . 214 . H3' 1 2 253 1 2 2 2 6 DT M7 . 214 . H5# 1 2 254 1 1 2 2 6 DT H4' . 214 . H4' 1 2 254 1 2 2 2 6 DT H6 . 214 . H6 1 2 255 1 1 2 2 6 DT H1' . 214 . H1' 1 2 255 1 2 2 2 6 DT H6 . 214 . H6 1 2 256 1 1 2 2 6 DT H3' . 214 . H3' 1 2 256 1 2 2 2 7 DG H8 . 215 . H8 1 2 257 1 1 2 2 6 DT H6 . 214 . H6 1 2 257 1 2 2 2 7 DG H8 . 215 . H8 1 2 258 1 1 2 2 7 DG H2'' . 215 . H2'' 1 2 258 1 2 2 2 7 DG H5' . 215 . H5' 1 2 259 1 1 2 2 7 DG H3' . 215 . H3' 1 2 259 1 2 2 2 7 DG H5' . 215 . H5' 1 2 260 1 1 2 2 7 DG H3' . 215 . H3' 1 2 260 1 2 2 2 7 DG H4' . 215 . H4' 1 2 261 1 1 2 2 7 DG H1' . 215 . H1' 1 2 261 1 2 2 2 7 DG H3' . 215 . H3' 1 2 262 1 1 2 2 7 DG H1' . 215 . H1' 1 2 262 1 2 2 2 7 DG H4' . 215 . H4' 1 2 263 1 1 2 2 7 DG H1' . 215 . H1' 1 2 263 1 2 2 2 7 DG H5' . 215 . H5' 1 2 264 1 1 2 2 7 DG H2' . 215 . H2' 1 2 264 1 2 2 2 7 DG H4' . 215 . H4' 1 2 265 1 1 2 2 7 DG H2' . 215 . H2' 1 2 265 1 2 2 2 7 DG H3' . 215 . H3' 1 2 266 1 1 2 2 7 DG H2'' . 215 . H2'' 1 2 266 1 2 2 2 7 DG H3' . 215 . H3' 1 2 267 1 1 2 2 7 DG H1' . 215 . H1' 1 2 267 1 2 2 2 7 DG H2'' . 215 . H2'' 1 2 268 1 1 2 2 7 DG H1' . 215 . H1' 1 2 268 1 2 2 2 7 DG H2' . 215 . H2' 1 2 269 1 1 2 2 7 DG H3' . 215 . H3' 1 2 269 1 2 2 2 7 DG H8 . 215 . H8 1 2 270 1 1 2 2 7 DG H2'' . 215 . H2'' 1 2 270 1 2 2 2 7 DG H8 . 215 . H8 1 2 271 1 1 2 2 7 DG H2' . 215 . H2' 1 2 271 1 2 2 2 7 DG H8 . 215 . H8 1 2 272 1 1 2 2 7 DG H2'' . 215 . H2'' 1 2 272 1 2 2 2 8 DC H6 . 216 . H6 1 2 273 1 1 2 2 7 DG H1' . 215 . H1' 1 2 273 1 2 2 2 8 DC H6 . 216 . H6 1 2 274 1 1 2 2 7 DG H2' . 215 . H2' 1 2 274 1 2 2 2 8 DC H6 . 216 . H6 1 2 275 1 1 2 2 7 DG H1' . 215 . H1' 1 2 275 1 2 2 2 7 DG H8 . 215 . H8 1 2 276 1 1 2 2 7 DG H3' . 215 . H3' 1 2 276 1 2 2 2 8 DC H5 . 216 . H5 1 2 277 1 1 2 2 7 DG H2'' . 215 . H2'' 1 2 277 1 2 2 2 8 DC H5 . 216 . H5 1 2 278 1 1 2 2 7 DG H2' . 215 . H2' 1 2 278 1 2 2 2 8 DC H5 . 216 . H5 1 2 279 1 1 2 2 7 DG H8 . 215 . H8 1 2 279 1 2 2 2 8 DC H5 . 216 . H5 1 2 280 1 1 2 2 7 DG H8 . 215 . H8 1 2 280 1 2 2 2 8 DC H6 . 216 . H6 1 2 281 1 1 2 2 8 DC H1' . 216 . H1' 1 2 281 1 2 2 2 8 DC H3' . 216 . H3' 1 2 282 1 1 2 2 8 DC H2' . 216 . H2' 1 2 282 1 2 2 2 8 DC H5'' . 216 . H5'' 1 2 283 1 1 2 2 8 DC H2' . 216 . H2' 1 2 283 1 2 2 2 8 DC H3' . 216 . H3' 1 2 284 1 1 2 2 8 DC H5 . 216 . H5 1 2 284 1 2 2 2 8 DC H6 . 216 . H6 1 2 285 1 1 2 2 8 DC H1' . 216 . H1' 1 2 285 1 2 2 2 8 DC H2'' . 216 . H2'' 1 2 286 1 1 2 2 8 DC H3' . 216 . H3' 1 2 286 1 2 2 2 8 DC H6 . 216 . H6 1 2 287 1 1 2 2 8 DC H2' . 216 . H2' 1 2 287 1 2 2 2 8 DC H6 . 216 . H6 1 2 288 1 1 2 2 8 DC H1' . 216 . H1' 1 2 288 1 2 2 2 8 DC H4' . 216 . H4' 1 2 289 1 1 2 2 8 DC H3' . 216 . H3' 1 2 289 1 2 2 2 8 DC H5 . 216 . H5 1 2 290 1 1 2 2 8 DC H2' . 216 . H2' 1 2 290 1 2 2 2 8 DC H5 . 216 . H5 1 2 291 1 1 2 2 8 DC H1' . 216 . H1' 1 2 291 1 2 2 2 8 DC H2' . 216 . H2' 1 2 292 1 1 2 2 8 DC H4' . 216 . H4' 1 2 292 1 2 2 2 8 DC H6 . 216 . H6 1 2 293 1 1 2 2 8 DC H1' . 216 . H1' 1 2 293 1 2 2 2 8 DC H6 . 216 . H6 1 2 294 1 1 1 1 1 DG H1 . 201 . H1 1 2 294 1 2 2 2 7 DG H1 . 215 . H1 1 2 295 1 1 1 1 3 DA H2 . 203 . H2 1 2 295 1 2 2 2 5 DG H1 . 213 . H1 1 2 296 1 1 1 1 3 DA H2 . 203 . H2 1 2 296 1 2 2 2 6 DT H3 . 214 . H3 1 2 297 1 1 1 1 3 DA H2 . 203 . H2 1 2 297 1 2 2 2 7 DG H1 . 215 . H1 1 2 298 1 1 1 1 5 DA H2 . 205 . H2 1 2 298 1 2 2 2 3 DT H3 . 211 . H3 1 2 299 1 1 1 1 5 DA H2 . 205 . H2 1 2 299 1 2 2 2 4 DT H3 . 212 . H3 1 2 300 1 1 1 1 5 DA H2 . 205 . H2 1 2 300 1 2 2 2 5 DG H1 . 213 . H1 1 2 301 1 1 1 1 5 DA H2 . 205 . H2 1 2 301 1 2 1 1 6 DA H2 . 206 . H2 1 2 302 1 1 1 1 6 DA H2 . 206 . H2 1 2 302 1 2 2 2 3 DT H3 . 211 . H3 1 2 303 1 1 1 1 6 DA H2 . 206 . H2 1 2 303 1 2 1 1 7 DA H2 . 207 . H2 1 2 304 1 1 1 1 7 DA H2 . 207 . H2 1 2 304 1 2 2 2 2 DT H3 . 210 . H3 1 2 305 1 1 1 1 7 DA H2 . 207 . H2 1 2 305 1 2 2 2 3 DT H3 . 211 . H3 1 2 306 1 1 1 1 7 DA H2 . 207 . H2 1 2 306 1 2 2 2 1 DG H1 . 209 . H1 1 2 307 1 1 2 2 1 DG H1 . 209 . H1 1 2 307 1 2 2 2 2 DT H3 . 210 . H3 1 2 308 1 1 2 2 2 DT H3 . 210 . H3 1 2 308 1 2 2 2 3 DT H3 . 211 . H3 1 2 309 1 1 2 2 3 DT H3 . 211 . H3 1 2 309 1 2 2 2 4 DT H3 . 212 . H3 1 2 310 1 1 2 2 4 DT H3 . 212 . H3 1 2 310 1 2 2 2 5 DG H1 . 213 . H1 1 2 311 1 1 2 2 5 DG H1 . 213 . H1 1 2 311 1 2 2 2 6 DT H3 . 214 . H3 1 2 312 1 1 2 2 6 DT H3 . 214 . H3 1 2 312 1 2 2 2 6 DT M7 . 214 . H5# 1 2 313 1 1 2 2 6 DT H3 . 214 . H3 1 2 313 1 2 2 2 7 DG H1 . 215 . H1 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 1.7 5.0 1 2 2 1 . . . . . 2.0 1.7 2.5 1 2 3 1 . . . . . 3.5 1.7 4.0 1 2 4 1 . . . . . 3.5 1.7 4.0 1 2 5 1 . . . . . 2.0 1.7 2.5 1 2 6 1 . . . . . 2.5 1.8 3.0 1 2 7 1 . . . . . 3.0 1.7 3.5 1 2 8 1 . . . . . 4.5 1.7 5.0 1 2 9 1 . . . . . 3.5 1.7 4.0 1 2 10 1 . . . . . 4.5 1.7 5.0 1 2 11 1 . . . . . 3.0 1.7 3.5 1 2 12 1 . . . . . 3.0 1.7 3.5 1 2 13 1 . . . . . 3.5 1.7 4.0 1 2 14 1 . . . . . 3.5 1.7 4.0 1 2 15 1 . . . . . 3.0 1.7 3.5 1 2 16 1 . . . . . 2.5 1.8 3.0 1 2 17 1 . . . . . 3.5 1.7 4.0 1 2 18 1 . . . . . 3.0 1.7 3.5 1 2 19 1 . . . . . 4.5 2.3 5.0 1 2 20 1 . . . . . 4.5 1.7 5.0 1 2 21 1 . . . . . 4.5 1.7 5.0 1 2 22 1 . . . . . 5.5 1.7 6.0 1 2 23 1 . . . . . 2.5 1.7 3.0 1 2 24 1 . . . . . 2.5 1.7 3.0 1 2 25 1 . . . . . 3.5 2.0 4.0 1 2 26 1 . . . . . 3.0 1.7 3.5 1 2 27 1 . . . . . 3.0 1.7 3.5 1 2 28 1 . . . . . 2.0 1.7 2.5 1 2 29 1 . . . . . 2.5 1.8 3.0 1 2 30 1 . . . . . 3.0 1.7 3.5 1 2 31 1 . . . . . 3.0 1.7 3.5 1 2 32 1 . . . . . 2.5 1.8 3.0 1 2 33 1 . . . . . 3.5 1.7 4.0 1 2 34 1 . . . . . 3.5 1.7 4.0 1 2 35 1 . . . . . 3.5 1.7 4.0 1 2 36 1 . . . . . 2.5 1.8 3.0 1 2 37 1 . . . . . 4.5 3.2 5.0 1 2 38 1 . . . . . 4.5 1.7 5.0 1 2 39 1 . . . . . 4.5 2.5 6.0 1 2 40 1 . . . . . 4.5 1.7 5.0 1 2 41 1 . . . . . 5.5 1.7 6.0 1 2 42 1 . . . . . 3.5 1.7 4.0 1 2 43 1 . . . . . 3.0 1.7 3.5 1 2 44 1 . . . . . 2.5 1.8 3.0 1 2 45 1 . . . . . 3.5 1.7 4.0 1 2 46 1 . . . . . 3.5 1.7 4.0 1 2 47 1 . . . . . 2.5 1.8 3.0 1 2 48 1 . . . . . 3.0 1.7 3.5 1 2 49 1 . . . . . 3.5 1.7 4.0 1 2 50 1 . . . . . 3.0 1.7 3.5 1 2 51 1 . . . . . 3.5 1.7 4.0 1 2 52 1 . . . . . 3.0 1.7 3.5 1 2 53 1 . . . . . 3.0 1.7 3.5 1 2 54 1 . . . . . 3.5 1.7 4.0 1 2 55 1 . . . . . 4.5 1.7 5.0 1 2 56 1 . . . . . 3.5 1.7 4.0 1 2 57 1 . . . . . 3.5 1.7 4.0 1 2 58 1 . . . . . 3.5 1.7 4.0 1 2 59 1 . . . . . 3.5 1.7 4.0 1 2 60 1 . . . . . 3.5 1.7 4.0 1 2 61 1 . . . . . 3.5 1.7 4.0 1 2 62 1 . . . . . 5.5 1.7 6.0 1 2 63 1 . . . . . 2.5 1.7 3.0 1 2 64 1 . . . . . 3.0 1.7 3.5 1 2 65 1 . . . . . 3.0 1.7 3.5 1 2 66 1 . . . . . 2.0 1.7 2.5 1 2 67 1 . . . . . 3.0 1.7 3.5 1 2 68 1 . . . . . 3.0 1.7 3.5 1 2 69 1 . . . . . 3.5 1.7 4.0 1 2 70 1 . . . . . 3.5 1.7 4.0 1 2 71 1 . . . . . 5.5 1.7 6.0 1 2 72 1 . . . . . 5.5 1.7 6.0 1 2 73 1 . . . . . 3.5 1.7 4.0 1 2 74 1 . . . . . 3.5 1.7 4.0 1 2 75 1 . . . . . 4.5 1.7 5.0 1 2 76 1 . . . . . 2.5 1.8 3.0 1 2 77 1 . . . . . 3.5 1.7 4.0 1 2 78 1 . . . . . 3.5 1.7 4.0 1 2 79 1 . . . . . 4.5 1.7 5.0 1 2 80 1 . . . . . 5.5 1.7 6.0 1 2 81 1 . . . . . 3.0 1.7 3.5 1 2 82 1 . . . . . 3.5 1.7 4.0 1 2 83 1 . . . . . 3.5 1.7 4.0 1 2 84 1 . . . . . 2.5 1.8 3.0 1 2 85 1 . . . . . 3.0 1.7 3.5 1 2 86 1 . . . . . 3.0 1.7 3.5 1 2 87 1 . . . . . 4.5 1.7 5.0 1 2 88 1 . . . . . 4.5 1.7 5.0 1 2 89 1 . . . . . 3.5 1.7 4.0 1 2 90 1 . . . . . 3.5 1.7 4.0 1 2 91 1 . . . . . 3.5 1.7 4.0 1 2 92 1 . . . . . 4.5 1.7 5.0 1 2 93 1 . . . . . 3.5 1.7 4.0 1 2 94 1 . . . . . 5.5 1.7 6.0 1 2 95 1 . . . . . 3.5 2.0 4.0 1 2 96 1 . . . . . 3.5 1.7 4.0 1 2 97 1 . . . . . 4.5 1.7 5.0 1 2 98 1 . . . . . 2.5 1.8 3.0 1 2 99 1 . . . . . 3.0 1.7 3.5 1 2 100 1 . . . . . 3.0 1.7 3.5 1 2 101 1 . . . . . 3.0 1.7 3.5 1 2 102 1 . . . . . 3.5 1.7 4.0 1 2 103 1 . . . . . 2.5 1.8 3.0 1 2 104 1 . . . . . 4.5 1.7 5.0 1 2 105 1 . . . . . 3.5 1.7 4.0 1 2 106 1 . . . . . 2.5 1.8 3.0 1 2 107 1 . . . . . 5.5 1.7 6.0 1 2 108 1 . . . . . 4.5 1.7 5.0 1 2 109 1 . . . . . 4.5 1.7 5.0 1 2 110 1 . . . . . 3.5 1.7 4.0 1 2 111 1 . . . . . 4.5 1.7 5.0 1 2 112 1 . . . . . 5.5 1.7 6.0 1 2 113 1 . . . . . 3.5 1.7 4.0 1 2 114 1 . . . . . 3.5 1.7 4.0 1 2 115 1 . . . . . 4.5 1.7 5.0 1 2 116 1 . . . . . 2.0 1.7 2.5 1 2 117 1 . . . . . 2.5 1.8 3.0 1 2 118 1 . . . . . 3.5 1.7 4.0 1 2 119 1 . . . . . 3.5 1.7 4.0 1 2 120 1 . . . . . 3.5 1.7 4.0 1 2 121 1 . . . . . 4.5 1.7 5.0 1 2 122 1 . . . . . 5.5 1.7 6.0 1 2 123 1 . . . . . 4.5 1.7 5.0 1 2 124 1 . . . . . 3.5 1.7 4.0 1 2 125 1 . . . . . 4.5 1.7 5.0 1 2 126 1 . . . . . 5.5 1.7 6.0 1 2 127 1 . . . . . 3.5 1.7 4.0 1 2 128 1 . . . . . 3.5 1.7 4.0 1 2 129 1 . . . . . 4.5 1.7 5.0 1 2 130 1 . . . . . 3.5 1.7 4.0 1 2 131 1 . . . . . 4.5 1.7 5.0 1 2 132 1 . . . . . 4.5 1.7 5.0 1 2 133 1 . . . . . 4.5 1.7 5.0 1 2 134 1 . . . . . 3.5 1.7 4.0 1 2 135 1 . . . . . 3.5 1.7 4.0 1 2 136 1 . . . . . 3.0 1.7 3.5 1 2 137 1 . . . . . 2.0 1.7 2.5 1 2 138 1 . . . . . 3.0 1.7 3.5 1 2 139 1 . . . . . 2.5 1.8 3.0 1 2 140 1 . . . . . 3.5 1.7 4.0 1 2 141 1 . . . . . 2.5 1.8 3.0 1 2 142 1 . . . . . 3.5 1.7 4.0 1 2 143 1 . . . . . 4.5 1.7 5.0 1 2 144 1 . . . . . 3.5 1.7 4.0 1 2 145 1 . . . . . 4.5 1.7 5.0 1 2 146 1 . . . . . 3.5 1.7 4.0 1 2 147 1 . . . . . 5.5 1.7 6.0 1 2 148 1 . . . . . 3.5 1.7 4.0 1 2 149 1 . . . . . 5.5 1.7 6.0 1 2 150 1 . . . . . 4.5 1.7 5.0 1 2 151 1 . . . . . 3.5 1.7 4.0 1 2 152 1 . . . . . 4.5 1.7 5.0 1 2 153 1 . . . . . 3.5 1.7 4.0 1 2 154 1 . . . . . 3.5 1.7 4.0 1 2 155 1 . . . . . 3.5 1.7 4.0 1 2 156 1 . . . . . 2.5 1.7 3.0 1 2 157 1 . . . . . 3.0 1.7 4.0 1 2 158 1 . . . . . 4.5 1.7 5.5 1 2 159 1 . . . . . 4.5 1.7 5.0 1 2 160 1 . . . . . 2.5 1.8 3.0 1 2 161 1 . . . . . 3.5 1.7 4.0 1 2 162 1 . . . . . 2.5 1.7 3.0 1 2 163 1 . . . . . 4.5 1.7 5.0 1 2 164 1 . . . . . 2.5 1.8 3.0 1 2 165 1 . . . . . 4.5 1.7 5.0 1 2 166 1 . . . . . 4.5 1.7 5.0 1 2 167 1 . . . . . 3.5 1.7 4.0 1 2 168 1 . . . . . 4.5 1.7 5.0 1 2 169 1 . . . . . 3.5 1.7 4.0 1 2 170 1 . . . . . 3.5 1.7 4.5 1 2 171 1 . . . . . 4.5 1.7 5.0 1 2 172 1 . . . . . 3.5 1.7 4.5 1 2 173 1 . . . . . 3.0 1.7 3.5 1 2 174 1 . . . . . 3.0 1.7 3.5 1 2 175 1 . . . . . 3.0 1.7 3.5 1 2 176 1 . . . . . 3.5 1.7 4.0 1 2 177 1 . . . . . 2.5 1.8 3.0 1 2 178 1 . . . . . 4.5 1.7 5.0 1 2 179 1 . . . . . 4.5 1.7 5.0 1 2 180 1 . . . . . 2.0 1.7 3.0 1 2 181 1 . . . . . 3.0 1.7 4.0 1 2 182 1 . . . . . 3.0 1.7 4.0 1 2 183 1 . . . . . 3.5 1.7 4.0 1 2 184 1 . . . . . 3.5 1.7 4.0 1 2 185 1 . . . . . 3.5 1.7 4.0 1 2 186 1 . . . . . 3.0 1.7 4.0 1 2 187 1 . . . . . 3.5 1.7 4.0 1 2 188 1 . . . . . 4.5 1.7 5.0 1 2 189 1 . . . . . 3.0 1.7 3.5 1 2 190 1 . . . . . 3.0 1.7 3.5 1 2 191 1 . . . . . 2.5 1.8 3.0 1 2 192 1 . . . . . 2.0 1.7 3.0 1 2 193 1 . . . . . 3.5 1.7 4.0 1 2 194 1 . . . . . 3.5 1.7 5.0 1 2 195 1 . . . . . 3.0 1.8 3.5 1 2 196 1 . . . . . 3.5 1.7 4.5 1 2 197 1 . . . . . 3.5 1.7 4.0 1 2 198 1 . . . . . 4.5 1.7 5.0 1 2 199 1 . . . . . 3.5 1.7 4.0 1 2 200 1 . . . . . 3.5 1.7 4.0 1 2 201 1 . . . . . 4.5 1.7 5.5 1 2 202 1 . . . . . 3.5 1.7 4.0 1 2 203 1 . . . . . 3.5 1.7 4.0 1 2 204 1 . . . . . 3.5 1.7 4.5 1 2 205 1 . . . . . 4.5 1.7 5.0 1 2 206 1 . . . . . 3.0 1.7 3.5 1 2 207 1 . . . . . 3.0 1.7 3.5 1 2 208 1 . . . . . 3.5 1.7 4.0 1 2 209 1 . . . . . 3.0 1.7 3.5 1 2 210 1 . . . . . 2.5 1.8 3.5 1 2 211 1 . . . . . 4.5 1.7 5.0 1 2 212 1 . . . . . 3.5 1.7 4.0 1 2 213 1 . . . . . 3.5 1.7 4.0 1 2 214 1 . . . . . 5.5 1.7 6.5 1 2 215 1 . . . . . 3.5 1.7 4.0 1 2 216 1 . . . . . 3.5 1.7 4.0 1 2 217 1 . . . . . 3.5 1.7 4.0 1 2 218 1 . . . . . 3.5 1.7 4.0 1 2 219 1 . . . . . 3.5 1.7 4.0 1 2 220 1 . . . . . 4.5 1.7 5.0 1 2 221 1 . . . . . 4.5 1.7 5.0 1 2 222 1 . . . . . 4.5 1.7 5.0 1 2 223 1 . . . . . 3.0 1.7 3.5 1 2 224 1 . . . . . 3.0 1.7 3.5 1 2 225 1 . . . . . 3.5 1.7 4.0 1 2 226 1 . . . . . 3.0 1.7 3.5 1 2 227 1 . . . . . 3.0 1.7 3.5 1 2 228 1 . . . . . 3.0 1.7 3.5 1 2 229 1 . . . . . 3.5 1.7 4.0 1 2 230 1 . . . . . 3.5 1.7 4.5 1 2 231 1 . . . . . 3.0 1.7 4.0 1 2 232 1 . . . . . 3.5 1.7 4.0 1 2 233 1 . . . . . 4.5 1.7 5.0 1 2 234 1 . . . . . 3.5 1.7 4.0 1 2 235 1 . . . . . 4.5 2.5 6.0 1 2 236 1 . . . . . 3.5 1.7 4.0 1 2 237 1 . . . . . 4.5 1.7 5.0 1 2 238 1 . . . . . 5.5 1.7 6.0 1 2 239 1 . . . . . 3.5 1.7 4.0 1 2 240 1 . . . . . 3.0 1.7 3.5 1 2 241 1 . . . . . 3.0 1.7 3.5 1 2 242 1 . . . . . 3.5 1.7 4.0 1 2 243 1 . . . . . 3.0 1.7 3.5 1 2 244 1 . . . . . 3.0 1.7 3.5 1 2 245 1 . . . . . 3.5 1.7 4.0 1 2 246 1 . . . . . 2.5 1.8 3.0 1 2 247 1 . . . . . 2.5 1.8 3.0 1 2 248 1 . . . . . 4.5 1.7 5.0 1 2 249 1 . . . . . 3.5 1.7 4.0 1 2 250 1 . . . . . 5.5 1.7 6.0 1 2 251 1 . . . . . 2.5 1.8 3.0 1 2 252 1 . . . . . 3.5 1.7 4.0 1 2 253 1 . . . . . 4.5 1.7 5.5 1 2 254 1 . . . . . 4.5 1.7 5.0 1 2 255 1 . . . . . 3.5 2.2 4.0 1 2 256 1 . . . . . 3.5 1.7 4.0 1 2 257 1 . . . . . 4.5 1.7 5.0 1 2 258 1 . . . . . 4.5 1.7 5.0 1 2 259 1 . . . . . 3.5 1.7 4.0 1 2 260 1 . . . . . 2.5 1.8 3.0 1 2 261 1 . . . . . 3.5 1.7 4.0 1 2 262 1 . . . . . 3.5 1.7 4.0 1 2 263 1 . . . . . 4.5 1.7 5.0 1 2 264 1 . . . . . 3.5 1.7 4.0 1 2 265 1 . . . . . 3.0 1.7 3.5 1 2 266 1 . . . . . 3.0 1.7 3.5 1 2 267 1 . . . . . 3.0 1.7 3.5 1 2 268 1 . . . . . 3.0 1.7 3.5 1 2 269 1 . . . . . 3.5 1.7 4.0 1 2 270 1 . . . . . 4.5 1.7 5.0 1 2 271 1 . . . . . 2.5 1.8 3.0 1 2 272 1 . . . . . 3.0 1.7 3.5 1 2 273 1 . . . . . 4.5 1.7 5.0 1 2 274 1 . . . . . 3.5 1.7 4.0 1 2 275 1 . . . . . 3.5 1.7 4.0 1 2 276 1 . . . . . 4.5 1.7 5.0 1 2 277 1 . . . . . 3.5 1.7 4.0 1 2 278 1 . . . . . 3.5 1.7 4.0 1 2 279 1 . . . . . 3.5 1.7 4.0 1 2 280 1 . . . . . 4.5 1.7 5.0 1 2 281 1 . . . . . 3.5 1.7 4.0 1 2 282 1 . . . . . 4.5 1.7 5.0 1 2 283 1 . . . . . 2.5 1.8 3.0 1 2 284 1 . . . . . 2.0 1.7 2.5 1 2 285 1 . . . . . 2.0 1.7 2.5 1 2 286 1 . . . . . 3.0 1.7 3.5 1 2 287 1 . . . . . 2.5 1.8 3.0 1 2 288 1 . . . . . 3.5 1.7 4.0 1 2 289 1 . . . . . 4.5 1.7 5.0 1 2 290 1 . . . . . 4.5 1.7 5.0 1 2 291 1 . . . . . 2.5 1.7 3.0 1 2 292 1 . . . . . 4.5 1.7 5.0 1 2 293 1 . . . . . 3.5 0.7 4.0 1 2 294 1 . . . . . 3.5 1.7 4.0 1 2 295 1 . . . . . 3.0 2.5 5.0 1 2 296 1 . . . . . 2.5 2.0 3.0 1 2 297 1 . . . . . 3.0 2.5 5.0 1 2 298 1 . . . . . 4.5 1.7 5.5 1 2 299 1 . . . . . 2.5 2.0 3.0 1 2 300 1 . . . . . 3.0 2.5 5.0 1 2 301 1 . . . . . 5.5 1.7 6.0 1 2 302 1 . . . . . 2.5 2.0 3.0 1 2 303 1 . . . . . 4.5 1.7 5.0 1 2 304 1 . . . . . 2.5 2.0 3.0 1 2 305 1 . . . . . 4.5 1.7 5.0 1 2 306 1 . . . . . 4.5 1.7 5.0 1 2 307 1 . . . . . 3.5 1.7 4.0 1 2 308 1 . . . . . 3.5 1.7 4.0 1 2 309 1 . . . . . 4.5 1.7 5.0 1 2 310 1 . . . . . 4.5 1.7 5.0 1 2 311 1 . . . . . 3.5 1.7 4.0 1 2 312 1 . . . . . 4.5 1.7 5.0 1 2 313 1 . . . . . 4.5 1.7 5.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_10_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 67 1 . . . 1 3 68 1 . . . 1 3 69 1 . . . 1 3 70 1 . . . 1 3 71 1 . . . 1 3 72 1 . . . 1 3 73 1 . . . 1 3 74 1 . . . 1 3 75 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 3 DA H4' . 203 . H4' 1 3 1 1 2 3 3 4 ARG QG . 4 . HG# 1 3 2 1 1 1 1 3 DA H2'' . 203 . H2'' 1 3 2 1 2 3 3 4 ARG QG . 4 . HG# 1 3 3 1 1 1 1 4 DC H4' . 204 . H4' 1 3 3 1 2 3 3 7 ARG QG . 7 . HG# 1 3 4 1 1 1 1 4 DC H4' . 204 . H4' 1 3 4 1 2 3 3 7 ARG QD . 7 . HD# 1 3 5 1 1 1 1 5 DA H2'' . 205 . H2'' 1 3 5 1 2 3 3 9 MET HA . 9 . HA 1 3 6 1 1 1 1 6 DA H3' . 206 . H3' 1 3 6 1 2 3 3 9 MET ME . 9 . HE# 1 3 7 1 1 1 1 6 DA H4' . 206 . H4' 1 3 7 1 2 3 3 9 MET ME . 9 . HE# 1 3 8 1 1 2 2 6 DT H4' . 214 . H4' 1 3 8 1 2 3 3 10 ASN QB . 10 . HB# 1 3 9 1 1 2 2 5 DG H4' . 213 . H4' 1 3 9 1 2 3 3 10 ASN QB . 10 . HB# 1 3 10 1 1 2 2 5 DG H2'' . 213 . H2'' 1 3 10 1 2 3 3 10 ASN QB . 10 . HB# 1 3 11 1 1 1 1 5 DA H2 . 205 . H2 1 3 11 1 2 3 3 10 ASN QD . 10 . HD2# 1 3 12 1 1 1 1 5 DA H1' . 205 . H1' 1 3 12 1 2 3 3 10 ASN QD . 10 . HD2# 1 3 13 1 1 2 2 5 DG H5'' . 213 . H5'' 1 3 13 1 2 3 3 11 ALA MB . 11 . HB# 1 3 14 1 1 2 2 5 DG H4' . 213 . H4' 1 3 14 1 2 3 3 11 ALA MB . 11 . HB# 1 3 15 1 1 2 2 4 DT H1' . 212 . H1' 1 3 15 1 2 3 3 12 PHE QB . 12 . HB# 1 3 16 1 1 2 2 3 DT H2' . 211 . H2' 1 3 16 1 2 3 3 12 PHE HZ . 12 . HZ 1 3 17 1 1 1 1 6 DA H2 . 206 . H2 1 3 17 1 2 3 3 12 PHE HZ . 12 . HZ 1 3 18 1 1 2 2 5 DG H5' . 213 . H5' 1 3 18 1 2 3 3 12 PHE HA . 12 . HA 1 3 19 1 1 2 2 5 DG H1' . 213 . H1' 1 3 19 1 2 3 3 12 PHE QD . 12 . HD# 1 3 20 1 1 1 1 5 DA H2 . 205 . H2 1 3 20 1 2 3 3 13 ILE MD . 13 . HD1# 1 3 21 1 1 1 1 5 DA H2 . 205 . H2 1 3 21 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 22 1 1 1 1 5 DA H1' . 205 . H1' 1 3 22 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 23 1 1 1 1 5 DA H2'' . 205 . H2'' 1 3 23 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 24 1 1 1 1 5 DA H2 . 205 . H2 1 3 24 1 2 3 3 13 ILE QG . 13 . HG1# 1 3 25 1 1 1 1 6 DA H2 . 206 . H2 1 3 25 1 2 3 3 13 ILE MD . 13 . HD# 1 3 26 1 1 1 1 6 DA H3' . 206 . H3' 1 3 26 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 27 1 1 1 1 6 DA H2 . 206 . H2 1 3 27 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 28 1 1 1 1 6 DA H4' . 206 . H4' 1 3 28 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 29 1 1 1 1 6 DA H1' . 206 . H1' 1 3 29 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 30 1 1 1 1 6 DA H8 . 206 . H8 1 3 30 1 2 3 3 13 ILE MG . 13 . HG2# 1 3 31 1 1 1 1 5 DA H2 . 205 . H2 1 3 31 1 2 3 3 13 ILE HB . 13 . HB 1 3 32 1 1 1 1 5 DA H3' . 205 . H3' 1 3 32 1 2 3 3 13 ILE HB . 13 . HB 1 3 33 1 1 2 2 3 DT H3 . 211 . H3 1 3 33 1 2 3 3 13 ILE MD . 13 . HD# 1 3 34 1 1 2 2 4 DT H3 . 212 . H3 1 3 34 1 2 3 3 13 ILE MD . 13 . HD# 1 3 35 1 1 2 2 4 DT H3 . 212 . H3 1 3 35 1 2 3 3 13 ILE QG . 13 . HG1# 1 3 36 1 1 1 1 6 DA H4' . 206 . H4' 1 3 36 1 2 3 3 17 ARG HA . 17 . HA 1 3 37 1 1 1 1 7 DA H5' . 207 . H5' 1 3 37 1 2 3 3 17 ARG HA . 17 . HA 1 3 38 1 1 1 1 6 DA H4' . 206 . H4' 1 3 38 1 2 3 3 17 ARG QD . 17 . HD# 1 3 39 1 1 1 1 6 DA H3' . 206 . H3' 1 3 39 1 2 3 3 17 ARG QD . 17 . HD# 1 3 40 1 1 1 1 7 DA H4' . 207 . H4' 1 3 40 1 2 3 3 20 ARG QG . 20 . HG# 1 3 41 1 1 1 1 7 DA H1' . 207 . H1' 1 3 41 1 2 3 3 20 ARG QB . 20 . HB# 1 3 42 1 1 1 1 7 DA H4' . 207 . H4' 1 3 42 1 2 3 3 24 ALA MB . 24 . HB# 1 3 43 1 1 1 1 8 DC H1' . 208 . H1' 1 3 43 1 2 3 3 24 ALA MB . 24 . HB# 1 3 44 1 1 1 1 8 DC H5' . 208 . H5' 1 3 44 1 2 3 3 24 ALA MB . 24 . HB# 1 3 45 1 1 1 1 8 DC H4' . 208 . H4' 1 3 45 1 2 3 3 24 ALA MB . 24 . HB# 1 3 46 1 1 2 2 1 DG H1' . 209 . H1' 1 3 46 1 2 3 3 33 SER QB . 33 . HB# 1 3 47 1 1 2 2 2 DT H1' . 210 . H1' 1 3 47 1 2 3 3 33 SER QB . 33 . HB# 1 3 48 1 1 1 1 8 DC H2'' . 208 . H2'' 1 3 48 1 2 3 3 35 ILE MD . 35 . HD1# 1 3 49 1 1 1 1 8 DC H1' . 208 . H1' 1 3 49 1 2 3 3 35 ILE MD . 35 . HD1# 1 3 50 1 1 1 1 8 DC H1' . 208 . H1' 1 3 50 1 2 3 3 35 ILE MG . 35 . HG2# 1 3 51 1 1 2 2 2 DT H1' . 210 . H1' 1 3 51 1 2 3 3 36 SER HA . 36 . HA 1 3 52 1 1 2 2 2 DT H1' . 210 . H1' 1 3 52 1 2 3 3 36 SER QB . 36 . HB# 1 3 53 1 1 2 2 3 DT H1' . 211 . H1' 1 3 53 1 2 3 3 36 SER HA . 36 . HA 1 3 54 1 1 2 2 3 DT H5' . 211 . H5' 1 3 54 1 2 3 3 37 LYS QD . 37 . HD# 1 3 55 1 1 2 2 3 DT H5' . 211 . H5' 1 3 55 1 2 3 3 37 LYS QG . 37 . HG# 1 3 56 1 1 2 2 3 DT H4' . 211 . H4' 1 3 56 1 2 3 3 37 LYS QG . 37 . HG# 1 3 57 1 1 2 2 3 DT H2'' . 211 . H2'' 1 3 57 1 2 3 3 43 TRP HE1 . 43 . HE1 1 3 58 1 1 2 2 4 DT H3' . 212 . H3' 1 3 58 1 2 3 3 43 TRP HE1 . 43 . HE1 1 3 59 1 1 2 2 4 DT H5' . 212 . H5' 1 3 59 1 2 3 3 43 TRP HE1 . 43 . HE1 1 3 60 1 1 2 2 4 DT H4' . 212 . H4' 1 3 60 1 2 3 3 43 TRP HE1 . 43 . HE1 1 3 61 1 1 2 2 4 DT H5' . 212 . H5' 1 3 61 1 2 3 3 43 TRP HD1 . 43 . HD1 1 3 62 1 1 2 2 4 DT H3' . 212 . H3' 1 3 62 1 2 3 3 43 TRP HD1 . 43 . HD1 1 3 63 1 1 2 2 4 DT H1' . 212 . H1' 1 3 63 1 2 3 3 43 TRP HD1 . 43 . HD1 1 3 64 1 1 2 2 3 DT H2'' . 211 . H2'' 1 3 64 1 2 3 3 43 TRP HD1 . 43 . HD1 1 3 65 1 1 2 2 6 DT H4' . 214 . H4' 1 3 65 1 2 3 3 66 ARG QG . 66 . HG# 1 3 66 1 1 2 2 7 DG H5' . 215 . H5' 1 3 66 1 2 3 3 66 ARG QD . 66 . HD# 1 3 67 1 1 2 2 8 DC H4' . 216 . H4' 1 3 67 1 2 3 3 73 LYS QE . 73 . HE# 1 3 68 1 1 2 2 8 DC H5' . 216 . H5' 1 3 68 1 2 3 3 73 LYS QD . 73 . HD# 1 3 69 1 1 1 1 3 DA H2 . 203 . H2 1 3 69 1 2 3 3 74 TYR QE . 74 . HE# 1 3 70 1 1 1 1 4 DC H4' . 204 . H4' 1 3 70 1 2 3 3 74 TYR QE . 74 . HE# 1 3 71 1 1 1 1 3 DA H4' . 203 . H4' 1 3 71 1 2 3 3 74 TYR QE . 74 . HE# 1 3 72 1 1 2 2 7 DG H1' . 215 . H1' 1 3 72 1 2 3 3 74 TYR QD . 74 . HD# 1 3 73 1 1 2 2 7 DG H1' . 215 . H1' 1 3 73 1 2 3 3 74 TYR QE . 74 . HE# 1 3 74 1 1 1 1 3 DA H3' . 203 . H3' 1 3 74 1 2 3 3 74 TYR QD . 74 . HD# 1 3 75 1 1 1 1 3 DA H5' . 203 . H5' 1 3 75 1 2 3 3 74 TYR QD . 74 . HD# 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 0.7 5.0 1 3 2 1 . . . . . 4.5 0.7 5.0 1 3 3 1 . . . . . 4.5 0.7 5.0 1 3 4 1 . . . . . 4.5 0.7 5.0 1 3 5 1 . . . . . 5.5 1.7 6.0 1 3 6 1 . . . . . 4.5 1.7 5.0 1 3 7 1 . . . . . 2.8 1.7 3.8 1 3 8 1 . . . . . 5.5 2.7 6.0 1 3 9 1 . . . . . 5.5 1.7 6.0 1 3 10 1 . . . . . 5.5 1.7 6.0 1 3 11 1 . . . . . 4.5 0.7 5.0 1 3 12 1 . . . . . 5.5 1.7 6.0 1 3 13 1 . . . . . 5.5 1.7 6.5 1 3 14 1 . . . . . 5.5 1.7 6.5 1 3 15 1 . . . . . 4.5 1.7 5.0 1 3 16 1 . . . . . 4.0 1.8 6.0 1 3 17 1 . . . . . 4.0 1.8 6.0 1 3 18 1 . . . . . 5.5 1.7 6.0 1 3 19 1 . . . . . 5.5 1.7 6.0 1 3 20 1 . . . . . 2.8 1.7 3.8 1 3 21 1 . . . . . 4.5 1.7 5.5 1 3 22 1 . . . . . 5.5 2.7 6.5 1 3 23 1 . . . . . 5.5 2.7 6.5 1 3 24 1 . . . . . 4.5 1.7 5.0 1 3 25 1 . . . . . 2.8 1.7 3.8 1 3 26 1 . . . . . 5.5 1.7 6.5 1 3 27 1 . . . . . 4.5 1.7 5.5 1 3 28 1 . . . . . 4.5 1.7 5.5 1 3 29 1 . . . . . 3.0 0.2 4.0 1 3 30 1 . . . . . 5.5 1.7 6.5 1 3 31 1 . . . . . 3.0 2.5 5.0 1 3 32 1 . . . . . 6.5 2.7 7.0 1 3 33 1 . . . . . 4.0 1.2 4.5 1 3 34 1 . . . . . 4.0 1.2 4.5 1 3 35 1 . . . . . 5.5 1.7 6.0 1 3 36 1 . . . . . 5.5 1.7 6.5 1 3 37 1 . . . . . 4.5 1.7 5.0 1 3 38 1 . . . . . 4.5 0.7 5.0 1 3 39 1 . . . . . 5.5 1.7 6.0 1 3 40 1 . . . . . 4.5 1.7 5.0 1 3 41 1 . . . . . 5.5 2.7 6.0 1 3 42 1 . . . . . 5.5 1.7 6.5 1 3 43 1 . . . . . 5.5 1.7 6.5 1 3 44 1 . . . . . 3.5 2.4 4.5 1 3 45 1 . . . . . 4.5 1.7 5.5 1 3 46 1 . . . . . 3.5 1.7 4.0 1 3 47 1 . . . . . 3.5 1.7 4.0 1 3 48 1 . . . . . 4.5 1.7 5.5 1 3 49 1 . . . . . 4.5 1.7 5.5 1 3 50 1 . . . . . 4.5 0.7 6.0 1 3 51 1 . . . . . 5.5 1.7 6.0 1 3 52 1 . . . . . 4.5 1.7 5.0 1 3 53 1 . . . . . 4.5 1.7 5.0 1 3 54 1 . . . . . 5.5 1.7 6.0 1 3 55 1 . . . . . 4.5 0.7 5.0 1 3 56 1 . . . . . 4.5 0.7 5.0 1 3 57 1 . . . . . 5.5 1.7 6.0 1 3 58 1 . . . . . 5.5 1.7 7.0 1 3 59 1 . . . . . 4.5 1.7 5.0 1 3 60 1 . . . . . 4.5 1.7 5.0 1 3 61 1 . . . . . 5.5 1.7 6.0 1 3 62 1 . . . . . 4.5 1.7 5.0 1 3 63 1 . . . . . 5.5 1.7 6.0 1 3 64 1 . . . . . 5.5 1.7 6.0 1 3 65 1 . . . . . 5.5 1.7 6.0 1 3 66 1 . . . . . 4.5 0.7 5.0 1 3 67 1 . . . . . 2.8 0.0 3.3 1 3 68 1 . . . . . 5.5 2.7 6.0 1 3 69 1 . . . . . 2.8 1.0 3.3 1 3 70 1 . . . . . 3.7 1.7 4.2 1 3 71 1 . . . . . 5.5 1.7 6.0 1 3 72 1 . . . . . 3.5 -0.3 4.0 1 3 73 1 . . . . . 5.5 1.7 6.0 1 3 74 1 . . . . . 5.5 1.7 6.0 1 3 75 1 . . . . . 5.5 1.7 6.0 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 11 1 . . . 1 4 12 1 . . . 1 4 13 1 . . . 1 4 14 1 . . . 1 4 15 1 . . . 1 4 16 1 . . . 1 4 17 1 . . . 1 4 18 1 . . . 1 4 19 1 . . . 1 4 20 1 . . . 1 4 21 1 . . . 1 4 22 1 . . . 1 4 23 1 . . . 1 4 24 1 . . . 1 4 25 1 . . . 1 4 26 1 . . . 1 4 27 1 . . . 1 4 28 1 . . . 1 4 29 1 . . . 1 4 30 1 . . . 1 4 31 1 . . . 1 4 32 1 . . . 1 4 33 1 . . . 1 4 34 1 . . . 1 4 35 1 . . . 1 4 36 1 . . . 1 4 37 1 . . . 1 4 38 1 . . . 1 4 39 1 . . . 1 4 40 1 . . . 1 4 41 1 . . . 1 4 42 1 . . . 1 4 43 1 . . . 1 4 44 1 . . . 1 4 45 1 . . . 1 4 46 1 . . . 1 4 47 1 . . . 1 4 48 1 . . . 1 4 49 1 . . . 1 4 50 1 . . . 1 4 51 1 . . . 1 4 52 1 . . . 1 4 53 1 . . . 1 4 54 1 . . . 1 4 55 1 . . . 1 4 56 1 . . . 1 4 57 1 . . . 1 4 58 1 . . . 1 4 59 1 . . . 1 4 60 1 . . . 1 4 61 1 . . . 1 4 62 1 . . . 1 4 63 1 . . . 1 4 64 1 . . . 1 4 65 1 . . . 1 4 66 1 . . . 1 4 67 1 . . . 1 4 68 1 . . . 1 4 69 1 . . . 1 4 70 1 . . . 1 4 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 3 3 11 ALA O . 11 . O 1 4 1 1 2 3 3 15 TRP N . 15 . N 1 4 2 1 1 3 3 11 ALA O . 11 . O 1 4 2 1 2 3 3 15 TRP H . 15 . HN 1 4 3 1 1 3 3 12 PHE O . 12 . O 1 4 3 1 2 3 3 16 SER N . 16 . N 1 4 4 1 1 3 3 12 PHE O . 12 . O 1 4 4 1 2 3 3 16 SER H . 16 . HN 1 4 5 1 1 3 3 13 ILE O . 13 . O 1 4 5 1 2 3 3 17 ARG N . 17 . N 1 4 6 1 1 3 3 13 ILE O . 13 . O 1 4 6 1 2 3 3 17 ARG H . 17 . HN 1 4 7 1 1 3 3 14 VAL O . 14 . O 1 4 7 1 2 3 3 18 ASP N . 18 . N 1 4 8 1 1 3 3 14 VAL O . 14 . O 1 4 8 1 2 3 3 18 ASP H . 18 . HN 1 4 9 1 1 3 3 15 TRP O . 15 . O 1 4 9 1 2 3 3 19 GLN N . 19 . N 1 4 10 1 1 3 3 15 TRP O . 15 . O 1 4 10 1 2 3 3 19 GLN H . 19 . HN 1 4 11 1 1 3 3 16 SER O . 16 . O 1 4 11 1 2 3 3 20 ARG N . 20 . N 1 4 12 1 1 3 3 16 SER O . 16 . O 1 4 12 1 2 3 3 20 ARG H . 20 . HN 1 4 13 1 1 3 3 17 ARG O . 17 . O 1 4 13 1 2 3 3 21 ARG N . 21 . N 1 4 14 1 1 3 3 17 ARG O . 17 . O 1 4 14 1 2 3 3 21 ARG H . 21 . HN 1 4 15 1 1 3 3 18 ASP O . 18 . O 1 4 15 1 2 3 3 22 LYS N . 22 . N 1 4 16 1 1 3 3 18 ASP O . 18 . O 1 4 16 1 2 3 3 22 LYS H . 22 . HN 1 4 17 1 1 3 3 19 GLN O . 19 . O 1 4 17 1 2 3 3 23 MET N . 23 . N 1 4 18 1 1 3 3 19 GLN O . 19 . O 1 4 18 1 2 3 3 23 MET H . 23 . HN 1 4 19 1 1 3 3 20 ARG O . 20 . O 1 4 19 1 2 3 3 24 ALA N . 24 . N 1 4 20 1 1 3 3 20 ARG O . 20 . O 1 4 20 1 2 3 3 24 ALA H . 24 . HN 1 4 21 1 1 3 3 21 ARG O . 21 . O 1 4 21 1 2 3 3 25 LEU N . 25 . N 1 4 22 1 1 3 3 21 ARG O . 21 . O 1 4 22 1 2 3 3 25 LEU H . 25 . HN 1 4 23 1 1 3 3 34 GLU O . 34 . O 1 4 23 1 2 3 3 38 GLN N . 38 . N 1 4 24 1 1 3 3 34 GLU O . 34 . O 1 4 24 1 2 3 3 38 GLN H . 38 . HN 1 4 25 1 1 3 3 35 ILE O . 35 . O 1 4 25 1 2 3 3 39 LEU N . 39 . N 1 4 26 1 1 3 3 35 ILE O . 35 . O 1 4 26 1 2 3 3 39 LEU H . 39 . HN 1 4 27 1 1 3 3 36 SER O . 36 . O 1 4 27 1 2 3 3 40 GLY N . 40 . N 1 4 28 1 1 3 3 36 SER O . 36 . O 1 4 28 1 2 3 3 40 GLY H . 40 . HN 1 4 29 1 1 3 3 37 LYS O . 37 . O 1 4 29 1 2 3 3 41 TYR N . 41 . N 1 4 30 1 1 3 3 37 LYS O . 37 . O 1 4 30 1 2 3 3 41 TYR H . 41 . HN 1 4 31 1 1 3 3 38 GLN O . 38 . O 1 4 31 1 2 3 3 42 GLN N . 42 . N 1 4 32 1 1 3 3 38 GLN O . 38 . O 1 4 32 1 2 3 3 42 GLN H . 42 . HN 1 4 33 1 1 3 3 39 LEU O . 39 . O 1 4 33 1 2 3 3 43 TRP N . 43 . N 1 4 34 1 1 3 3 39 LEU O . 39 . O 1 4 34 1 2 3 3 43 TRP H . 43 . HN 1 4 35 1 1 3 3 40 GLY O . 40 . O 1 4 35 1 2 3 3 44 LYS N . 44 . N 1 4 36 1 1 3 3 40 GLY O . 40 . O 1 4 36 1 2 3 3 44 LYS H . 44 . HN 1 4 37 1 1 3 3 48 GLU O . 48 . O 1 4 37 1 2 3 3 52 TRP N . 52 . N 1 4 38 1 1 3 3 48 GLU O . 48 . O 1 4 38 1 2 3 3 52 TRP H . 52 . HN 1 4 39 1 1 3 3 50 GLU O . 50 . O 1 4 39 1 2 3 3 54 PHE N . 54 . N 1 4 40 1 1 3 3 50 GLU O . 50 . O 1 4 40 1 2 3 3 54 PHE H . 54 . HN 1 4 41 1 1 3 3 51 LYS O . 51 . O 1 4 41 1 2 3 3 55 PHE N . 55 . N 1 4 42 1 1 3 3 51 LYS O . 51 . O 1 4 42 1 2 3 3 55 PHE H . 55 . HN 1 4 43 1 1 3 3 52 TRP O . 52 . O 1 4 43 1 2 3 3 56 GLN N . 56 . N 1 4 44 1 1 3 3 52 TRP O . 52 . O 1 4 44 1 2 3 3 56 GLN H . 56 . HN 1 4 45 1 1 3 3 54 PHE O . 54 . O 1 4 45 1 2 3 3 58 ALA N . 58 . N 1 4 46 1 1 3 3 54 PHE O . 54 . O 1 4 46 1 2 3 3 58 ALA H . 58 . HN 1 4 47 1 1 3 3 55 PHE O . 55 . O 1 4 47 1 2 3 3 59 GLN N . 59 . N 1 4 48 1 1 3 3 55 PHE O . 55 . O 1 4 48 1 2 3 3 59 GLN H . 59 . HN 1 4 49 1 1 3 3 56 GLN O . 56 . O 1 4 49 1 2 3 3 60 LYS N . 60 . N 1 4 50 1 1 3 3 56 GLN O . 56 . O 1 4 50 1 2 3 3 60 LYS H . 60 . HN 1 4 51 1 1 3 3 57 GLU O . 57 . O 1 4 51 1 2 3 3 61 LEU N . 61 . N 1 4 52 1 1 3 3 57 GLU O . 57 . O 1 4 52 1 2 3 3 61 LEU H . 61 . HN 1 4 53 1 1 3 3 58 ALA O . 58 . O 1 4 53 1 2 3 3 62 GLN N . 62 . N 1 4 54 1 1 3 3 58 ALA O . 58 . O 1 4 54 1 2 3 3 62 GLN H . 62 . HN 1 4 55 1 1 3 3 59 GLN O . 59 . O 1 4 55 1 2 3 3 63 ALA N . 63 . N 1 4 56 1 1 3 3 59 GLN O . 59 . O 1 4 56 1 2 3 3 63 ALA H . 63 . HN 1 4 57 1 1 3 3 60 LYS O . 60 . O 1 4 57 1 2 3 3 64 MET N . 64 . N 1 4 58 1 1 3 3 60 LYS O . 60 . O 1 4 58 1 2 3 3 64 MET H . 64 . HN 1 4 59 1 1 3 3 61 LEU O . 61 . O 1 4 59 1 2 3 3 65 HIS N . 65 . N 1 4 60 1 1 3 3 61 LEU O . 61 . O 1 4 60 1 2 3 3 65 HIS H . 65 . HN 1 4 61 1 1 3 3 62 GLN O . 62 . O 1 4 61 1 2 3 3 66 ARG N . 66 . N 1 4 62 1 1 3 3 62 GLN O . 62 . O 1 4 62 1 2 3 3 66 ARG H . 66 . HN 1 4 63 1 1 3 3 63 ALA O . 63 . O 1 4 63 1 2 3 3 67 GLU N . 67 . N 1 4 64 1 1 3 3 63 ALA O . 63 . O 1 4 64 1 2 3 3 67 GLU H . 67 . HN 1 4 65 1 1 3 3 64 MET O . 64 . O 1 4 65 1 2 3 3 68 LYS N . 68 . N 1 4 66 1 1 3 3 64 MET O . 64 . O 1 4 66 1 2 3 3 68 LYS H . 68 . HN 1 4 67 1 1 3 3 66 ARG O . 66 . O 1 4 67 1 2 3 3 69 TYR H . 69 . HN 1 4 68 1 1 3 3 66 ARG O . 66 . O 1 4 68 1 2 3 3 69 TYR N . 69 . N 1 4 69 1 1 3 3 69 TYR O . 69 . O 1 4 69 1 2 3 3 72 TYR N . 72 . N 1 4 70 1 1 3 3 69 TYR O . 69 . O 1 4 70 1 2 3 3 72 TYR H . 72 . HN 1 4 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 . . . . . 2.8 2.4 3.8 1 4 2 1 . . . . . 1.8 1.5 2.8 1 4 3 1 . . . . . 2.8 2.4 3.5 1 4 4 1 . . . . . 1.8 1.5 2.5 1 4 5 1 . . . . . 2.8 2.4 3.5 1 4 6 1 . . . . . 1.8 1.5 2.5 1 4 7 1 . . . . . 2.8 2.4 3.5 1 4 8 1 . . . . . 1.8 1.5 2.5 1 4 9 1 . . . . . 2.8 2.4 3.5 1 4 10 1 . . . . . 1.8 1.5 2.5 1 4 11 1 . . . . . 2.8 2.4 3.5 1 4 12 1 . . . . . 1.8 1.5 2.5 1 4 13 1 . . . . . 2.8 2.4 3.5 1 4 14 1 . . . . . 1.8 1.5 2.5 1 4 15 1 . . . . . 2.8 2.4 3.5 1 4 16 1 . . . . . 1.8 1.5 2.5 1 4 17 1 . . . . . 2.8 2.4 3.6 1 4 18 1 . . . . . 1.8 1.5 2.6 1 4 19 1 . . . . . 2.8 2.4 3.5 1 4 20 1 . . . . . 1.8 1.5 2.5 1 4 21 1 . . . . . 2.8 2.4 3.5 1 4 22 1 . . . . . 1.8 1.5 2.5 1 4 23 1 . . . . . 2.8 2.4 3.5 1 4 24 1 . . . . . 1.8 1.5 2.5 1 4 25 1 . . . . . 2.8 2.4 3.5 1 4 26 1 . . . . . 1.8 1.5 2.5 1 4 27 1 . . . . . 2.8 2.4 3.5 1 4 28 1 . . . . . 1.8 1.5 2.5 1 4 29 1 . . . . . 2.8 2.4 3.5 1 4 30 1 . . . . . 1.8 1.5 2.5 1 4 31 1 . . . . . 2.8 2.4 3.5 1 4 32 1 . . . . . 1.8 1.5 2.5 1 4 33 1 . . . . . 2.8 2.4 3.5 1 4 34 1 . . . . . 1.8 1.5 2.5 1 4 35 1 . . . . . 2.8 2.4 3.5 1 4 36 1 . . . . . 1.8 1.5 2.5 1 4 37 1 . . . . . 2.8 2.4 4.0 1 4 38 1 . . . . . 1.8 1.5 3.0 1 4 39 1 . . . . . 2.8 2.4 4.0 1 4 40 1 . . . . . 1.8 1.5 3.0 1 4 41 1 . . . . . 2.8 2.4 4.0 1 4 42 1 . . . . . 1.8 1.5 3.0 1 4 43 1 . . . . . 2.8 2.4 4.0 1 4 44 1 . . . . . 1.8 1.5 3.0 1 4 45 1 . . . . . 2.8 2.4 3.5 1 4 46 1 . . . . . 1.8 1.5 2.5 1 4 47 1 . . . . . 2.8 2.4 3.5 1 4 48 1 . . . . . 1.8 1.5 2.5 1 4 49 1 . . . . . 2.8 2.4 4.0 1 4 50 1 . . . . . 1.8 1.5 3.0 1 4 51 1 . . . . . 2.8 2.4 3.5 1 4 52 1 . . . . . 1.8 1.5 2.5 1 4 53 1 . . . . . 2.8 2.4 3.5 1 4 54 1 . . . . . 1.8 1.5 2.5 1 4 55 1 . . . . . 2.8 2.4 3.5 1 4 56 1 . . . . . 1.8 1.5 2.5 1 4 57 1 . . . . . 2.8 2.4 3.5 1 4 58 1 . . . . . 1.8 1.5 2.5 1 4 59 1 . . . . . 2.8 2.4 3.5 1 4 60 1 . . . . . 1.8 1.5 2.5 1 4 61 1 . . . . . 2.8 2.4 3.5 1 4 62 1 . . . . . 1.8 1.5 2.5 1 4 63 1 . . . . . 2.8 2.4 3.5 1 4 64 1 . . . . . 1.8 1.5 2.5 1 4 65 1 . . . . . 2.8 2.4 3.5 1 4 66 1 . . . . . 1.8 1.5 2.5 1 4 67 1 . . . . . 1.8 1.5 2.5 1 4 68 1 . . . . . 2.8 2.5 3.5 1 4 69 1 . . . . . 2.8 2.5 3.5 1 4 70 1 . . . . . 1.8 1.5 2.5 1 4 stop_ save_ save_CNS/XPLOR_distance_constraints_7_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 5 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 5 2 1 . . . 1 5 3 1 . . . 1 5 4 1 . . . 1 5 5 1 . . . 1 5 6 1 . . . 1 5 7 1 . . . 1 5 8 1 . . . 1 5 9 1 . . . 1 5 10 1 . . . 1 5 11 1 . . . 1 5 12 1 . . . 1 5 13 1 . . . 1 5 14 1 . . . 1 5 15 1 . . . 1 5 16 1 . . . 1 5 17 1 . . . 1 5 18 1 . . . 1 5 19 1 . . . 1 5 20 1 . . . 1 5 21 1 . . . 1 5 22 1 . . . 1 5 23 1 . . . 1 5 24 1 . . . 1 5 25 1 . . . 1 5 26 1 . . . 1 5 27 1 . . . 1 5 28 1 . . . 1 5 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 DG N1 . 201 . N1 1 5 1 1 2 2 2 8 DC N3 . 216 . N3 1 5 2 1 1 1 1 1 DG H1 . 201 . H1 1 5 2 1 2 2 2 8 DC N3 . 216 . N3 1 5 3 1 1 1 1 1 DG O6 . 201 . O6 1 5 3 1 2 2 2 8 DC N4 . 216 . N4 1 5 4 1 1 1 1 1 DG N2 . 201 . N2 1 5 4 1 2 2 2 8 DC O2 . 216 . O2 1 5 5 1 1 1 1 2 DC N3 . 202 . N3 1 5 5 1 2 2 2 7 DG N1 . 215 . N1 1 5 6 1 1 1 1 2 DC N3 . 202 . N3 1 5 6 1 2 2 2 7 DG H1 . 215 . H1 1 5 7 1 1 1 1 2 DC N4 . 202 . N4 1 5 7 1 2 2 2 7 DG O6 . 215 . O6 1 5 8 1 1 1 1 2 DC O2 . 202 . O2 1 5 8 1 2 2 2 7 DG N2 . 215 . N2 1 5 9 1 1 1 1 4 DC N3 . 204 . N3 1 5 9 1 2 2 2 5 DG N1 . 213 . N1 1 5 10 1 1 1 1 4 DC N3 . 204 . N3 1 5 10 1 2 2 2 5 DG H1 . 213 . H1 1 5 11 1 1 1 1 4 DC N4 . 204 . N4 1 5 11 1 2 2 2 5 DG O6 . 213 . O6 1 5 12 1 1 1 1 4 DC O2 . 204 . O2 1 5 12 1 2 2 2 5 DG N2 . 213 . N2 1 5 13 1 1 1 1 8 DC N3 . 208 . N3 1 5 13 1 2 2 2 1 DG N1 . 209 . N1 1 5 14 1 1 1 1 8 DC N3 . 208 . N3 1 5 14 1 2 2 2 1 DG H1 . 209 . H1 1 5 15 1 1 1 1 8 DC N4 . 208 . N4 1 5 15 1 2 2 2 1 DG O6 . 209 . O6 1 5 16 1 1 1 1 8 DC O2 . 208 . O2 1 5 16 1 2 2 2 1 DG N2 . 209 . N2 1 5 17 1 1 1 1 3 DA N1 . 203 . N1 1 5 17 1 2 2 2 6 DT N3 . 214 . N3 1 5 18 1 1 1 1 3 DA N1 . 203 . N1 1 5 18 1 2 2 2 6 DT H3 . 214 . H3 1 5 19 1 1 1 1 3 DA N6 . 203 . N6 1 5 19 1 2 2 2 6 DT O4 . 214 . O4 1 5 20 1 1 1 1 5 DA N1 . 205 . N1 1 5 20 1 2 2 2 4 DT N3 . 212 . N3 1 5 21 1 1 1 1 5 DA N1 . 205 . N1 1 5 21 1 2 2 2 4 DT H3 . 212 . H3 1 5 22 1 1 1 1 5 DA N6 . 205 . N6 1 5 22 1 2 2 2 4 DT O4 . 212 . O4 1 5 23 1 1 1 1 6 DA N1 . 206 . N1 1 5 23 1 2 2 2 3 DT N3 . 211 . N3 1 5 24 1 1 1 1 6 DA N1 . 206 . N1 1 5 24 1 2 2 2 3 DT H3 . 211 . H3 1 5 25 1 1 1 1 6 DA N6 . 206 . N6 1 5 25 1 2 2 2 3 DT O4 . 211 . O4 1 5 26 1 1 1 1 7 DA N1 . 207 . N1 1 5 26 1 2 2 2 2 DT N3 . 210 . N3 1 5 27 1 1 1 1 7 DA N1 . 207 . N1 1 5 27 1 2 2 2 2 DT H3 . 210 . H3 1 5 28 1 1 1 1 7 DA N6 . 207 . N6 1 5 28 1 2 2 2 2 DT O4 . 210 . O4 1 5 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 . . . . . 2.95 2.75 3.15 1 5 2 1 . . . . . 1.95 1.75 2.15 1 5 3 1 . . . . . 2.91 2.71 3.11 1 5 4 1 . . . . . 2.86 2.66 3.06 1 5 5 1 . . . . . 2.95 2.75 3.15 1 5 6 1 . . . . . 1.95 1.75 2.15 1 5 7 1 . . . . . 2.91 2.71 3.11 1 5 8 1 . . . . . 2.86 2.66 3.06 1 5 9 1 . . . . . 2.95 2.75 3.15 1 5 10 1 . . . . . 1.95 1.75 2.15 1 5 11 1 . . . . . 2.91 2.71 3.11 1 5 12 1 . . . . . 2.86 2.66 3.06 1 5 13 1 . . . . . 2.95 2.75 3.15 1 5 14 1 . . . . . 1.95 1.75 2.15 1 5 15 1 . . . . . 2.91 2.71 3.11 1 5 16 1 . . . . . 2.86 2.66 3.06 1 5 17 1 . . . . . 2.82 2.62 3.02 1 5 18 1 . . . . . 1.82 1.62 2.02 1 5 19 1 . . . . . 2.95 2.75 3.15 1 5 20 1 . . . . . 2.82 2.62 3.02 1 5 21 1 . . . . . 1.82 1.62 2.02 1 5 22 1 . . . . . 2.95 2.75 3.15 1 5 23 1 . . . . . 2.82 2.62 3.02 1 5 24 1 . . . . . 1.82 1.62 2.02 1 5 25 1 . . . . . 2.95 2.75 3.15 1 5 26 1 . . . . . 2.82 2.62 3.02 1 5 27 1 . . . . . 1.82 1.62 2.02 1 5 28 1 . . . . . 2.95 2.75 3.15 1 5 stop_ save_ save_CNS/XPLOR_dihedral_12 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 3 3 3 ASP C 3 3 4 ARG N 3 3 4 ARG CA 3 3 4 ARG C -85.0 -65.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 2 . 3 3 4 ARG C 3 3 5 VAL N 3 3 5 VAL CA 3 3 5 VAL C -98.0 -78.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 3 . 3 3 5 VAL C 3 3 6 LYS N 3 3 6 LYS CA 3 3 6 LYS C -89.99999 -70.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 4 . 3 3 6 LYS C 3 3 7 ARG N 3 3 7 ARG CA 3 3 7 ARG C -150.0 -89.99999 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 5 . 3 3 7 ARG C 3 3 8 PRO N 3 3 8 PRO CA 3 3 8 PRO C -77.0 -37.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 6 . 3 3 8 PRO C 3 3 9 MET N 3 3 9 MET CA 3 3 9 MET C -75.0 -55.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 7 . 3 3 9 MET C 3 3 10 ASN N 3 3 10 ASN CA 3 3 10 ASN C -120.0 -60.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 8 . 3 3 10 ASN C 3 3 11 ALA N 3 3 11 ALA CA 3 3 11 ALA C -50.0 -30.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 9 . 3 3 11 ALA C 3 3 12 PHE N 3 3 12 PHE CA 3 3 12 PHE C -89.99999 -70.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 10 . 3 3 12 PHE C 3 3 13 ILE N 3 3 13 ILE CA 3 3 13 ILE C -75.0 -55.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 11 . 3 3 13 ILE C 3 3 14 VAL N 3 3 14 VAL CA 3 3 14 VAL C -63.0 -43.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 12 . 3 3 14 VAL C 3 3 15 TRP N 3 3 15 TRP CA 3 3 15 TRP C -65.0 -44.999996 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 13 . 3 3 15 TRP C 3 3 16 SER N 3 3 16 SER CA 3 3 16 SER C -65.0 -25.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 14 . 3 3 16 SER C 3 3 17 ARG N 3 3 17 ARG CA 3 3 17 ARG C -50.0 -30.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 15 . 3 3 17 ARG C 3 3 18 ASP N 3 3 18 ASP CA 3 3 18 ASP C -83.0 -63.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 16 . 3 3 18 ASP C 3 3 19 GLN N 3 3 19 GLN CA 3 3 19 GLN C -73.0 -53.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 17 . 3 3 19 GLN C 3 3 20 ARG N 3 3 20 ARG CA 3 3 20 ARG C -58.0 -38.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 18 . 3 3 20 ARG C 3 3 21 ARG N 3 3 21 ARG CA 3 3 21 ARG C -73.0 -53.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 19 . 3 3 21 ARG C 3 3 22 LYS N 3 3 22 LYS CA 3 3 22 LYS C -78.0 -58.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 20 . 3 3 22 LYS C 3 3 23 MET N 3 3 23 MET CA 3 3 23 MET C -73.0 -53.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 21 . 3 3 23 MET C 3 3 24 ALA N 3 3 24 ALA CA 3 3 24 ALA C -80.0 -60.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 22 . 3 3 24 ALA C 3 3 25 LEU N 3 3 25 LEU CA 3 3 25 LEU C -77.0 -57.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 23 . 3 3 25 LEU C 3 3 26 GLU N 3 3 26 GLU CA 3 3 26 GLU C -88.0 -68.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 24 . 3 3 26 GLU C 3 3 27 ASN N 3 3 27 ASN CA 3 3 27 ASN C -140.0 -100.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 25 . 3 3 27 ASN C 3 3 28 PRO N 3 3 28 PRO CA 3 3 28 PRO C -87.0 -26.999998 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 26 . 3 3 28 PRO C 3 3 29 ARG N 3 3 29 ARG CA 3 3 29 ARG C -135.0 -105.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 27 . 3 3 29 ARG C 3 3 30 MET N 3 3 30 MET CA 3 3 30 MET C -88.0 -68.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 28 . 3 3 30 MET C 3 3 31 ARG N 3 3 31 ARG CA 3 3 31 ARG C -85.0 -65.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 29 . 3 3 32 ASN C 3 3 33 SER N 3 3 33 SER CA 3 3 33 SER C -120.0 -60.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 30 . 3 3 33 SER C 3 3 34 GLU N 3 3 34 GLU CA 3 3 34 GLU C -95.0 -75.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 31 . 3 3 34 GLU C 3 3 35 ILE N 3 3 35 ILE CA 3 3 35 ILE C -60.0 -40.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 32 . 3 3 35 ILE C 3 3 36 SER N 3 3 36 SER CA 3 3 36 SER C -89.99999 -50.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 33 . 3 3 36 SER C 3 3 37 LYS N 3 3 37 LYS CA 3 3 37 LYS C -73.0 -53.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 34 . 3 3 37 LYS C 3 3 38 GLN N 3 3 38 GLN CA 3 3 38 GLN C -78.0 -58.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 35 . 3 3 38 GLN C 3 3 39 LEU N 3 3 39 LEU CA 3 3 39 LEU C -70.0 -50.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 36 . 3 3 39 LEU C 3 3 40 GLY N 3 3 40 GLY CA 3 3 40 GLY C -68.0 -47.999996 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 37 . 3 3 40 GLY C 3 3 41 TYR N 3 3 41 TYR CA 3 3 41 TYR C -70.0 -50.0 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 38 . 3 3 41 TYR C 3 3 42 GLN N 3 3 42 GLN CA 3 3 42 GLN C -75.0 -55.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 39 . 3 3 42 GLN C 3 3 43 TRP N 3 3 43 TRP CA 3 3 43 TRP C -89.99999 -50.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 40 . 3 3 43 TRP C 3 3 44 LYS N 3 3 44 LYS CA 3 3 44 LYS C -75.0 -55.0 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 41 . 3 3 44 LYS C 3 3 45 MET N 3 3 45 MET CA 3 3 45 MET C -158.0 -138.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 42 . 3 3 45 MET C 3 3 46 LEU N 3 3 46 LEU CA 3 3 46 LEU C -85.0 -44.999996 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 43 . 3 3 46 LEU C 3 3 47 THR N 3 3 47 THR CA 3 3 47 THR C -85.0 -65.0 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 44 . 3 3 47 THR C 3 3 48 GLU N 3 3 48 GLU CA 3 3 48 GLU C -70.0 -30.0 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1 45 . 3 3 48 GLU C 3 3 49 ALA N 3 3 49 ALA CA 3 3 49 ALA C -73.0 -53.0 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 46 . 3 3 49 ALA C 3 3 50 GLU N 3 3 50 GLU CA 3 3 50 GLU C -110.0 -70.0 . 49 . C . 50 . N . 50 . CA . 50 . C 1 1 47 . 3 3 50 GLU C 3 3 51 LYS N 3 3 51 LYS CA 3 3 51 LYS C -85.0 -65.0 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 48 . 3 3 51 LYS C 3 3 52 TRP N 3 3 52 TRP CA 3 3 52 TRP C -53.0 -33.0 . 51 . C . 52 . N . 52 . CA . 52 . C 1 1 49 . 3 3 52 TRP C 3 3 53 PRO N 3 3 53 PRO CA 3 3 53 PRO C -87.0 -26.999998 . 52 . C . 53 . N . 53 . CA . 53 . C 1 1 50 . 3 3 53 PRO C 3 3 54 PHE N 3 3 54 PHE CA 3 3 54 PHE C -95.0 -55.0 . 53 . C . 54 . N . 54 . CA . 54 . C 1 1 51 . 3 3 54 PHE C 3 3 55 PHE N 3 3 55 PHE CA 3 3 55 PHE C -89.99999 -60.0 . 54 . C . 55 . N . 55 . CA . 55 . C 1 1 52 . 3 3 55 PHE C 3 3 56 GLN N 3 3 56 GLN CA 3 3 56 GLN C -65.0 -44.999996 . 55 . C . 56 . N . 56 . CA . 56 . C 1 1 53 . 3 3 56 GLN C 3 3 57 GLU N 3 3 57 GLU CA 3 3 57 GLU C -73.0 -53.0 . 56 . C . 57 . N . 57 . CA . 57 . C 1 1 54 . 3 3 57 GLU C 3 3 58 ALA N 3 3 58 ALA CA 3 3 58 ALA C -65.0 -44.999996 . 57 . C . 58 . N . 58 . CA . 58 . C 1 1 55 . 3 3 58 ALA C 3 3 59 GLN N 3 3 59 GLN CA 3 3 59 GLN C -80.0 -60.0 . 58 . C . 59 . N . 59 . CA . 59 . C 1 1 56 . 3 3 59 GLN C 3 3 60 LYS N 3 3 60 LYS CA 3 3 60 LYS C -73.0 -53.0 . 59 . C . 60 . N . 60 . CA . 60 . C 1 1 57 . 3 3 60 LYS C 3 3 61 LEU N 3 3 61 LEU CA 3 3 61 LEU C -60.0 -20.0 . 60 . C . 61 . N . 61 . CA . 61 . C 1 1 58 . 3 3 61 LEU C 3 3 62 GLN N 3 3 62 GLN CA 3 3 62 GLN C -73.0 -53.0 . 61 . C . 62 . N . 62 . CA . 62 . C 1 1 59 . 3 3 62 GLN C 3 3 63 ALA N 3 3 63 ALA CA 3 3 63 ALA C -70.0 -50.0 . 62 . C . 63 . N . 63 . CA . 63 . C 1 1 60 . 3 3 63 ALA C 3 3 64 MET N 3 3 64 MET CA 3 3 64 MET C -75.0 -55.0 . 63 . C . 64 . N . 64 . CA . 64 . C 1 1 61 . 3 3 64 MET C 3 3 65 HIS N 3 3 65 HIS CA 3 3 65 HIS C -73.0 -53.0 . 64 . C . 65 . N . 65 . CA . 65 . C 1 1 62 . 3 3 65 HIS C 3 3 66 ARG N 3 3 66 ARG CA 3 3 66 ARG C -75.0 -55.0 . 65 . C . 66 . N . 66 . CA . 66 . C 1 1 63 . 3 3 66 ARG C 3 3 67 GLU N 3 3 67 GLU CA 3 3 67 GLU C -85.0 -65.0 . 66 . C . 67 . N . 67 . CA . 67 . C 1 1 64 . 3 3 67 GLU C 3 3 68 LYS N 3 3 68 LYS CA 3 3 68 LYS C -93.0 -73.0 . 67 . C . 68 . N . 68 . CA . 68 . C 1 1 65 . 3 3 68 LYS C 3 3 69 TYR N 3 3 69 TYR CA 3 3 69 TYR C -150.0 -110.0 . 68 . C . 69 . N . 69 . CA . 69 . C 1 1 66 . 3 3 69 TYR C 3 3 70 PRO N 3 3 70 PRO CA 3 3 70 PRO C -89.99999 -30.0 . 69 . C . 70 . N . 70 . CA . 70 . C 1 1 67 . 3 3 70 PRO C 3 3 71 ASN N 3 3 71 ASN CA 3 3 71 ASN C -120.0 0.0 . 70 . C . 71 . N . 71 . CA . 71 . C 1 1 68 . 3 3 71 ASN C 3 3 72 TYR N 3 3 72 TYR CA 3 3 72 TYR C -89.99999 -30.0 . 71 . C . 72 . N . 72 . CA . 72 . C 1 1 69 . 3 3 72 TYR C 3 3 73 LYS N 3 3 73 LYS CA 3 3 73 LYS C -140.0 -100.0 . 72 . C . 73 . N . 73 . CA . 73 . C 1 1 70 . 3 3 73 LYS C 3 3 74 TYR N 3 3 74 TYR CA 3 3 74 TYR C -80.0 -40.0 . 73 . C . 74 . N . 74 . CA . 74 . C 1 1 71 . 3 3 74 TYR C 3 3 75 ARG N 3 3 75 ARG CA 3 3 75 ARG C -140.0 -100.0 . 74 . C . 75 . N . 75 . CA . 75 . C 1 1 72 . 3 3 3 ASP N 3 3 3 ASP CA 3 3 3 ASP C 3 3 4 ARG N -120.0 -80.0 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 73 . 3 3 4 ARG N 3 3 4 ARG CA 3 3 4 ARG C 3 3 5 VAL N 60.0 140.0 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 74 . 3 3 5 VAL N 3 3 5 VAL CA 3 3 5 VAL C 3 3 6 LYS N 130.0 190.0 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 75 . 3 3 6 LYS N 3 3 6 LYS CA 3 3 6 LYS C 3 3 7 ARG N 120.0 179.99998 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 76 . 3 3 69 TYR N 3 3 69 TYR CA 3 3 69 TYR C 3 3 70 PRO N 40.0 100.0 . 69 . N . 69 . CA . 69 . C . 70 . N 1 1 77 . 3 3 70 PRO N 3 3 70 PRO CA 3 3 70 PRO C 3 3 71 ASN N -89.99999 -30.0 . 70 . N . 70 . CA . 70 . C . 71 . N 1 1 78 . 3 3 71 ASN N 3 3 71 ASN CA 3 3 71 ASN C 3 3 72 TYR N -30.0 30.0 . 71 . N . 71 . CA . 71 . C . 72 . N 1 1 79 . 3 3 72 TYR N 3 3 72 TYR CA 3 3 72 TYR C 3 3 73 LYS N 60.0 120.0 . 72 . N . 72 . CA . 72 . C . 73 . N 1 1 80 . 3 3 73 LYS N 3 3 73 LYS CA 3 3 73 LYS C 3 3 74 TYR N 125.0 195.0 . 73 . N . 73 . CA . 73 . C . 74 . N 1 1 81 . 3 3 74 TYR N 3 3 74 TYR CA 3 3 74 TYR C 3 3 75 ARG N 110.0 179.99998 . 74 . N . 74 . CA . 74 . C . 75 . N 1 1 82 . 3 3 4 ARG N 3 3 4 ARG CA 3 3 4 ARG CB 3 3 4 ARG CG -80.0 -40.0 . 4 . N . 4 . CA . 4 . CB . 4 . CG 1 1 83 . 3 3 5 VAL N 3 3 5 VAL CA 3 3 5 VAL CB 3 3 5 VAL CG1 160.0 200.0 . 5 . N . 5 . CA . 5 . CB . 5 . CG1 1 1 84 . 3 3 7 ARG N 3 3 7 ARG CA 3 3 7 ARG CB 3 3 7 ARG CG 40.0 80.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 85 . 3 3 9 MET N 3 3 9 MET CA 3 3 9 MET CB 3 3 9 MET CG -80.0 -40.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1 86 . 3 3 10 ASN N 3 3 10 ASN CA 3 3 10 ASN CB 3 3 10 ASN CG -80.0 -40.0 . 10 . N . 10 . CA . 10 . CB . 10 . CG 1 1 87 . 3 3 12 PHE N 3 3 12 PHE CA 3 3 12 PHE CB 3 3 12 PHE CG 160.0 200.0 . 12 . N . 12 . CA . 12 . CB . 12 . CG 1 1 88 . 3 3 13 ILE N 3 3 13 ILE CA 3 3 13 ILE CB 3 3 13 ILE CG1 -80.0 -40.0 . 13 . N . 13 . CA . 13 . CB . 13 . CG1 1 1 89 . 3 3 14 VAL N 3 3 14 VAL CA 3 3 14 VAL CB 3 3 14 VAL CG1 160.0 200.0 . 14 . N . 14 . CA . 14 . CB . 14 . CG1 1 1 90 . 3 3 15 TRP N 3 3 15 TRP CA 3 3 15 TRP CB 3 3 15 TRP CG -80.0 -40.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 91 . 3 3 16 SER N 3 3 16 SER CA 3 3 16 SER CB 3 3 16 SER OG 160.0 200.0 . 16 . N . 16 . CA . 16 . CB . 16 . OG 1 1 92 . 3 3 17 ARG N 3 3 17 ARG CA 3 3 17 ARG CB 3 3 17 ARG CG -80.0 -40.0 . 17 . N . 17 . CA . 17 . CB . 17 . CG 1 1 93 . 3 3 18 ASP N 3 3 18 ASP CA 3 3 18 ASP CB 3 3 18 ASP CG -80.0 -40.0 . 18 . N . 18 . CA . 18 . CB . 18 . CG 1 1 94 . 3 3 19 GLN N 3 3 19 GLN CA 3 3 19 GLN CB 3 3 19 GLN CG 160.0 200.0 . 19 . N . 19 . CA . 19 . CB . 19 . CG 1 1 95 . 3 3 21 ARG N 3 3 21 ARG CA 3 3 21 ARG CB 3 3 21 ARG CG 160.0 200.0 . 21 . N . 21 . CA . 21 . CB . 21 . CG 1 1 96 . 3 3 22 LYS N 3 3 22 LYS CA 3 3 22 LYS CB 3 3 22 LYS CG 160.0 200.0 . 22 . N . 22 . CA . 22 . CB . 22 . CG 1 1 97 . 3 3 23 MET N 3 3 23 MET CA 3 3 23 MET CB 3 3 23 MET CG 160.0 200.0 . 23 . N . 23 . CA . 23 . CB . 23 . CG 1 1 98 . 3 3 25 LEU N 3 3 25 LEU CA 3 3 25 LEU CB 3 3 25 LEU CG -80.0 -40.0 . 25 . N . 25 . CA . 25 . CB . 25 . CG 1 1 99 . 3 3 26 GLU N 3 3 26 GLU CA 3 3 26 GLU CB 3 3 26 GLU CG -80.0 -40.0 . 26 . N . 26 . CA . 26 . CB . 26 . CG 1 1 100 . 3 3 27 ASN N 3 3 27 ASN CA 3 3 27 ASN CB 3 3 27 ASN CG -80.0 -40.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1 101 . 3 3 29 ARG N 3 3 29 ARG CA 3 3 29 ARG CB 3 3 29 ARG CG -89.99999 -30.0 . 29 . N . 29 . CA . 29 . CB . 29 . CG 1 1 102 . 3 3 30 MET N 3 3 30 MET CA 3 3 30 MET CB 3 3 30 MET CG -80.0 -40.0 . 30 . N . 30 . CA . 30 . CB . 30 . CG 1 1 103 . 3 3 31 ARG N 3 3 31 ARG CA 3 3 31 ARG CB 3 3 31 ARG CG -80.0 -40.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 104 . 3 3 33 SER N 3 3 33 SER CA 3 3 33 SER CB 3 3 33 SER OG -89.99999 -30.0 . 33 . N . 33 . CA . 33 . CB . 33 . OG 1 1 105 . 3 3 34 GLU N 3 3 34 GLU CA 3 3 34 GLU CB 3 3 34 GLU CG -80.0 -40.0 . 34 . N . 34 . CA . 34 . CB . 34 . CG 1 1 106 . 3 3 35 ILE N 3 3 35 ILE CA 3 3 35 ILE CB 3 3 35 ILE CG1 160.0 200.0 . 35 . N . 35 . CA . 35 . CB . 35 . CG1 1 1 107 . 3 3 36 SER N 3 3 36 SER CA 3 3 36 SER CB 3 3 36 SER OG -80.0 -40.0 . 36 . N . 36 . CA . 36 . CB . 36 . OG 1 1 108 . 3 3 37 LYS N 3 3 37 LYS CA 3 3 37 LYS CB 3 3 37 LYS CG -80.0 -40.0 . 37 . N . 37 . CA . 37 . CB . 37 . CG 1 1 109 . 3 3 38 GLN N 3 3 38 GLN CA 3 3 38 GLN CB 3 3 38 GLN CG -80.0 -40.0 . 38 . N . 38 . CA . 38 . CB . 38 . CG 1 1 110 . 3 3 39 LEU N 3 3 39 LEU CA 3 3 39 LEU CB 3 3 39 LEU CG -80.0 -40.0 . 39 . N . 39 . CA . 39 . CB . 39 . CG 1 1 111 . 3 3 41 TYR N 3 3 41 TYR CA 3 3 41 TYR CB 3 3 41 TYR CG 160.0 200.0 . 41 . N . 41 . CA . 41 . CB . 41 . CG 1 1 112 . 3 3 42 GLN N 3 3 42 GLN CA 3 3 42 GLN CB 3 3 42 GLN CG -80.0 -40.0 . 42 . N . 42 . CA . 42 . CB . 42 . CG 1 1 113 . 3 3 43 TRP N 3 3 43 TRP CA 3 3 43 TRP CB 3 3 43 TRP CG -80.0 -40.0 . 43 . N . 43 . CA . 43 . CB . 43 . CG 1 1 114 . 3 3 44 LYS N 3 3 44 LYS CA 3 3 44 LYS CB 3 3 44 LYS CG -80.0 -40.0 . 44 . N . 44 . CA . 44 . CB . 44 . CG 1 1 115 . 3 3 45 MET N 3 3 45 MET CA 3 3 45 MET CB 3 3 45 MET CG -80.0 -40.0 . 45 . N . 45 . CA . 45 . CB . 45 . CG 1 1 116 . 3 3 46 LEU N 3 3 46 LEU CA 3 3 46 LEU CB 3 3 46 LEU CG -80.0 -40.0 . 46 . N . 46 . CA . 46 . CB . 46 . CG 1 1 117 . 3 3 47 THR N 3 3 47 THR CA 3 3 47 THR CB 3 3 47 THR OG1 40.0 80.0 . 47 . N . 47 . CA . 47 . CB . 47 . OG1 1 1 118 . 3 3 48 GLU N 3 3 48 GLU CA 3 3 48 GLU CB 3 3 48 GLU CG -80.0 -40.0 . 48 . N . 48 . CA . 48 . CB . 48 . CG 1 1 119 . 3 3 50 GLU N 3 3 50 GLU CA 3 3 50 GLU CB 3 3 50 GLU CG -80.0 -40.0 . 50 . N . 50 . CA . 50 . CB . 50 . CG 1 1 120 . 3 3 51 LYS N 3 3 51 LYS CA 3 3 51 LYS CB 3 3 51 LYS CG -80.0 -40.0 . 51 . N . 51 . CA . 51 . CB . 51 . CG 1 1 121 . 3 3 52 TRP N 3 3 52 TRP CA 3 3 52 TRP CB 3 3 52 TRP CG 160.0 200.0 . 52 . N . 52 . CA . 52 . CB . 52 . CG 1 1 122 . 3 3 54 PHE N 3 3 54 PHE CA 3 3 54 PHE CB 3 3 54 PHE CG 40.0 80.0 . 54 . N . 54 . CA . 54 . CB . 54 . CG 1 1 123 . 3 3 55 PHE N 3 3 55 PHE CA 3 3 55 PHE CB 3 3 55 PHE CG -89.99999 -30.0 . 55 . N . 55 . CA . 55 . CB . 55 . CG 1 1 124 . 3 3 56 GLN N 3 3 56 GLN CA 3 3 56 GLN CB 3 3 56 GLN CG -80.0 -40.0 . 56 . N . 56 . CA . 56 . CB . 56 . CG 1 1 125 . 3 3 57 GLU N 3 3 57 GLU CA 3 3 57 GLU CB 3 3 57 GLU CG 160.0 200.0 . 57 . N . 57 . CA . 57 . CB . 57 . CG 1 1 126 . 3 3 59 GLN N 3 3 59 GLN CA 3 3 59 GLN CB 3 3 59 GLN CG -80.0 -40.0 . 59 . N . 59 . CA . 59 . CB . 59 . CG 1 1 127 . 3 3 60 LYS N 3 3 60 LYS CA 3 3 60 LYS CB 3 3 60 LYS CG 40.0 80.0 . 60 . N . 60 . CA . 60 . CB . 60 . CG 1 1 128 . 3 3 61 LEU N 3 3 61 LEU CA 3 3 61 LEU CB 3 3 61 LEU CG -80.0 -40.0 . 61 . N . 61 . CA . 61 . CB . 61 . CG 1 1 129 . 3 3 64 MET N 3 3 64 MET CA 3 3 64 MET CB 3 3 64 MET CG -80.0 -40.0 . 64 . N . 64 . CA . 64 . CB . 64 . CG 1 1 130 . 3 3 65 HIS N 3 3 65 HIS CA 3 3 65 HIS CB 3 3 65 HIS CG -80.0 -40.0 . 65 . N . 65 . CA . 65 . CB . 65 . CG 1 1 131 . 3 3 67 GLU N 3 3 67 GLU CA 3 3 67 GLU CB 3 3 67 GLU CG -80.0 -40.0 . 67 . N . 67 . CA . 67 . CB . 67 . CG 1 1 132 . 3 3 68 LYS N 3 3 68 LYS CA 3 3 68 LYS CB 3 3 68 LYS CG -80.0 -40.0 . 68 . N . 68 . CA . 68 . CB . 68 . CG 1 1 133 . 3 3 69 TYR N 3 3 69 TYR CA 3 3 69 TYR CB 3 3 69 TYR CG -80.0 -40.0 . 69 . N . 69 . CA . 69 . CB . 69 . CG 1 1 134 . 3 3 71 ASN N 3 3 71 ASN CA 3 3 71 ASN CB 3 3 71 ASN CG -80.0 -40.0 . 71 . N . 71 . CA . 71 . CB . 71 . CG 1 1 135 . 3 3 72 TYR N 3 3 72 TYR CA 3 3 72 TYR CB 3 3 72 TYR CG 160.0 200.0 . 72 . N . 72 . CA . 72 . CB . 72 . CG 1 1 136 . 3 3 73 LYS N 3 3 73 LYS CA 3 3 73 LYS CB 3 3 73 LYS CG -80.0 -40.0 . 73 . N . 73 . CA . 73 . CB . 73 . CG 1 1 137 . 3 3 74 TYR N 3 3 74 TYR CA 3 3 74 TYR CB 3 3 74 TYR CG -80.0 -40.0 . 74 . N . 74 . CA . 74 . CB . 74 . CG 1 1 138 . 3 3 12 PHE CA 3 3 12 PHE CB 3 3 12 PHE CG 3 3 12 PHE CD1 70.0 110.0 . 12 . CA . 12 . CB . 12 . CG . 12 . CD1 1 1 139 . 3 3 15 TRP CA 3 3 15 TRP CB 3 3 15 TRP CG 3 3 15 TRP CD1 -70.0 -30.0 . 15 . CA . 15 . CB . 15 . CG . 15 . CD1 1 1 140 . 3 3 41 TYR CA 3 3 41 TYR CB 3 3 41 TYR CG 3 3 41 TYR CD1 70.0 110.0 . 41 . CA . 41 . CB . 41 . CG . 41 . CD1 1 1 141 . 3 3 52 TRP CA 3 3 52 TRP CB 3 3 52 TRP CG 3 3 52 TRP CD1 40.0 80.0 . 52 . CA . 52 . CB . 52 . CG . 52 . CD1 1 1 142 . 3 3 54 PHE CA 3 3 54 PHE CB 3 3 54 PHE CG 3 3 54 PHE CD1 70.0 110.0 . 54 . CA . 54 . CB . 54 . CG . 54 . CD1 1 1 143 . 3 3 55 PHE CA 3 3 55 PHE CB 3 3 55 PHE CG 3 3 55 PHE CD1 70.0 110.0 . 55 . CA . 55 . CB . 55 . CG . 55 . CD1 1 1 144 . 3 3 65 HIS CA 3 3 65 HIS CB 3 3 65 HIS CG 3 3 65 HIS ND1 150.0 210.0 . 65 . CA . 65 . CB . 65 . CG . 65 . ND1 1 1 145 . 3 3 69 TYR CA 3 3 69 TYR CB 3 3 69 TYR CG 3 3 69 TYR CD1 60.0 120.0 . 69 . CA . 69 . CB . 69 . CG . 69 . CD1 1 1 146 . 3 3 72 TYR CA 3 3 72 TYR CB 3 3 72 TYR CG 3 3 72 TYR CD1 60.0 120.0 . 72 . CA . 72 . CB . 72 . CG . 72 . CD1 1 1 147 . 3 3 74 TYR CA 3 3 74 TYR CB 3 3 74 TYR CG 3 3 74 TYR CD1 60.0 120.0 . 74 . CA . 74 . CB . 74 . CG . 74 . CD1 1 1 148 . 3 3 13 ILE CA 3 3 13 ILE CB 3 3 13 ILE CG1 3 3 13 ILE CD1 160.0 200.0 . 13 . CA . 13 . CB . 13 . CG1 . 13 . CD1 1 1 149 . 3 3 25 LEU CA 3 3 25 LEU CB 3 3 25 LEU CG 3 3 25 LEU CD1 160.0 200.0 . 25 . CA . 25 . CB . 25 . CG . 25 . CD1 1 1 150 . 3 3 35 ILE CA 3 3 35 ILE CB 3 3 35 ILE CG1 3 3 35 ILE CD1 -80.0 -40.0 . 35 . CA . 35 . CB . 35 . CG1 . 35 . CD1 1 1 151 . 3 3 39 LEU CA 3 3 39 LEU CB 3 3 39 LEU CG 3 3 39 LEU CD1 160.0 200.0 . 39 . CA . 39 . CB . 39 . CG . 39 . CD1 1 1 152 . 3 3 46 LEU CA 3 3 46 LEU CB 3 3 46 LEU CG 3 3 46 LEU CD1 160.0 200.0 . 46 . CA . 46 . CB . 46 . CG . 46 . CD1 1 1 153 . 3 3 61 LEU CA 3 3 61 LEU CB 3 3 61 LEU CG 3 3 61 LEU CD1 -80.0 -40.0 . 61 . CA . 61 . CB . 61 . CG . 61 . CD1 1 1 154 . 1 1 1 DG C4' 1 1 1 DG C3' 1 1 1 DG O3' 1 1 2 DC P -230.00002 -130.0 . 201 . C4' . 201 . C3' . 201 . O3' . 202 . P 1 1 155 . 1 1 1 DG C3' 1 1 1 DG O3' 1 1 2 DC P 1 1 2 DC O5' -135.0 -35.0 . 201 . C3' . 201 . O3' . 202 . P . 202 . O5' 1 1 156 . 1 1 1 DG O3' 1 1 2 DC P 1 1 2 DC O5' 1 1 2 DC C5' -110.0 -10.0 . 201 . O3' . 202 . P . 202 . O5' . 202 . C5' 1 1 157 . 1 1 2 DC P 1 1 2 DC O5' 1 1 2 DC C5' 1 1 2 DC C4' 130.0 230.00002 . 202 . P . 202 . O5' . 202 . C5' . 202 . C4' 1 1 158 . 1 1 2 DC C4' 1 1 2 DC C3' 1 1 2 DC O3' 1 1 3 DA P -230.00002 -130.0 . 202 . C4' . 202 . C3' . 202 . O3' . 203 . P 1 1 159 . 1 1 2 DC C3' 1 1 2 DC O3' 1 1 3 DA P 1 1 3 DA O5' -135.0 -35.0 . 202 . C3' . 202 . O3' . 203 . P . 203 . O5' 1 1 160 . 1 1 2 DC O3' 1 1 3 DA P 1 1 3 DA O5' 1 1 3 DA C5' -110.0 -10.0 . 202 . O3' . 203 . P . 203 . O5' . 203 . C5' 1 1 161 . 1 1 3 DA P 1 1 3 DA O5' 1 1 3 DA C5' 1 1 3 DA C4' 130.0 230.00002 . 203 . P . 203 . O5' . 203 . C5' . 203 . C4' 1 1 162 . 1 1 3 DA C4' 1 1 3 DA C3' 1 1 3 DA O3' 1 1 4 DC P -230.00002 -130.0 . 203 . C4' . 203 . C3' . 203 . O3' . 204 . P 1 1 163 . 1 1 3 DA C3' 1 1 3 DA O3' 1 1 4 DC P 1 1 4 DC O5' -135.0 -35.0 . 203 . C3' . 203 . O3' . 204 . P . 204 . O5' 1 1 164 . 1 1 3 DA O3' 1 1 4 DC P 1 1 4 DC O5' 1 1 4 DC C5' -110.0 -10.0 . 203 . O3' . 204 . P . 204 . O5' . 204 . C5' 1 1 165 . 1 1 4 DC P 1 1 4 DC O5' 1 1 4 DC C5' 1 1 4 DC C4' 130.0 230.00002 . 204 . P . 204 . O5' . 204 . C5' . 204 . C4' 1 1 166 . 1 1 4 DC C4' 1 1 4 DC C3' 1 1 4 DC O3' 1 1 5 DA P -230.00002 -130.0 . 204 . C4' . 204 . C3' . 204 . O3' . 205 . P 1 1 167 . 1 1 4 DC C3' 1 1 4 DC O3' 1 1 5 DA P 1 1 5 DA O5' -135.0 -35.0 . 204 . C3' . 204 . O3' . 205 . P . 205 . O5' 1 1 168 . 1 1 4 DC O3' 1 1 5 DA P 1 1 5 DA O5' 1 1 5 DA C5' -110.0 -10.0 . 204 . O3' . 205 . P . 205 . O5' . 205 . C5' 1 1 169 . 1 1 5 DA P 1 1 5 DA O5' 1 1 5 DA C5' 1 1 5 DA C4' 130.0 230.00002 . 205 . P . 205 . O5' . 205 . C5' . 205 . C4' 1 1 170 . 1 1 5 DA C4' 1 1 5 DA C3' 1 1 5 DA O3' 1 1 6 DA P -230.00002 -130.0 . 205 . C4' . 205 . C3' . 205 . O3' . 206 . P 1 1 171 . 1 1 5 DA C3' 1 1 5 DA O3' 1 1 6 DA P 1 1 6 DA O5' -135.0 -35.0 . 205 . C3' . 205 . O3' . 206 . P . 206 . O5' 1 1 172 . 1 1 5 DA O3' 1 1 6 DA P 1 1 6 DA O5' 1 1 6 DA C5' -110.0 -10.0 . 205 . O3' . 206 . P . 206 . O5' . 206 . C5' 1 1 173 . 1 1 6 DA P 1 1 6 DA O5' 1 1 6 DA C5' 1 1 6 DA C4' 130.0 230.00002 . 206 . P . 206 . O5' . 206 . C5' . 206 . C4' 1 1 174 . 1 1 6 DA C4' 1 1 6 DA C3' 1 1 6 DA O3' 1 1 7 DA P -230.00002 -130.0 . 206 . C4' . 206 . C3' . 206 . O3' . 207 . P 1 1 175 . 1 1 6 DA C3' 1 1 6 DA O3' 1 1 7 DA P 1 1 7 DA O5' -135.0 -35.0 . 206 . C3' . 206 . O3' . 207 . P . 207 . O5' 1 1 176 . 1 1 6 DA O3' 1 1 7 DA P 1 1 7 DA O5' 1 1 7 DA C5' -110.0 -10.0 . 206 . O3' . 207 . P . 207 . O5' . 207 . C5' 1 1 177 . 1 1 7 DA P 1 1 7 DA O5' 1 1 7 DA C5' 1 1 7 DA C4' 130.0 230.00002 . 207 . P . 207 . O5' . 207 . C5' . 207 . C4' 1 1 178 . 1 1 7 DA C4' 1 1 7 DA C3' 1 1 7 DA O3' 1 1 8 DC P -230.00002 -130.0 . 207 . C4' . 207 . C3' . 207 . O3' . 208 . P 1 1 179 . 1 1 7 DA C3' 1 1 7 DA O3' 1 1 8 DC P 1 1 8 DC O5' -135.0 -35.0 . 207 . C3' . 207 . O3' . 208 . P . 208 . O5' 1 1 180 . 1 1 7 DA O3' 1 1 8 DC P 1 1 8 DC O5' 1 1 8 DC C5' -110.0 -10.0 . 207 . O3' . 208 . P . 208 . O5' . 208 . C5' 1 1 181 . 1 1 8 DC P 1 1 8 DC O5' 1 1 8 DC C5' 1 1 8 DC C4' 130.0 230.00002 . 208 . P . 208 . O5' . 208 . C5' . 208 . C4' 1 1 182 . 2 2 1 DG C4' 2 2 1 DG C3' 2 2 1 DG O3' 2 2 2 DT P -230.00002 -130.0 . 209 . C4' . 209 . C3' . 209 . O3' . 210 . P 1 1 183 . 2 2 1 DG C3' 2 2 1 DG O3' 2 2 2 DT P 2 2 2 DT O5' -135.0 -35.0 . 209 . C3' . 209 . O3' . 210 . P . 210 . O5' 1 1 184 . 2 2 1 DG O3' 2 2 2 DT P 2 2 2 DT O5' 2 2 2 DT C5' -110.0 -10.0 . 209 . O3' . 210 . P . 210 . O5' . 210 . C5' 1 1 185 . 2 2 2 DT P 2 2 2 DT O5' 2 2 2 DT C5' 2 2 2 DT C4' 130.0 230.00002 . 210 . P . 210 . O5' . 210 . C5' . 210 . C4' 1 1 186 . 2 2 2 DT C4' 2 2 2 DT C3' 2 2 2 DT O3' 2 2 3 DT P -230.00002 -130.0 . 210 . C4' . 210 . C3' . 210 . O3' . 211 . P 1 1 187 . 2 2 2 DT C3' 2 2 2 DT O3' 2 2 3 DT P 2 2 3 DT O5' -135.0 -35.0 . 210 . C3' . 210 . O3' . 211 . P . 211 . O5' 1 1 188 . 2 2 2 DT O3' 2 2 3 DT P 2 2 3 DT O5' 2 2 3 DT C5' -110.0 -10.0 . 210 . O3' . 211 . P . 211 . O5' . 211 . C5' 1 1 189 . 2 2 3 DT P 2 2 3 DT O5' 2 2 3 DT C5' 2 2 3 DT C4' 130.0 230.00002 . 211 . P . 211 . O5' . 211 . C5' . 211 . C4' 1 1 190 . 2 2 3 DT C4' 2 2 3 DT C3' 2 2 3 DT O3' 2 2 4 DT P -230.00002 -130.0 . 211 . C4' . 211 . C3' . 211 . O3' . 212 . P 1 1 191 . 2 2 3 DT C3' 2 2 3 DT O3' 2 2 4 DT P 2 2 4 DT O5' -135.0 -35.0 . 211 . C3' . 211 . O3' . 212 . P . 212 . O5' 1 1 192 . 2 2 3 DT O3' 2 2 4 DT P 2 2 4 DT O5' 2 2 4 DT C5' -110.0 -10.0 . 211 . O3' . 212 . P . 212 . O5' . 212 . C5' 1 1 193 . 2 2 4 DT P 2 2 4 DT O5' 2 2 4 DT C5' 2 2 4 DT C4' 130.0 230.00002 . 212 . P . 212 . O5' . 212 . C5' . 212 . C4' 1 1 194 . 2 2 4 DT C4' 2 2 4 DT C3' 2 2 4 DT O3' 2 2 5 DG P -230.00002 -130.0 . 212 . C4' . 212 . C3' . 212 . O3' . 213 . P 1 1 195 . 2 2 4 DT C3' 2 2 4 DT O3' 2 2 5 DG P 2 2 5 DG O5' -135.0 -35.0 . 212 . C3' . 212 . O3' . 213 . P . 213 . O5' 1 1 196 . 2 2 4 DT O3' 2 2 5 DG P 2 2 5 DG O5' 2 2 5 DG C5' -110.0 -10.0 . 212 . O3' . 213 . P . 213 . O5' . 213 . C5' 1 1 197 . 2 2 5 DG P 2 2 5 DG O5' 2 2 5 DG C5' 2 2 5 DG C4' 130.0 230.00002 . 213 . P . 213 . O5' . 213 . C5' . 213 . C4' 1 1 198 . 2 2 5 DG C4' 2 2 5 DG C3' 2 2 5 DG O3' 2 2 6 DT P -230.00002 -130.0 . 213 . C4' . 213 . C3' . 213 . O3' . 214 . P 1 1 199 . 2 2 5 DG C3' 2 2 5 DG O3' 2 2 6 DT P 2 2 6 DT O5' -135.0 -35.0 . 213 . C3' . 213 . O3' . 214 . P . 214 . O5' 1 1 200 . 2 2 5 DG O3' 2 2 6 DT P 2 2 6 DT O5' 2 2 6 DT C5' -110.0 -10.0 . 213 . O3' . 214 . P . 214 . O5' . 214 . C5' 1 1 201 . 2 2 6 DT P 2 2 6 DT O5' 2 2 6 DT C5' 2 2 6 DT C4' 130.0 230.00002 . 214 . P . 214 . O5' . 214 . C5' . 214 . C4' 1 1 202 . 2 2 6 DT C4' 2 2 6 DT C3' 2 2 6 DT O3' 2 2 7 DG P -230.00002 -130.0 . 214 . C4' . 214 . C3' . 214 . O3' . 215 . P 1 1 203 . 2 2 6 DT C3' 2 2 6 DT O3' 2 2 7 DG P 2 2 7 DG O5' -135.0 -35.0 . 214 . C3' . 214 . O3' . 215 . P . 215 . O5' 1 1 204 . 2 2 6 DT O3' 2 2 7 DG P 2 2 7 DG O5' 2 2 7 DG C5' -110.0 -10.0 . 214 . O3' . 215 . P . 215 . O5' . 215 . C5' 1 1 205 . 2 2 7 DG P 2 2 7 DG O5' 2 2 7 DG C5' 2 2 7 DG C4' 130.0 230.00002 . 215 . P . 215 . O5' . 215 . C5' . 215 . C4' 1 1 206 . 2 2 7 DG C4' 2 2 7 DG C3' 2 2 7 DG O3' 2 2 8 DC P -230.00002 -130.0 . 215 . C4' . 215 . C3' . 215 . O3' . 216 . P 1 1 207 . 2 2 7 DG C3' 2 2 7 DG O3' 2 2 8 DC P 2 2 8 DC O5' -135.0 -35.0 . 215 . C3' . 215 . O3' . 216 . P . 216 . O5' 1 1 208 . 2 2 7 DG O3' 2 2 8 DC P 2 2 8 DC O5' 2 2 8 DC C5' -110.0 -10.0 . 215 . O3' . 216 . P . 216 . O5' . 216 . C5' 1 1 209 . 2 2 8 DC P 2 2 8 DC O5' 2 2 8 DC C5' 2 2 8 DC C4' 130.0 230.00002 . 216 . P . 216 . O5' . 216 . C5' . 216 . C4' 1 1 210 . 1 1 1 DG C5' 1 1 1 DG C4' 1 1 1 DG C3' 1 1 1 DG O3' 10.0 170.0 . 201 . C5' . 201 . C4' . 201 . C3' . 201 . O3' 1 1 211 . 1 1 2 DC C5' 1 1 2 DC C4' 1 1 2 DC C3' 1 1 2 DC O3' 40.0 140.0 . 202 . C5' . 202 . C4' . 202 . C3' . 202 . O3' 1 1 212 . 1 1 3 DA C5' 1 1 3 DA C4' 1 1 3 DA C3' 1 1 3 DA O3' 40.0 140.0 . 203 . C5' . 203 . C4' . 203 . C3' . 203 . O3' 1 1 213 . 1 1 4 DC C5' 1 1 4 DC C4' 1 1 4 DC C3' 1 1 4 DC O3' 40.0 140.0 . 204 . C5' . 204 . C4' . 204 . C3' . 204 . O3' 1 1 214 . 1 1 5 DA C5' 1 1 5 DA C4' 1 1 5 DA C3' 1 1 5 DA O3' 20.0 140.0 . 205 . C5' . 205 . C4' . 205 . C3' . 205 . O3' 1 1 215 . 1 1 6 DA C5' 1 1 6 DA C4' 1 1 6 DA C3' 1 1 6 DA O3' 40.0 140.0 . 206 . C5' . 206 . C4' . 206 . C3' . 206 . O3' 1 1 216 . 1 1 7 DA C5' 1 1 7 DA C4' 1 1 7 DA C3' 1 1 7 DA O3' 10.0 170.0 . 207 . C5' . 207 . C4' . 207 . C3' . 207 . O3' 1 1 217 . 1 1 8 DC C5' 1 1 8 DC C4' 1 1 8 DC C3' 1 1 8 DC O3' 40.0 140.0 . 208 . C5' . 208 . C4' . 208 . C3' . 208 . O3' 1 1 218 . 2 2 1 DG C5' 2 2 1 DG C4' 2 2 1 DG C3' 2 2 1 DG O3' 10.0 170.0 . 209 . C5' . 209 . C4' . 209 . C3' . 209 . O3' 1 1 219 . 2 2 2 DT C5' 2 2 2 DT C4' 2 2 2 DT C3' 2 2 2 DT O3' 40.0 140.0 . 210 . C5' . 210 . C4' . 210 . C3' . 210 . O3' 1 1 220 . 2 2 3 DT C5' 2 2 3 DT C4' 2 2 3 DT C3' 2 2 3 DT O3' 40.0 140.0 . 211 . C5' . 211 . C4' . 211 . C3' . 211 . O3' 1 1 221 . 2 2 4 DT C5' 2 2 4 DT C4' 2 2 4 DT C3' 2 2 4 DT O3' 40.0 140.0 . 212 . C5' . 212 . C4' . 212 . C3' . 212 . O3' 1 1 222 . 2 2 5 DG C5' 2 2 5 DG C4' 2 2 5 DG C3' 2 2 5 DG O3' 10.0 170.0 . 213 . C5' . 213 . C4' . 213 . C3' . 213 . O3' 1 1 223 . 2 2 6 DT C5' 2 2 6 DT C4' 2 2 6 DT C3' 2 2 6 DT O3' 40.0 140.0 . 214 . C5' . 214 . C4' . 214 . C3' . 214 . O3' 1 1 224 . 2 2 7 DG C5' 2 2 7 DG C4' 2 2 7 DG C3' 2 2 7 DG O3' 40.0 140.0 . 215 . C5' . 215 . C4' . 215 . C3' . 215 . O3' 1 1 225 . 2 2 8 DC C5' 2 2 8 DC C4' 2 2 8 DC C3' 2 2 8 DC O3' 40.0 140.0 . 216 . C5' . 216 . C4' . 216 . C3' . 216 . O3' 1 1 226 . 1 1 1 DG O5' 1 1 1 DG C5' 1 1 1 DG C4' 1 1 1 DG C3' 25.0 95.0 . 201 . O5' . 201 . C5' . 201 . C4' . 201 . C3' 1 1 227 . 1 1 2 DC O5' 1 1 2 DC C5' 1 1 2 DC C4' 1 1 2 DC C3' 25.0 95.0 . 202 . O5' . 202 . C5' . 202 . C4' . 202 . C3' 1 1 228 . 1 1 3 DA O5' 1 1 3 DA C5' 1 1 3 DA C4' 1 1 3 DA C3' 25.0 95.0 . 203 . O5' . 203 . C5' . 203 . C4' . 203 . C3' 1 1 229 . 1 1 4 DC O5' 1 1 4 DC C5' 1 1 4 DC C4' 1 1 4 DC C3' 25.0 95.0 . 204 . O5' . 204 . C5' . 204 . C4' . 204 . C3' 1 1 230 . 1 1 5 DA O5' 1 1 5 DA C5' 1 1 5 DA C4' 1 1 5 DA C3' 25.0 95.0 . 205 . O5' . 205 . C5' . 205 . C4' . 205 . C3' 1 1 231 . 1 1 6 DA O5' 1 1 6 DA C5' 1 1 6 DA C4' 1 1 6 DA C3' 25.0 95.0 . 206 . O5' . 206 . C5' . 206 . C4' . 206 . C3' 1 1 232 . 1 1 7 DA O5' 1 1 7 DA C5' 1 1 7 DA C4' 1 1 7 DA C3' 25.0 95.0 . 207 . O5' . 207 . C5' . 207 . C4' . 207 . C3' 1 1 233 . 1 1 8 DC O5' 1 1 8 DC C5' 1 1 8 DC C4' 1 1 8 DC C3' 25.0 95.0 . 208 . O5' . 208 . C5' . 208 . C4' . 208 . C3' 1 1 234 . 2 2 1 DG O5' 2 2 1 DG C5' 2 2 1 DG C4' 2 2 1 DG C3' 25.0 95.0 . 209 . O5' . 209 . C5' . 209 . C4' . 209 . C3' 1 1 235 . 2 2 2 DT O5' 2 2 2 DT C5' 2 2 2 DT C4' 2 2 2 DT C3' 25.0 95.0 . 210 . O5' . 210 . C5' . 210 . C4' . 210 . C3' 1 1 236 . 2 2 3 DT O5' 2 2 3 DT C5' 2 2 3 DT C4' 2 2 3 DT C3' 25.0 95.0 . 211 . O5' . 211 . C5' . 211 . C4' . 211 . C3' 1 1 237 . 2 2 4 DT O5' 2 2 4 DT C5' 2 2 4 DT C4' 2 2 4 DT C3' 25.0 95.0 . 212 . O5' . 212 . C5' . 212 . C4' . 212 . C3' 1 1 238 . 2 2 5 DG O5' 2 2 5 DG C5' 2 2 5 DG C4' 2 2 5 DG C3' 25.0 95.0 . 213 . O5' . 213 . C5' . 213 . C4' . 213 . C3' 1 1 239 . 2 2 6 DT O5' 2 2 6 DT C5' 2 2 6 DT C4' 2 2 6 DT C3' 25.0 95.0 . 214 . O5' . 214 . C5' . 214 . C4' . 214 . C3' 1 1 240 . 2 2 7 DG O5' 2 2 7 DG C5' 2 2 7 DG C4' 2 2 7 DG C3' 25.0 95.0 . 215 . O5' . 215 . C5' . 215 . C4' . 215 . C3' 1 1 241 . 2 2 8 DC O5' 2 2 8 DC C5' 2 2 8 DC C4' 2 2 8 DC C3' 25.0 95.0 . 216 . O5' . 216 . C5' . 216 . C4' . 216 . C3' 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 DG C1' C 5.249 5.131 0.985 1.00 . A B . 1 DG C1' 1 1 1 2 1 1 1 DG C2 C 4.527 1.138 2.683 1.00 . A B . 1 DG C2 1 1 1 3 1 1 1 DG C2' C 5.857 5.419 -0.381 1.00 . A B . 1 DG C2' 1 1 1 4 1 1 1 DG C3' C 5.672 6.892 -0.649 1.00 . A B . 1 DG C3' 1 1 1 5 1 1 1 DG C4 C 4.007 2.948 1.430 1.00 . A B . 1 DG C4 1 1 1 6 1 1 1 DG C4' C 5.146 7.478 0.664 1.00 . A B . 1 DG C4' 1 1 1 7 1 1 1 DG C5 C 2.785 2.423 0.981 1.00 . A B . 1 DG C5 1 1 1 8 1 1 1 DG C5' C 3.931 8.375 0.452 1.00 . A B . 1 DG C5' 1 1 1 9 1 1 1 DG C6 C 2.387 1.121 1.425 1.00 . A B . 1 DG C6 1 1 1 10 1 1 1 DG C8 C 2.993 4.289 0.128 1.00 . A B . 1 DG C8 1 1 1 11 1 1 1 DG H1 H 3.108 -0.363 2.623 1.00 . A B . 1 DG H1 1 1 1 12 1 1 1 DG H1' H 6.004 4.692 1.641 1.00 . A B . 1 DG H1' 1 1 1 13 1 1 1 DG H2' H 5.356 4.826 -1.146 1.00 . A B . 1 DG H2' 1 1 1 14 1 1 1 DG H2'' H 6.915 5.187 -0.374 1.00 . A B . 1 DG H2'' 1 1 1 15 1 1 1 DG H21 H 5.005 -0.491 3.814 1.00 . A B . 1 DG H21 1 1 1 16 1 1 1 DG H22 H 6.178 0.808 3.829 1.00 . A B . 1 DG H22 1 1 1 17 1 1 1 DG H3' H 4.945 7.032 -1.454 1.00 . A B . 1 DG H3' 1 1 1 18 1 1 1 DG H4' H 5.936 8.067 1.126 1.00 . A B . 1 DG H4' 1 1 1 19 1 1 1 DG H5' H 3.425 8.492 1.402 1.00 . A B . 1 DG H5' 1 1 1 20 1 1 1 DG H5'' H 4.265 9.352 0.100 1.00 . A B . 1 DG H5'' 1 1 1 21 1 1 1 DG H8 H 2.806 5.187 -0.459 1.00 . A B . 1 DG H8 1 1 1 22 1 1 1 DG HO5' H 2.157 7.778 -0.076 1.00 . A B . 1 DG HO5' 1 1 1 23 1 1 1 DG N1 N 3.332 0.547 2.284 1.00 . A B . 1 DG N1 1 1 1 24 1 1 1 DG N2 N 5.299 0.428 3.509 1.00 . A B . 1 DG N2 1 1 1 25 1 1 1 DG N3 N 4.911 2.362 2.272 1.00 . A B . 1 DG N3 1 1 1 26 1 1 1 DG N7 N 2.140 3.329 0.126 1.00 . A B . 1 DG N7 1 1 1 27 1 1 1 DG N9 N 4.125 4.189 0.850 1.00 . A B . 1 DG N9 1 1 1 28 1 1 1 DG O3' O 6.910 7.495 -1.026 1.00 . A B . 1 DG O3' 1 1 1 29 1 1 1 DG O4' O 4.809 6.383 1.546 1.00 . A B . 1 DG O4' 1 1 1 30 1 1 1 DG O5' O 3.017 7.820 -0.499 1.00 . A B . 1 DG O5' 1 1 1 31 1 1 1 DG O6 O 1.365 0.497 1.145 1.00 . A B . 1 DG O6 1 1 1 32 1 1 2 DC C1' C 8.584 2.097 -1.529 1.00 . A B . 2 DC C1' 1 1 1 33 1 1 2 DC C2 C 6.696 0.591 -0.929 1.00 . A B . 2 DC C2 1 1 1 34 1 1 2 DC C2' C 9.165 2.040 -2.938 1.00 . A B . 2 DC C2' 1 1 1 35 1 1 2 DC C3' C 9.922 3.337 -3.149 1.00 . A B . 2 DC C3' 1 1 1 36 1 1 2 DC C4 C 4.484 1.116 -1.590 1.00 . A B . 2 DC C4 1 1 1 37 1 1 2 DC C4' C 9.813 4.090 -1.818 1.00 . A B . 2 DC C4' 1 1 1 38 1 1 2 DC C5 C 4.918 2.324 -2.235 1.00 . A B . 2 DC C5 1 1 1 39 1 1 2 DC C5' C 9.479 5.572 -2.011 1.00 . A B . 2 DC C5' 1 1 1 40 1 1 2 DC C6 C 6.244 2.606 -2.192 1.00 . A B . 2 DC C6 1 1 1 41 1 1 2 DC H1' H 9.122 1.398 -0.887 1.00 . A B . 2 DC H1' 1 1 1 42 1 1 2 DC H2' H 8.358 1.948 -3.666 1.00 . A B . 2 DC H2' 1 1 1 43 1 1 2 DC H2'' H 9.849 1.194 -3.035 1.00 . A B . 2 DC H2'' 1 1 1 44 1 1 2 DC H3' H 9.454 3.913 -3.954 1.00 . A B . 2 DC H3' 1 1 1 45 1 1 2 DC H4' H 10.767 4.014 -1.297 1.00 . A B . 2 DC H4' 1 1 1 46 1 1 2 DC H41 H 2.879 -0.071 -1.153 1.00 . A B . 2 DC H41 1 1 1 47 1 1 2 DC H42 H 2.519 1.378 -2.067 1.00 . A B . 2 DC H42 1 1 1 48 1 1 2 DC H5 H 4.213 2.986 -2.735 1.00 . A B . 2 DC H5 1 1 1 49 1 1 2 DC H5' H 9.660 6.100 -1.076 1.00 . A B . 2 DC H5' 1 1 1 50 1 1 2 DC H5'' H 10.129 5.983 -2.783 1.00 . A B . 2 DC H5'' 1 1 1 51 1 1 2 DC H6 H 6.614 3.513 -2.670 1.00 . A B . 2 DC H6 1 1 1 52 1 1 2 DC N1 N 7.132 1.767 -1.556 1.00 . A B . 2 DC N1 1 1 1 53 1 1 2 DC N3 N 5.365 0.307 -0.971 1.00 . A B . 2 DC N3 1 1 1 54 1 1 2 DC N4 N 3.189 0.781 -1.605 1.00 . A B . 2 DC N4 1 1 1 55 1 1 2 DC O2 O 7.491 -0.158 -0.363 1.00 . A B . 2 DC O2 1 1 1 56 1 1 2 DC O3' O 11.287 3.079 -3.484 1.00 . A B . 2 DC O3' 1 1 1 57 1 1 2 DC O4' O 8.803 3.430 -1.026 1.00 . A B . 2 DC O4' 1 1 1 58 1 1 2 DC O5' O 8.116 5.766 -2.396 1.00 . A B . 2 DC O5' 1 1 1 59 1 1 2 DC OP1 O 8.629 8.199 -2.708 1.00 . A B . 2 DC OP1 1 1 1 60 1 1 2 DC OP2 O 6.380 7.226 -3.459 1.00 . A B . 2 DC OP2 1 1 1 61 1 1 2 DC P P 7.509 7.253 -2.501 1.00 . A B . 2 DC P 1 1 1 62 1 1 3 DA C1' C 9.643 -2.165 -5.603 1.00 . A B . 3 DA C1' 1 1 1 63 1 1 3 DA C2 C 5.775 -3.771 -4.300 1.00 . A B . 3 DA C2 1 1 1 64 1 1 3 DA C2' C 10.073 -1.820 -7.020 1.00 . A B . 3 DA C2' 1 1 1 65 1 1 3 DA C3' C 11.414 -1.132 -6.919 1.00 . A B . 3 DA C3' 1 1 1 66 1 1 3 DA C4 C 7.201 -2.144 -4.886 1.00 . A B . 3 DA C4 1 1 1 67 1 1 3 DA C4' C 11.812 -1.219 -5.442 1.00 . A B . 3 DA C4' 1 1 1 68 1 1 3 DA C5 C 6.253 -1.135 -4.721 1.00 . A B . 3 DA C5 1 1 1 69 1 1 3 DA C5' C 12.268 0.132 -4.886 1.00 . A B . 3 DA C5' 1 1 1 70 1 1 3 DA C6 C 4.974 -1.562 -4.306 1.00 . A B . 3 DA C6 1 1 1 71 1 1 3 DA C8 C 8.001 -0.227 -5.325 1.00 . A B . 3 DA C8 1 1 1 72 1 1 3 DA H1' H 9.531 -3.246 -5.510 1.00 . A B . 3 DA H1' 1 1 1 73 1 1 3 DA H2 H 5.542 -4.821 -4.122 1.00 . A B . 3 DA H2 1 1 1 74 1 1 3 DA H2' H 9.338 -1.157 -7.480 1.00 . A B . 3 DA H2' 1 1 1 75 1 1 3 DA H2'' H 10.174 -2.729 -7.613 1.00 . A B . 3 DA H2'' 1 1 1 76 1 1 3 DA H3' H 11.313 -0.088 -7.229 1.00 . A B . 3 DA H3' 1 1 1 77 1 1 3 DA H4' H 12.631 -1.930 -5.342 1.00 . A B . 3 DA H4' 1 1 1 78 1 1 3 DA H5' H 12.444 0.033 -3.818 1.00 . A B . 3 DA H5' 1 1 1 79 1 1 3 DA H5'' H 13.198 0.422 -5.375 1.00 . A B . 3 DA H5'' 1 1 1 80 1 1 3 DA H61 H 3.055 -1.090 -3.812 1.00 . A B . 3 DA H61 1 1 1 81 1 1 3 DA H62 H 4.074 0.264 -4.256 1.00 . A B . 3 DA H62 1 1 1 82 1 1 3 DA H8 H 8.729 0.526 -5.628 1.00 . A B . 3 DA H8 1 1 1 83 1 1 3 DA N1 N 4.782 -2.892 -4.107 1.00 . A B . 3 DA N1 1 1 1 84 1 1 3 DA N3 N 7.023 -3.484 -4.691 1.00 . A B . 3 DA N3 1 1 1 85 1 1 3 DA N6 N 3.953 -0.727 -4.108 1.00 . A B . 3 DA N6 1 1 1 86 1 1 3 DA N7 N 6.803 0.120 -5.015 1.00 . A B . 3 DA N7 1 1 1 87 1 1 3 DA N9 N 8.358 -1.525 -5.288 1.00 . A B . 3 DA N9 1 1 1 88 1 1 3 DA O3' O 12.381 -1.784 -7.749 1.00 . A B . 3 DA O3' 1 1 1 89 1 1 3 DA O4' O 10.677 -1.717 -4.701 1.00 . A B . 3 DA O4' 1 1 1 90 1 1 3 DA O5' O 11.291 1.154 -5.103 1.00 . A B . 3 DA O5' 1 1 1 91 1 1 3 DA OP1 O 13.171 2.808 -5.111 1.00 . A B . 3 DA OP1 1 1 1 92 1 1 3 DA OP2 O 10.832 3.478 -5.914 1.00 . A B . 3 DA OP2 1 1 1 93 1 1 3 DA P P 11.699 2.708 -4.996 1.00 . A B . 3 DA P 1 1 1 94 1 1 4 DC C1' C 7.999 -4.869 -9.696 1.00 . A B . 4 DC C1' 1 1 1 95 1 1 4 DC C2 C 5.833 -3.968 -8.878 1.00 . A B . 4 DC C2 1 1 1 96 1 1 4 DC C2' C 8.300 -4.702 -11.181 1.00 . A B . 4 DC C2' 1 1 1 97 1 1 4 DC C3' C 9.803 -4.765 -11.338 1.00 . A B . 4 DC C3' 1 1 1 98 1 1 4 DC C4 C 5.607 -1.668 -8.358 1.00 . A B . 4 DC C4 1 1 1 99 1 1 4 DC C4' C 10.345 -5.074 -9.936 1.00 . A B . 4 DC C4' 1 1 1 100 1 1 4 DC C5 C 6.984 -1.414 -8.698 1.00 . A B . 4 DC C5 1 1 1 101 1 1 4 DC C5' C 11.529 -4.176 -9.560 1.00 . A B . 4 DC C5' 1 1 1 102 1 1 4 DC C6 C 7.721 -2.473 -9.121 1.00 . A B . 4 DC C6 1 1 1 103 1 1 4 DC H1' H 7.483 -5.818 -9.531 1.00 . A B . 4 DC H1' 1 1 1 104 1 1 4 DC H2' H 7.922 -3.738 -11.528 1.00 . A B . 4 DC H2' 1 1 1 105 1 1 4 DC H2'' H 7.835 -5.505 -11.755 1.00 . A B . 4 DC H2'' 1 1 1 106 1 1 4 DC H3' H 10.179 -3.798 -11.687 1.00 . A B . 4 DC H3' 1 1 1 107 1 1 4 DC H4' H 10.673 -6.113 -9.909 1.00 . A B . 4 DC H4' 1 1 1 108 1 1 4 DC H41 H 3.848 -0.851 -7.710 1.00 . A B . 4 DC H41 1 1 1 109 1 1 4 DC H42 H 5.188 0.268 -7.869 1.00 . A B . 4 DC H42 1 1 1 110 1 1 4 DC H5 H 7.421 -0.417 -8.612 1.00 . A B . 4 DC H5 1 1 1 111 1 1 4 DC H5' H 11.784 -4.345 -8.514 1.00 . A B . 4 DC H5' 1 1 1 112 1 1 4 DC H5'' H 12.385 -4.440 -10.181 1.00 . A B . 4 DC H5'' 1 1 1 113 1 1 4 DC H6 H 8.763 -2.327 -9.402 1.00 . A B . 4 DC H6 1 1 1 114 1 1 4 DC N1 N 7.172 -3.731 -9.215 1.00 . A B . 4 DC N1 1 1 1 115 1 1 4 DC N3 N 5.089 -2.907 -8.457 1.00 . A B . 4 DC N3 1 1 1 116 1 1 4 DC N4 N 4.818 -0.668 -7.945 1.00 . A B . 4 DC N4 1 1 1 117 1 1 4 DC O2 O 5.350 -5.096 -8.966 1.00 . A B . 4 DC O2 1 1 1 118 1 1 4 DC O3' O 10.170 -5.784 -12.273 1.00 . A B . 4 DC O3' 1 1 1 119 1 1 4 DC O4' O 9.261 -4.911 -8.997 1.00 . A B . 4 DC O4' 1 1 1 120 1 1 4 DC O5' O 11.225 -2.792 -9.748 1.00 . A B . 4 DC O5' 1 1 1 121 1 1 4 DC OP1 O 13.613 -2.049 -9.914 1.00 . A B . 4 DC OP1 1 1 1 122 1 1 4 DC OP2 O 11.721 -0.336 -9.684 1.00 . A B . 4 DC OP2 1 1 1 123 1 1 4 DC P P 12.300 -1.658 -9.353 1.00 . A B . 4 DC P 1 1 1 124 1 1 5 DA C1' C 5.165 -6.060 -14.019 1.00 . A B . 5 DA C1' 1 1 1 125 1 1 5 DA C2 C 2.078 -3.455 -12.336 1.00 . A B . 5 DA C2 1 1 1 126 1 1 5 DA C2' C 5.429 -6.152 -15.506 1.00 . A B . 5 DA C2' 1 1 1 127 1 1 5 DA C3' C 6.197 -7.437 -15.697 1.00 . A B . 5 DA C3' 1 1 1 128 1 1 5 DA C4 C 4.148 -3.941 -13.043 1.00 . A B . 5 DA C4 1 1 1 129 1 1 5 DA C4' C 6.834 -7.719 -14.324 1.00 . A B . 5 DA C4' 1 1 1 130 1 1 5 DA C5 C 4.640 -2.668 -12.756 1.00 . A B . 5 DA C5 1 1 1 131 1 1 5 DA C5' C 8.339 -7.430 -14.307 1.00 . A B . 5 DA C5' 1 1 1 132 1 1 5 DA C6 C 3.702 -1.759 -12.209 1.00 . A B . 5 DA C6 1 1 1 133 1 1 5 DA C8 C 6.207 -3.765 -13.534 1.00 . A B . 5 DA C8 1 1 1 134 1 1 5 DA H1' H 4.180 -6.477 -13.806 1.00 . A B . 5 DA H1' 1 1 1 135 1 1 5 DA H2 H 1.041 -3.736 -12.155 1.00 . A B . 5 DA H2 1 1 1 136 1 1 5 DA H2' H 6.030 -5.304 -15.826 1.00 . A B . 5 DA H2' 1 1 1 137 1 1 5 DA H2'' H 4.489 -6.174 -16.060 1.00 . A B . 5 DA H2'' 1 1 1 138 1 1 5 DA H3' H 5.490 -8.237 -15.929 1.00 . A B . 5 DA H3' 1 1 1 139 1 1 5 DA H4' H 6.672 -8.764 -14.053 1.00 . A B . 5 DA H4' 1 1 1 140 1 1 5 DA H5' H 8.774 -7.908 -13.430 1.00 . A B . 5 DA H5' 1 1 1 141 1 1 5 DA H5'' H 8.802 -7.850 -15.199 1.00 . A B . 5 DA H5'' 1 1 1 142 1 1 5 DA H61 H 3.290 0.105 -11.488 1.00 . A B . 5 DA H61 1 1 1 143 1 1 5 DA H62 H 4.943 -0.155 -12.010 1.00 . A B . 5 DA H62 1 1 1 144 1 1 5 DA H8 H 7.194 -4.050 -13.894 1.00 . A B . 5 DA H8 1 1 1 145 1 1 5 DA N1 N 2.430 -2.199 -12.016 1.00 . A B . 5 DA N1 1 1 1 146 1 1 5 DA N3 N 2.878 -4.394 -12.855 1.00 . A B . 5 DA N3 1 1 1 147 1 1 5 DA N6 N 4.004 -0.501 -11.876 1.00 . A B . 5 DA N6 1 1 1 148 1 1 5 DA N7 N 6.001 -2.574 -13.087 1.00 . A B . 5 DA N7 1 1 1 149 1 1 5 DA N9 N 5.199 -4.659 -13.559 1.00 . A B . 5 DA N9 1 1 1 150 1 1 5 DA O3' O 7.160 -7.368 -16.760 1.00 . A B . 5 DA O3' 1 1 1 151 1 1 5 DA O4' O 6.161 -6.870 -13.358 1.00 . A B . 5 DA O4' 1 1 1 152 1 1 5 DA O5' O 8.616 -6.028 -14.248 1.00 . A B . 5 DA O5' 1 1 1 153 1 1 5 DA OP1 O 11.082 -6.376 -14.531 1.00 . A B . 5 DA OP1 1 1 1 154 1 1 5 DA OP2 O 10.133 -4.040 -14.073 1.00 . A B . 5 DA OP2 1 1 1 155 1 1 5 DA P P 10.091 -5.504 -13.860 1.00 . A B . 5 DA P 1 1 1 156 1 1 6 DA C1' C 2.213 -5.328 -19.343 1.00 . A B . 6 DA C1' 1 1 1 157 1 1 6 DA C2 C 0.179 -2.294 -16.872 1.00 . A B . 6 DA C2 1 1 1 158 1 1 6 DA C2' C 2.874 -5.305 -20.717 1.00 . A B . 6 DA C2' 1 1 1 159 1 1 6 DA C3' C 3.663 -6.591 -20.848 1.00 . A B . 6 DA C3' 1 1 1 160 1 1 6 DA C4 C 1.960 -3.329 -17.766 1.00 . A B . 6 DA C4 1 1 1 161 1 1 6 DA C4' C 3.370 -7.393 -19.574 1.00 . A B . 6 DA C4' 1 1 1 162 1 1 6 DA C5 C 2.872 -2.484 -17.132 1.00 . A B . 6 DA C5 1 1 1 163 1 1 6 DA C5' C 4.653 -7.771 -18.822 1.00 . A B . 6 DA C5' 1 1 1 164 1 1 6 DA C6 C 2.311 -1.483 -16.311 1.00 . A B . 6 DA C6 1 1 1 165 1 1 6 DA C8 C 3.973 -3.822 -18.244 1.00 . A B . 6 DA C8 1 1 1 166 1 1 6 DA H1' H 1.131 -5.232 -19.454 1.00 . A B . 6 DA H1' 1 1 1 167 1 1 6 DA H2 H -0.896 -2.181 -16.743 1.00 . A B . 6 DA H2 1 1 1 168 1 1 6 DA H2' H 3.536 -4.439 -20.795 1.00 . A B . 6 DA H2' 1 1 1 169 1 1 6 DA H2'' H 2.116 -5.257 -21.502 1.00 . A B . 6 DA H2'' 1 1 1 170 1 1 6 DA H3' H 4.731 -6.363 -20.922 1.00 . A B . 6 DA H3' 1 1 1 171 1 1 6 DA H4' H 2.840 -8.307 -19.848 1.00 . A B . 6 DA H4' 1 1 1 172 1 1 6 DA H5' H 4.408 -8.476 -18.028 1.00 . A B . 6 DA H5' 1 1 1 173 1 1 6 DA H5'' H 5.348 -8.243 -19.515 1.00 . A B . 6 DA H5'' 1 1 1 174 1 1 6 DA H61 H 2.589 0.092 -15.059 1.00 . A B . 6 DA H61 1 1 1 175 1 1 6 DA H62 H 4.052 -0.633 -15.691 1.00 . A B . 6 DA H62 1 1 1 176 1 1 6 DA H8 H 4.812 -4.341 -18.706 1.00 . A B . 6 DA H8 1 1 1 177 1 1 6 DA N1 N 0.957 -1.424 -16.210 1.00 . A B . 6 DA N1 1 1 1 178 1 1 6 DA N3 N 0.599 -3.284 -17.676 1.00 . A B . 6 DA N3 1 1 1 179 1 1 6 DA N6 N 3.044 -0.604 -15.633 1.00 . A B . 6 DA N6 1 1 1 180 1 1 6 DA N7 N 4.189 -2.828 -17.461 1.00 . A B . 6 DA N7 1 1 1 181 1 1 6 DA N9 N 2.711 -4.219 -18.505 1.00 . A B . 6 DA N9 1 1 1 182 1 1 6 DA O3' O 3.260 -7.320 -22.008 1.00 . A B . 6 DA O3' 1 1 1 183 1 1 6 DA O4' O 2.512 -6.597 -18.726 1.00 . A B . 6 DA O4' 1 1 1 184 1 1 6 DA O5' O 5.274 -6.618 -18.250 1.00 . A B . 6 DA O5' 1 1 1 185 1 1 6 DA OP1 O 7.495 -7.217 -19.237 1.00 . A B . 6 DA OP1 1 1 1 186 1 1 6 DA OP2 O 7.226 -5.094 -17.834 1.00 . A B . 6 DA OP2 1 1 1 187 1 1 6 DA P P 6.874 -6.508 -18.095 1.00 . A B . 6 DA P 1 1 1 188 1 1 7 DA C1' C 0.179 -2.827 -22.922 1.00 . A B . 7 DA C1' 1 1 1 189 1 1 7 DA C2 C -0.235 0.609 -20.184 1.00 . A B . 7 DA C2 1 1 1 190 1 1 7 DA C2' C 0.515 -2.646 -24.394 1.00 . A B . 7 DA C2' 1 1 1 191 1 1 7 DA C3' C 0.559 -4.019 -25.022 1.00 . A B . 7 DA C3' 1 1 1 192 1 1 7 DA C4 C 0.886 -0.998 -21.283 1.00 . A B . 7 DA C4 1 1 1 193 1 1 7 DA C4' C 0.199 -4.986 -23.884 1.00 . A B . 7 DA C4' 1 1 1 194 1 1 7 DA C5 C 2.120 -0.603 -20.772 1.00 . A B . 7 DA C5 1 1 1 195 1 1 7 DA C5' C 1.148 -6.180 -23.814 1.00 . A B . 7 DA C5' 1 1 1 196 1 1 7 DA C6 C 2.095 0.503 -19.898 1.00 . A B . 7 DA C6 1 1 1 197 1 1 7 DA C8 C 2.472 -2.215 -22.003 1.00 . A B . 7 DA C8 1 1 1 198 1 1 7 DA H1' H -0.830 -2.453 -22.722 1.00 . A B . 7 DA H1' 1 1 1 199 1 1 7 DA H2 H -1.159 1.129 -19.932 1.00 . A B . 7 DA H2 1 1 1 200 1 1 7 DA H2' H 1.483 -2.148 -24.497 1.00 . A B . 7 DA H2' 1 1 1 201 1 1 7 DA H2'' H -0.242 -2.058 -24.869 1.00 . A B . 7 DA H2'' 1 1 1 202 1 1 7 DA H3' H 1.569 -4.214 -25.395 1.00 . A B . 7 DA H3' 1 1 1 203 1 1 7 DA H4' H -0.814 -5.356 -24.050 1.00 . A B . 7 DA H4' 1 1 1 204 1 1 7 DA H5' H 0.953 -6.736 -22.897 1.00 . A B . 7 DA H5' 1 1 1 205 1 1 7 DA H5'' H 0.963 -6.830 -24.669 1.00 . A B . 7 DA H5'' 1 1 1 206 1 1 7 DA H61 H 3.116 1.795 -18.711 1.00 . A B . 7 DA H61 1 1 1 207 1 1 7 DA H62 H 4.090 0.586 -19.518 1.00 . A B . 7 DA H62 1 1 1 208 1 1 7 DA H8 H 2.976 -2.990 -22.575 1.00 . A B . 7 DA H8 1 1 1 209 1 1 7 DA N1 N 0.892 1.082 -19.629 1.00 . A B . 7 DA N1 1 1 1 210 1 1 7 DA N3 N -0.332 -0.433 -21.026 1.00 . A B . 7 DA N3 1 1 1 211 1 1 7 DA N6 N 3.189 1.001 -19.330 1.00 . A B . 7 DA N6 1 1 1 212 1 1 7 DA N7 N 3.150 -1.418 -21.259 1.00 . A B . 7 DA N7 1 1 1 213 1 1 7 DA N9 N 1.141 -2.076 -22.103 1.00 . A B . 7 DA N9 1 1 1 214 1 1 7 DA O3' O -0.384 -4.133 -26.103 1.00 . A B . 7 DA O3' 1 1 1 215 1 1 7 DA O4' O 0.218 -4.240 -22.643 1.00 . A B . 7 DA O4' 1 1 1 216 1 1 7 DA O5' O 2.513 -5.766 -23.829 1.00 . A B . 7 DA O5' 1 1 1 217 1 1 7 DA OP1 O 3.577 -7.955 -24.410 1.00 . A B . 7 DA OP1 1 1 1 218 1 1 7 DA OP2 O 4.954 -6.065 -23.362 1.00 . A B . 7 DA OP2 1 1 1 219 1 1 7 DA P P 3.682 -6.812 -23.476 1.00 . A B . 7 DA P 1 1 1 220 1 1 8 DC C1' C -2.162 1.048 -25.476 1.00 . A B . 8 DC C1' 1 1 1 221 1 1 8 DC C2 C -0.624 2.350 -24.053 1.00 . A B . 8 DC C2 1 1 1 222 1 1 8 DC C2' C -2.404 1.879 -26.728 1.00 . A B . 8 DC C2' 1 1 1 223 1 1 8 DC C3' C -2.498 0.900 -27.874 1.00 . A B . 8 DC C3' 1 1 1 224 1 1 8 DC C4 C 1.667 1.756 -23.887 1.00 . A B . 8 DC C4 1 1 1 225 1 1 8 DC C4' C -2.764 -0.451 -27.220 1.00 . A B . 8 DC C4' 1 1 1 226 1 1 8 DC C5 C 1.486 0.667 -24.812 1.00 . A B . 8 DC C5 1 1 1 227 1 1 8 DC C5' C -2.071 -1.621 -27.962 1.00 . A B . 8 DC C5' 1 1 1 228 1 1 8 DC C6 C 0.244 0.484 -25.310 1.00 . A B . 8 DC C6 1 1 1 229 1 1 8 DC H1' H -2.904 1.297 -24.711 1.00 . A B . 8 DC H1' 1 1 1 230 1 1 8 DC H2' H -1.577 2.574 -26.884 1.00 . A B . 8 DC H2' 1 1 1 231 1 1 8 DC H2'' H -3.341 2.428 -26.639 1.00 . A B . 8 DC H2'' 1 1 1 232 1 1 8 DC H3' H -1.544 0.873 -28.408 1.00 . A B . 8 DC H3' 1 1 1 233 1 1 8 DC H4' H -3.840 -0.625 -27.214 1.00 . A B . 8 DC H4' 1 1 1 234 1 1 8 DC H41 H 3.008 2.752 -22.697 1.00 . A B . 8 DC H41 1 1 1 235 1 1 8 DC H42 H 3.655 1.394 -23.596 1.00 . A B . 8 DC H42 1 1 1 236 1 1 8 DC H5 H 2.307 0.003 -25.094 1.00 . A B . 8 DC H5 1 1 1 237 1 1 8 DC H5' H -2.725 -2.494 -27.934 1.00 . A B . 8 DC H5' 1 1 1 238 1 1 8 DC H5'' H -1.906 -1.349 -29.004 1.00 . A B . 8 DC H5'' 1 1 1 239 1 1 8 DC H6 H 0.080 -0.291 -26.041 1.00 . A B . 8 DC H6 1 1 1 240 1 1 8 DC HO3' H -3.465 2.184 -28.970 1.00 . A B . 8 DC HO3' 1 1 1 241 1 1 8 DC N1 N -0.800 1.295 -24.945 1.00 . A B . 8 DC N1 1 1 1 242 1 1 8 DC N3 N 0.628 2.547 -23.548 1.00 . A B . 8 DC N3 1 1 1 243 1 1 8 DC N4 N 2.874 1.985 -23.350 1.00 . A B . 8 DC N4 1 1 1 244 1 1 8 DC O2 O -1.573 3.066 -23.737 1.00 . A B . 8 DC O2 1 1 1 245 1 1 8 DC O3' O -3.553 1.250 -28.774 1.00 . A B . 8 DC O3' 1 1 1 246 1 1 8 DC O4' O -2.317 -0.344 -25.847 1.00 . A B . 8 DC O4' 1 1 1 247 1 1 8 DC O5' O -0.808 -1.957 -27.360 1.00 . A B . 8 DC O5' 1 1 1 248 1 1 8 DC OP1 O -0.910 -4.161 -28.557 1.00 . A B . 8 DC OP1 1 1 1 249 1 1 8 DC OP2 O 1.322 -3.235 -27.711 1.00 . A B . 8 DC OP2 1 1 1 250 1 1 8 DC P P -0.136 -3.419 -27.537 1.00 . A B . 8 DC P 1 1 1 251 2 2 1 DG C1' C 1.724 9.824 -20.207 1.00 . B C . 1 DG C1' 1 1 1 252 2 2 1 DG C2 C 0.867 5.916 -22.017 1.00 . B C . 1 DG C2 1 1 1 253 2 2 1 DG C2' C 1.568 9.966 -18.704 1.00 . B C . 1 DG C2' 1 1 1 254 2 2 1 DG C3' C 1.654 11.453 -18.412 1.00 . B C . 1 DG C3' 1 1 1 255 2 2 1 DG C4 C 2.209 7.486 -21.097 1.00 . B C . 1 DG C4 1 1 1 256 2 2 1 DG C4' C 2.344 12.046 -19.645 1.00 . B C . 1 DG C4' 1 1 1 257 2 2 1 DG C5 C 3.374 6.707 -21.199 1.00 . B C . 1 DG C5 1 1 1 258 2 2 1 DG C5' C 3.797 12.404 -19.341 1.00 . B C . 1 DG C5' 1 1 1 259 2 2 1 DG C6 C 3.278 5.395 -21.769 1.00 . B C . 1 DG C6 1 1 1 260 2 2 1 DG C8 C 3.918 8.505 -20.343 1.00 . B C . 1 DG C8 1 1 1 261 2 2 1 DG H1 H 1.847 4.193 -22.581 1.00 . B C . 1 DG H1 1 1 1 262 2 2 1 DG H1' H 0.740 9.666 -20.663 1.00 . B C . 1 DG H1' 1 1 1 263 2 2 1 DG H2' H 2.379 9.428 -18.218 1.00 . B C . 1 DG H2' 1 1 1 264 2 2 1 DG H2'' H 0.607 9.566 -18.378 1.00 . B C . 1 DG H2'' 1 1 1 265 2 2 1 DG H21 H -0.341 4.507 -22.854 1.00 . B C . 1 DG H21 1 1 1 266 2 2 1 DG H22 H -1.132 5.995 -22.389 1.00 . B C . 1 DG H22 1 1 1 267 2 2 1 DG H3' H 0.642 11.859 -18.344 1.00 . B C . 1 DG H3' 1 1 1 268 2 2 1 DG H4' H 1.817 12.947 -19.965 1.00 . B C . 1 DG H4' 1 1 1 269 2 2 1 DG H5' H 4.320 12.596 -20.278 1.00 . B C . 1 DG H5' 1 1 1 270 2 2 1 DG H5'' H 3.821 13.305 -18.728 1.00 . B C . 1 DG H5'' 1 1 1 271 2 2 1 DG H8 H 4.513 9.301 -19.895 1.00 . B C . 1 DG H8 1 1 1 272 2 2 1 DG HO5' H 5.320 11.683 -18.368 1.00 . B C . 1 DG HO5' 1 1 1 273 2 2 1 DG N1 N 1.970 5.085 -22.156 1.00 . B C . 1 DG N1 1 1 1 274 2 2 1 DG N2 N -0.297 5.434 -22.455 1.00 . B C . 1 DG N2 1 1 1 275 2 2 1 DG N3 N 0.941 7.150 -21.483 1.00 . B C . 1 DG N3 1 1 1 276 2 2 1 DG N7 N 4.481 7.404 -20.695 1.00 . B C . 1 DG N7 1 1 1 277 2 2 1 DG N9 N 2.592 8.677 -20.527 1.00 . B C . 1 DG N9 1 1 1 278 2 2 1 DG O3' O 2.360 11.779 -17.190 1.00 . B C . 1 DG O3' 1 1 1 279 2 2 1 DG O4' O 2.283 11.059 -20.704 1.00 . B C . 1 DG O4' 1 1 1 280 2 2 1 DG O5' O 4.464 11.348 -18.644 1.00 . B C . 1 DG O5' 1 1 1 281 2 2 1 DG O6 O 4.170 4.564 -21.940 1.00 . B C . 1 DG O6 1 1 1 282 2 2 2 DT C1' C -0.861 6.775 -16.637 1.00 . B C . 2 DT C1' 1 1 1 283 2 2 2 DT C2 C -0.012 4.740 -17.778 1.00 . B C . 2 DT C2 1 1 1 284 2 2 2 DT C2' C -0.931 6.652 -15.116 1.00 . B C . 2 DT C2' 1 1 1 285 2 2 2 DT C3' C -0.771 8.052 -14.557 1.00 . B C . 2 DT C3' 1 1 1 286 2 2 2 DT C4 C 2.425 4.406 -18.112 1.00 . B C . 2 DT C4 1 1 1 287 2 2 2 DT C4' C -0.880 8.981 -15.765 1.00 . B C . 2 DT C4' 1 1 1 288 2 2 2 DT C5 C 2.628 5.690 -17.464 1.00 . B C . 2 DT C5 1 1 1 289 2 2 2 DT C5' C 0.129 10.133 -15.699 1.00 . B C . 2 DT C5' 1 1 1 290 2 2 2 DT C6 C 1.568 6.413 -17.019 1.00 . B C . 2 DT C6 1 1 1 291 2 2 2 DT C7 C 4.056 6.219 -17.287 1.00 . B C . 2 DT C7 1 1 1 292 2 2 2 DT H1' H -1.803 6.436 -17.077 1.00 . B C . 2 DT H1' 1 1 1 293 2 2 2 DT H2' H -0.128 6.004 -14.757 1.00 . B C . 2 DT H2' 1 1 1 294 2 2 2 DT H2'' H -1.895 6.242 -14.813 1.00 . B C . 2 DT H2'' 1 1 1 295 2 2 2 DT H3 H 0.906 3.132 -18.666 1.00 . B C . 2 DT H3 1 1 1 296 2 2 2 DT H3' H 0.214 8.151 -14.089 1.00 . B C . 2 DT H3' 1 1 1 297 2 2 2 DT H4' H -1.885 9.401 -15.792 1.00 . B C . 2 DT H4' 1 1 1 298 2 2 2 DT H5' H -0.184 10.918 -16.384 1.00 . B C . 2 DT H5' 1 1 1 299 2 2 2 DT H5'' H 0.151 10.532 -14.686 1.00 . B C . 2 DT H5'' 1 1 1 300 2 2 2 DT H6 H 1.745 7.374 -16.535 1.00 . B C . 2 DT H6 1 1 1 301 2 2 2 DT H71 H 4.593 5.580 -16.585 1.00 . B C . 2 DT H71 1 1 1 302 2 2 2 DT H72 H 4.035 7.240 -16.902 1.00 . B C . 2 DT H72 1 1 1 303 2 2 2 DT H73 H 4.567 6.207 -18.249 1.00 . B C . 2 DT H73 1 1 1 304 2 2 2 DT N1 N 0.274 5.964 -17.163 1.00 . B C . 2 DT N1 1 1 1 305 2 2 2 DT N3 N 1.089 4.019 -18.223 1.00 . B C . 2 DT N3 1 1 1 306 2 2 2 DT O2 O -1.160 4.321 -17.917 1.00 . B C . 2 DT O2 1 1 1 307 2 2 2 DT O3' O -1.781 8.344 -13.591 1.00 . B C . 2 DT O3' 1 1 1 308 2 2 2 DT O4 O 3.320 3.687 -18.546 1.00 . B C . 2 DT O4 1 1 1 309 2 2 2 DT O4' O -0.683 8.175 -16.950 1.00 . B C . 2 DT O4' 1 1 1 310 2 2 2 DT O5' O 1.440 9.696 -16.055 1.00 . B C . 2 DT O5' 1 1 1 311 2 2 2 DT OP1 O 2.682 11.416 -14.727 1.00 . B C . 2 DT OP1 1 1 1 312 2 2 2 DT OP2 O 3.903 9.949 -16.433 1.00 . B C . 2 DT OP2 1 1 1 313 2 2 2 DT P P 2.697 10.704 -16.024 1.00 . B C . 2 DT P 1 1 1 314 2 2 3 DT C1' C -3.383 3.039 -14.097 1.00 . B C . 3 DT C1' 1 1 1 315 2 2 3 DT C2 C -1.553 1.577 -14.917 1.00 . B C . 3 DT C2 1 1 1 316 2 2 3 DT C2' C -3.872 2.728 -12.683 1.00 . B C . 3 DT C2' 1 1 1 317 2 2 3 DT C3' C -4.303 4.047 -12.076 1.00 . B C . 3 DT C3' 1 1 1 318 2 2 3 DT C4 C 0.815 2.146 -14.434 1.00 . B C . 3 DT C4 1 1 1 319 2 2 3 DT C4' C -4.373 5.017 -13.252 1.00 . B C . 3 DT C4' 1 1 1 320 2 2 3 DT C5 C 0.327 3.319 -13.729 1.00 . B C . 3 DT C5 1 1 1 321 2 2 3 DT C5' C -3.862 6.409 -12.879 1.00 . B C . 3 DT C5' 1 1 1 322 2 2 3 DT C6 C -1.008 3.568 -13.647 1.00 . B C . 3 DT C6 1 1 1 323 2 2 3 DT C7 C 1.334 4.269 -13.073 1.00 . B C . 3 DT C7 1 1 1 324 2 2 3 DT H1' H -3.960 2.459 -14.824 1.00 . B C . 3 DT H1' 1 1 1 325 2 2 3 DT H2' H -3.063 2.285 -12.097 1.00 . B C . 3 DT H2' 1 1 1 326 2 2 3 DT H2'' H -4.721 2.042 -12.716 1.00 . B C . 3 DT H2'' 1 1 1 327 2 2 3 DT H3 H 0.112 0.519 -15.483 1.00 . B C . 3 DT H3 1 1 1 328 2 2 3 DT H3' H -3.552 4.381 -11.356 1.00 . B C . 3 DT H3' 1 1 1 329 2 2 3 DT H4' H -5.409 5.103 -13.567 1.00 . B C . 3 DT H4' 1 1 1 330 2 2 3 DT H5' H -3.824 7.027 -13.775 1.00 . B C . 3 DT H5' 1 1 1 331 2 2 3 DT H5'' H -4.555 6.860 -12.168 1.00 . B C . 3 DT H5'' 1 1 1 332 2 2 3 DT H6 H -1.357 4.455 -13.117 1.00 . B C . 3 DT H6 1 1 1 333 2 2 3 DT H71 H 1.986 3.700 -12.408 1.00 . B C . 3 DT H71 1 1 1 334 2 2 3 DT H72 H 0.810 5.035 -12.496 1.00 . B C . 3 DT H72 1 1 1 335 2 2 3 DT H73 H 1.936 4.747 -13.846 1.00 . B C . 3 DT H73 1 1 1 336 2 2 3 DT N1 N -1.935 2.729 -14.221 1.00 . B C . 3 DT N1 1 1 1 337 2 2 3 DT N3 N -0.185 1.345 -14.987 1.00 . B C . 3 DT N3 1 1 1 338 2 2 3 DT O2 O -2.368 0.816 -15.436 1.00 . B C . 3 DT O2 1 1 1 339 2 2 3 DT O3' O -5.580 3.937 -11.432 1.00 . B C . 3 DT O3' 1 1 1 340 2 2 3 DT O4 O 1.998 1.842 -14.560 1.00 . B C . 3 DT O4 1 1 1 341 2 2 3 DT O4' O -3.613 4.447 -14.337 1.00 . B C . 3 DT O4' 1 1 1 342 2 2 3 DT O5' O -2.564 6.356 -12.289 1.00 . B C . 3 DT O5' 1 1 1 343 2 2 3 DT OP1 O -2.415 8.597 -11.182 1.00 . B C . 3 DT OP1 1 1 1 344 2 2 3 DT OP2 O -0.294 7.322 -11.854 1.00 . B C . 3 DT OP2 1 1 1 345 2 2 3 DT P P -1.701 7.701 -12.119 1.00 . B C . 3 DT P 1 1 1 346 2 2 4 DT C1' C -3.707 -0.812 -10.284 1.00 . B C . 4 DT C1' 1 1 1 347 2 2 4 DT C2 C -1.348 -1.019 -11.040 1.00 . B C . 4 DT C2 1 1 1 348 2 2 4 DT C2' C -4.088 -1.028 -8.822 1.00 . B C . 4 DT C2' 1 1 1 349 2 2 4 DT C3' C -5.482 -0.451 -8.649 1.00 . B C . 4 DT C3' 1 1 1 350 2 2 4 DT C4 C 0.283 0.805 -10.646 1.00 . B C . 4 DT C4 1 1 1 351 2 2 4 DT C4' C -5.870 0.087 -10.029 1.00 . B C . 4 DT C4' 1 1 1 352 2 2 4 DT C5 C -0.789 1.542 -9.996 1.00 . B C . 4 DT C5 1 1 1 353 2 2 4 DT C5' C -6.491 1.482 -9.954 1.00 . B C . 4 DT C5' 1 1 1 354 2 2 4 DT C6 C -2.037 1.002 -9.895 1.00 . B C . 4 DT C6 1 1 1 355 2 2 4 DT C7 C -0.496 2.930 -9.418 1.00 . B C . 4 DT C7 1 1 1 356 2 2 4 DT H1' H -3.775 -1.763 -10.814 1.00 . B C . 4 DT H1' 1 1 1 357 2 2 4 DT H2' H -3.377 -0.511 -8.174 1.00 . B C . 4 DT H2' 1 1 1 358 2 2 4 DT H2'' H -4.097 -2.094 -8.584 1.00 . B C . 4 DT H2'' 1 1 1 359 2 2 4 DT H3 H 0.620 -0.979 -11.581 1.00 . B C . 4 DT H3 1 1 1 360 2 2 4 DT H3' H -5.461 0.358 -7.914 1.00 . B C . 4 DT H3' 1 1 1 361 2 2 4 DT H4' H -6.599 -0.591 -10.473 1.00 . B C . 4 DT H4' 1 1 1 362 2 2 4 DT H5' H -6.788 1.793 -10.955 1.00 . B C . 4 DT H5' 1 1 1 363 2 2 4 DT H5'' H -7.374 1.444 -9.317 1.00 . B C . 4 DT H5'' 1 1 1 364 2 2 4 DT H6 H -2.826 1.568 -9.400 1.00 . B C . 4 DT H6 1 1 1 365 2 2 4 DT H71 H 0.242 2.840 -8.621 1.00 . B C . 4 DT H71 1 1 1 366 2 2 4 DT H72 H -1.410 3.372 -9.016 1.00 . B C . 4 DT H72 1 1 1 367 2 2 4 DT H73 H -0.102 3.572 -10.206 1.00 . B C . 4 DT H73 1 1 1 368 2 2 4 DT N1 N -2.328 -0.249 -10.402 1.00 . B C . 4 DT N1 1 1 1 369 2 2 4 DT N3 N -0.090 -0.443 -11.126 1.00 . B C . 4 DT N3 1 1 1 370 2 2 4 DT O2 O -1.573 -2.137 -11.493 1.00 . B C . 4 DT O2 1 1 1 371 2 2 4 DT O3' O -6.406 -1.458 -8.226 1.00 . B C . 4 DT O3' 1 1 1 372 2 2 4 DT O4 O 1.443 1.200 -10.787 1.00 . B C . 4 DT O4 1 1 1 373 2 2 4 DT O4' O -4.683 0.086 -10.849 1.00 . B C . 4 DT O4' 1 1 1 374 2 2 4 DT O5' O -5.577 2.442 -9.422 1.00 . B C . 4 DT O5' 1 1 1 375 2 2 4 DT OP1 O -7.094 4.428 -9.497 1.00 . B C . 4 DT OP1 1 1 1 376 2 2 4 DT OP2 O -4.561 4.725 -9.266 1.00 . B C . 4 DT OP2 1 1 1 377 2 2 4 DT P P -5.718 3.991 -9.825 1.00 . B C . 4 DT P 1 1 1 378 2 2 5 DG C1' C -2.703 -5.148 -6.797 1.00 . B C . 5 DG C1' 1 1 1 379 2 2 5 DG C2 C 1.529 -4.484 -7.763 1.00 . B C . 5 DG C2 1 1 1 380 2 2 5 DG C2' C -3.282 -5.338 -5.406 1.00 . B C . 5 DG C2' 1 1 1 381 2 2 5 DG C3' C -4.754 -5.624 -5.573 1.00 . B C . 5 DG C3' 1 1 1 382 2 2 5 DG C4 C -0.550 -3.830 -7.166 1.00 . B C . 5 DG C4 1 1 1 383 2 2 5 DG C4' C -5.049 -5.411 -7.065 1.00 . B C . 5 DG C4' 1 1 1 384 2 2 5 DG C5 C -0.211 -2.470 -7.055 1.00 . B C . 5 DG C5 1 1 1 385 2 2 5 DG C5' C -6.074 -4.295 -7.292 1.00 . B C . 5 DG C5' 1 1 1 386 2 2 5 DG C6 C 1.142 -2.072 -7.327 1.00 . B C . 5 DG C6 1 1 1 387 2 2 5 DG C8 C -2.216 -2.639 -6.592 1.00 . B C . 5 DG C8 1 1 1 388 2 2 5 DG H1 H 2.902 -2.947 -7.879 1.00 . B C . 5 DG H1 1 1 1 389 2 2 5 DG H1' H -2.072 -6.002 -7.042 1.00 . B C . 5 DG H1' 1 1 1 390 2 2 5 DG H2' H -3.141 -4.428 -4.830 1.00 . B C . 5 DG H2' 1 1 1 391 2 2 5 DG H2'' H -2.795 -6.171 -4.902 1.00 . B C . 5 DG H2'' 1 1 1 392 2 2 5 DG H21 H 3.398 -5.083 -8.302 1.00 . B C . 5 DG H21 1 1 1 393 2 2 5 DG H22 H 2.203 -6.356 -8.192 1.00 . B C . 5 DG H22 1 1 1 394 2 2 5 DG H3' H -5.339 -4.933 -4.960 1.00 . B C . 5 DG H3' 1 1 1 395 2 2 5 DG H4' H -5.442 -6.339 -7.483 1.00 . B C . 5 DG H4' 1 1 1 396 2 2 5 DG H5' H -6.055 -4.002 -8.342 1.00 . B C . 5 DG H5' 1 1 1 397 2 2 5 DG H5'' H -7.067 -4.668 -7.045 1.00 . B C . 5 DG H5'' 1 1 1 398 2 2 5 DG H8 H -3.237 -2.391 -6.305 1.00 . B C . 5 DG H8 1 1 1 399 2 2 5 DG N1 N 1.949 -3.162 -7.678 1.00 . B C . 5 DG N1 1 1 1 400 2 2 5 DG N2 N 2.451 -5.380 -8.114 1.00 . B C . 5 DG N2 1 1 1 401 2 2 5 DG N3 N 0.264 -4.871 -7.511 1.00 . B C . 5 DG N3 1 1 1 402 2 2 5 DG N7 N -1.328 -1.711 -6.676 1.00 . B C . 5 DG N7 1 1 1 403 2 2 5 DG N9 N -1.886 -3.920 -6.852 1.00 . B C . 5 DG N9 1 1 1 404 2 2 5 DG O3' O -5.051 -6.964 -5.173 1.00 . B C . 5 DG O3' 1 1 1 405 2 2 5 DG O4' O -3.803 -5.091 -7.729 1.00 . B C . 5 DG O4' 1 1 1 406 2 2 5 DG O5' O -5.788 -3.153 -6.481 1.00 . B C . 5 DG O5' 1 1 1 407 2 2 5 DG O6 O 1.636 -0.943 -7.285 1.00 . B C . 5 DG O6 1 1 1 408 2 2 5 DG OP1 O -8.053 -2.088 -6.447 1.00 . B C . 5 DG OP1 1 1 1 409 2 2 5 DG OP2 O -5.957 -0.733 -5.864 1.00 . B C . 5 DG OP2 1 1 1 410 2 2 5 DG P P -6.619 -1.788 -6.664 1.00 . B C . 5 DG P 1 1 1 411 2 2 6 DT C1' C 0.308 -7.365 -3.379 1.00 . B C . 6 DT C1' 1 1 1 412 2 2 6 DT C2 C 1.711 -5.366 -3.819 1.00 . B C . 6 DT C2 1 1 1 413 2 2 6 DT C2' C 0.014 -7.775 -1.937 1.00 . B C . 6 DT C2' 1 1 1 414 2 2 6 DT C3' C -1.177 -8.707 -1.981 1.00 . B C . 6 DT C3' 1 1 1 415 2 2 6 DT C4 C 0.802 -3.080 -3.532 1.00 . B C . 6 DT C4 1 1 1 416 2 2 6 DT C4' C -1.477 -8.895 -3.476 1.00 . B C . 6 DT C4' 1 1 1 417 2 2 6 DT C5 C -0.466 -3.688 -3.177 1.00 . B C . 6 DT C5 1 1 1 418 2 2 6 DT C5' C -2.977 -8.859 -3.783 1.00 . B C . 6 DT C5' 1 1 1 419 2 2 6 DT C6 C -0.601 -5.042 -3.162 1.00 . B C . 6 DT C6 1 1 1 420 2 2 6 DT C7 C -1.634 -2.790 -2.775 1.00 . B C . 6 DT C7 1 1 1 421 2 2 6 DT H1' H 1.225 -7.862 -3.712 1.00 . B C . 6 DT H1' 1 1 1 422 2 2 6 DT H2' H -0.218 -6.893 -1.343 1.00 . B C . 6 DT H2' 1 1 1 423 2 2 6 DT H2'' H 0.873 -8.294 -1.506 1.00 . B C . 6 DT H2'' 1 1 1 424 2 2 6 DT H3 H 2.697 -3.602 -4.075 1.00 . B C . 6 DT H3 1 1 1 425 2 2 6 DT H3' H -2.031 -8.242 -1.481 1.00 . B C . 6 DT H3' 1 1 1 426 2 2 6 DT H4' H -1.079 -9.858 -3.796 1.00 . B C . 6 DT H4' 1 1 1 427 2 2 6 DT H5' H -3.117 -8.871 -4.864 1.00 . B C . 6 DT H5' 1 1 1 428 2 2 6 DT H5'' H -3.448 -9.743 -3.355 1.00 . B C . 6 DT H5'' 1 1 1 429 2 2 6 DT H6 H -1.571 -5.479 -2.919 1.00 . B C . 6 DT H6 1 1 1 430 2 2 6 DT H71 H -2.575 -3.285 -2.989 1.00 . B C . 6 DT H71 1 1 1 431 2 2 6 DT H72 H -1.581 -1.854 -3.329 1.00 . B C . 6 DT H72 1 1 1 432 2 2 6 DT H73 H -1.575 -2.581 -1.708 1.00 . B C . 6 DT H73 1 1 1 433 2 2 6 DT N1 N 0.459 -5.880 -3.468 1.00 . B C . 6 DT N1 1 1 1 434 2 2 6 DT N3 N 1.810 -3.986 -3.830 1.00 . B C . 6 DT N3 1 1 1 435 2 2 6 DT O2 O 2.671 -6.081 -4.100 1.00 . B C . 6 DT O2 1 1 1 436 2 2 6 DT O3' O -0.867 -9.948 -1.334 1.00 . B C . 6 DT O3' 1 1 1 437 2 2 6 DT O4 O 1.021 -1.870 -3.578 1.00 . B C . 6 DT O4 1 1 1 438 2 2 6 DT O4' O -0.782 -7.848 -4.189 1.00 . B C . 6 DT O4' 1 1 1 439 2 2 6 DT O5' O -3.600 -7.690 -3.246 1.00 . B C . 6 DT O5' 1 1 1 440 2 2 6 DT OP1 O -5.931 -8.579 -3.471 1.00 . B C . 6 DT OP1 1 1 1 441 2 2 6 DT OP2 O -5.516 -6.126 -2.859 1.00 . B C . 6 DT OP2 1 1 1 442 2 2 6 DT P P -5.131 -7.342 -3.608 1.00 . B C . 6 DT P 1 1 1 443 2 2 7 DG C1' C 3.386 -7.193 1.407 1.00 . B C . 7 DG C1' 1 1 1 444 2 2 7 DG C2 C 4.807 -3.273 -0.004 1.00 . B C . 7 DG C2 1 1 1 445 2 2 7 DG C2' C 2.875 -7.451 2.820 1.00 . B C . 7 DG C2' 1 1 1 446 2 2 7 DG C3' C 2.254 -8.828 2.821 1.00 . B C . 7 DG C3' 1 1 1 447 2 2 7 DG C4 C 3.239 -4.853 0.402 1.00 . B C . 7 DG C4 1 1 1 448 2 2 7 DG C4' C 2.627 -9.432 1.469 1.00 . B C . 7 DG C4' 1 1 1 449 2 2 7 DG C5 C 2.175 -4.078 -0.088 1.00 . B C . 7 DG C5 1 1 1 450 2 2 7 DG C5' C 1.456 -10.141 0.762 1.00 . B C . 7 DG C5' 1 1 1 451 2 2 7 DG C6 C 2.449 -2.765 -0.588 1.00 . B C . 7 DG C6 1 1 1 452 2 2 7 DG C8 C 1.380 -5.876 0.535 1.00 . B C . 7 DG C8 1 1 1 453 2 2 7 DG H1 H 4.058 -1.537 -0.839 1.00 . B C . 7 DG H1 1 1 1 454 2 2 7 DG H1' H 4.458 -6.986 1.430 1.00 . B C . 7 DG H1' 1 1 1 455 2 2 7 DG H2' H 2.134 -6.701 3.091 1.00 . B C . 7 DG H2' 1 1 1 456 2 2 7 DG H2'' H 3.703 -7.424 3.529 1.00 . B C . 7 DG H2'' 1 1 1 457 2 2 7 DG H21 H 6.227 -1.853 -0.364 1.00 . B C . 7 DG H21 1 1 1 458 2 2 7 DG H22 H 6.813 -3.341 0.346 1.00 . B C . 7 DG H22 1 1 1 459 2 2 7 DG H3' H 1.171 -8.750 2.927 1.00 . B C . 7 DG H3' 1 1 1 460 2 2 7 DG H4' H 3.419 -10.158 1.644 1.00 . B C . 7 DG H4' 1 1 1 461 2 2 7 DG H5' H 1.669 -10.163 -0.299 1.00 . B C . 7 DG H5' 1 1 1 462 2 2 7 DG H5'' H 1.384 -11.165 1.131 1.00 . B C . 7 DG H5'' 1 1 1 463 2 2 7 DG H8 H 0.673 -6.672 0.767 1.00 . B C . 7 DG H8 1 1 1 464 2 2 7 DG N1 N 3.809 -2.444 -0.506 1.00 . B C . 7 DG N1 1 1 1 465 2 2 7 DG N2 N 6.049 -2.783 -0.007 1.00 . B C . 7 DG N2 1 1 1 466 2 2 7 DG N3 N 4.562 -4.512 0.470 1.00 . B C . 7 DG N3 1 1 1 467 2 2 7 DG N7 N 0.965 -4.778 0.013 1.00 . B C . 7 DG N7 1 1 1 468 2 2 7 DG N9 N 2.687 -6.045 0.810 1.00 . B C . 7 DG N9 1 1 1 469 2 2 7 DG O3' O 2.785 -9.617 3.890 1.00 . B C . 7 DG O3' 1 1 1 470 2 2 7 DG O4' O 3.154 -8.382 0.633 1.00 . B C . 7 DG O4' 1 1 1 471 2 2 7 DG O5' O 0.193 -9.497 0.933 1.00 . B C . 7 DG O5' 1 1 1 472 2 2 7 DG O6 O 1.660 -1.943 -1.050 1.00 . B C . 7 DG O6 1 1 1 473 2 2 7 DG OP1 O -1.126 -11.593 0.541 1.00 . B C . 7 DG OP1 1 1 1 474 2 2 7 DG OP2 O -2.294 -9.317 0.635 1.00 . B C . 7 DG OP2 1 1 1 475 2 2 7 DG P P -1.127 -10.141 0.252 1.00 . B C . 7 DG P 1 1 1 476 2 2 8 DC C1' C 4.892 -4.730 6.105 1.00 . B C . 8 DC C1' 1 1 1 477 2 2 8 DC C2 C 4.236 -2.858 4.606 1.00 . B C . 8 DC C2 1 1 1 478 2 2 8 DC C2' C 4.273 -4.745 7.501 1.00 . B C . 8 DC C2' 1 1 1 479 2 2 8 DC C3' C 4.170 -6.198 7.913 1.00 . B C . 8 DC C3' 1 1 1 480 2 2 8 DC C4 C 2.192 -2.942 3.414 1.00 . B C . 8 DC C4 1 1 1 481 2 2 8 DC C4' C 5.010 -6.954 6.889 1.00 . B C . 8 DC C4' 1 1 1 482 2 2 8 DC C5 C 1.880 -4.236 3.951 1.00 . B C . 8 DC C5 1 1 1 483 2 2 8 DC C5' C 4.384 -8.295 6.494 1.00 . B C . 8 DC C5' 1 1 1 484 2 2 8 DC C6 C 2.780 -4.783 4.805 1.00 . B C . 8 DC C6 1 1 1 485 2 2 8 DC H1' H 5.832 -4.170 6.125 1.00 . B C . 8 DC H1' 1 1 1 486 2 2 8 DC H2' H 3.282 -4.285 7.477 1.00 . B C . 8 DC H2' 1 1 1 487 2 2 8 DC H2'' H 4.911 -4.208 8.206 1.00 . B C . 8 DC H2'' 1 1 1 488 2 2 8 DC H3' H 3.128 -6.524 7.865 1.00 . B C . 8 DC H3' 1 1 1 489 2 2 8 DC H4' H 5.988 -7.140 7.327 1.00 . B C . 8 DC H4' 1 1 1 490 2 2 8 DC H41 H 1.556 -1.440 2.184 1.00 . B C . 8 DC H41 1 1 1 491 2 2 8 DC H42 H 0.484 -2.819 2.306 1.00 . B C . 8 DC H42 1 1 1 492 2 2 8 DC H5 H 0.961 -4.756 3.686 1.00 . B C . 8 DC H5 1 1 1 493 2 2 8 DC H5' H 5.036 -8.797 5.783 1.00 . B C . 8 DC H5' 1 1 1 494 2 2 8 DC H5'' H 4.288 -8.917 7.384 1.00 . B C . 8 DC H5'' 1 1 1 495 2 2 8 DC H6 H 2.582 -5.766 5.234 1.00 . B C . 8 DC H6 1 1 1 496 2 2 8 DC HO3' H 4.884 -7.328 9.324 1.00 . B C . 8 DC HO3' 1 1 1 497 2 2 8 DC N1 N 3.941 -4.120 5.139 1.00 . B C . 8 DC N1 1 1 1 498 2 2 8 DC N3 N 3.331 -2.308 3.749 1.00 . B C . 8 DC N3 1 1 1 499 2 2 8 DC N4 N 1.341 -2.353 2.566 1.00 . B C . 8 DC N4 1 1 1 500 2 2 8 DC O2 O 5.275 -2.273 4.906 1.00 . B C . 8 DC O2 1 1 1 501 2 2 8 DC O3' O 4.675 -6.396 9.236 1.00 . B C . 8 DC O3' 1 1 1 502 2 2 8 DC O4' O 5.178 -6.098 5.742 1.00 . B C . 8 DC O4' 1 1 1 503 2 2 8 DC O5' O 3.094 -8.132 5.900 1.00 . B C . 8 DC O5' 1 1 1 504 2 2 8 DC OP1 O 2.695 -10.587 6.195 1.00 . B C . 8 DC OP1 1 1 1 505 2 2 8 DC OP2 O 0.828 -9.050 5.345 1.00 . B C . 8 DC OP2 1 1 1 506 2 2 8 DC P P 2.261 -9.417 5.399 1.00 . B C . 8 DC P 1 1 1 507 3 3 3 ASP C C 15.962 -9.093 -5.152 1.00 . C A . 3 ASP C 1 1 1 508 3 3 3 ASP CA C 17.460 -8.995 -4.871 1.00 . C A . 3 ASP CA 1 1 1 509 3 3 3 ASP CB C 18.106 -8.111 -5.942 1.00 . C A . 3 ASP CB 1 1 1 510 3 3 3 ASP CG C 19.570 -7.853 -5.586 1.00 . C A . 3 ASP CG 1 1 1 511 3 3 3 ASP H H 17.888 -10.952 -5.664 1.00 . C A . 3 ASP H 1 1 1 512 3 3 3 ASP HA H 17.616 -8.554 -3.897 1.00 . C A . 3 ASP HA 1 1 1 513 3 3 3 ASP HB2 H 18.049 -8.608 -6.900 1.00 . C A . 3 ASP HB2 1 1 1 514 3 3 3 ASP HB3 H 17.580 -7.170 -5.994 1.00 . C A . 3 ASP HB3 1 1 1 515 3 3 3 ASP N N 18.069 -10.355 -4.907 1.00 . C A . 3 ASP N 1 1 1 516 3 3 3 ASP O O 15.174 -9.430 -4.290 1.00 . C A . 3 ASP O 1 1 1 517 3 3 3 ASP OD1 O 19.811 -7.234 -4.563 1.00 . C A . 3 ASP OD1 1 1 1 518 3 3 3 ASP OD2 O 20.424 -8.275 -6.348 1.00 . C A . 3 ASP OD2 1 1 1 519 3 3 4 ARG C C 13.675 -10.271 -6.913 1.00 . C A . 4 ARG C 1 1 1 520 3 3 4 ARG CA C 14.121 -8.840 -6.703 1.00 . C A . 4 ARG CA 1 1 1 521 3 3 4 ARG CB C 13.875 -8.092 -8.009 1.00 . C A . 4 ARG CB 1 1 1 522 3 3 4 ARG CD C 15.090 -6.204 -9.131 1.00 . C A . 4 ARG CD 1 1 1 523 3 3 4 ARG CG C 14.312 -6.614 -7.880 1.00 . C A . 4 ARG CG 1 1 1 524 3 3 4 ARG CZ C 16.067 -4.182 -9.996 1.00 . C A . 4 ARG CZ 1 1 1 525 3 3 4 ARG H H 16.220 -8.508 -7.029 1.00 . C A . 4 ARG H 1 1 1 526 3 3 4 ARG HA H 13.539 -8.388 -5.916 1.00 . C A . 4 ARG HA 1 1 1 527 3 3 4 ARG HB2 H 14.437 -8.583 -8.797 1.00 . C A . 4 ARG HB2 1 1 1 528 3 3 4 ARG HB3 H 12.822 -8.139 -8.248 1.00 . C A . 4 ARG HB3 1 1 1 529 3 3 4 ARG HD2 H 16.064 -6.658 -9.108 1.00 . C A . 4 ARG HD2 1 1 1 530 3 3 4 ARG HD3 H 14.561 -6.539 -10.015 1.00 . C A . 4 ARG HD3 1 1 1 531 3 3 4 ARG HE H 14.718 -4.170 -8.542 1.00 . C A . 4 ARG HE 1 1 1 532 3 3 4 ARG HG2 H 13.437 -5.983 -7.790 1.00 . C A . 4 ARG HG2 1 1 1 533 3 3 4 ARG HG3 H 14.942 -6.484 -7.005 1.00 . C A . 4 ARG HG3 1 1 1 534 3 3 4 ARG HH11 H 16.611 -5.928 -10.810 1.00 . C A . 4 ARG HH11 1 1 1 535 3 3 4 ARG HH12 H 17.377 -4.522 -11.471 1.00 . C A . 4 ARG HH12 1 1 1 536 3 3 4 ARG HH21 H 15.701 -2.316 -9.380 1.00 . C A . 4 ARG HH21 1 1 1 537 3 3 4 ARG HH22 H 16.858 -2.471 -10.657 1.00 . C A . 4 ARG HH22 1 1 1 538 3 3 4 ARG N N 15.565 -8.786 -6.355 1.00 . C A . 4 ARG N 1 1 1 539 3 3 4 ARG NE N 15.236 -4.727 -9.158 1.00 . C A . 4 ARG NE 1 1 1 540 3 3 4 ARG NH1 N 16.737 -4.936 -10.824 1.00 . C A . 4 ARG NH1 1 1 1 541 3 3 4 ARG NH2 N 16.221 -2.889 -10.012 1.00 . C A . 4 ARG NH2 1 1 1 542 3 3 4 ARG O O 14.291 -11.035 -7.631 1.00 . C A . 4 ARG O 1 1 1 543 3 3 5 VAL C C 11.140 -11.913 -7.781 1.00 . C A . 5 VAL C 1 1 1 544 3 3 5 VAL CA C 12.026 -11.976 -6.542 1.00 . C A . 5 VAL CA 1 1 1 545 3 3 5 VAL CB C 11.205 -12.380 -5.313 1.00 . C A . 5 VAL CB 1 1 1 546 3 3 5 VAL CG1 C 10.697 -13.846 -5.450 1.00 . C A . 5 VAL CG1 1 1 1 547 3 3 5 VAL CG2 C 12.098 -12.228 -4.071 1.00 . C A . 5 VAL CG2 1 1 1 548 3 3 5 VAL H H 12.073 -9.969 -5.800 1.00 . C A . 5 VAL H 1 1 1 549 3 3 5 VAL HA H 12.830 -12.685 -6.699 1.00 . C A . 5 VAL HA 1 1 1 550 3 3 5 VAL HB H 10.360 -11.711 -5.225 1.00 . C A . 5 VAL HB 1 1 1 551 3 3 5 VAL HG11 H 11.024 -14.269 -6.389 1.00 . C A . 5 VAL HG11 1 1 1 552 3 3 5 VAL HG12 H 11.079 -14.453 -4.642 1.00 . C A . 5 VAL HG12 1 1 1 553 3 3 5 VAL HG13 H 9.615 -13.858 -5.416 1.00 . C A . 5 VAL HG13 1 1 1 554 3 3 5 VAL HG21 H 13.054 -12.697 -4.254 1.00 . C A . 5 VAL HG21 1 1 1 555 3 3 5 VAL HG22 H 12.249 -11.178 -3.865 1.00 . C A . 5 VAL HG22 1 1 1 556 3 3 5 VAL HG23 H 11.626 -12.695 -3.222 1.00 . C A . 5 VAL HG23 1 1 1 557 3 3 5 VAL N N 12.571 -10.620 -6.338 1.00 . C A . 5 VAL N 1 1 1 558 3 3 5 VAL O O 10.658 -10.861 -8.149 1.00 . C A . 5 VAL O 1 1 1 559 3 3 6 LYS C C 8.620 -12.806 -9.230 1.00 . C A . 6 LYS C 1 1 1 560 3 3 6 LYS CA C 10.081 -12.994 -9.654 1.00 . C A . 6 LYS CA 1 1 1 561 3 3 6 LYS CB C 10.257 -14.332 -10.414 1.00 . C A . 6 LYS CB 1 1 1 562 3 3 6 LYS CD C 10.749 -16.788 -10.072 1.00 . C A . 6 LYS CD 1 1 1 563 3 3 6 LYS CE C 9.429 -17.407 -9.603 1.00 . C A . 6 LYS CE 1 1 1 564 3 3 6 LYS CG C 10.901 -15.374 -9.483 1.00 . C A . 6 LYS CG 1 1 1 565 3 3 6 LYS H H 11.335 -13.845 -8.125 1.00 . C A . 6 LYS H 1 1 1 566 3 3 6 LYS HA H 10.379 -12.169 -10.288 1.00 . C A . 6 LYS HA 1 1 1 567 3 3 6 LYS HB2 H 9.297 -14.698 -10.755 1.00 . C A . 6 LYS HB2 1 1 1 568 3 3 6 LYS HB3 H 10.901 -14.179 -11.269 1.00 . C A . 6 LYS HB3 1 1 1 569 3 3 6 LYS HD2 H 10.760 -16.740 -11.155 1.00 . C A . 6 LYS HD2 1 1 1 570 3 3 6 LYS HD3 H 11.571 -17.405 -9.734 1.00 . C A . 6 LYS HD3 1 1 1 571 3 3 6 LYS HE2 H 9.511 -17.679 -8.561 1.00 . C A . 6 LYS HE2 1 1 1 572 3 3 6 LYS HE3 H 8.628 -16.691 -9.726 1.00 . C A . 6 LYS HE3 1 1 1 573 3 3 6 LYS HG2 H 11.953 -15.145 -9.372 1.00 . C A . 6 LYS HG2 1 1 1 574 3 3 6 LYS HG3 H 10.420 -15.334 -8.511 1.00 . C A . 6 LYS HG3 1 1 1 575 3 3 6 LYS HZ1 H 10.022 -19.147 -10.576 1.00 . C A . 6 LYS HZ1 1 1 1 576 3 3 6 LYS HZ2 H 8.466 -19.225 -9.900 1.00 . C A . 6 LYS HZ2 1 1 1 577 3 3 6 LYS HZ3 H 8.725 -18.341 -11.323 1.00 . C A . 6 LYS HZ3 1 1 1 578 3 3 6 LYS N N 10.929 -13.008 -8.431 1.00 . C A . 6 LYS N 1 1 1 579 3 3 6 LYS NZ N 9.138 -18.622 -10.412 1.00 . C A . 6 LYS NZ 1 1 1 580 3 3 6 LYS O O 8.231 -13.181 -8.141 1.00 . C A . 6 LYS O 1 1 1 581 3 3 7 ARG C C 5.503 -12.215 -10.989 1.00 . C A . 7 ARG C 1 1 1 582 3 3 7 ARG CA C 6.373 -11.999 -9.725 1.00 . C A . 7 ARG CA 1 1 1 583 3 3 7 ARG CB C 6.178 -10.563 -9.180 1.00 . C A . 7 ARG CB 1 1 1 584 3 3 7 ARG CD C 8.353 -9.390 -9.838 1.00 . C A . 7 ARG CD 1 1 1 585 3 3 7 ARG CG C 6.833 -9.499 -10.094 1.00 . C A . 7 ARG CG 1 1 1 586 3 3 7 ARG CZ C 10.334 -9.186 -11.232 1.00 . C A . 7 ARG CZ 1 1 1 587 3 3 7 ARG H H 8.149 -11.918 -10.949 1.00 . C A . 7 ARG H 1 1 1 588 3 3 7 ARG HA H 6.098 -12.696 -8.954 1.00 . C A . 7 ARG HA 1 1 1 589 3 3 7 ARG HB2 H 5.121 -10.358 -9.107 1.00 . C A . 7 ARG HB2 1 1 1 590 3 3 7 ARG HB3 H 6.616 -10.498 -8.194 1.00 . C A . 7 ARG HB3 1 1 1 591 3 3 7 ARG HD2 H 8.579 -8.466 -9.332 1.00 . C A . 7 ARG HD2 1 1 1 592 3 3 7 ARG HD3 H 8.693 -10.213 -9.224 1.00 . C A . 7 ARG HD3 1 1 1 593 3 3 7 ARG HE H 8.528 -9.517 -11.983 1.00 . C A . 7 ARG HE 1 1 1 594 3 3 7 ARG HG2 H 6.670 -9.757 -11.125 1.00 . C A . 7 ARG HG2 1 1 1 595 3 3 7 ARG HG3 H 6.371 -8.540 -9.900 1.00 . C A . 7 ARG HG3 1 1 1 596 3 3 7 ARG HH11 H 10.602 -9.189 -9.249 1.00 . C A . 7 ARG HH11 1 1 1 597 3 3 7 ARG HH12 H 12.030 -8.942 -10.198 1.00 . C A . 7 ARG HH12 1 1 1 598 3 3 7 ARG HH21 H 10.373 -9.186 -13.235 1.00 . C A . 7 ARG HH21 1 1 1 599 3 3 7 ARG HH22 H 11.899 -8.938 -12.455 1.00 . C A . 7 ARG HH22 1 1 1 600 3 3 7 ARG N N 7.810 -12.219 -10.079 1.00 . C A . 7 ARG N 1 1 1 601 3 3 7 ARG NE N 9.049 -9.395 -11.161 1.00 . C A . 7 ARG NE 1 1 1 602 3 3 7 ARG NH1 N 11.044 -9.096 -10.142 1.00 . C A . 7 ARG NH1 1 1 1 603 3 3 7 ARG NH2 N 10.915 -9.096 -12.398 1.00 . C A . 7 ARG NH2 1 1 1 604 3 3 7 ARG O O 5.738 -11.577 -11.993 1.00 . C A . 7 ARG O 1 1 1 605 3 3 8 PRO C C 2.858 -12.068 -12.417 1.00 . C A . 8 PRO C 1 1 1 606 3 3 8 PRO CA C 3.681 -13.327 -12.140 1.00 . C A . 8 PRO CA 1 1 1 607 3 3 8 PRO CB C 2.760 -14.509 -11.772 1.00 . C A . 8 PRO CB 1 1 1 608 3 3 8 PRO CD C 4.159 -13.946 -9.783 1.00 . C A . 8 PRO CD 1 1 1 609 3 3 8 PRO CG C 2.934 -14.765 -10.253 1.00 . C A . 8 PRO CG 1 1 1 610 3 3 8 PRO HA H 4.292 -13.576 -12.994 1.00 . C A . 8 PRO HA 1 1 1 611 3 3 8 PRO HB2 H 1.725 -14.271 -11.995 1.00 . C A . 8 PRO HB2 1 1 1 612 3 3 8 PRO HB3 H 3.054 -15.391 -12.324 1.00 . C A . 8 PRO HB3 1 1 1 613 3 3 8 PRO HD2 H 3.895 -13.327 -8.933 1.00 . C A . 8 PRO HD2 1 1 1 614 3 3 8 PRO HD3 H 4.979 -14.606 -9.533 1.00 . C A . 8 PRO HD3 1 1 1 615 3 3 8 PRO HG2 H 2.045 -14.443 -9.722 1.00 . C A . 8 PRO HG2 1 1 1 616 3 3 8 PRO HG3 H 3.100 -15.813 -10.076 1.00 . C A . 8 PRO HG3 1 1 1 617 3 3 8 PRO N N 4.520 -13.104 -10.951 1.00 . C A . 8 PRO N 1 1 1 618 3 3 8 PRO O O 3.023 -11.049 -11.776 1.00 . C A . 8 PRO O 1 1 1 619 3 3 9 MET C C 0.235 -10.672 -12.443 1.00 . C A . 9 MET C 1 1 1 620 3 3 9 MET CA C 1.111 -10.972 -13.659 1.00 . C A . 9 MET CA 1 1 1 621 3 3 9 MET CB C 0.229 -11.297 -14.863 1.00 . C A . 9 MET CB 1 1 1 622 3 3 9 MET CE C 2.975 -11.167 -17.928 1.00 . C A . 9 MET CE 1 1 1 623 3 3 9 MET CG C 1.114 -11.729 -16.034 1.00 . C A . 9 MET CG 1 1 1 624 3 3 9 MET H H 1.839 -12.984 -13.844 1.00 . C A . 9 MET H 1 1 1 625 3 3 9 MET HA H 1.733 -10.117 -13.882 1.00 . C A . 9 MET HA 1 1 1 626 3 3 9 MET HB2 H -0.448 -12.099 -14.605 1.00 . C A . 9 MET HB2 1 1 1 627 3 3 9 MET HB3 H -0.336 -10.422 -15.144 1.00 . C A . 9 MET HB3 1 1 1 628 3 3 9 MET HE1 H 2.312 -11.899 -18.366 1.00 . C A . 9 MET HE1 1 1 1 629 3 3 9 MET HE2 H 3.254 -10.446 -18.678 1.00 . C A . 9 MET HE2 1 1 1 630 3 3 9 MET HE3 H 3.862 -11.657 -17.555 1.00 . C A . 9 MET HE3 1 1 1 631 3 3 9 MET HG2 H 1.755 -12.541 -15.720 1.00 . C A . 9 MET HG2 1 1 1 632 3 3 9 MET HG3 H 0.494 -12.057 -16.853 1.00 . C A . 9 MET HG3 1 1 1 633 3 3 9 MET N N 1.962 -12.145 -13.352 1.00 . C A . 9 MET N 1 1 1 634 3 3 9 MET O O -0.162 -11.565 -11.721 1.00 . C A . 9 MET O 1 1 1 635 3 3 9 MET SD S 2.130 -10.329 -16.566 1.00 . C A . 9 MET SD 1 1 1 636 3 3 10 ASN C C -2.398 -9.197 -11.449 1.00 . C A . 10 ASN C 1 1 1 637 3 3 10 ASN CA C -0.933 -9.087 -11.034 1.00 . C A . 10 ASN CA 1 1 1 638 3 3 10 ASN CB C -0.636 -7.658 -10.577 1.00 . C A . 10 ASN CB 1 1 1 639 3 3 10 ASN CG C 0.877 -7.439 -10.538 1.00 . C A . 10 ASN CG 1 1 1 640 3 3 10 ASN H H 0.250 -8.718 -12.799 1.00 . C A . 10 ASN H 1 1 1 641 3 3 10 ASN HA H -0.736 -9.774 -10.223 1.00 . C A . 10 ASN HA 1 1 1 642 3 3 10 ASN HB2 H -1.085 -6.957 -11.266 1.00 . C A . 10 ASN HB2 1 1 1 643 3 3 10 ASN HB3 H -1.046 -7.505 -9.589 1.00 . C A . 10 ASN HB3 1 1 1 644 3 3 10 ASN HD21 H 1.192 -8.874 -9.203 1.00 . C A . 10 ASN HD21 1 1 1 645 3 3 10 ASN HD22 H 2.581 -8.053 -9.725 1.00 . C A . 10 ASN HD22 1 1 1 646 3 3 10 ASN N N -0.075 -9.427 -12.206 1.00 . C A . 10 ASN N 1 1 1 647 3 3 10 ASN ND2 N 1.610 -8.184 -9.757 1.00 . C A . 10 ASN ND2 1 1 1 648 3 3 10 ASN O O -2.756 -8.873 -12.564 1.00 . C A . 10 ASN O 1 1 1 649 3 3 10 ASN OD1 O 1.397 -6.584 -11.227 1.00 . C A . 10 ASN OD1 1 1 1 650 3 3 11 ALA C C -5.163 -8.538 -11.660 1.00 . C A . 11 ALA C 1 1 1 651 3 3 11 ALA CA C -4.694 -9.788 -10.913 1.00 . C A . 11 ALA CA 1 1 1 652 3 3 11 ALA CB C -5.515 -9.964 -9.630 1.00 . C A . 11 ALA CB 1 1 1 653 3 3 11 ALA H H -2.933 -9.908 -9.672 1.00 . C A . 11 ALA H 1 1 1 654 3 3 11 ALA HA H -4.829 -10.653 -11.544 1.00 . C A . 11 ALA HA 1 1 1 655 3 3 11 ALA HB1 H -4.979 -10.608 -8.946 1.00 . C A . 11 ALA HB1 1 1 1 656 3 3 11 ALA HB2 H -5.675 -9.001 -9.165 1.00 . C A . 11 ALA HB2 1 1 1 657 3 3 11 ALA HB3 H -6.469 -10.411 -9.872 1.00 . C A . 11 ALA HB3 1 1 1 658 3 3 11 ALA N N -3.247 -9.653 -10.565 1.00 . C A . 11 ALA N 1 1 1 659 3 3 11 ALA O O -6.135 -8.564 -12.391 1.00 . C A . 11 ALA O 1 1 1 660 3 3 12 PHE C C -4.395 -6.270 -13.652 1.00 . C A . 12 PHE C 1 1 1 661 3 3 12 PHE CA C -4.870 -6.198 -12.196 1.00 . C A . 12 PHE CA 1 1 1 662 3 3 12 PHE CB C -4.248 -4.982 -11.497 1.00 . C A . 12 PHE CB 1 1 1 663 3 3 12 PHE CD1 C -5.679 -3.095 -12.408 1.00 . C A . 12 PHE CD1 1 1 1 664 3 3 12 PHE CD2 C -3.353 -3.250 -13.100 1.00 . C A . 12 PHE CD2 1 1 1 665 3 3 12 PHE CE1 C -5.837 -1.950 -13.216 1.00 . C A . 12 PHE CE1 1 1 1 666 3 3 12 PHE CE2 C -3.509 -2.107 -13.905 1.00 . C A . 12 PHE CE2 1 1 1 667 3 3 12 PHE CG C -4.432 -3.746 -12.353 1.00 . C A . 12 PHE CG 1 1 1 668 3 3 12 PHE CZ C -4.752 -1.458 -13.964 1.00 . C A . 12 PHE CZ 1 1 1 669 3 3 12 PHE H H -3.685 -7.446 -10.903 1.00 . C A . 12 PHE H 1 1 1 670 3 3 12 PHE HA H -5.945 -6.109 -12.177 1.00 . C A . 12 PHE HA 1 1 1 671 3 3 12 PHE HB2 H -4.733 -4.832 -10.543 1.00 . C A . 12 PHE HB2 1 1 1 672 3 3 12 PHE HB3 H -3.195 -5.158 -11.340 1.00 . C A . 12 PHE HB3 1 1 1 673 3 3 12 PHE HD1 H -6.513 -3.473 -11.836 1.00 . C A . 12 PHE HD1 1 1 1 674 3 3 12 PHE HD2 H -2.402 -3.743 -13.048 1.00 . C A . 12 PHE HD2 1 1 1 675 3 3 12 PHE HE1 H -6.784 -1.448 -13.259 1.00 . C A . 12 PHE HE1 1 1 1 676 3 3 12 PHE HE2 H -2.676 -1.731 -14.479 1.00 . C A . 12 PHE HE2 1 1 1 677 3 3 12 PHE HZ H -4.876 -0.580 -14.581 1.00 . C A . 12 PHE HZ 1 1 1 678 3 3 12 PHE N N -4.470 -7.443 -11.490 1.00 . C A . 12 PHE N 1 1 1 679 3 3 12 PHE O O -5.176 -6.101 -14.570 1.00 . C A . 12 PHE O 1 1 1 680 3 3 13 ILE C C -3.395 -7.770 -15.983 24.61 . C A . 13 ILE C 1 1 1 681 3 3 13 ILE CA C -2.674 -6.597 -15.301 24.61 . C A . 13 ILE CA 1 1 1 682 3 3 13 ILE CB C -1.124 -6.735 -15.383 24.61 . C A . 13 ILE CB 1 1 1 683 3 3 13 ILE CD1 C 1.004 -5.359 -14.928 24.61 . C A . 13 ILE CD1 1 1 1 684 3 3 13 ILE CG1 C -0.513 -5.325 -15.180 24.61 . C A . 13 ILE CG1 1 1 1 685 3 3 13 ILE CG2 C -0.716 -7.307 -16.765 24.61 . C A . 13 ILE CG2 1 1 1 686 3 3 13 ILE H H -2.503 -6.663 -13.149 1.00 . C A . 13 ILE H 1 1 1 687 3 3 13 ILE HA H -2.973 -5.685 -15.803 1.00 . C A . 13 ILE HA 1 1 1 688 3 3 13 ILE HB H -0.778 -7.397 -14.601 1.00 . C A . 13 ILE HB 1 1 1 689 3 3 13 ILE HD11 H 1.218 -5.983 -14.073 1.00 . C A . 13 ILE HD11 1 1 1 690 3 3 13 ILE HD12 H 1.524 -5.738 -15.791 1.00 . C A . 13 ILE HD12 1 1 1 691 3 3 13 ILE HD13 H 1.344 -4.350 -14.728 1.00 . C A . 13 ILE HD13 1 1 1 692 3 3 13 ILE HG12 H -0.709 -4.723 -16.050 1.00 . C A . 13 ILE HG12 1 1 1 693 3 3 13 ILE HG13 H -0.985 -4.871 -14.331 1.00 . C A . 13 ILE HG13 1 1 1 694 3 3 13 ILE HG21 H -1.426 -6.998 -17.511 1.00 . C A . 13 ILE HG21 1 1 1 695 3 3 13 ILE HG22 H 0.257 -6.954 -17.047 1.00 . C A . 13 ILE HG22 1 1 1 696 3 3 13 ILE HG23 H -0.699 -8.384 -16.716 1.00 . C A . 13 ILE HG23 1 1 1 697 3 3 13 ILE N N -3.131 -6.522 -13.888 24.61 . C A . 13 ILE N 1 1 1 698 3 3 13 ILE O O -3.602 -7.759 -17.176 24.61 . C A . 13 ILE O 1 1 1 699 3 3 14 VAL C C -5.703 -9.269 -16.725 1.00 . C A . 14 VAL C 1 1 1 700 3 3 14 VAL CA C -4.576 -9.884 -15.895 1.00 . C A . 14 VAL CA 1 1 1 701 3 3 14 VAL CB C -5.158 -10.836 -14.835 1.00 . C A . 14 VAL CB 1 1 1 702 3 3 14 VAL CG1 C -6.075 -11.886 -15.489 1.00 . C A . 14 VAL CG1 1 1 1 703 3 3 14 VAL CG2 C -4.011 -11.566 -14.136 1.00 . C A . 14 VAL CG2 1 1 1 704 3 3 14 VAL H H -3.699 -8.753 -14.269 1.00 . C A . 14 VAL H 1 1 1 705 3 3 14 VAL HA H -3.908 -10.428 -16.546 1.00 . C A . 14 VAL HA 1 1 1 706 3 3 14 VAL HB H -5.721 -10.269 -14.109 1.00 . C A . 14 VAL HB 1 1 1 707 3 3 14 VAL HG11 H -6.847 -11.405 -16.068 1.00 . C A . 14 VAL HG11 1 1 1 708 3 3 14 VAL HG12 H -5.489 -12.524 -16.133 1.00 . C A . 14 VAL HG12 1 1 1 709 3 3 14 VAL HG13 H -6.537 -12.486 -14.719 1.00 . C A . 14 VAL HG13 1 1 1 710 3 3 14 VAL HG21 H -3.383 -12.040 -14.876 1.00 . C A . 14 VAL HG21 1 1 1 711 3 3 14 VAL HG22 H -3.427 -10.862 -13.569 1.00 . C A . 14 VAL HG22 1 1 1 712 3 3 14 VAL HG23 H -4.414 -12.317 -13.473 1.00 . C A . 14 VAL HG23 1 1 1 713 3 3 14 VAL N N -3.831 -8.763 -15.240 1.00 . C A . 14 VAL N 1 1 1 714 3 3 14 VAL O O -5.846 -9.556 -17.901 1.00 . C A . 14 VAL O 1 1 1 715 3 3 15 TRP C C -6.926 -7.175 -18.176 101.08 . C A . 15 TRP C 1 1 1 716 3 3 15 TRP CA C -7.574 -7.753 -16.934 101.08 . C A . 15 TRP CA 1 1 1 717 3 3 15 TRP CB C -8.234 -6.602 -16.154 101.08 . C A . 15 TRP CB 1 1 1 718 3 3 15 TRP CD1 C -10.230 -8.001 -15.443 101.08 . C A . 15 TRP CD1 1 1 1 719 3 3 15 TRP CD2 C -9.369 -6.766 -13.768 101.08 . C A . 15 TRP CD2 1 1 1 720 3 3 15 TRP CE2 C -10.460 -7.491 -13.225 101.08 . C A . 15 TRP CE2 1 1 1 721 3 3 15 TRP CE3 C -8.649 -5.901 -12.916 101.08 . C A . 15 TRP CE3 1 1 1 722 3 3 15 TRP CG C -9.235 -7.118 -15.173 101.08 . C A . 15 TRP CG 1 1 1 723 3 3 15 TRP CH2 C -10.101 -6.500 -11.042 101.08 . C A . 15 TRP CH2 1 1 1 724 3 3 15 TRP CZ2 C -10.827 -7.366 -11.879 101.08 . C A . 15 TRP CZ2 1 1 1 725 3 3 15 TRP CZ3 C -9.015 -5.766 -11.560 101.08 . C A . 15 TRP CZ3 1 1 1 726 3 3 15 TRP H H -6.353 -8.154 -15.198 1.00 . C A . 15 TRP H 1 1 1 727 3 3 15 TRP HA H -8.308 -8.489 -17.216 1.00 . C A . 15 TRP HA 1 1 1 728 3 3 15 TRP HB2 H -7.472 -6.052 -15.624 1.00 . C A . 15 TRP HB2 1 1 1 729 3 3 15 TRP HB3 H -8.731 -5.935 -16.847 1.00 . C A . 15 TRP HB3 1 1 1 730 3 3 15 TRP HD1 H -10.427 -8.459 -16.399 1.00 . C A . 15 TRP HD1 1 1 1 731 3 3 15 TRP HE1 H -11.716 -8.834 -14.205 1.00 . C A . 15 TRP HE1 1 1 1 732 3 3 15 TRP HE3 H -7.818 -5.333 -13.307 1.00 . C A . 15 TRP HE3 1 1 1 733 3 3 15 TRP HH2 H -10.378 -6.395 -10.004 1.00 . C A . 15 TRP HH2 1 1 1 734 3 3 15 TRP HZ2 H -11.657 -7.933 -11.489 1.00 . C A . 15 TRP HZ2 1 1 1 735 3 3 15 TRP HZ3 H -8.458 -5.102 -10.916 1.00 . C A . 15 TRP HZ3 1 1 1 736 3 3 15 TRP N N -6.491 -8.396 -16.139 101.08 . C A . 15 TRP N 1 1 1 737 3 3 15 TRP NE1 N -10.949 -8.228 -14.284 101.08 . C A . 15 TRP NE1 1 1 1 738 3 3 15 TRP O O -7.306 -7.485 -19.287 101.08 . C A . 15 TRP O 1 1 1 739 3 3 16 SER C C -5.068 -6.764 -20.244 1.00 . C A . 16 SER C 1 1 1 740 3 3 16 SER CA C -5.229 -5.725 -19.137 1.00 . C A . 16 SER CA 1 1 1 741 3 3 16 SER CB C -3.853 -5.208 -18.711 1.00 . C A . 16 SER CB 1 1 1 742 3 3 16 SER H H -5.648 -6.124 -17.068 1.00 . C A . 16 SER H 1 1 1 743 3 3 16 SER HA H -5.817 -4.903 -19.495 1.00 . C A . 16 SER HA 1 1 1 744 3 3 16 SER HB2 H -3.921 -4.755 -17.736 1.00 . C A . 16 SER HB2 1 1 1 745 3 3 16 SER HB3 H -3.154 -6.028 -18.676 1.00 . C A . 16 SER HB3 1 1 1 746 3 3 16 SER HG H -3.510 -4.606 -20.530 1.00 . C A . 16 SER HG 1 1 1 747 3 3 16 SER N N -5.931 -6.341 -17.982 1.00 . C A . 16 SER N 1 1 1 748 3 3 16 SER O O -5.534 -6.593 -21.320 1.00 . C A . 16 SER O 1 1 1 749 3 3 16 SER OG O -3.410 -4.236 -19.650 1.00 . C A . 16 SER OG 1 1 1 750 3 3 17 ARG C C -5.572 -9.078 -21.850 1.00 . C A . 17 ARG C 1 1 1 751 3 3 17 ARG CA C -4.272 -8.905 -21.023 1.00 . C A . 17 ARG CA 1 1 1 752 3 3 17 ARG CB C -3.941 -10.242 -20.355 1.00 . C A . 17 ARG CB 1 1 1 753 3 3 17 ARG CD C -1.424 -9.909 -20.209 1.00 . C A . 17 ARG CD 1 1 1 754 3 3 17 ARG CG C -2.728 -10.096 -19.421 1.00 . C A . 17 ARG CG 1 1 1 755 3 3 17 ARG CZ C -0.347 -10.952 -22.122 1.00 . C A . 17 ARG CZ 1 1 1 756 3 3 17 ARG H H -4.075 -7.997 -19.073 1.00 . C A . 17 ARG H 1 1 1 757 3 3 17 ARG HA H -3.461 -8.627 -21.682 1.00 . C A . 17 ARG HA 1 1 1 758 3 3 17 ARG HB2 H -4.795 -10.564 -19.776 1.00 . C A . 17 ARG HB2 1 1 1 759 3 3 17 ARG HB3 H -3.732 -10.977 -21.112 1.00 . C A . 17 ARG HB3 1 1 1 760 3 3 17 ARG HD2 H -1.387 -8.929 -20.636 1.00 . C A . 17 ARG HD2 1 1 1 761 3 3 17 ARG HD3 H -0.583 -10.021 -19.527 1.00 . C A . 17 ARG HD3 1 1 1 762 3 3 17 ARG HE H -2.122 -11.519 -21.461 1.00 . C A . 17 ARG HE 1 1 1 763 3 3 17 ARG HG2 H -2.871 -9.245 -18.782 1.00 . C A . 17 ARG HG2 1 1 1 764 3 3 17 ARG HG3 H -2.647 -10.984 -18.811 1.00 . C A . 17 ARG HG3 1 1 1 765 3 3 17 ARG HH11 H 0.736 -9.639 -21.065 1.00 . C A . 17 ARG HH11 1 1 1 766 3 3 17 ARG HH12 H 1.497 -10.262 -22.492 1.00 . C A . 17 ARG HH12 1 1 1 767 3 3 17 ARG HH21 H -1.163 -12.325 -23.327 1.00 . C A . 17 ARG HH21 1 1 1 768 3 3 17 ARG HH22 H 0.419 -11.781 -23.775 1.00 . C A . 17 ARG HH22 1 1 1 769 3 3 17 ARG N N -4.436 -7.856 -19.971 1.00 . C A . 17 ARG N 1 1 1 770 3 3 17 ARG NE N -1.366 -10.916 -21.313 1.00 . C A . 17 ARG NE 1 1 1 771 3 3 17 ARG NH1 N 0.710 -10.225 -21.876 1.00 . C A . 17 ARG NH1 1 1 1 772 3 3 17 ARG NH2 N -0.365 -11.747 -23.156 1.00 . C A . 17 ARG NH2 1 1 1 773 3 3 17 ARG O O -5.666 -8.639 -22.983 1.00 . C A . 17 ARG O 1 1 1 774 3 3 18 ASP C C -8.767 -8.779 -22.113 1.00 . C A . 18 ASP C 1 1 1 775 3 3 18 ASP CA C -7.830 -10.004 -22.056 1.00 . C A . 18 ASP CA 1 1 1 776 3 3 18 ASP CB C -8.570 -11.162 -21.388 1.00 . C A . 18 ASP CB 1 1 1 777 3 3 18 ASP CG C -7.637 -12.371 -21.282 1.00 . C A . 18 ASP CG 1 1 1 778 3 3 18 ASP H H -6.444 -10.114 -20.395 1.00 . C A . 18 ASP H 1 1 1 779 3 3 18 ASP HA H -7.580 -10.296 -23.066 1.00 . C A . 18 ASP HA 1 1 1 780 3 3 18 ASP HB2 H -8.886 -10.864 -20.399 1.00 . C A . 18 ASP HB2 1 1 1 781 3 3 18 ASP HB3 H -9.433 -11.429 -21.978 1.00 . C A . 18 ASP HB3 1 1 1 782 3 3 18 ASP N N -6.554 -9.748 -21.300 1.00 . C A . 18 ASP N 1 1 1 783 3 3 18 ASP O O -9.265 -8.424 -23.163 1.00 . C A . 18 ASP O 1 1 1 784 3 3 18 ASP OD1 O -7.246 -12.886 -22.317 1.00 . C A . 18 ASP OD1 1 1 1 785 3 3 18 ASP OD2 O -7.328 -12.761 -20.168 1.00 . C A . 18 ASP OD2 1 1 1 786 3 3 19 GLN C C -9.585 -5.983 -22.070 1.00 . C A . 19 GLN C 1 1 1 787 3 3 19 GLN CA C -10.001 -6.991 -21.013 1.00 . C A . 19 GLN CA 1 1 1 788 3 3 19 GLN CB C -9.948 -6.298 -19.647 1.00 . C A . 19 GLN CB 1 1 1 789 3 3 19 GLN CD C -12.342 -5.624 -19.814 1.00 . C A . 19 GLN CD 1 1 1 790 3 3 19 GLN CG C -10.923 -5.119 -19.605 1.00 . C A . 19 GLN CG 1 1 1 791 3 3 19 GLN H H -8.672 -8.472 -20.155 1.00 . C A . 19 GLN H 1 1 1 792 3 3 19 GLN HA H -11.001 -7.336 -21.215 1.00 . C A . 19 GLN HA 1 1 1 793 3 3 19 GLN HB2 H -10.204 -7.003 -18.873 1.00 . C A . 19 GLN HB2 1 1 1 794 3 3 19 GLN HB3 H -8.949 -5.928 -19.478 1.00 . C A . 19 GLN HB3 1 1 1 795 3 3 19 GLN HE21 H -12.574 -6.106 -17.913 1.00 . C A . 19 GLN HE21 1 1 1 796 3 3 19 GLN HE22 H -13.908 -6.420 -18.909 1.00 . C A . 19 GLN HE22 1 1 1 797 3 3 19 GLN HG2 H -10.856 -4.639 -18.638 1.00 . C A . 19 GLN HG2 1 1 1 798 3 3 19 GLN HG3 H -10.675 -4.404 -20.376 1.00 . C A . 19 GLN HG3 1 1 1 799 3 3 19 GLN N N -9.052 -8.158 -21.002 1.00 . C A . 19 GLN N 1 1 1 800 3 3 19 GLN NE2 N -12.996 -6.089 -18.795 1.00 . C A . 19 GLN NE2 1 1 1 801 3 3 19 GLN O O -10.359 -5.550 -22.890 1.00 . C A . 19 GLN O 1 1 1 802 3 3 19 GLN OE1 O -12.859 -5.597 -20.911 1.00 . C A . 19 GLN OE1 1 1 1 803 3 3 20 ARG C C -8.000 -5.097 -24.402 1.00 . C A . 20 ARG C 1 1 1 804 3 3 20 ARG CA C -7.830 -4.608 -22.977 1.00 . C A . 20 ARG CA 1 1 1 805 3 3 20 ARG CB C -6.377 -4.561 -22.639 1.00 . C A . 20 ARG CB 1 1 1 806 3 3 20 ARG CD C -4.199 -3.477 -22.722 1.00 . C A . 20 ARG CD 1 1 1 807 3 3 20 ARG CG C -5.593 -3.507 -23.375 1.00 . C A . 20 ARG CG 1 1 1 808 3 3 20 ARG CZ C -2.999 -3.421 -24.809 1.00 . C A . 20 ARG CZ 1 1 1 809 3 3 20 ARG H H -7.781 -5.969 -21.333 1.00 . C A . 20 ARG H 1 1 1 810 3 3 20 ARG HA H -8.286 -3.641 -22.834 1.00 . C A . 20 ARG HA 1 1 1 811 3 3 20 ARG HB2 H -6.283 -4.389 -21.587 1.00 . C A . 20 ARG HB2 1 1 1 812 3 3 20 ARG HB3 H -5.957 -5.514 -22.889 1.00 . C A . 20 ARG HB3 1 1 1 813 3 3 20 ARG HD2 H -4.227 -2.856 -21.854 1.00 . C A . 20 ARG HD2 1 1 1 814 3 3 20 ARG HD3 H -3.904 -4.488 -22.419 1.00 . C A . 20 ARG HD3 1 1 1 815 3 3 20 ARG HE H -2.768 -2.063 -23.408 1.00 . C A . 20 ARG HE 1 1 1 816 3 3 20 ARG HG2 H -5.529 -3.772 -24.419 1.00 . C A . 20 ARG HG2 1 1 1 817 3 3 20 ARG HG3 H -6.067 -2.544 -23.269 1.00 . C A . 20 ARG HG3 1 1 1 818 3 3 20 ARG HH11 H -4.037 -5.103 -24.484 1.00 . C A . 20 ARG HH11 1 1 1 819 3 3 20 ARG HH12 H -3.291 -4.970 -26.043 1.00 . C A . 20 ARG HH12 1 1 1 820 3 3 20 ARG HH21 H -1.858 -1.922 -25.360 1.00 . C A . 20 ARG HH21 1 1 1 821 3 3 20 ARG HH22 H -2.040 -3.190 -26.516 1.00 . C A . 20 ARG HH22 1 1 1 822 3 3 20 ARG N N -8.369 -5.604 -22.027 1.00 . C A . 20 ARG N 1 1 1 823 3 3 20 ARG NE N -3.220 -2.893 -23.653 1.00 . C A . 20 ARG NE 1 1 1 824 3 3 20 ARG NH1 N -3.480 -4.589 -25.137 1.00 . C A . 20 ARG NH1 1 1 1 825 3 3 20 ARG NH2 N -2.249 -2.796 -25.626 1.00 . C A . 20 ARG NH2 1 1 1 826 3 3 20 ARG O O -8.316 -4.331 -25.292 1.00 . C A . 20 ARG O 1 1 1 827 3 3 21 ARG C C -9.329 -6.401 -26.524 1.00 . C A . 21 ARG C 1 1 1 828 3 3 21 ARG CA C -7.957 -6.852 -26.034 1.00 . C A . 21 ARG CA 1 1 1 829 3 3 21 ARG CB C -7.831 -8.391 -26.089 1.00 . C A . 21 ARG CB 1 1 1 830 3 3 21 ARG CD C -7.410 -8.503 -28.611 1.00 . C A . 21 ARG CD 1 1 1 831 3 3 21 ARG CG C -8.321 -8.960 -27.447 1.00 . C A . 21 ARG CG 1 1 1 832 3 3 21 ARG CZ C -5.852 -9.569 -30.126 1.00 . C A . 21 ARG CZ 1 1 1 833 3 3 21 ARG H H -7.532 -6.981 -23.923 1.00 . C A . 21 ARG H 1 1 1 834 3 3 21 ARG HA H -7.194 -6.398 -26.638 1.00 . C A . 21 ARG HA 1 1 1 835 3 3 21 ARG HB2 H -6.796 -8.664 -25.946 1.00 . C A . 21 ARG HB2 1 1 1 836 3 3 21 ARG HB3 H -8.419 -8.822 -25.296 1.00 . C A . 21 ARG HB3 1 1 1 837 3 3 21 ARG HD2 H -8.006 -8.141 -29.430 1.00 . C A . 21 ARG HD2 1 1 1 838 3 3 21 ARG HD3 H -6.749 -7.711 -28.292 1.00 . C A . 21 ARG HD3 1 1 1 839 3 3 21 ARG HE H -6.692 -10.534 -28.612 1.00 . C A . 21 ARG HE 1 1 1 840 3 3 21 ARG HG2 H -8.299 -10.039 -27.393 1.00 . C A . 21 ARG HG2 1 1 1 841 3 3 21 ARG HG3 H -9.336 -8.645 -27.633 1.00 . C A . 21 ARG HG3 1 1 1 842 3 3 21 ARG HH11 H -6.211 -7.614 -30.372 1.00 . C A . 21 ARG HH11 1 1 1 843 3 3 21 ARG HH12 H -5.127 -8.326 -31.520 1.00 . C A . 21 ARG HH12 1 1 1 844 3 3 21 ARG HH21 H -5.284 -11.487 -30.097 1.00 . C A . 21 ARG HH21 1 1 1 845 3 3 21 ARG HH22 H -4.603 -10.523 -31.364 1.00 . C A . 21 ARG HH22 1 1 1 846 3 3 21 ARG N N -7.793 -6.364 -24.645 1.00 . C A . 21 ARG N 1 1 1 847 3 3 21 ARG NE N -6.620 -9.675 -29.080 1.00 . C A . 21 ARG NE 1 1 1 848 3 3 21 ARG NH1 N -5.722 -8.414 -30.720 1.00 . C A . 21 ARG NH1 1 1 1 849 3 3 21 ARG NH2 N -5.196 -10.608 -30.564 1.00 . C A . 21 ARG NH2 1 1 1 850 3 3 21 ARG O O -9.501 -6.063 -27.671 1.00 . C A . 21 ARG O 1 1 1 851 3 3 22 LYS C C -11.575 -4.442 -26.494 1.00 . C A . 22 LYS C 1 1 1 852 3 3 22 LYS CA C -11.655 -5.912 -26.070 1.00 . C A . 22 LYS CA 1 1 1 853 3 3 22 LYS CB C -12.601 -6.063 -24.875 1.00 . C A . 22 LYS CB 1 1 1 854 3 3 22 LYS CD C -14.775 -5.126 -24.006 1.00 . C A . 22 LYS CD 1 1 1 855 3 3 22 LYS CE C -14.305 -3.694 -23.690 1.00 . C A . 22 LYS CE 1 1 1 856 3 3 22 LYS CG C -14.047 -5.677 -25.248 1.00 . C A . 22 LYS CG 1 1 1 857 3 3 22 LYS H H -10.140 -6.623 -24.706 1.00 . C A . 22 LYS H 1 1 1 858 3 3 22 LYS HA H -12.003 -6.513 -26.893 1.00 . C A . 22 LYS HA 1 1 1 859 3 3 22 LYS HB2 H -12.579 -7.090 -24.536 1.00 . C A . 22 LYS HB2 1 1 1 860 3 3 22 LYS HB3 H -12.253 -5.428 -24.086 1.00 . C A . 22 LYS HB3 1 1 1 861 3 3 22 LYS HD2 H -15.840 -5.121 -24.190 1.00 . C A . 22 LYS HD2 1 1 1 862 3 3 22 LYS HD3 H -14.564 -5.764 -23.160 1.00 . C A . 22 LYS HD3 1 1 1 863 3 3 22 LYS HE2 H -13.375 -3.725 -23.144 1.00 . C A . 22 LYS HE2 1 1 1 864 3 3 22 LYS HE3 H -14.167 -3.141 -24.607 1.00 . C A . 22 LYS HE3 1 1 1 865 3 3 22 LYS HG2 H -14.045 -4.933 -26.029 1.00 . C A . 22 LYS HG2 1 1 1 866 3 3 22 LYS HG3 H -14.569 -6.554 -25.601 1.00 . C A . 22 LYS HG3 1 1 1 867 3 3 22 LYS HZ1 H -15.579 -3.621 -22.045 1.00 . C A . 22 LYS HZ1 1 1 1 868 3 3 22 LYS HZ2 H -14.943 -2.110 -22.502 1.00 . C A . 22 LYS HZ2 1 1 1 869 3 3 22 LYS HZ3 H -16.179 -2.830 -23.423 1.00 . C A . 22 LYS HZ3 1 1 1 870 3 3 22 LYS N N -10.302 -6.364 -25.650 1.00 . C A . 22 LYS N 1 1 1 871 3 3 22 LYS NZ N -15.329 -3.012 -22.853 1.00 . C A . 22 LYS NZ 1 1 1 872 3 3 22 LYS O O -12.082 -4.052 -27.526 1.00 . C A . 22 LYS O 1 1 1 873 3 3 23 MET C C -10.024 -2.028 -27.353 1.00 . C A . 23 MET C 1 1 1 874 3 3 23 MET CA C -10.819 -2.181 -26.052 1.00 . C A . 23 MET CA 1 1 1 875 3 3 23 MET CB C -10.093 -1.444 -24.919 1.00 . C A . 23 MET CB 1 1 1 876 3 3 23 MET CE C -11.880 2.258 -24.539 1.00 . C A . 23 MET CE 1 1 1 877 3 3 23 MET CG C -10.324 0.064 -25.044 1.00 . C A . 23 MET CG 1 1 1 878 3 3 23 MET H H -10.534 -3.963 -24.876 1.00 . C A . 23 MET H 1 1 1 879 3 3 23 MET HA H -11.805 -1.758 -26.181 1.00 . C A . 23 MET HA 1 1 1 880 3 3 23 MET HB2 H -10.475 -1.787 -23.968 1.00 . C A . 23 MET HB2 1 1 1 881 3 3 23 MET HB3 H -9.034 -1.650 -24.975 1.00 . C A . 23 MET HB3 1 1 1 882 3 3 23 MET HE1 H -10.875 2.535 -24.259 1.00 . C A . 23 MET HE1 1 1 1 883 3 3 23 MET HE2 H -12.109 2.656 -25.516 1.00 . C A . 23 MET HE2 1 1 1 884 3 3 23 MET HE3 H -12.573 2.663 -23.821 1.00 . C A . 23 MET HE3 1 1 1 885 3 3 23 MET HG2 H -9.640 0.584 -24.389 1.00 . C A . 23 MET HG2 1 1 1 886 3 3 23 MET HG3 H -10.152 0.372 -26.065 1.00 . C A . 23 MET HG3 1 1 1 887 3 3 23 MET N N -10.938 -3.625 -25.702 1.00 . C A . 23 MET N 1 1 1 888 3 3 23 MET O O -10.217 -1.095 -28.104 1.00 . C A . 23 MET O 1 1 1 889 3 3 23 MET SD S -12.031 0.452 -24.573 1.00 . C A . 23 MET SD 1 1 1 890 3 3 24 ALA C C -9.153 -3.159 -30.099 1.00 . C A . 24 ALA C 1 1 1 891 3 3 24 ALA CA C -8.301 -2.825 -28.859 1.00 . C A . 24 ALA CA 1 1 1 892 3 3 24 ALA CB C -7.109 -3.795 -28.759 1.00 . C A . 24 ALA CB 1 1 1 893 3 3 24 ALA H H -8.967 -3.671 -26.990 1.00 . C A . 24 ALA H 1 1 1 894 3 3 24 ALA HA H -7.932 -1.816 -28.947 1.00 . C A . 24 ALA HA 1 1 1 895 3 3 24 ALA HB1 H -7.368 -4.607 -28.097 1.00 . C A . 24 ALA HB1 1 1 1 896 3 3 24 ALA HB2 H -6.864 -4.192 -29.735 1.00 . C A . 24 ALA HB2 1 1 1 897 3 3 24 ALA HB3 H -6.248 -3.274 -28.361 1.00 . C A . 24 ALA HB3 1 1 1 898 3 3 24 ALA N N -9.119 -2.930 -27.617 1.00 . C A . 24 ALA N 1 1 1 899 3 3 24 ALA O O -8.892 -2.676 -31.182 1.00 . C A . 24 ALA O 1 1 1 900 3 3 25 LEU C C -11.773 -3.157 -31.650 1.00 . C A . 25 LEU C 1 1 1 901 3 3 25 LEU CA C -10.990 -4.363 -31.137 1.00 . C A . 25 LEU CA 1 1 1 902 3 3 25 LEU CB C -11.998 -5.442 -30.733 1.00 . C A . 25 LEU CB 1 1 1 903 3 3 25 LEU CD1 C -12.268 -7.752 -29.787 1.00 . C A . 25 LEU CD1 1 1 1 904 3 3 25 LEU CD2 C -10.591 -7.341 -31.628 1.00 . C A . 25 LEU CD2 1 1 1 905 3 3 25 LEU CG C -11.269 -6.741 -30.374 1.00 . C A . 25 LEU CG 1 1 1 906 3 3 25 LEU H H -10.337 -4.383 -29.078 1.00 . C A . 25 LEU H 1 1 1 907 3 3 25 LEU HA H -10.358 -4.740 -31.925 1.00 . C A . 25 LEU HA 1 1 1 908 3 3 25 LEU HB2 H -12.559 -5.094 -29.877 1.00 . C A . 25 LEU HB2 1 1 1 909 3 3 25 LEU HB3 H -12.676 -5.623 -31.554 1.00 . C A . 25 LEU HB3 1 1 1 910 3 3 25 LEU HD11 H -12.965 -7.243 -29.136 1.00 . C A . 25 LEU HD11 1 1 1 911 3 3 25 LEU HD12 H -12.810 -8.232 -30.589 1.00 . C A . 25 LEU HD12 1 1 1 912 3 3 25 LEU HD13 H -11.731 -8.497 -29.221 1.00 . C A . 25 LEU HD13 1 1 1 913 3 3 25 LEU HD21 H -11.178 -7.120 -32.507 1.00 . C A . 25 LEU HD21 1 1 1 914 3 3 25 LEU HD22 H -9.604 -6.918 -31.741 1.00 . C A . 25 LEU HD22 1 1 1 915 3 3 25 LEU HD23 H -10.506 -8.413 -31.518 1.00 . C A . 25 LEU HD23 1 1 1 916 3 3 25 LEU HG H -10.519 -6.522 -29.637 1.00 . C A . 25 LEU HG 1 1 1 917 3 3 25 LEU N N -10.149 -3.991 -29.956 1.00 . C A . 25 LEU N 1 1 1 918 3 3 25 LEU O O -11.613 -2.731 -32.777 1.00 . C A . 25 LEU O 1 1 1 919 3 3 26 GLU C C -12.736 -0.173 -31.165 1.00 . C A . 26 GLU C 1 1 1 920 3 3 26 GLU CA C -13.495 -1.492 -31.288 1.00 . C A . 26 GLU CA 1 1 1 921 3 3 26 GLU CB C -14.741 -1.434 -30.409 1.00 . C A . 26 GLU CB 1 1 1 922 3 3 26 GLU CD C -16.890 -2.567 -29.840 1.00 . C A . 26 GLU CD 1 1 1 923 3 3 26 GLU CG C -15.655 -2.612 -30.740 1.00 . C A . 26 GLU CG 1 1 1 924 3 3 26 GLU H H -12.790 -3.026 -29.956 1.00 . C A . 26 GLU H 1 1 1 925 3 3 26 GLU HA H -13.793 -1.641 -32.315 1.00 . C A . 26 GLU HA 1 1 1 926 3 3 26 GLU HB2 H -14.447 -1.487 -29.369 1.00 . C A . 26 GLU HB2 1 1 1 927 3 3 26 GLU HB3 H -15.267 -0.509 -30.588 1.00 . C A . 26 GLU HB3 1 1 1 928 3 3 26 GLU HG2 H -15.959 -2.552 -31.775 1.00 . C A . 26 GLU HG2 1 1 1 929 3 3 26 GLU HG3 H -15.124 -3.538 -30.574 1.00 . C A . 26 GLU HG3 1 1 1 930 3 3 26 GLU N N -12.655 -2.639 -30.846 1.00 . C A . 26 GLU N 1 1 1 931 3 3 26 GLU O O -13.101 0.809 -31.779 1.00 . C A . 26 GLU O 1 1 1 932 3 3 26 GLU OE1 O -17.297 -1.474 -29.481 1.00 . C A . 26 GLU OE1 1 1 1 933 3 3 26 GLU OE2 O -17.407 -3.626 -29.523 1.00 . C A . 26 GLU OE2 1 1 1 934 3 3 27 ASN C C -9.422 0.933 -30.211 1.00 . C A . 27 ASN C 1 1 1 935 3 3 27 ASN CA C -10.948 1.160 -30.196 1.00 . C A . 27 ASN CA 1 1 1 936 3 3 27 ASN CB C -11.341 1.765 -28.856 1.00 . C A . 27 ASN CB 1 1 1 937 3 3 27 ASN CG C -12.810 2.189 -28.877 1.00 . C A . 27 ASN CG 1 1 1 938 3 3 27 ASN H H -11.430 -0.920 -29.861 1.00 . C A . 27 ASN H 1 1 1 939 3 3 27 ASN HA H -11.205 1.853 -30.983 1.00 . C A . 27 ASN HA 1 1 1 940 3 3 27 ASN HB2 H -11.185 1.042 -28.070 1.00 . C A . 27 ASN HB2 1 1 1 941 3 3 27 ASN HB3 H -10.734 2.621 -28.680 1.00 . C A . 27 ASN HB3 1 1 1 942 3 3 27 ASN HD21 H -12.390 4.112 -29.146 1.00 . C A . 27 ASN HD21 1 1 1 943 3 3 27 ASN HD22 H -14.044 3.735 -29.052 1.00 . C A . 27 ASN HD22 1 1 1 944 3 3 27 ASN N N -11.701 -0.124 -30.364 1.00 . C A . 27 ASN N 1 1 1 945 3 3 27 ASN ND2 N -13.107 3.450 -29.039 1.00 . C A . 27 ASN ND2 1 1 1 946 3 3 27 ASN O O -8.750 1.292 -29.264 1.00 . C A . 27 ASN O 1 1 1 947 3 3 27 ASN OD1 O -13.696 1.368 -28.742 1.00 . C A . 27 ASN OD1 1 1 1 948 3 3 28 PRO C C -6.690 1.464 -31.516 1.00 . C A . 28 PRO C 1 1 1 949 3 3 28 PRO CA C -7.454 0.131 -31.416 1.00 . C A . 28 PRO CA 1 1 1 950 3 3 28 PRO CB C -7.310 -0.676 -32.728 1.00 . C A . 28 PRO CB 1 1 1 951 3 3 28 PRO CD C -9.717 -0.085 -32.434 1.00 . C A . 28 PRO CD 1 1 1 952 3 3 28 PRO CG C -8.693 -0.653 -33.439 1.00 . C A . 28 PRO CG 1 1 1 953 3 3 28 PRO HA H -7.088 -0.444 -30.584 1.00 . C A . 28 PRO HA 1 1 1 954 3 3 28 PRO HB2 H -6.554 -0.232 -33.367 1.00 . C A . 28 PRO HB2 1 1 1 955 3 3 28 PRO HB3 H -7.037 -1.698 -32.504 1.00 . C A . 28 PRO HB3 1 1 1 956 3 3 28 PRO HD2 H -10.262 0.743 -32.866 1.00 . C A . 28 PRO HD2 1 1 1 957 3 3 28 PRO HD3 H -10.394 -0.861 -32.121 1.00 . C A . 28 PRO HD3 1 1 1 958 3 3 28 PRO HG2 H -8.643 -0.019 -34.317 1.00 . C A . 28 PRO HG2 1 1 1 959 3 3 28 PRO HG3 H -8.979 -1.655 -33.729 1.00 . C A . 28 PRO HG3 1 1 1 960 3 3 28 PRO N N -8.908 0.371 -31.283 1.00 . C A . 28 PRO N 1 1 1 961 3 3 28 PRO O O -5.478 1.473 -31.598 1.00 . C A . 28 PRO O 1 1 1 962 3 3 29 ARG C C -7.035 4.850 -30.527 1.00 . C A . 29 ARG C 1 1 1 963 3 3 29 ARG CA C -6.678 3.907 -31.672 1.00 . C A . 29 ARG CA 1 1 1 964 3 3 29 ARG CB C -7.115 4.589 -32.965 1.00 . C A . 29 ARG CB 1 1 1 965 3 3 29 ARG CD C -7.517 4.253 -35.388 1.00 . C A . 29 ARG CD 1 1 1 966 3 3 29 ARG CG C -6.765 3.722 -34.173 1.00 . C A . 29 ARG CG 1 1 1 967 3 3 29 ARG CZ C -6.073 3.271 -37.097 1.00 . C A . 29 ARG CZ 1 1 1 968 3 3 29 ARG H H -8.361 2.553 -31.493 1.00 . C A . 29 ARG H 1 1 1 969 3 3 29 ARG HA H -5.607 3.766 -31.694 1.00 . C A . 29 ARG HA 1 1 1 970 3 3 29 ARG HB2 H -8.184 4.751 -32.934 1.00 . C A . 29 ARG HB2 1 1 1 971 3 3 29 ARG HB3 H -6.613 5.541 -33.052 1.00 . C A . 29 ARG HB3 1 1 1 972 3 3 29 ARG HD2 H -8.569 4.223 -35.199 1.00 . C A . 29 ARG HD2 1 1 1 973 3 3 29 ARG HD3 H -7.218 5.292 -35.565 1.00 . C A . 29 ARG HD3 1 1 1 974 3 3 29 ARG HE H -7.982 2.805 -36.909 1.00 . C A . 29 ARG HE 1 1 1 975 3 3 29 ARG HG2 H -5.701 3.760 -34.352 1.00 . C A . 29 ARG HG2 1 1 1 976 3 3 29 ARG HG3 H -7.066 2.701 -33.983 1.00 . C A . 29 ARG HG3 1 1 1 977 3 3 29 ARG HH11 H -5.285 4.752 -36.001 1.00 . C A . 29 ARG HH11 1 1 1 978 3 3 29 ARG HH12 H -4.209 4.000 -37.132 1.00 . C A . 29 ARG HH12 1 1 1 979 3 3 29 ARG HH21 H -6.604 1.817 -38.364 1.00 . C A . 29 ARG HH21 1 1 1 980 3 3 29 ARG HH22 H -4.955 2.336 -38.467 1.00 . C A . 29 ARG HH22 1 1 1 981 3 3 29 ARG N N -7.382 2.583 -31.540 1.00 . C A . 29 ARG N 1 1 1 982 3 3 29 ARG NE N -7.256 3.364 -36.562 1.00 . C A . 29 ARG NE 1 1 1 983 3 3 29 ARG NH1 N -5.113 4.068 -36.710 1.00 . C A . 29 ARG NH1 1 1 1 984 3 3 29 ARG NH2 N -5.860 2.406 -38.049 1.00 . C A . 29 ARG NH2 1 1 1 985 3 3 29 ARG O O -7.662 5.868 -30.740 1.00 . C A . 29 ARG O 1 1 1 986 3 3 30 MET C C -5.922 6.659 -28.278 1.00 . C A . 30 MET C 1 1 1 987 3 3 30 MET CA C -6.938 5.522 -28.229 1.00 . C A . 30 MET CA 1 1 1 988 3 3 30 MET CB C -6.867 4.831 -26.858 1.00 . C A . 30 MET CB 1 1 1 989 3 3 30 MET CE C -9.830 5.316 -25.748 1.00 . C A . 30 MET CE 1 1 1 990 3 3 30 MET CG C -7.885 3.688 -26.780 1.00 . C A . 30 MET CG 1 1 1 991 3 3 30 MET H H -6.091 3.763 -29.154 1.00 . C A . 30 MET H 1 1 1 992 3 3 30 MET HA H -7.922 5.939 -28.378 1.00 . C A . 30 MET HA 1 1 1 993 3 3 30 MET HB2 H -5.873 4.434 -26.707 1.00 . C A . 30 MET HB2 1 1 1 994 3 3 30 MET HB3 H -7.084 5.553 -26.084 1.00 . C A . 30 MET HB3 1 1 1 995 3 3 30 MET HE1 H -9.469 4.803 -24.876 1.00 . C A . 30 MET HE1 1 1 1 996 3 3 30 MET HE2 H -9.310 6.258 -25.858 1.00 . C A . 30 MET HE2 1 1 1 997 3 3 30 MET HE3 H -10.890 5.494 -25.646 1.00 . C A . 30 MET HE3 1 1 1 998 3 3 30 MET HG2 H -7.602 2.908 -27.471 1.00 . C A . 30 MET HG2 1 1 1 999 3 3 30 MET HG3 H -7.898 3.288 -25.777 1.00 . C A . 30 MET HG3 1 1 1 1000 3 3 30 MET N N -6.623 4.568 -29.326 1.00 . C A . 30 MET N 1 1 1 1001 3 3 30 MET O O -4.727 6.445 -28.230 1.00 . C A . 30 MET O 1 1 1 1002 3 3 30 MET SD S -9.538 4.296 -27.205 1.00 . C A . 30 MET SD 1 1 1 1003 3 3 31 ARG C C -4.729 9.087 -27.035 1.00 . C A . 31 ARG C 1 1 1 1004 3 3 31 ARG CA C -5.474 9.035 -28.362 1.00 . C A . 31 ARG CA 1 1 1 1005 3 3 31 ARG CB C -6.293 10.337 -28.488 1.00 . C A . 31 ARG CB 1 1 1 1006 3 3 31 ARG CD C -6.965 9.585 -30.864 1.00 . C A . 31 ARG CD 1 1 1 1007 3 3 31 ARG CG C -6.599 10.742 -29.942 1.00 . C A . 31 ARG CG 1 1 1 1008 3 3 31 ARG CZ C -8.084 10.309 -32.932 1.00 . C A . 31 ARG CZ 1 1 1 1009 3 3 31 ARG H H -7.365 8.012 -28.359 1.00 . C A . 31 ARG H 1 1 1 1010 3 3 31 ARG HA H -4.770 8.953 -29.172 1.00 . C A . 31 ARG HA 1 1 1 1011 3 3 31 ARG HB2 H -7.228 10.203 -27.969 1.00 . C A . 31 ARG HB2 1 1 1 1012 3 3 31 ARG HB3 H -5.751 11.148 -28.015 1.00 . C A . 31 ARG HB3 1 1 1 1013 3 3 31 ARG HD2 H -6.209 8.845 -30.891 1.00 . C A . 31 ARG HD2 1 1 1 1014 3 3 31 ARG HD3 H -7.908 9.130 -30.532 1.00 . C A . 31 ARG HD3 1 1 1 1015 3 3 31 ARG HE H -6.219 10.734 -32.519 1.00 . C A . 31 ARG HE 1 1 1 1016 3 3 31 ARG HG2 H -7.425 11.436 -29.934 1.00 . C A . 31 ARG HG2 1 1 1 1017 3 3 31 ARG HG3 H -5.733 11.248 -30.346 1.00 . C A . 31 ARG HG3 1 1 1 1018 3 3 31 ARG HH11 H -9.002 8.790 -32.011 1.00 . C A . 31 ARG HH11 1 1 1 1019 3 3 31 ARG HH12 H -9.900 9.550 -33.279 1.00 . C A . 31 ARG HH12 1 1 1 1020 3 3 31 ARG HH21 H -7.369 11.771 -34.098 1.00 . C A . 31 ARG HH21 1 1 1 1021 3 3 31 ARG HH22 H -8.980 11.251 -34.458 1.00 . C A . 31 ARG HH22 1 1 1 1022 3 3 31 ARG N N -6.396 7.868 -28.343 1.00 . C A . 31 ARG N 1 1 1 1023 3 3 31 ARG NE N -7.009 10.236 -32.223 1.00 . C A . 31 ARG NE 1 1 1 1024 3 3 31 ARG NH1 N -9.073 9.486 -32.723 1.00 . C A . 31 ARG NH1 1 1 1 1025 3 3 31 ARG NH2 N -8.149 11.174 -33.910 1.00 . C A . 31 ARG NH2 1 1 1 1026 3 3 31 ARG O O -3.549 8.800 -26.945 1.00 . C A . 31 ARG O 1 1 1 1027 3 3 32 ASN C C -4.827 8.333 -23.919 1.00 . C A . 32 ASN C 1 1 1 1028 3 3 32 ASN CA C -4.796 9.648 -24.686 1.00 . C A . 32 ASN CA 1 1 1 1029 3 3 32 ASN CB C -5.595 10.684 -23.908 1.00 . C A . 32 ASN CB 1 1 1 1030 3 3 32 ASN CG C -5.386 12.059 -24.531 1.00 . C A . 32 ASN CG 1 1 1 1031 3 3 32 ASN H H -6.358 9.756 -26.147 1.00 . C A . 32 ASN H 1 1 1 1032 3 3 32 ASN HA H -3.776 9.986 -24.788 1.00 . C A . 32 ASN HA 1 1 1 1033 3 3 32 ASN HB2 H -6.644 10.426 -23.947 1.00 . C A . 32 ASN HB2 1 1 1 1034 3 3 32 ASN HB3 H -5.264 10.699 -22.881 1.00 . C A . 32 ASN HB3 1 1 1 1035 3 3 32 ASN HD21 H -6.536 12.981 -23.216 1.00 . C A . 32 ASN HD21 1 1 1 1036 3 3 32 ASN HD22 H -5.846 13.986 -24.395 1.00 . C A . 32 ASN HD22 1 1 1 1037 3 3 32 ASN N N -5.418 9.504 -26.021 1.00 . C A . 32 ASN N 1 1 1 1038 3 3 32 ASN ND2 N -5.972 13.095 -24.005 1.00 . C A . 32 ASN ND2 1 1 1 1039 3 3 32 ASN O O -5.132 7.281 -24.447 1.00 . C A . 32 ASN O 1 1 1 1040 3 3 32 ASN OD1 O -4.687 12.191 -25.512 1.00 . C A . 32 ASN OD1 1 1 1 1041 3 3 33 SER C C -5.927 7.099 -21.156 1.00 . C A . 33 SER C 1 1 1 1042 3 3 33 SER CA C -4.534 7.210 -21.786 1.00 . C A . 33 SER CA 1 1 1 1043 3 3 33 SER CB C -3.465 7.383 -20.697 1.00 . C A . 33 SER CB 1 1 1 1044 3 3 33 SER H H -4.295 9.282 -22.269 1.00 . C A . 33 SER H 1 1 1 1045 3 3 33 SER HA H -4.322 6.325 -22.371 1.00 . C A . 33 SER HA 1 1 1 1046 3 3 33 SER HB2 H -3.352 8.429 -20.464 1.00 . C A . 33 SER HB2 1 1 1 1047 3 3 33 SER HB3 H -3.757 6.845 -19.803 1.00 . C A . 33 SER HB3 1 1 1 1048 3 3 33 SER HG H -1.894 7.502 -21.838 1.00 . C A . 33 SER HG 1 1 1 1049 3 3 33 SER N N -4.522 8.412 -22.655 1.00 . C A . 33 SER N 1 1 1 1050 3 3 33 SER O O -6.084 7.156 -19.953 1.00 . C A . 33 SER O 1 1 1 1051 3 3 33 SER OG O -2.225 6.886 -21.178 1.00 . C A . 33 SER OG 1 1 1 1052 3 3 34 GLU C C -8.572 5.430 -20.931 1.00 . C A . 34 GLU C 1 1 1 1053 3 3 34 GLU CA C -8.326 6.854 -21.424 1.00 . C A . 34 GLU CA 1 1 1 1054 3 3 34 GLU CB C -9.336 7.204 -22.522 1.00 . C A . 34 GLU CB 1 1 1 1055 3 3 34 GLU CD C -10.338 9.176 -23.709 1.00 . C A . 34 GLU CD 1 1 1 1056 3 3 34 GLU CG C -9.082 8.634 -23.022 1.00 . C A . 34 GLU CG 1 1 1 1057 3 3 34 GLU H H -6.793 6.919 -22.936 1.00 . C A . 34 GLU H 1 1 1 1058 3 3 34 GLU HA H -8.438 7.543 -20.599 1.00 . C A . 34 GLU HA 1 1 1 1059 3 3 34 GLU HB2 H -9.227 6.513 -23.344 1.00 . C A . 34 GLU HB2 1 1 1 1060 3 3 34 GLU HB3 H -10.339 7.132 -22.123 1.00 . C A . 34 GLU HB3 1 1 1 1061 3 3 34 GLU HG2 H -8.829 9.271 -22.186 1.00 . C A . 34 GLU HG2 1 1 1 1062 3 3 34 GLU HG3 H -8.265 8.624 -23.729 1.00 . C A . 34 GLU HG3 1 1 1 1063 3 3 34 GLU N N -6.942 6.953 -21.968 1.00 . C A . 34 GLU N 1 1 1 1064 3 3 34 GLU O O -9.111 5.216 -19.864 1.00 . C A . 34 GLU O 1 1 1 1065 3 3 34 GLU OE1 O -10.796 8.548 -24.648 1.00 . C A . 34 GLU OE1 1 1 1 1066 3 3 34 GLU OE2 O -10.822 10.211 -23.283 1.00 . C A . 34 GLU OE2 1 1 1 1067 3 3 35 ILE C C -7.861 2.897 -19.811 1.00 . C A . 35 ILE C 1 1 1 1068 3 3 35 ILE CA C -8.353 3.042 -21.256 1.00 . C A . 35 ILE CA 1 1 1 1069 3 3 35 ILE CB C -7.581 2.118 -22.228 1.00 . C A . 35 ILE CB 1 1 1 1070 3 3 35 ILE CD1 C -5.989 0.796 -20.666 1.00 . C A . 35 ILE CD1 1 1 1 1071 3 3 35 ILE CG1 C -7.258 0.749 -21.567 1.00 . C A . 35 ILE CG1 1 1 1 1072 3 3 35 ILE CG2 C -6.300 2.819 -22.729 1.00 . C A . 35 ILE CG2 1 1 1 1073 3 3 35 ILE H H -7.718 4.647 -22.542 1.00 . C A . 35 ILE H 1 1 1 1074 3 3 35 ILE HA H -9.406 2.801 -21.294 1.00 . C A . 35 ILE HA 1 1 1 1075 3 3 35 ILE HB H -8.219 1.937 -23.087 1.00 . C A . 35 ILE HB 1 1 1 1076 3 3 35 ILE HD11 H -5.695 1.808 -20.463 1.00 . C A . 35 ILE HD11 1 1 1 1077 3 3 35 ILE HD12 H -6.193 0.298 -19.728 1.00 . C A . 35 ILE HD12 1 1 1 1078 3 3 35 ILE HD13 H -5.174 0.284 -21.163 1.00 . C A . 35 ILE HD13 1 1 1 1079 3 3 35 ILE HG12 H -8.106 0.450 -20.967 1.00 . C A . 35 ILE HG12 1 1 1 1080 3 3 35 ILE HG13 H -7.111 0.014 -22.347 1.00 . C A . 35 ILE HG13 1 1 1 1081 3 3 35 ILE HG21 H -5.907 3.470 -21.962 1.00 . C A . 35 ILE HG21 1 1 1 1082 3 3 35 ILE HG22 H -5.558 2.080 -22.990 1.00 . C A . 35 ILE HG22 1 1 1 1083 3 3 35 ILE HG23 H -6.534 3.411 -23.604 1.00 . C A . 35 ILE HG23 1 1 1 1084 3 3 35 ILE N N -8.163 4.453 -21.691 1.00 . C A . 35 ILE N 1 1 1 1085 3 3 35 ILE O O -8.158 1.933 -19.133 1.00 . C A . 35 ILE O 1 1 1 1086 3 3 36 SER C C -7.670 4.248 -16.959 1.00 . C A . 36 SER C 1 1 1 1087 3 3 36 SER CA C -6.588 3.791 -17.948 1.00 . C A . 36 SER CA 1 1 1 1088 3 3 36 SER CB C -5.370 4.709 -17.836 1.00 . C A . 36 SER CB 1 1 1 1089 3 3 36 SER H H -6.887 4.621 -19.911 1.00 . C A . 36 SER H 1 1 1 1090 3 3 36 SER HA H -6.295 2.778 -17.719 1.00 . C A . 36 SER HA 1 1 1 1091 3 3 36 SER HB2 H -5.645 5.710 -18.123 1.00 . C A . 36 SER HB2 1 1 1 1092 3 3 36 SER HB3 H -5.013 4.713 -16.816 1.00 . C A . 36 SER HB3 1 1 1 1093 3 3 36 SER HG H -3.555 4.103 -18.189 1.00 . C A . 36 SER HG 1 1 1 1094 3 3 36 SER N N -7.111 3.855 -19.341 1.00 . C A . 36 SER N 1 1 1 1095 3 3 36 SER O O -8.090 3.500 -16.096 1.00 . C A . 36 SER O 1 1 1 1096 3 3 36 SER OG O -4.351 4.240 -18.709 1.00 . C A . 36 SER OG 1 1 1 1097 3 3 37 LYS C C -10.467 5.175 -16.370 1.00 . C A . 37 LYS C 1 1 1 1098 3 3 37 LYS CA C -9.178 5.966 -16.144 1.00 . C A . 37 LYS CA 1 1 1 1099 3 3 37 LYS CB C -9.463 7.453 -16.404 1.00 . C A . 37 LYS CB 1 1 1 1100 3 3 37 LYS CD C -7.053 7.978 -16.948 1.00 . C A . 37 LYS CD 1 1 1 1101 3 3 37 LYS CE C -6.120 9.194 -17.083 1.00 . C A . 37 LYS CE 1 1 1 1102 3 3 37 LYS CG C -8.245 8.315 -16.032 1.00 . C A . 37 LYS CG 1 1 1 1103 3 3 37 LYS H H -7.776 6.048 -17.780 1.00 . C A . 37 LYS H 1 1 1 1104 3 3 37 LYS HA H -8.848 5.835 -15.123 1.00 . C A . 37 LYS HA 1 1 1 1105 3 3 37 LYS HB2 H -9.697 7.595 -17.449 1.00 . C A . 37 LYS HB2 1 1 1 1106 3 3 37 LYS HB3 H -10.308 7.760 -15.807 1.00 . C A . 37 LYS HB3 1 1 1 1107 3 3 37 LYS HD2 H -6.501 7.152 -16.524 1.00 . C A . 37 LYS HD2 1 1 1 1108 3 3 37 LYS HD3 H -7.414 7.704 -17.929 1.00 . C A . 37 LYS HD3 1 1 1 1109 3 3 37 LYS HE2 H -5.116 8.856 -17.291 1.00 . C A . 37 LYS HE2 1 1 1 1110 3 3 37 LYS HE3 H -6.460 9.822 -17.896 1.00 . C A . 37 LYS HE3 1 1 1 1111 3 3 37 LYS HG2 H -8.508 9.359 -16.145 1.00 . C A . 37 LYS HG2 1 1 1 1112 3 3 37 LYS HG3 H -7.975 8.124 -15.003 1.00 . C A . 37 LYS HG3 1 1 1 1113 3 3 37 LYS HZ1 H -6.997 9.796 -15.290 1.00 . C A . 37 LYS HZ1 1 1 1 1114 3 3 37 LYS HZ2 H -5.302 9.704 -15.236 1.00 . C A . 37 LYS HZ2 1 1 1 1115 3 3 37 LYS HZ3 H -6.062 10.992 -16.041 1.00 . C A . 37 LYS HZ3 1 1 1 1116 3 3 37 LYS N N -8.125 5.466 -17.078 1.00 . C A . 37 LYS N 1 1 1 1117 3 3 37 LYS NZ N -6.121 9.980 -15.817 1.00 . C A . 37 LYS NZ 1 1 1 1118 3 3 37 LYS O O -11.298 5.056 -15.491 1.00 . C A . 37 LYS O 1 1 1 1119 3 3 38 GLN C C -11.913 2.608 -16.987 1.00 . C A . 38 GLN C 1 1 1 1120 3 3 38 GLN CA C -11.891 3.879 -17.830 1.00 . C A . 38 GLN CA 1 1 1 1121 3 3 38 GLN CB C -11.958 3.511 -19.315 1.00 . C A . 38 GLN CB 1 1 1 1122 3 3 38 GLN CD C -13.750 5.107 -20.057 1.00 . C A . 38 GLN CD 1 1 1 1123 3 3 38 GLN CG C -12.259 4.761 -20.150 1.00 . C A . 38 GLN CG 1 1 1 1124 3 3 38 GLN H H -9.972 4.759 -18.250 1.00 . C A . 38 GLN H 1 1 1 1125 3 3 38 GLN HA H -12.742 4.485 -17.572 1.00 . C A . 38 GLN HA 1 1 1 1126 3 3 38 GLN HB2 H -11.009 3.094 -19.622 1.00 . C A . 38 GLN HB2 1 1 1 1127 3 3 38 GLN HB3 H -12.737 2.781 -19.471 1.00 . C A . 38 GLN HB3 1 1 1 1128 3 3 38 GLN HE21 H -13.751 6.169 -21.735 1.00 . C A . 38 GLN HE21 1 1 1 1129 3 3 38 GLN HE22 H -15.244 6.075 -20.933 1.00 . C A . 38 GLN HE22 1 1 1 1130 3 3 38 GLN HG2 H -11.672 5.591 -19.782 1.00 . C A . 38 GLN HG2 1 1 1 1131 3 3 38 GLN HG3 H -12.001 4.571 -21.182 1.00 . C A . 38 GLN HG3 1 1 1 1132 3 3 38 GLN N N -10.648 4.645 -17.550 1.00 . C A . 38 GLN N 1 1 1 1133 3 3 38 GLN NE2 N -14.293 5.844 -20.986 1.00 . C A . 38 GLN NE2 1 1 1 1134 3 3 38 GLN O O -12.903 2.284 -16.369 1.00 . C A . 38 GLN O 1 1 1 1135 3 3 38 GLN OE1 O -14.428 4.704 -19.133 1.00 . C A . 38 GLN OE1 1 1 1 1136 3 3 39 LEU C C -11.161 1.036 -14.674 1.00 . C A . 39 LEU C 1 1 1 1137 3 3 39 LEU CA C -10.843 0.649 -16.114 1.00 . C A . 39 LEU CA 1 1 1 1138 3 3 39 LEU CB C -9.477 -0.037 -16.177 1.00 . C A . 39 LEU CB 1 1 1 1139 3 3 39 LEU CD1 C -7.805 -0.986 -17.791 1.00 . C A . 39 LEU CD1 1 1 1 1140 3 3 39 LEU CD2 C -10.012 -2.092 -17.547 1.00 . C A . 39 LEU CD2 1 1 1 1141 3 3 39 LEU CG C -9.294 -0.738 -17.534 1.00 . C A . 39 LEU CG 1 1 1 1142 3 3 39 LEU H H -10.035 2.149 -17.437 1.00 . C A . 39 LEU H 1 1 1 1143 3 3 39 LEU HA H -11.610 -0.016 -16.476 1.00 . C A . 39 LEU HA 1 1 1 1144 3 3 39 LEU HB2 H -8.705 0.709 -16.046 1.00 . C A . 39 LEU HB2 1 1 1 1145 3 3 39 LEU HB3 H -9.405 -0.760 -15.387 1.00 . C A . 39 LEU HB3 1 1 1 1146 3 3 39 LEU HD11 H -7.255 -0.064 -17.675 1.00 . C A . 39 LEU HD11 1 1 1 1147 3 3 39 LEU HD12 H -7.436 -1.716 -17.084 1.00 . C A . 39 LEU HD12 1 1 1 1148 3 3 39 LEU HD13 H -7.670 -1.360 -18.794 1.00 . C A . 39 LEU HD13 1 1 1 1149 3 3 39 LEU HD21 H -9.710 -2.670 -16.689 1.00 . C A . 39 LEU HD21 1 1 1 1150 3 3 39 LEU HD22 H -11.080 -1.946 -17.526 1.00 . C A . 39 LEU HD22 1 1 1 1151 3 3 39 LEU HD23 H -9.743 -2.623 -18.447 1.00 . C A . 39 LEU HD23 1 1 1 1152 3 3 39 LEU HG H -9.695 -0.114 -18.315 1.00 . C A . 39 LEU HG 1 1 1 1153 3 3 39 LEU N N -10.837 1.883 -16.941 1.00 . C A . 39 LEU N 1 1 1 1154 3 3 39 LEU O O -11.830 0.318 -13.959 1.00 . C A . 39 LEU O 1 1 1 1155 3 3 40 GLY C C -12.526 2.559 -12.655 1.00 . C A . 40 GLY C 1 1 1 1156 3 3 40 GLY CA C -11.010 2.609 -12.853 1.00 . C A . 40 GLY CA 1 1 1 1157 3 3 40 GLY H H -10.178 2.756 -14.835 1.00 . C A . 40 GLY H 1 1 1 1158 3 3 40 GLY HA2 H -10.526 1.942 -12.153 1.00 . C A . 40 GLY HA2 1 1 1 1159 3 3 40 GLY HA3 H -10.660 3.616 -12.697 1.00 . C A . 40 GLY HA3 1 1 1 1160 3 3 40 GLY N N -10.705 2.179 -14.242 1.00 . C A . 40 GLY N 1 1 1 1161 3 3 40 GLY O O -13.015 2.130 -11.630 1.00 . C A . 40 GLY O 1 1 1 1162 3 3 41 TYR C C -15.212 1.483 -13.356 1.00 . C A . 41 TYR C 1 1 1 1163 3 3 41 TYR CA C -14.760 2.941 -13.523 1.00 . C A . 41 TYR CA 1 1 1 1164 3 3 41 TYR CB C -15.398 3.555 -14.781 1.00 . C A . 41 TYR CB 1 1 1 1165 3 3 41 TYR CD1 C -17.821 4.021 -14.220 1.00 . C A . 41 TYR CD1 1 1 1 1166 3 3 41 TYR CD2 C -17.267 2.023 -15.506 1.00 . C A . 41 TYR CD2 1 1 1 1167 3 3 41 TYR CE1 C -19.184 3.674 -14.267 1.00 . C A . 41 TYR CE1 1 1 1 1168 3 3 41 TYR CE2 C -18.631 1.677 -15.554 1.00 . C A . 41 TYR CE2 1 1 1 1169 3 3 41 TYR CG C -16.864 3.196 -14.839 1.00 . C A . 41 TYR CG 1 1 1 1170 3 3 41 TYR CZ C -19.590 2.501 -14.936 1.00 . C A . 41 TYR CZ 1 1 1 1171 3 3 41 TYR H H -12.856 3.311 -14.467 1.00 . C A . 41 TYR H 1 1 1 1172 3 3 41 TYR HA H -15.062 3.509 -12.658 1.00 . C A . 41 TYR HA 1 1 1 1173 3 3 41 TYR HB2 H -15.295 4.630 -14.747 1.00 . C A . 41 TYR HB2 1 1 1 1174 3 3 41 TYR HB3 H -14.904 3.177 -15.659 1.00 . C A . 41 TYR HB3 1 1 1 1175 3 3 41 TYR HD1 H -17.509 4.920 -13.709 1.00 . C A . 41 TYR HD1 1 1 1 1176 3 3 41 TYR HD2 H -16.529 1.390 -15.980 1.00 . C A . 41 TYR HD2 1 1 1 1177 3 3 41 TYR HE1 H -19.919 4.307 -13.792 1.00 . C A . 41 TYR HE1 1 1 1 1178 3 3 41 TYR HE2 H -18.942 0.778 -16.067 1.00 . C A . 41 TYR HE2 1 1 1 1179 3 3 41 TYR HH H -21.355 2.725 -15.627 1.00 . C A . 41 TYR HH 1 1 1 1180 3 3 41 TYR N N -13.274 2.980 -13.643 1.00 . C A . 41 TYR N 1 1 1 1181 3 3 41 TYR O O -16.106 1.185 -12.589 1.00 . C A . 41 TYR O 1 1 1 1182 3 3 41 TYR OH O -20.926 2.160 -14.981 1.00 . C A . 41 TYR OH 1 1 1 1183 3 3 42 GLN C C -14.724 -1.345 -12.530 1.00 . C A . 42 GLN C 1 1 1 1184 3 3 42 GLN CA C -15.001 -0.861 -13.954 1.00 . C A . 42 GLN CA 1 1 1 1185 3 3 42 GLN CB C -14.176 -1.698 -14.946 1.00 . C A . 42 GLN CB 1 1 1 1186 3 3 42 GLN CD C -15.864 -2.660 -16.542 1.00 . C A . 42 GLN CD 1 1 1 1187 3 3 42 GLN CG C -14.776 -1.597 -16.361 1.00 . C A . 42 GLN CG 1 1 1 1188 3 3 42 GLN H H -13.886 0.834 -14.686 1.00 . C A . 42 GLN H 1 1 1 1189 3 3 42 GLN HA H -16.052 -0.967 -14.176 1.00 . C A . 42 GLN HA 1 1 1 1190 3 3 42 GLN HB2 H -13.161 -1.328 -14.962 1.00 . C A . 42 GLN HB2 1 1 1 1191 3 3 42 GLN HB3 H -14.169 -2.733 -14.630 1.00 . C A . 42 GLN HB3 1 1 1 1192 3 3 42 GLN HE21 H -14.569 -4.085 -17.032 1.00 . C A . 42 GLN HE21 1 1 1 1193 3 3 42 GLN HE22 H -16.201 -4.566 -17.000 1.00 . C A . 42 GLN HE22 1 1 1 1194 3 3 42 GLN HG2 H -15.204 -0.614 -16.508 1.00 . C A . 42 GLN HG2 1 1 1 1195 3 3 42 GLN HG3 H -13.996 -1.759 -17.092 1.00 . C A . 42 GLN HG3 1 1 1 1196 3 3 42 GLN N N -14.604 0.573 -14.071 1.00 . C A . 42 GLN N 1 1 1 1197 3 3 42 GLN NE2 N -15.516 -3.870 -16.889 1.00 . C A . 42 GLN NE2 1 1 1 1198 3 3 42 GLN O O -15.438 -2.155 -11.986 1.00 . C A . 42 GLN O 1 1 1 1199 3 3 42 GLN OE1 O -17.035 -2.389 -16.367 1.00 . C A . 42 GLN OE1 1 1 1 1200 3 3 43 TRP C C -14.449 -0.887 -9.579 1.00 . C A . 43 TRP C 1 1 1 1201 3 3 43 TRP CA C -13.332 -1.278 -10.545 1.00 . C A . 43 TRP CA 1 1 1 1202 3 3 43 TRP CB C -12.015 -0.618 -10.172 1.00 . C A . 43 TRP CB 1 1 1 1203 3 3 43 TRP CD1 C -9.720 -0.395 -11.201 1.00 . C A . 43 TRP CD1 1 1 1 1204 3 3 43 TRP CD2 C -10.908 -2.020 -12.237 1.00 . C A . 43 TRP CD2 1 1 1 1205 3 3 43 TRP CE2 C -9.629 -1.971 -12.858 1.00 . C A . 43 TRP CE2 1 1 1 1206 3 3 43 TRP CE3 C -11.834 -2.984 -12.739 1.00 . C A . 43 TRP CE3 1 1 1 1207 3 3 43 TRP CG C -10.933 -0.995 -11.162 1.00 . C A . 43 TRP CG 1 1 1 1208 3 3 43 TRP CH2 C -10.212 -3.770 -14.377 1.00 . C A . 43 TRP CH2 1 1 1 1209 3 3 43 TRP CZ2 C -9.284 -2.831 -13.911 1.00 . C A . 43 TRP CZ2 1 1 1 1210 3 3 43 TRP CZ3 C -11.484 -3.843 -13.795 1.00 . C A . 43 TRP CZ3 1 1 1 1211 3 3 43 TRP H H -13.113 -0.207 -12.397 1.00 . C A . 43 TRP H 1 1 1 1212 3 3 43 TRP HA H -13.215 -2.344 -10.493 1.00 . C A . 43 TRP HA 1 1 1 1213 3 3 43 TRP HB2 H -12.142 0.455 -10.174 1.00 . C A . 43 TRP HB2 1 1 1 1214 3 3 43 TRP HB3 H -11.722 -0.940 -9.184 1.00 . C A . 43 TRP HB3 1 1 1 1215 3 3 43 TRP HD1 H -9.399 0.408 -10.555 1.00 . C A . 43 TRP HD1 1 1 1 1216 3 3 43 TRP HE1 H -8.046 -0.707 -12.427 1.00 . C A . 43 TRP HE1 1 1 1 1217 3 3 43 TRP HE3 H -12.810 -3.057 -12.338 1.00 . C A . 43 TRP HE3 1 1 1 1218 3 3 43 TRP HH2 H -9.949 -4.435 -15.186 1.00 . C A . 43 TRP HH2 1 1 1 1219 3 3 43 TRP HZ2 H -8.306 -2.771 -14.359 1.00 . C A . 43 TRP HZ2 1 1 1 1220 3 3 43 TRP HZ3 H -12.201 -4.572 -14.149 1.00 . C A . 43 TRP HZ3 1 1 1 1221 3 3 43 TRP N N -13.680 -0.856 -11.931 1.00 . C A . 43 TRP N 1 1 1 1222 3 3 43 TRP NE1 N -8.958 -0.968 -12.200 1.00 . C A . 43 TRP NE1 1 1 1 1223 3 3 43 TRP O O -14.838 -1.670 -8.735 1.00 . C A . 43 TRP O 1 1 1 1224 3 3 44 LYS C C -17.326 -0.211 -9.116 1.00 . C A . 44 LYS C 1 1 1 1225 3 3 44 LYS CA C -16.104 0.660 -8.777 1.00 . C A . 44 LYS CA 1 1 1 1226 3 3 44 LYS CB C -16.425 2.156 -8.927 1.00 . C A . 44 LYS CB 1 1 1 1227 3 3 44 LYS CD C -14.671 3.931 -9.490 1.00 . C A . 44 LYS CD 1 1 1 1228 3 3 44 LYS CE C -13.275 4.470 -9.111 1.00 . C A . 44 LYS CE 1 1 1 1229 3 3 44 LYS CG C -15.240 3.017 -8.381 1.00 . C A . 44 LYS CG 1 1 1 1230 3 3 44 LYS H H -14.693 0.910 -10.390 1.00 . C A . 44 LYS H 1 1 1 1231 3 3 44 LYS HA H -15.800 0.459 -7.759 1.00 . C A . 44 LYS HA 1 1 1 1232 3 3 44 LYS HB2 H -16.599 2.375 -9.970 1.00 . C A . 44 LYS HB2 1 1 1 1233 3 3 44 LYS HB3 H -17.322 2.381 -8.366 1.00 . C A . 44 LYS HB3 1 1 1 1234 3 3 44 LYS HD2 H -14.593 3.369 -10.406 1.00 . C A . 44 LYS HD2 1 1 1 1235 3 3 44 LYS HD3 H -15.345 4.765 -9.640 1.00 . C A . 44 LYS HD3 1 1 1 1236 3 3 44 LYS HE2 H -12.755 3.767 -8.474 1.00 . C A . 44 LYS HE2 1 1 1 1237 3 3 44 LYS HE3 H -12.695 4.625 -10.012 1.00 . C A . 44 LYS HE3 1 1 1 1238 3 3 44 LYS HG2 H -15.590 3.631 -7.563 1.00 . C A . 44 LYS HG2 1 1 1 1239 3 3 44 LYS HG3 H -14.455 2.367 -8.017 1.00 . C A . 44 LYS HG3 1 1 1 1240 3 3 44 LYS HZ1 H -14.102 5.673 -7.625 1.00 . C A . 44 LYS HZ1 1 1 1 1241 3 3 44 LYS HZ2 H -12.499 6.051 -8.010 1.00 . C A . 44 LYS HZ2 1 1 1 1242 3 3 44 LYS HZ3 H -13.744 6.500 -9.060 1.00 . C A . 44 LYS HZ3 1 1 1 1243 3 3 44 LYS N N -14.993 0.288 -9.696 1.00 . C A . 44 LYS N 1 1 1 1244 3 3 44 LYS NZ N -13.417 5.771 -8.398 1.00 . C A . 44 LYS NZ 1 1 1 1245 3 3 44 LYS O O -18.296 -0.258 -8.387 1.00 . C A . 44 LYS O 1 1 1 1246 3 3 45 MET C C -17.755 -3.054 -11.321 1.00 . C A . 45 MET C 1 1 1 1247 3 3 45 MET CA C -18.372 -1.840 -10.626 1.00 . C A . 45 MET CA 1 1 1 1248 3 3 45 MET CB C -19.316 -1.134 -11.607 1.00 . C A . 45 MET CB 1 1 1 1249 3 3 45 MET CE C -20.012 2.814 -10.732 1.00 . C A . 45 MET CE 1 1 1 1250 3 3 45 MET CG C -19.949 0.095 -10.948 1.00 . C A . 45 MET CG 1 1 1 1251 3 3 45 MET H H -16.446 -0.881 -10.766 1.00 . C A . 45 MET H 1 1 1 1252 3 3 45 MET HA H -18.923 -2.162 -9.752 1.00 . C A . 45 MET HA 1 1 1 1253 3 3 45 MET HB2 H -18.758 -0.823 -12.478 1.00 . C A . 45 MET HB2 1 1 1 1254 3 3 45 MET HB3 H -20.095 -1.820 -11.907 1.00 . C A . 45 MET HB3 1 1 1 1255 3 3 45 MET HE1 H -20.863 2.395 -10.213 1.00 . C A . 45 MET HE1 1 1 1 1256 3 3 45 MET HE2 H -19.533 3.553 -10.107 1.00 . C A . 45 MET HE2 1 1 1 1257 3 3 45 MET HE3 H -20.344 3.278 -11.644 1.00 . C A . 45 MET HE3 1 1 1 1258 3 3 45 MET HG2 H -20.886 0.324 -11.436 1.00 . C A . 45 MET HG2 1 1 1 1259 3 3 45 MET HG3 H -20.128 -0.099 -9.900 1.00 . C A . 45 MET HG3 1 1 1 1260 3 3 45 MET N N -17.256 -0.926 -10.215 1.00 . C A . 45 MET N 1 1 1 1261 3 3 45 MET O O -17.848 -3.209 -12.523 1.00 . C A . 45 MET O 1 1 1 1262 3 3 45 MET SD S -18.827 1.501 -11.119 1.00 . C A . 45 MET SD 1 1 1 1263 3 3 46 LEU C C -17.465 -6.004 -11.845 1.00 . C A . 46 LEU C 1 1 1 1264 3 3 46 LEU CA C -16.430 -5.086 -11.185 1.00 . C A . 46 LEU CA 1 1 1 1265 3 3 46 LEU CB C -15.713 -5.864 -10.081 1.00 . C A . 46 LEU CB 1 1 1 1266 3 3 46 LEU CD1 C -14.151 -5.535 -8.143 1.00 . C A . 46 LEU CD1 1 1 1 1267 3 3 46 LEU CD2 C -13.277 -5.368 -10.454 1.00 . C A . 46 LEU CD2 1 1 1 1268 3 3 46 LEU CG C -14.490 -5.081 -9.563 1.00 . C A . 46 LEU CG 1 1 1 1269 3 3 46 LEU H H -17.014 -3.733 -9.614 1.00 . C A . 46 LEU H 1 1 1 1270 3 3 46 LEU HA H -15.713 -4.761 -11.921 1.00 . C A . 46 LEU HA 1 1 1 1271 3 3 46 LEU HB2 H -16.404 -6.043 -9.268 1.00 . C A . 46 LEU HB2 1 1 1 1272 3 3 46 LEU HB3 H -15.386 -6.807 -10.483 1.00 . C A . 46 LEU HB3 1 1 1 1273 3 3 46 LEU HD11 H -15.002 -5.363 -7.498 1.00 . C A . 46 LEU HD11 1 1 1 1274 3 3 46 LEU HD12 H -13.910 -6.588 -8.150 1.00 . C A . 46 LEU HD12 1 1 1 1275 3 3 46 LEU HD13 H -13.304 -4.972 -7.779 1.00 . C A . 46 LEU HD13 1 1 1 1276 3 3 46 LEU HD21 H -13.102 -6.431 -10.485 1.00 . C A . 46 LEU HD21 1 1 1 1277 3 3 46 LEU HD22 H -13.464 -5.011 -11.448 1.00 . C A . 46 LEU HD22 1 1 1 1278 3 3 46 LEU HD23 H -12.406 -4.875 -10.048 1.00 . C A . 46 LEU HD23 1 1 1 1279 3 3 46 LEU HG H -14.703 -4.021 -9.565 1.00 . C A . 46 LEU HG 1 1 1 1280 3 3 46 LEU N N -17.095 -3.896 -10.577 1.00 . C A . 46 LEU N 1 1 1 1281 3 3 46 LEU O O -18.476 -6.341 -11.262 1.00 . C A . 46 LEU O 1 1 1 1282 3 3 47 THR C C -17.899 -8.775 -13.318 1.00 . C A . 47 THR C 1 1 1 1283 3 3 47 THR CA C -18.153 -7.328 -13.767 1.00 . C A . 47 THR CA 1 1 1 1284 3 3 47 THR CB C -17.927 -7.209 -15.278 1.00 . C A . 47 THR CB 1 1 1 1285 3 3 47 THR CG2 C -18.181 -5.766 -15.721 1.00 . C A . 47 THR CG2 1 1 1 1286 3 3 47 THR H H -16.376 -6.139 -13.501 1.00 . C A . 47 THR H 1 1 1 1287 3 3 47 THR HA H -19.168 -7.049 -13.529 1.00 . C A . 47 THR HA 1 1 1 1288 3 3 47 THR HB H -18.607 -7.862 -15.799 1.00 . C A . 47 THR HB 1 1 1 1289 3 3 47 THR HG1 H -16.004 -6.945 -15.155 1.00 . C A . 47 THR HG1 1 1 1 1290 3 3 47 THR HG21 H -19.150 -5.447 -15.366 1.00 . C A . 47 THR HG21 1 1 1 1291 3 3 47 THR HG22 H -17.416 -5.124 -15.310 1.00 . C A . 47 THR HG22 1 1 1 1292 3 3 47 THR HG23 H -18.156 -5.712 -16.799 1.00 . C A . 47 THR HG23 1 1 1 1293 3 3 47 THR N N -17.205 -6.418 -13.059 1.00 . C A . 47 THR N 1 1 1 1294 3 3 47 THR O O -16.830 -9.314 -13.520 1.00 . C A . 47 THR O 1 1 1 1295 3 3 47 THR OG1 O -16.589 -7.572 -15.587 1.00 . C A . 47 THR OG1 1 1 1 1296 3 3 48 GLU C C -18.337 -11.727 -13.414 1.00 . C A . 48 GLU C 1 1 1 1297 3 3 48 GLU CA C -18.684 -10.811 -12.238 1.00 . C A . 48 GLU CA 1 1 1 1298 3 3 48 GLU CB C -19.976 -11.298 -11.578 1.00 . C A . 48 GLU CB 1 1 1 1299 3 3 48 GLU CD C -21.681 -10.802 -9.819 1.00 . C A . 48 GLU CD 1 1 1 1300 3 3 48 GLU CG C -20.391 -10.314 -10.481 1.00 . C A . 48 GLU CG 1 1 1 1301 3 3 48 GLU H H -19.724 -8.946 -12.554 1.00 . C A . 48 GLU H 1 1 1 1302 3 3 48 GLU HA H -17.882 -10.846 -11.518 1.00 . C A . 48 GLU HA 1 1 1 1303 3 3 48 GLU HB2 H -20.757 -11.362 -12.321 1.00 . C A . 48 GLU HB2 1 1 1 1304 3 3 48 GLU HB3 H -19.812 -12.272 -11.141 1.00 . C A . 48 GLU HB3 1 1 1 1305 3 3 48 GLU HG2 H -19.608 -10.248 -9.741 1.00 . C A . 48 GLU HG2 1 1 1 1306 3 3 48 GLU HG3 H -20.560 -9.341 -10.917 1.00 . C A . 48 GLU HG3 1 1 1 1307 3 3 48 GLU N N -18.870 -9.402 -12.709 1.00 . C A . 48 GLU N 1 1 1 1308 3 3 48 GLU O O -17.692 -12.744 -13.249 1.00 . C A . 48 GLU O 1 1 1 1309 3 3 48 GLU OE1 O -22.068 -11.929 -10.079 1.00 . C A . 48 GLU OE1 1 1 1 1310 3 3 48 GLU OE2 O -22.260 -10.040 -9.062 1.00 . C A . 48 GLU OE2 1 1 1 1311 3 3 49 ALA C C -16.945 -12.377 -15.947 1.00 . C A . 49 ALA C 1 1 1 1312 3 3 49 ALA CA C -18.460 -12.244 -15.774 1.00 . C A . 49 ALA CA 1 1 1 1313 3 3 49 ALA CB C -19.045 -11.589 -17.025 1.00 . C A . 49 ALA CB 1 1 1 1314 3 3 49 ALA H H -19.286 -10.563 -14.707 1.00 . C A . 49 ALA H 1 1 1 1315 3 3 49 ALA HA H -18.900 -13.220 -15.637 1.00 . C A . 49 ALA HA 1 1 1 1316 3 3 49 ALA HB1 H -18.800 -10.535 -17.023 1.00 . C A . 49 ALA HB1 1 1 1 1317 3 3 49 ALA HB2 H -18.626 -12.053 -17.906 1.00 . C A . 49 ALA HB2 1 1 1 1318 3 3 49 ALA HB3 H -20.119 -11.711 -17.029 1.00 . C A . 49 ALA HB3 1 1 1 1319 3 3 49 ALA N N -18.763 -11.384 -14.594 1.00 . C A . 49 ALA N 1 1 1 1320 3 3 49 ALA O O -16.459 -13.320 -16.538 1.00 . C A . 49 ALA O 1 1 1 1321 3 3 50 GLU C C -14.038 -11.904 -14.305 1.00 . C A . 50 GLU C 1 1 1 1322 3 3 50 GLU CA C -14.715 -11.452 -15.612 1.00 . C A . 50 GLU CA 1 1 1 1323 3 3 50 GLU CB C -14.246 -10.036 -15.969 1.00 . C A . 50 GLU CB 1 1 1 1324 3 3 50 GLU CD C -15.959 -9.886 -17.785 1.00 . C A . 50 GLU CD 1 1 1 1325 3 3 50 GLU CG C -14.467 -9.776 -17.462 1.00 . C A . 50 GLU CG 1 1 1 1326 3 3 50 GLU H H -16.626 -10.663 -15.007 1.00 . C A . 50 GLU H 1 1 1 1327 3 3 50 GLU HA H -14.438 -12.128 -16.409 1.00 . C A . 50 GLU HA 1 1 1 1328 3 3 50 GLU HB2 H -14.819 -9.321 -15.397 1.00 . C A . 50 GLU HB2 1 1 1 1329 3 3 50 GLU HB3 H -13.197 -9.927 -15.739 1.00 . C A . 50 GLU HB3 1 1 1 1330 3 3 50 GLU HG2 H -14.116 -8.785 -17.711 1.00 . C A . 50 GLU HG2 1 1 1 1331 3 3 50 GLU HG3 H -13.922 -10.508 -18.039 1.00 . C A . 50 GLU HG3 1 1 1 1332 3 3 50 GLU N N -16.203 -11.422 -15.459 1.00 . C A . 50 GLU N 1 1 1 1333 3 3 50 GLU O O -12.920 -12.389 -14.313 1.00 . C A . 50 GLU O 1 1 1 1334 3 3 50 GLU OE1 O -16.647 -8.886 -17.658 1.00 . C A . 50 GLU OE1 1 1 1 1335 3 3 50 GLU OE2 O -16.388 -10.969 -18.151 1.00 . C A . 50 GLU OE2 1 1 1 1336 3 3 51 LYS C C -13.922 -13.622 -11.740 1.00 . C A . 51 LYS C 1 1 1 1337 3 3 51 LYS CA C -14.050 -12.103 -11.884 1.00 . C A . 51 LYS CA 1 1 1 1338 3 3 51 LYS CB C -14.915 -11.612 -10.725 1.00 . C A . 51 LYS CB 1 1 1 1339 3 3 51 LYS CD C -16.001 -9.644 -9.616 1.00 . C A . 51 LYS CD 1 1 1 1340 3 3 51 LYS CE C -15.258 -9.558 -8.262 1.00 . C A . 51 LYS CE 1 1 1 1341 3 3 51 LYS CG C -15.049 -10.088 -10.750 1.00 . C A . 51 LYS CG 1 1 1 1342 3 3 51 LYS H H -15.573 -11.308 -13.193 1.00 . C A . 51 LYS H 1 1 1 1343 3 3 51 LYS HA H -13.075 -11.649 -11.815 1.00 . C A . 51 LYS HA 1 1 1 1344 3 3 51 LYS HB2 H -15.897 -12.055 -10.806 1.00 . C A . 51 LYS HB2 1 1 1 1345 3 3 51 LYS HB3 H -14.465 -11.913 -9.791 1.00 . C A . 51 LYS HB3 1 1 1 1346 3 3 51 LYS HD2 H -16.423 -8.685 -9.861 1.00 . C A . 51 LYS HD2 1 1 1 1347 3 3 51 LYS HD3 H -16.807 -10.358 -9.524 1.00 . C A . 51 LYS HD3 1 1 1 1348 3 3 51 LYS HE2 H -14.246 -9.930 -8.357 1.00 . C A . 51 LYS HE2 1 1 1 1349 3 3 51 LYS HE3 H -15.227 -8.531 -7.923 1.00 . C A . 51 LYS HE3 1 1 1 1350 3 3 51 LYS HG2 H -14.076 -9.636 -10.615 1.00 . C A . 51 LYS HG2 1 1 1 1351 3 3 51 LYS HG3 H -15.456 -9.779 -11.698 1.00 . C A . 51 LYS HG3 1 1 1 1352 3 3 51 LYS HZ1 H -16.269 -11.283 -7.695 1.00 . C A . 51 LYS HZ1 1 1 1 1353 3 3 51 LYS HZ2 H -15.370 -10.566 -6.446 1.00 . C A . 51 LYS HZ2 1 1 1 1354 3 3 51 LYS HZ3 H -16.839 -9.873 -6.946 1.00 . C A . 51 LYS HZ3 1 1 1 1355 3 3 51 LYS N N -14.685 -11.721 -13.184 1.00 . C A . 51 LYS N 1 1 1 1356 3 3 51 LYS NZ N -15.989 -10.381 -7.261 1.00 . C A . 51 LYS NZ 1 1 1 1357 3 3 51 LYS O O -12.861 -14.188 -11.893 1.00 . C A . 51 LYS O 1 1 1 1358 3 3 52 TRP C C -14.006 -16.489 -12.170 1.00 . C A . 52 TRP C 1 1 1 1359 3 3 52 TRP CA C -14.946 -15.751 -11.180 1.00 . C A . 52 TRP CA 1 1 1 1360 3 3 52 TRP CB C -16.363 -16.341 -11.201 1.00 . C A . 52 TRP CB 1 1 1 1361 3 3 52 TRP CD1 C -15.685 -18.452 -9.996 1.00 . C A . 52 TRP CD1 1 1 1 1362 3 3 52 TRP CD2 C -16.800 -18.874 -11.905 1.00 . C A . 52 TRP CD2 1 1 1 1363 3 3 52 TRP CE2 C -16.477 -20.131 -11.327 1.00 . C A . 52 TRP CE2 1 1 1 1364 3 3 52 TRP CE3 C -17.511 -18.865 -13.129 1.00 . C A . 52 TRP CE3 1 1 1 1365 3 3 52 TRP CG C -16.283 -17.825 -11.036 1.00 . C A . 52 TRP CG 1 1 1 1366 3 3 52 TRP CH2 C -17.550 -21.312 -13.149 1.00 . C A . 52 TRP CH2 1 1 1 1367 3 3 52 TRP CZ2 C -16.844 -21.334 -11.935 1.00 . C A . 52 TRP CZ2 1 1 1 1368 3 3 52 TRP CZ3 C -17.885 -20.078 -13.746 1.00 . C A . 52 TRP CZ3 1 1 1 1369 3 3 52 TRP H H -15.834 -13.788 -11.251 1.00 . C A . 52 TRP H 1 1 1 1370 3 3 52 TRP HA H -14.546 -15.909 -10.188 1.00 . C A . 52 TRP HA 1 1 1 1371 3 3 52 TRP HB2 H -16.931 -15.925 -10.381 1.00 . C A . 52 TRP HB2 1 1 1 1372 3 3 52 TRP HB3 H -16.856 -16.102 -12.121 1.00 . C A . 52 TRP HB3 1 1 1 1373 3 3 52 TRP HD1 H -15.197 -17.965 -9.165 1.00 . C A . 52 TRP HD1 1 1 1 1374 3 3 52 TRP HE1 H -15.454 -20.501 -9.560 1.00 . C A . 52 TRP HE1 1 1 1 1375 3 3 52 TRP HE3 H -17.771 -17.924 -13.592 1.00 . C A . 52 TRP HE3 1 1 1 1376 3 3 52 TRP HH2 H -17.837 -22.238 -13.625 1.00 . C A . 52 TRP HH2 1 1 1 1377 3 3 52 TRP HZ2 H -16.584 -22.273 -11.470 1.00 . C A . 52 TRP HZ2 1 1 1 1378 3 3 52 TRP HZ3 H -18.427 -20.063 -14.680 1.00 . C A . 52 TRP HZ3 1 1 1 1379 3 3 52 TRP N N -14.995 -14.276 -11.399 1.00 . C A . 52 TRP N 1 1 1 1380 3 3 52 TRP NE1 N -15.801 -19.819 -10.170 1.00 . C A . 52 TRP NE1 1 1 1 1381 3 3 52 TRP O O -13.134 -17.198 -11.713 1.00 . C A . 52 TRP O 1 1 1 1382 3 3 53 PRO C C -11.800 -17.062 -14.043 1.00 . C A . 53 PRO C 1 1 1 1383 3 3 53 PRO CA C -13.297 -17.061 -14.435 1.00 . C A . 53 PRO CA 1 1 1 1384 3 3 53 PRO CB C -13.523 -16.345 -15.787 1.00 . C A . 53 PRO CB 1 1 1 1385 3 3 53 PRO CD C -15.202 -15.504 -14.139 1.00 . C A . 53 PRO CD 1 1 1 1386 3 3 53 PRO CG C -14.682 -15.330 -15.583 1.00 . C A . 53 PRO CG 1 1 1 1387 3 3 53 PRO HA H -13.635 -18.082 -14.522 1.00 . C A . 53 PRO HA 1 1 1 1388 3 3 53 PRO HB2 H -12.622 -15.823 -16.093 1.00 . C A . 53 PRO HB2 1 1 1 1389 3 3 53 PRO HB3 H -13.799 -17.063 -16.549 1.00 . C A . 53 PRO HB3 1 1 1 1390 3 3 53 PRO HD2 H -15.307 -14.549 -13.662 1.00 . C A . 53 PRO HD2 1 1 1 1391 3 3 53 PRO HD3 H -16.146 -16.023 -14.161 1.00 . C A . 53 PRO HD3 1 1 1 1392 3 3 53 PRO HG2 H -14.312 -14.323 -15.724 1.00 . C A . 53 PRO HG2 1 1 1 1393 3 3 53 PRO HG3 H -15.480 -15.526 -16.288 1.00 . C A . 53 PRO HG3 1 1 1 1394 3 3 53 PRO N N -14.173 -16.348 -13.477 1.00 . C A . 53 PRO N 1 1 1 1395 3 3 53 PRO O O -11.268 -18.079 -13.645 1.00 . C A . 53 PRO O 1 1 1 1396 3 3 54 PHE C C -9.232 -15.867 -12.469 102.11 . C A . 54 PHE C 1 1 1 1397 3 3 54 PHE CA C -9.613 -15.989 -13.959 102.11 . C A . 54 PHE CA 1 1 1 1398 3 3 54 PHE CB C -8.917 -14.903 -14.781 102.11 . C A . 54 PHE CB 1 1 1 1399 3 3 54 PHE CD1 C -8.532 -13.047 -13.120 102.11 . C A . 54 PHE CD1 1 1 1 1400 3 3 54 PHE CD2 C -10.194 -12.731 -14.878 102.11 . C A . 54 PHE CD2 1 1 1 1401 3 3 54 PHE CE1 C -8.799 -11.756 -12.636 102.11 . C A . 54 PHE CE1 1 1 1 1402 3 3 54 PHE CE2 C -10.464 -11.442 -14.389 102.11 . C A . 54 PHE CE2 1 1 1 1403 3 3 54 PHE CG C -9.228 -13.534 -14.242 102.11 . C A . 54 PHE CG 1 1 1 1404 3 3 54 PHE CZ C -9.766 -10.954 -13.270 102.11 . C A . 54 PHE CZ 1 1 1 1405 3 3 54 PHE H H -11.514 -15.170 -14.619 1.00 . C A . 54 PHE H 1 1 1 1406 3 3 54 PHE HA H -9.233 -16.942 -14.304 1.00 . C A . 54 PHE HA 1 1 1 1407 3 3 54 PHE HB2 H -7.849 -15.062 -14.747 1.00 . C A . 54 PHE HB2 1 1 1 1408 3 3 54 PHE HB3 H -9.251 -14.967 -15.808 1.00 . C A . 54 PHE HB3 1 1 1 1409 3 3 54 PHE HD1 H -7.791 -13.665 -12.633 1.00 . C A . 54 PHE HD1 1 1 1 1410 3 3 54 PHE HD2 H -10.729 -13.106 -15.737 1.00 . C A . 54 PHE HD2 1 1 1 1411 3 3 54 PHE HE1 H -8.267 -11.379 -11.774 1.00 . C A . 54 PHE HE1 1 1 1 1412 3 3 54 PHE HE2 H -11.207 -10.825 -14.875 1.00 . C A . 54 PHE HE2 1 1 1 1413 3 3 54 PHE HZ H -9.964 -9.967 -12.905 1.00 . C A . 54 PHE HZ 1 1 1 1414 3 3 54 PHE N N -11.093 -15.972 -14.234 102.11 . C A . 54 PHE N 1 1 1 1415 3 3 54 PHE O O -8.108 -16.154 -12.113 102.11 . C A . 54 PHE O 1 1 1 1416 3 3 55 PHE C C -9.295 -16.790 -9.617 1.00 . C A . 55 PHE C 1 1 1 1417 3 3 55 PHE CA C -9.671 -15.396 -10.145 1.00 . C A . 55 PHE CA 1 1 1 1418 3 3 55 PHE CB C -10.772 -14.783 -9.248 1.00 . C A . 55 PHE CB 1 1 1 1419 3 3 55 PHE CD1 C -10.904 -12.433 -10.244 1.00 . C A . 55 PHE CD1 1 1 1 1420 3 3 55 PHE CD2 C -10.244 -12.699 -7.913 1.00 . C A . 55 PHE CD2 1 1 1 1421 3 3 55 PHE CE1 C -10.786 -11.035 -10.108 1.00 . C A . 55 PHE CE1 1 1 1 1422 3 3 55 PHE CE2 C -10.122 -11.305 -7.783 1.00 . C A . 55 PHE CE2 1 1 1 1423 3 3 55 PHE CG C -10.633 -13.270 -9.147 1.00 . C A . 55 PHE CG 1 1 1 1424 3 3 55 PHE CZ C -10.394 -10.473 -8.879 1.00 . C A . 55 PHE CZ 1 1 1 1425 3 3 55 PHE H H -11.026 -15.247 -11.844 1.00 . C A . 55 PHE H 1 1 1 1426 3 3 55 PHE HA H -8.792 -14.772 -10.095 1.00 . C A . 55 PHE HA 1 1 1 1427 3 3 55 PHE HB2 H -11.736 -15.014 -9.676 1.00 . C A . 55 PHE HB2 1 1 1 1428 3 3 55 PHE HB3 H -10.719 -15.213 -8.256 1.00 . C A . 55 PHE HB3 1 1 1 1429 3 3 55 PHE HD1 H -11.189 -12.857 -11.188 1.00 . C A . 55 PHE HD1 1 1 1 1430 3 3 55 PHE HD2 H -10.033 -13.337 -7.067 1.00 . C A . 55 PHE HD2 1 1 1 1431 3 3 55 PHE HE1 H -11.002 -10.393 -10.943 1.00 . C A . 55 PHE HE1 1 1 1 1432 3 3 55 PHE HE2 H -9.820 -10.876 -6.839 1.00 . C A . 55 PHE HE2 1 1 1 1433 3 3 55 PHE HZ H -10.304 -9.402 -8.779 1.00 . C A . 55 PHE HZ 1 1 1 1434 3 3 55 PHE N N -10.109 -15.472 -11.582 1.00 . C A . 55 PHE N 1 1 1 1435 3 3 55 PHE O O -8.347 -16.934 -8.871 1.00 . C A . 55 PHE O 1 1 1 1436 3 3 56 GLN C C -8.197 -19.472 -9.762 1.00 . C A . 56 GLN C 1 1 1 1437 3 3 56 GLN CA C -9.667 -19.167 -9.459 1.00 . C A . 56 GLN CA 1 1 1 1438 3 3 56 GLN CB C -10.574 -20.215 -10.121 1.00 . C A . 56 GLN CB 1 1 1 1439 3 3 56 GLN CD C -13.075 -20.418 -10.451 1.00 . C A . 56 GLN CD 1 1 1 1440 3 3 56 GLN CG C -11.957 -20.245 -9.417 1.00 . C A . 56 GLN CG 1 1 1 1441 3 3 56 GLN H H -10.786 -17.690 -10.570 1.00 . C A . 56 GLN H 1 1 1 1442 3 3 56 GLN HA H -9.817 -19.187 -8.391 1.00 . C A . 56 GLN HA 1 1 1 1443 3 3 56 GLN HB2 H -10.695 -19.962 -11.167 1.00 . C A . 56 GLN HB2 1 1 1 1444 3 3 56 GLN HB3 H -10.112 -21.191 -10.045 1.00 . C A . 56 GLN HB3 1 1 1 1445 3 3 56 GLN HE21 H -12.482 -18.873 -11.543 1.00 . C A . 56 GLN HE21 1 1 1 1446 3 3 56 GLN HE22 H -13.854 -19.685 -12.122 1.00 . C A . 56 GLN HE22 1 1 1 1447 3 3 56 GLN HG2 H -11.989 -21.071 -8.720 1.00 . C A . 56 GLN HG2 1 1 1 1448 3 3 56 GLN HG3 H -12.118 -19.320 -8.878 1.00 . C A . 56 GLN HG3 1 1 1 1449 3 3 56 GLN N N -10.017 -17.811 -9.974 1.00 . C A . 56 GLN N 1 1 1 1450 3 3 56 GLN NE2 N -13.142 -19.591 -11.456 1.00 . C A . 56 GLN NE2 1 1 1 1451 3 3 56 GLN O O -7.460 -19.927 -8.911 1.00 . C A . 56 GLN O 1 1 1 1452 3 3 56 GLN OE1 O -13.893 -21.309 -10.339 1.00 . C A . 56 GLN OE1 1 1 1 1453 3 3 57 GLU C C -5.422 -18.544 -10.538 1.00 . C A . 57 GLU C 1 1 1 1454 3 3 57 GLU CA C -6.340 -19.509 -11.305 1.00 . C A . 57 GLU CA 1 1 1 1455 3 3 57 GLU CB C -6.142 -19.341 -12.818 1.00 . C A . 57 GLU CB 1 1 1 1456 3 3 57 GLU CD C -4.449 -19.553 -14.652 1.00 . C A . 57 GLU CD 1 1 1 1457 3 3 57 GLU CG C -4.647 -19.299 -13.156 1.00 . C A . 57 GLU CG 1 1 1 1458 3 3 57 GLU H H -8.370 -18.865 -11.638 1.00 . C A . 57 GLU H 1 1 1 1459 3 3 57 GLU HA H -6.099 -20.524 -11.024 1.00 . C A . 57 GLU HA 1 1 1 1460 3 3 57 GLU HB2 H -6.601 -20.175 -13.331 1.00 . C A . 57 GLU HB2 1 1 1 1461 3 3 57 GLU HB3 H -6.608 -18.422 -13.141 1.00 . C A . 57 GLU HB3 1 1 1 1462 3 3 57 GLU HG2 H -4.250 -18.327 -12.900 1.00 . C A . 57 GLU HG2 1 1 1 1463 3 3 57 GLU HG3 H -4.129 -20.059 -12.591 1.00 . C A . 57 GLU HG3 1 1 1 1464 3 3 57 GLU N N -7.763 -19.230 -10.962 1.00 . C A . 57 GLU N 1 1 1 1465 3 3 57 GLU O O -4.498 -18.955 -9.868 1.00 . C A . 57 GLU O 1 1 1 1466 3 3 57 GLU OE1 O -4.886 -20.592 -15.120 1.00 . C A . 57 GLU OE1 1 1 1 1467 3 3 57 GLU OE2 O -3.864 -18.705 -15.306 1.00 . C A . 57 GLU OE2 1 1 1 1468 3 3 58 ALA C C -4.599 -16.659 -8.473 1.00 . C A . 58 ALA C 1 1 1 1469 3 3 58 ALA CA C -4.794 -16.270 -9.943 1.00 . C A . 58 ALA CA 1 1 1 1470 3 3 58 ALA CB C -5.448 -14.888 -10.021 1.00 . C A . 58 ALA CB 1 1 1 1471 3 3 58 ALA H H -6.411 -16.955 -11.198 1.00 . C A . 58 ALA H 1 1 1 1472 3 3 58 ALA HA H -3.832 -16.235 -10.431 1.00 . C A . 58 ALA HA 1 1 1 1473 3 3 58 ALA HB1 H -6.504 -14.981 -9.831 1.00 . C A . 58 ALA HB1 1 1 1 1474 3 3 58 ALA HB2 H -5.006 -14.233 -9.282 1.00 . C A . 58 ALA HB2 1 1 1 1475 3 3 58 ALA HB3 H -5.294 -14.471 -11.006 1.00 . C A . 58 ALA HB3 1 1 1 1476 3 3 58 ALA N N -5.664 -17.265 -10.644 1.00 . C A . 58 ALA N 1 1 1 1477 3 3 58 ALA O O -3.647 -16.244 -7.839 1.00 . C A . 58 ALA O 1 1 1 1478 3 3 59 GLN C C -4.065 -18.671 -6.315 1.00 . C A . 59 GLN C 1 1 1 1479 3 3 59 GLN CA C -5.326 -17.822 -6.487 1.00 . C A . 59 GLN CA 1 1 1 1480 3 3 59 GLN CB C -6.542 -18.640 -6.028 1.00 . C A . 59 GLN CB 1 1 1 1481 3 3 59 GLN CD C -7.742 -17.111 -4.430 1.00 . C A . 59 GLN CD 1 1 1 1482 3 3 59 GLN CG C -7.763 -17.722 -5.835 1.00 . C A . 59 GLN CG 1 1 1 1483 3 3 59 GLN H H -6.251 -17.762 -8.435 1.00 . C A . 59 GLN H 1 1 1 1484 3 3 59 GLN HA H -5.244 -16.931 -5.883 1.00 . C A . 59 GLN HA 1 1 1 1485 3 3 59 GLN HB2 H -6.768 -19.385 -6.773 1.00 . C A . 59 GLN HB2 1 1 1 1486 3 3 59 GLN HB3 H -6.311 -19.133 -5.094 1.00 . C A . 59 GLN HB3 1 1 1 1487 3 3 59 GLN HE21 H -6.492 -15.650 -4.927 1.00 . C A . 59 GLN HE21 1 1 1 1488 3 3 59 GLN HE22 H -6.999 -15.653 -3.307 1.00 . C A . 59 GLN HE22 1 1 1 1489 3 3 59 GLN HG2 H -7.745 -16.931 -6.572 1.00 . C A . 59 GLN HG2 1 1 1 1490 3 3 59 GLN HG3 H -8.667 -18.301 -5.955 1.00 . C A . 59 GLN HG3 1 1 1 1491 3 3 59 GLN N N -5.484 -17.438 -7.919 1.00 . C A . 59 GLN N 1 1 1 1492 3 3 59 GLN NE2 N -7.017 -16.049 -4.203 1.00 . C A . 59 GLN NE2 1 1 1 1493 3 3 59 GLN O O -3.195 -18.350 -5.529 1.00 . C A . 59 GLN O 1 1 1 1494 3 3 59 GLN OE1 O -8.391 -17.606 -3.530 1.00 . C A . 59 GLN OE1 1 1 1 1495 3 3 60 LYS C C -1.490 -19.968 -7.360 1.00 . C A . 60 LYS C 1 1 1 1496 3 3 60 LYS CA C -2.775 -20.646 -6.848 1.00 . C A . 60 LYS CA 1 1 1 1497 3 3 60 LYS CB C -3.000 -21.990 -7.540 1.00 . C A . 60 LYS CB 1 1 1 1498 3 3 60 LYS CD C -3.212 -23.135 -9.738 1.00 . C A . 60 LYS CD 1 1 1 1499 3 3 60 LYS CE C -3.875 -23.061 -11.113 1.00 . C A . 60 LYS CE 1 1 1 1500 3 3 60 LYS CG C -3.353 -21.792 -9.015 1.00 . C A . 60 LYS CG 1 1 1 1501 3 3 60 LYS H H -4.691 -20.030 -7.625 1.00 . C A . 60 LYS H 1 1 1 1502 3 3 60 LYS HA H -2.650 -20.832 -5.790 1.00 . C A . 60 LYS HA 1 1 1 1503 3 3 60 LYS HB2 H -2.103 -22.582 -7.461 1.00 . C A . 60 LYS HB2 1 1 1 1504 3 3 60 LYS HB3 H -3.811 -22.507 -7.048 1.00 . C A . 60 LYS HB3 1 1 1 1505 3 3 60 LYS HD2 H -2.164 -23.370 -9.858 1.00 . C A . 60 LYS HD2 1 1 1 1506 3 3 60 LYS HD3 H -3.686 -23.910 -9.154 1.00 . C A . 60 LYS HD3 1 1 1 1507 3 3 60 LYS HE2 H -4.896 -22.722 -11.004 1.00 . C A . 60 LYS HE2 1 1 1 1508 3 3 60 LYS HE3 H -3.330 -22.373 -11.740 1.00 . C A . 60 LYS HE3 1 1 1 1509 3 3 60 LYS HG2 H -4.372 -21.438 -9.099 1.00 . C A . 60 LYS HG2 1 1 1 1510 3 3 60 LYS HG3 H -2.681 -21.074 -9.456 1.00 . C A . 60 LYS HG3 1 1 1 1511 3 3 60 LYS HZ1 H -2.957 -24.886 -11.521 1.00 . C A . 60 LYS HZ1 1 1 1 1512 3 3 60 LYS HZ2 H -4.640 -24.983 -11.345 1.00 . C A . 60 LYS HZ2 1 1 1 1513 3 3 60 LYS HZ3 H -3.976 -24.331 -12.758 1.00 . C A . 60 LYS HZ3 1 1 1 1514 3 3 60 LYS N N -3.970 -19.771 -7.014 1.00 . C A . 60 LYS N 1 1 1 1515 3 3 60 LYS NZ N -3.862 -24.417 -11.731 1.00 . C A . 60 LYS NZ 1 1 1 1516 3 3 60 LYS O O -0.450 -20.111 -6.747 1.00 . C A . 60 LYS O 1 1 1 1517 3 3 61 LEU C C 0.415 -17.887 -7.706 1.00 . C A . 61 LEU C 1 1 1 1518 3 3 61 LEU CA C -0.260 -18.540 -8.915 1.00 . C A . 61 LEU CA 1 1 1 1519 3 3 61 LEU CB C -0.568 -17.431 -9.959 1.00 . C A . 61 LEU CB 1 1 1 1520 3 3 61 LEU CD1 C 0.713 -18.248 -11.996 1.00 . C A . 61 LEU CD1 1 1 1 1521 3 3 61 LEU CD2 C -1.561 -19.234 -11.460 1.00 . C A . 61 LEU CD2 1 1 1 1522 3 3 61 LEU CG C -0.691 -17.968 -11.403 1.00 . C A . 61 LEU CG 1 1 1 1523 3 3 61 LEU H H -2.367 -19.090 -8.936 1.00 . C A . 61 LEU H 1 1 1 1524 3 3 61 LEU HA H 0.407 -19.273 -9.335 1.00 . C A . 61 LEU HA 1 1 1 1525 3 3 61 LEU HB2 H -1.497 -16.954 -9.691 1.00 . C A . 61 LEU HB2 1 1 1 1526 3 3 61 LEU HB3 H 0.220 -16.689 -9.934 1.00 . C A . 61 LEU HB3 1 1 1 1527 3 3 61 LEU HD11 H 1.411 -18.489 -11.209 1.00 . C A . 61 LEU HD11 1 1 1 1528 3 3 61 LEU HD12 H 0.662 -19.072 -12.694 1.00 . C A . 61 LEU HD12 1 1 1 1529 3 3 61 LEU HD13 H 1.066 -17.368 -12.518 1.00 . C A . 61 LEU HD13 1 1 1 1530 3 3 61 LEU HD21 H -1.136 -20.008 -10.845 1.00 . C A . 61 LEU HD21 1 1 1 1531 3 3 61 LEU HD22 H -2.552 -18.999 -11.113 1.00 . C A . 61 LEU HD22 1 1 1 1532 3 3 61 LEU HD23 H -1.616 -19.579 -12.482 1.00 . C A . 61 LEU HD23 1 1 1 1533 3 3 61 LEU HG H -1.166 -17.199 -12.003 1.00 . C A . 61 LEU HG 1 1 1 1534 3 3 61 LEU N N -1.526 -19.219 -8.449 1.00 . C A . 61 LEU N 1 1 1 1535 3 3 61 LEU O O 1.570 -18.130 -7.401 1.00 . C A . 61 LEU O 1 1 1 1536 3 3 62 GLN C C 0.641 -17.389 -4.771 1.00 . C A . 62 GLN C 1 1 1 1537 3 3 62 GLN CA C 0.231 -16.361 -5.836 1.00 . C A . 62 GLN CA 1 1 1 1538 3 3 62 GLN CB C -0.871 -15.427 -5.274 1.00 . C A . 62 GLN CB 1 1 1 1539 3 3 62 GLN CD C -1.517 -13.077 -4.748 1.00 . C A . 62 GLN CD 1 1 1 1540 3 3 62 GLN CG C -0.499 -13.954 -5.479 1.00 . C A . 62 GLN CG 1 1 1 1541 3 3 62 GLN H H -1.242 -16.890 -7.304 1.00 . C A . 62 GLN H 1 1 1 1542 3 3 62 GLN HA H 1.097 -15.785 -6.124 1.00 . C A . 62 GLN HA 1 1 1 1543 3 3 62 GLN HB2 H -1.799 -15.625 -5.791 1.00 . C A . 62 GLN HB2 1 1 1 1544 3 3 62 GLN HB3 H -1.015 -15.609 -4.214 1.00 . C A . 62 GLN HB3 1 1 1 1545 3 3 62 GLN HE21 H -0.354 -12.813 -3.157 1.00 . C A . 62 GLN HE21 1 1 1 1546 3 3 62 GLN HE22 H -1.866 -12.043 -3.092 1.00 . C A . 62 GLN HE22 1 1 1 1547 3 3 62 GLN HG2 H 0.492 -13.773 -5.082 1.00 . C A . 62 GLN HG2 1 1 1 1548 3 3 62 GLN HG3 H -0.516 -13.718 -6.535 1.00 . C A . 62 GLN HG3 1 1 1 1549 3 3 62 GLN N N -0.316 -17.059 -7.026 1.00 . C A . 62 GLN N 1 1 1 1550 3 3 62 GLN NE2 N -1.221 -12.605 -3.568 1.00 . C A . 62 GLN NE2 1 1 1 1551 3 3 62 GLN O O 1.725 -17.336 -4.237 1.00 . C A . 62 GLN O 1 1 1 1552 3 3 62 GLN OE1 O -2.592 -12.817 -5.257 1.00 . C A . 62 GLN OE1 1 1 1 1553 3 3 63 ALA C C 1.399 -20.005 -3.594 1.00 . C A . 63 ALA C 1 1 1 1554 3 3 63 ALA CA C 0.050 -19.305 -3.382 1.00 . C A . 63 ALA CA 1 1 1 1555 3 3 63 ALA CB C -1.061 -20.358 -3.388 1.00 . C A . 63 ALA CB 1 1 1 1556 3 3 63 ALA H H -1.117 -18.287 -4.882 1.00 . C A . 63 ALA H 1 1 1 1557 3 3 63 ALA HA H 0.055 -18.813 -2.421 1.00 . C A . 63 ALA HA 1 1 1 1558 3 3 63 ALA HB1 H -2.020 -19.869 -3.482 1.00 . C A . 63 ALA HB1 1 1 1 1559 3 3 63 ALA HB2 H -0.916 -21.031 -4.221 1.00 . C A . 63 ALA HB2 1 1 1 1560 3 3 63 ALA HB3 H -1.031 -20.918 -2.464 1.00 . C A . 63 ALA HB3 1 1 1 1561 3 3 63 ALA N N -0.240 -18.293 -4.446 1.00 . C A . 63 ALA N 1 1 1 1562 3 3 63 ALA O O 2.164 -20.169 -2.666 1.00 . C A . 63 ALA O 1 1 1 1563 3 3 64 MET C C 4.183 -20.262 -4.762 1.00 . C A . 64 MET C 1 1 1 1564 3 3 64 MET CA C 2.981 -21.178 -4.998 1.00 . C A . 64 MET CA 1 1 1 1565 3 3 64 MET CB C 3.029 -21.697 -6.433 1.00 . C A . 64 MET CB 1 1 1 1566 3 3 64 MET CE C 0.575 -23.126 -9.051 1.00 . C A . 64 MET CE 1 1 1 1567 3 3 64 MET CG C 1.842 -22.628 -6.677 1.00 . C A . 64 MET CG 1 1 1 1568 3 3 64 MET H H 1.056 -20.341 -5.517 1.00 . C A . 64 MET H 1 1 1 1569 3 3 64 MET HA H 3.035 -22.016 -4.320 1.00 . C A . 64 MET HA 1 1 1 1570 3 3 64 MET HB2 H 2.981 -20.863 -7.118 1.00 . C A . 64 MET HB2 1 1 1 1571 3 3 64 MET HB3 H 3.949 -22.241 -6.590 1.00 . C A . 64 MET HB3 1 1 1 1572 3 3 64 MET HE1 H 0.484 -22.051 -9.103 1.00 . C A . 64 MET HE1 1 1 1 1573 3 3 64 MET HE2 H 0.579 -23.530 -10.048 1.00 . C A . 64 MET HE2 1 1 1 1574 3 3 64 MET HE3 H -0.261 -23.536 -8.504 1.00 . C A . 64 MET HE3 1 1 1 1575 3 3 64 MET HG2 H 1.750 -23.314 -5.847 1.00 . C A . 64 MET HG2 1 1 1 1576 3 3 64 MET HG3 H 0.940 -22.041 -6.763 1.00 . C A . 64 MET HG3 1 1 1 1577 3 3 64 MET N N 1.690 -20.454 -4.779 1.00 . C A . 64 MET N 1 1 1 1578 3 3 64 MET O O 4.955 -20.451 -3.839 1.00 . C A . 64 MET O 1 1 1 1579 3 3 64 MET SD S 2.119 -23.560 -8.208 1.00 . C A . 64 MET SD 1 1 1 1580 3 3 65 HIS C C 5.546 -17.778 -4.043 0.22 . C A . 65 HIS C 1 1 1 1581 3 3 65 HIS CA C 5.535 -18.382 -5.445 0.22 . C A . 65 HIS CA 1 1 1 1582 3 3 65 HIS CB C 5.432 -17.286 -6.495 0.22 . C A . 65 HIS CB 1 1 1 1583 3 3 65 HIS CD2 C 5.487 -19.167 -8.323 0.22 . C A . 65 HIS CD2 1 1 1 1584 3 3 65 HIS CE1 C 4.308 -18.168 -9.837 0.22 . C A . 65 HIS CE1 1 1 1 1585 3 3 65 HIS CG C 5.145 -17.938 -7.816 0.22 . C A . 65 HIS CG 1 1 1 1586 3 3 65 HIS H H 3.741 -19.161 -6.350 1.00 . C A . 65 HIS H 1 1 1 1587 3 3 65 HIS HA H 6.443 -18.941 -5.600 1.00 . C A . 65 HIS HA 1 1 1 1588 3 3 65 HIS HB2 H 4.631 -16.608 -6.239 1.00 . C A . 65 HIS HB2 1 1 1 1589 3 3 65 HIS HB3 H 6.365 -16.745 -6.554 1.00 . C A . 65 HIS HB3 1 1 1 1590 3 3 65 HIS HD1 H 4.003 -16.426 -8.738 1.00 . C A . 65 HIS HD1 1 1 1 1591 3 3 65 HIS HD2 H 6.080 -19.909 -7.810 1.00 . C A . 65 HIS HD2 1 1 1 1592 3 3 65 HIS HE1 H 3.767 -17.956 -10.747 1.00 . C A . 65 HIS HE1 1 1 1 1593 3 3 65 HIS N N 4.365 -19.288 -5.600 0.22 . C A . 65 HIS N 1 1 1 1594 3 3 65 HIS ND1 N 4.398 -17.319 -8.795 0.22 . C A . 65 HIS ND1 1 1 1 1595 3 3 65 HIS NE2 N 4.957 -19.309 -9.601 0.22 . C A . 65 HIS NE2 1 1 1 1596 3 3 65 HIS O O 6.585 -17.568 -3.461 0.22 . C A . 65 HIS O 1 1 1 1597 3 3 66 ARG C C 5.023 -17.870 -1.123 1.00 . C A . 66 ARG C 1 1 1 1598 3 3 66 ARG CA C 4.375 -16.918 -2.121 1.00 . C A . 66 ARG CA 1 1 1 1599 3 3 66 ARG CB C 2.913 -16.707 -1.696 1.00 . C A . 66 ARG CB 1 1 1 1600 3 3 66 ARG CD C 2.814 -14.240 -1.321 1.00 . C A . 66 ARG CD 1 1 1 1601 3 3 66 ARG CG C 2.389 -15.378 -2.253 1.00 . C A . 66 ARG CG 1 1 1 1602 3 3 66 ARG CZ C 3.117 -11.874 -1.474 1.00 . C A . 66 ARG CZ 1 1 1 1603 3 3 66 ARG H H 3.571 -17.689 -3.966 1.00 . C A . 66 ARG H 1 1 1 1604 3 3 66 ARG HA H 4.902 -15.978 -2.121 1.00 . C A . 66 ARG HA 1 1 1 1605 3 3 66 ARG HB2 H 2.313 -17.519 -2.070 1.00 . C A . 66 ARG HB2 1 1 1 1606 3 3 66 ARG HB3 H 2.844 -16.692 -0.614 1.00 . C A . 66 ARG HB3 1 1 1 1607 3 3 66 ARG HD2 H 2.087 -14.115 -0.543 1.00 . C A . 66 ARG HD2 1 1 1 1608 3 3 66 ARG HD3 H 3.772 -14.466 -0.863 1.00 . C A . 66 ARG HD3 1 1 1 1609 3 3 66 ARG HE H 2.777 -12.988 -3.071 1.00 . C A . 66 ARG HE 1 1 1 1610 3 3 66 ARG HG2 H 2.799 -15.208 -3.242 1.00 . C A . 66 ARG HG2 1 1 1 1611 3 3 66 ARG HG3 H 1.310 -15.414 -2.312 1.00 . C A . 66 ARG HG3 1 1 1 1612 3 3 66 ARG HH11 H 3.293 -12.768 0.308 1.00 . C A . 66 ARG HH11 1 1 1 1613 3 3 66 ARG HH12 H 3.484 -11.051 0.302 1.00 . C A . 66 ARG HH12 1 1 1 1614 3 3 66 ARG HH21 H 2.992 -10.722 -3.104 1.00 . C A . 66 ARG HH21 1 1 1 1615 3 3 66 ARG HH22 H 3.301 -9.889 -1.619 1.00 . C A . 66 ARG HH22 1 1 1 1616 3 3 66 ARG N N 4.407 -17.508 -3.487 1.00 . C A . 66 ARG N 1 1 1 1617 3 3 66 ARG NE N 2.904 -12.982 -2.099 1.00 . C A . 66 ARG NE 1 1 1 1618 3 3 66 ARG NH1 N 3.312 -11.897 -0.185 1.00 . C A . 66 ARG NH1 1 1 1 1619 3 3 66 ARG NH2 N 3.140 -10.740 -2.116 1.00 . C A . 66 ARG NH2 1 1 1 1620 3 3 66 ARG O O 5.795 -17.477 -0.272 1.00 . C A . 66 ARG O 1 1 1 1621 3 3 67 GLU C C 6.707 -20.296 -0.439 1.00 . C A . 67 GLU C 1 1 1 1622 3 3 67 GLU CA C 5.200 -20.102 -0.237 1.00 . C A . 67 GLU CA 1 1 1 1623 3 3 67 GLU CB C 4.444 -21.413 -0.461 1.00 . C A . 67 GLU CB 1 1 1 1624 3 3 67 GLU CD C 2.642 -21.484 1.307 1.00 . C A . 67 GLU CD 1 1 1 1625 3 3 67 GLU CG C 2.940 -21.197 -0.167 1.00 . C A . 67 GLU CG 1 1 1 1626 3 3 67 GLU H H 4.016 -19.389 -1.875 1.00 . C A . 67 GLU H 1 1 1 1627 3 3 67 GLU HA H 5.016 -19.755 0.769 1.00 . C A . 67 GLU HA 1 1 1 1628 3 3 67 GLU HB2 H 4.568 -21.720 -1.491 1.00 . C A . 67 GLU HB2 1 1 1 1629 3 3 67 GLU HB3 H 4.839 -22.177 0.192 1.00 . C A . 67 GLU HB3 1 1 1 1630 3 3 67 GLU HG2 H 2.664 -20.172 -0.387 1.00 . C A . 67 GLU HG2 1 1 1 1631 3 3 67 GLU HG3 H 2.354 -21.862 -0.785 1.00 . C A . 67 GLU HG3 1 1 1 1632 3 3 67 GLU N N 4.670 -19.111 -1.199 1.00 . C A . 67 GLU N 1 1 1 1633 3 3 67 GLU O O 7.382 -20.851 0.404 1.00 . C A . 67 GLU O 1 1 1 1634 3 3 67 GLU OE1 O 3.469 -21.145 2.138 1.00 . C A . 67 GLU OE1 1 1 1 1635 3 3 67 GLU OE2 O 1.588 -22.035 1.580 1.00 . C A . 67 GLU OE2 1 1 1 1636 3 3 68 LYS C C 9.458 -18.788 -1.108 1.00 . C A . 68 LYS C 1 1 1 1637 3 3 68 LYS CA C 8.720 -19.970 -1.754 1.00 . C A . 68 LYS CA 1 1 1 1638 3 3 68 LYS CB C 9.027 -19.945 -3.258 1.00 . C A . 68 LYS CB 1 1 1 1639 3 3 68 LYS CD C 8.851 -21.151 -5.437 1.00 . C A . 68 LYS CD 1 1 1 1640 3 3 68 LYS CE C 9.014 -22.539 -6.081 1.00 . C A . 68 LYS CE 1 1 1 1641 3 3 68 LYS CG C 8.670 -21.281 -3.915 1.00 . C A . 68 LYS CG 1 1 1 1642 3 3 68 LYS H H 6.690 -19.366 -2.198 1.00 . C A . 68 LYS H 1 1 1 1643 3 3 68 LYS HA H 9.069 -20.900 -1.326 1.00 . C A . 68 LYS HA 1 1 1 1644 3 3 68 LYS HB2 H 8.456 -19.157 -3.723 1.00 . C A . 68 LYS HB2 1 1 1 1645 3 3 68 LYS HB3 H 10.082 -19.754 -3.406 1.00 . C A . 68 LYS HB3 1 1 1 1646 3 3 68 LYS HD2 H 7.984 -20.662 -5.856 1.00 . C A . 68 LYS HD2 1 1 1 1647 3 3 68 LYS HD3 H 9.731 -20.555 -5.647 1.00 . C A . 68 LYS HD3 1 1 1 1648 3 3 68 LYS HE2 H 8.572 -22.534 -7.068 1.00 . C A . 68 LYS HE2 1 1 1 1649 3 3 68 LYS HE3 H 10.065 -22.779 -6.164 1.00 . C A . 68 LYS HE3 1 1 1 1650 3 3 68 LYS HG2 H 9.320 -22.055 -3.534 1.00 . C A . 68 LYS HG2 1 1 1 1651 3 3 68 LYS HG3 H 7.642 -21.529 -3.695 1.00 . C A . 68 LYS HG3 1 1 1 1652 3 3 68 LYS HZ1 H 8.749 -23.571 -4.292 1.00 . C A . 68 LYS HZ1 1 1 1 1653 3 3 68 LYS HZ2 H 7.322 -23.356 -5.184 1.00 . C A . 68 LYS HZ2 1 1 1 1654 3 3 68 LYS HZ3 H 8.469 -24.506 -5.681 1.00 . C A . 68 LYS HZ3 1 1 1 1655 3 3 68 LYS N N 7.247 -19.826 -1.531 1.00 . C A . 68 LYS N 1 1 1 1656 3 3 68 LYS NZ N 8.337 -23.570 -5.246 1.00 . C A . 68 LYS NZ 1 1 1 1657 3 3 68 LYS O O 10.652 -18.846 -0.881 1.00 . C A . 68 LYS O 1 1 1 1658 3 3 69 TYR C C 8.649 -15.902 0.893 30.93 . C A . 69 TYR C 1 1 1 1659 3 3 69 TYR CA C 9.438 -16.478 -0.304 30.93 . C A . 69 TYR CA 1 1 1 1660 3 3 69 TYR CB C 9.474 -15.448 -1.433 30.93 . C A . 69 TYR CB 1 1 1 1661 3 3 69 TYR CD1 C 11.715 -15.941 -2.511 30.93 . C A . 69 TYR CD1 1 1 1 1662 3 3 69 TYR CD2 C 9.675 -16.552 -3.692 30.93 . C A . 69 TYR CD2 1 1 1 1663 3 3 69 TYR CE1 C 12.483 -16.459 -3.576 30.93 . C A . 69 TYR CE1 1 1 1 1664 3 3 69 TYR CE2 C 10.438 -17.072 -4.751 30.93 . C A . 69 TYR CE2 1 1 1 1665 3 3 69 TYR CG C 10.309 -15.987 -2.572 30.93 . C A . 69 TYR CG 1 1 1 1666 3 3 69 TYR CZ C 11.842 -17.025 -4.696 30.93 . C A . 69 TYR CZ 1 1 1 1667 3 3 69 TYR H H 7.819 -17.665 -1.102 1.00 . C A . 69 TYR H 1 1 1 1668 3 3 69 TYR HA H 10.448 -16.705 0.005 1.00 . C A . 69 TYR HA 1 1 1 1669 3 3 69 TYR HB2 H 8.468 -15.266 -1.780 1.00 . C A . 69 TYR HB2 1 1 1 1670 3 3 69 TYR HB3 H 9.893 -14.536 -1.081 1.00 . C A . 69 TYR HB3 1 1 1 1671 3 3 69 TYR HD1 H 12.206 -15.505 -1.654 1.00 . C A . 69 TYR HD1 1 1 1 1672 3 3 69 TYR HD2 H 8.604 -16.582 -3.740 1.00 . C A . 69 TYR HD2 1 1 1 1673 3 3 69 TYR HE1 H 13.561 -16.422 -3.532 1.00 . C A . 69 TYR HE1 1 1 1 1674 3 3 69 TYR HE2 H 9.945 -17.506 -5.609 1.00 . C A . 69 TYR HE2 1 1 1 1675 3 3 69 TYR HH H 13.302 -16.924 -5.921 1.00 . C A . 69 TYR HH 1 1 1 1676 3 3 69 TYR N N 8.770 -17.698 -0.868 30.93 . C A . 69 TYR N 1 1 1 1677 3 3 69 TYR O O 8.302 -14.739 0.885 30.93 . C A . 69 TYR O 1 1 1 1678 3 3 69 TYR OH O 12.589 -17.539 -5.735 30.93 . C A . 69 TYR OH 1 1 1 1679 3 3 70 PRO C C 8.174 -14.981 3.686 1.66 . C A . 70 PRO C 1 1 1 1680 3 3 70 PRO CA C 7.626 -16.286 3.079 1.66 . C A . 70 PRO CA 1 1 1 1681 3 3 70 PRO CB C 7.748 -17.463 4.078 1.66 . C A . 70 PRO CB 1 1 1 1682 3 3 70 PRO CD C 8.844 -18.126 1.929 1.66 . C A . 70 PRO CD 1 1 1 1683 3 3 70 PRO CG C 8.541 -18.599 3.368 1.66 . C A . 70 PRO CG 1 1 1 1684 3 3 70 PRO HA H 6.589 -16.149 2.811 1.00 . C A . 70 PRO HA 1 1 1 1685 3 3 70 PRO HB2 H 8.274 -17.145 4.973 1.00 . C A . 70 PRO HB2 1 1 1 1686 3 3 70 PRO HB3 H 6.763 -17.823 4.350 1.00 . C A . 70 PRO HB3 1 1 1 1687 3 3 70 PRO HD2 H 9.905 -18.188 1.723 1.00 . C A . 70 PRO HD2 1 1 1 1688 3 3 70 PRO HD3 H 8.288 -18.714 1.216 1.00 . C A . 70 PRO HD3 1 1 1 1689 3 3 70 PRO HG2 H 9.468 -18.788 3.900 1.00 . C A . 70 PRO HG2 1 1 1 1690 3 3 70 PRO HG3 H 7.950 -19.505 3.340 1.00 . C A . 70 PRO HG3 1 1 1 1691 3 3 70 PRO N N 8.390 -16.720 1.889 1.66 . C A . 70 PRO N 1 1 1 1692 3 3 70 PRO O O 7.524 -13.954 3.657 1.66 . C A . 70 PRO O 1 1 1 1693 3 3 71 ASN C C 10.623 -12.885 3.974 1.00 . C A . 71 ASN C 1 1 1 1694 3 3 71 ASN CA C 9.881 -13.800 4.952 1.00 . C A . 71 ASN CA 1 1 1 1695 3 3 71 ASN CB C 10.840 -14.228 6.064 1.00 . C A . 71 ASN CB 1 1 1 1696 3 3 71 ASN CG C 10.182 -15.318 6.910 1.00 . C A . 71 ASN CG 1 1 1 1697 3 3 71 ASN H H 9.826 -15.871 4.339 1.00 . C A . 71 ASN H 1 1 1 1698 3 3 71 ASN HA H 9.068 -13.247 5.391 1.00 . C A . 71 ASN HA 1 1 1 1699 3 3 71 ASN HB2 H 11.752 -14.609 5.627 1.00 . C A . 71 ASN HB2 1 1 1 1700 3 3 71 ASN HB3 H 11.068 -13.377 6.690 1.00 . C A . 71 ASN HB3 1 1 1 1701 3 3 71 ASN HD21 H 9.390 -14.035 8.205 1.00 . C A . 71 ASN HD21 1 1 1 1702 3 3 71 ASN HD22 H 9.061 -15.673 8.510 1.00 . C A . 71 ASN HD22 1 1 1 1703 3 3 71 ASN N N 9.334 -15.024 4.286 1.00 . C A . 71 ASN N 1 1 1 1704 3 3 71 ASN ND2 N 9.487 -14.981 7.962 1.00 . C A . 71 ASN ND2 1 1 1 1705 3 3 71 ASN O O 10.961 -11.769 4.317 1.00 . C A . 71 ASN O 1 1 1 1706 3 3 71 ASN OD1 O 10.299 -16.491 6.609 1.00 . C A . 71 ASN OD1 1 1 1 1707 3 3 72 TYR C C 10.643 -11.264 1.441 43.60 . C A . 72 TYR C 1 1 1 1708 3 3 72 TYR CA C 11.599 -12.389 1.838 43.60 . C A . 72 TYR CA 1 1 1 1709 3 3 72 TYR CB C 12.062 -13.148 0.601 43.60 . C A . 72 TYR CB 1 1 1 1710 3 3 72 TYR CD1 C 12.770 -11.339 -1.011 43.60 . C A . 72 TYR CD1 1 1 1 1711 3 3 72 TYR CD2 C 14.492 -12.643 0.122 43.60 . C A . 72 TYR CD2 1 1 1 1712 3 3 72 TYR CE1 C 13.765 -10.602 -1.677 43.60 . C A . 72 TYR CE1 1 1 1 1713 3 3 72 TYR CE2 C 15.488 -11.905 -0.545 43.60 . C A . 72 TYR CE2 1 1 1 1714 3 3 72 TYR CG C 13.134 -12.360 -0.111 43.60 . C A . 72 TYR CG 1 1 1 1715 3 3 72 TYR CZ C 15.125 -10.884 -1.445 43.60 . C A . 72 TYR CZ 1 1 1 1716 3 3 72 TYR H H 10.599 -14.204 2.477 1.00 . C A . 72 TYR H 1 1 1 1717 3 3 72 TYR HA H 12.455 -11.965 2.348 1.00 . C A . 72 TYR HA 1 1 1 1718 3 3 72 TYR HB2 H 12.449 -14.112 0.891 1.00 . C A . 72 TYR HB2 1 1 1 1719 3 3 72 TYR HB3 H 11.232 -13.278 -0.056 1.00 . C A . 72 TYR HB3 1 1 1 1720 3 3 72 TYR HD1 H 11.727 -11.123 -1.189 1.00 . C A . 72 TYR HD1 1 1 1 1721 3 3 72 TYR HD2 H 14.770 -13.427 0.812 1.00 . C A . 72 TYR HD2 1 1 1 1722 3 3 72 TYR HE1 H 13.487 -9.818 -2.367 1.00 . C A . 72 TYR HE1 1 1 1 1723 3 3 72 TYR HE2 H 16.531 -12.123 -0.366 1.00 . C A . 72 TYR HE2 1 1 1 1724 3 3 72 TYR HH H 16.937 -10.617 -1.978 1.00 . C A . 72 TYR HH 1 1 1 1725 3 3 72 TYR N N 10.884 -13.307 2.771 43.60 . C A . 72 TYR N 1 1 1 1726 3 3 72 TYR O O 9.576 -11.515 0.917 43.60 . C A . 72 TYR O 1 1 1 1727 3 3 72 TYR OH O 16.100 -10.160 -2.098 43.60 . C A . 72 TYR OH 1 1 1 1728 3 3 73 LYS C C 10.774 -7.893 0.442 1.00 . C A . 73 LYS C 1 1 1 1729 3 3 73 LYS CA C 10.087 -8.888 1.362 1.00 . C A . 73 LYS CA 1 1 1 1730 3 3 73 LYS CB C 9.698 -8.168 2.646 1.00 . C A . 73 LYS CB 1 1 1 1731 3 3 73 LYS CD C 8.069 -8.489 4.567 1.00 . C A . 73 LYS CD 1 1 1 1732 3 3 73 LYS CE C 8.168 -9.061 5.981 1.00 . C A . 73 LYS CE 1 1 1 1733 3 3 73 LYS CG C 9.106 -9.177 3.650 1.00 . C A . 73 LYS CG 1 1 1 1734 3 3 73 LYS H H 11.857 -9.854 2.146 1.00 . C A . 73 LYS H 1 1 1 1735 3 3 73 LYS HA H 9.191 -9.252 0.880 1.00 . C A . 73 LYS HA 1 1 1 1736 3 3 73 LYS HB2 H 10.579 -7.703 3.075 1.00 . C A . 73 LYS HB2 1 1 1 1737 3 3 73 LYS HB3 H 8.968 -7.408 2.416 1.00 . C A . 73 LYS HB3 1 1 1 1738 3 3 73 LYS HD2 H 8.258 -7.424 4.609 1.00 . C A . 73 LYS HD2 1 1 1 1739 3 3 73 LYS HD3 H 7.076 -8.661 4.176 1.00 . C A . 73 LYS HD3 1 1 1 1740 3 3 73 LYS HE2 H 7.276 -8.824 6.532 1.00 . C A . 73 LYS HE2 1 1 1 1741 3 3 73 LYS HE3 H 8.283 -10.129 5.929 1.00 . C A . 73 LYS HE3 1 1 1 1742 3 3 73 LYS HG2 H 8.621 -9.986 3.112 1.00 . C A . 73 LYS HG2 1 1 1 1743 3 3 73 LYS HG3 H 9.910 -9.586 4.248 1.00 . C A . 73 LYS HG3 1 1 1 1744 3 3 73 LYS HZ1 H 9.933 -7.965 5.954 1.00 . C A . 73 LYS HZ1 1 1 1 1745 3 3 73 LYS HZ2 H 9.040 -7.798 7.383 1.00 . C A . 73 LYS HZ2 1 1 1 1746 3 3 73 LYS HZ3 H 9.917 -9.216 7.097 1.00 . C A . 73 LYS HZ3 1 1 1 1747 3 3 73 LYS N N 10.998 -10.030 1.705 1.00 . C A . 73 LYS N 1 1 1 1748 3 3 73 LYS NZ N 9.354 -8.466 6.656 1.00 . C A . 73 LYS NZ 1 1 1 1749 3 3 73 LYS O O 11.970 -7.937 0.228 1.00 . C A . 73 LYS O 1 1 1 1750 3 3 74 TYR C C 11.659 -5.188 -0.188 1.00 . C A . 74 TYR C 1 1 1 1751 3 3 74 TYR CA C 10.610 -5.953 -0.983 1.00 . C A . 74 TYR CA 1 1 1 1752 3 3 74 TYR CB C 9.510 -5.017 -1.502 1.00 . C A . 74 TYR CB 1 1 1 1753 3 3 74 TYR CD1 C 9.258 -5.630 -3.946 1.00 . C A . 74 TYR CD1 1 1 1 1754 3 3 74 TYR CD2 C 7.630 -6.491 -2.347 1.00 . C A . 74 TYR CD2 1 1 1 1755 3 3 74 TYR CE1 C 8.599 -6.303 -4.986 1.00 . C A . 74 TYR CE1 1 1 1 1756 3 3 74 TYR CE2 C 6.971 -7.171 -3.390 1.00 . C A . 74 TYR CE2 1 1 1 1757 3 3 74 TYR CG C 8.776 -5.718 -2.624 1.00 . C A . 74 TYR CG 1 1 1 1758 3 3 74 TYR CZ C 7.457 -7.076 -4.709 1.00 . C A . 74 TYR CZ 1 1 1 1759 3 3 74 TYR H H 9.056 -6.952 0.111 1.00 . C A . 74 TYR H 1 1 1 1760 3 3 74 TYR HA H 11.093 -6.447 -1.815 1.00 . C A . 74 TYR HA 1 1 1 1761 3 3 74 TYR HB2 H 8.821 -4.786 -0.702 1.00 . C A . 74 TYR HB2 1 1 1 1762 3 3 74 TYR HB3 H 9.954 -4.106 -1.874 1.00 . C A . 74 TYR HB3 1 1 1 1763 3 3 74 TYR HD1 H 10.129 -5.036 -4.162 1.00 . C A . 74 TYR HD1 1 1 1 1764 3 3 74 TYR HD2 H 7.256 -6.560 -1.336 1.00 . C A . 74 TYR HD2 1 1 1 1765 3 3 74 TYR HE1 H 8.973 -6.232 -5.998 1.00 . C A . 74 TYR HE1 1 1 1 1766 3 3 74 TYR HE2 H 6.094 -7.763 -3.179 1.00 . C A . 74 TYR HE2 1 1 1 1767 3 3 74 TYR HH H 7.483 -8.007 -6.375 1.00 . C A . 74 TYR HH 1 1 1 1768 3 3 74 TYR N N 10.016 -6.974 -0.091 1.00 . C A . 74 TYR N 1 1 1 1769 3 3 74 TYR O O 11.742 -5.312 1.020 1.00 . C A . 74 TYR O 1 1 1 1770 3 3 74 TYR OH O 6.818 -7.746 -5.732 1.00 . C A . 74 TYR OH 1 1 1 1771 3 3 75 ARG C C 13.770 -2.326 -0.757 1.00 . C A . 75 ARG C 1 1 1 1772 3 3 75 ARG CA C 13.586 -3.716 -0.139 1.00 . C A . 75 ARG CA 1 1 1 1773 3 3 75 ARG CB C 14.863 -4.563 -0.308 1.00 . C A . 75 ARG CB 1 1 1 1774 3 3 75 ARG CD C 16.626 -5.614 1.149 1.00 . C A . 75 ARG CD 1 1 1 1775 3 3 75 ARG CG C 15.886 -4.310 0.825 1.00 . C A . 75 ARG CG 1 1 1 1776 3 3 75 ARG CZ C 18.451 -4.560 2.353 1.00 . C A . 75 ARG CZ 1 1 1 1777 3 3 75 ARG H H 12.431 -4.393 -1.830 1.00 . C A . 75 ARG H 1 1 1 1778 3 3 75 ARG HA H 13.341 -3.613 0.908 1.00 . C A . 75 ARG HA 1 1 1 1779 3 3 75 ARG HB2 H 14.577 -5.607 -0.307 1.00 . C A . 75 ARG HB2 1 1 1 1780 3 3 75 ARG HB3 H 15.322 -4.332 -1.260 1.00 . C A . 75 ARG HB3 1 1 1 1781 3 3 75 ARG HD2 H 15.921 -6.386 1.385 1.00 . C A . 75 ARG HD2 1 1 1 1782 3 3 75 ARG HD3 H 17.212 -5.921 0.280 1.00 . C A . 75 ARG HD3 1 1 1 1783 3 3 75 ARG HE H 17.203 -5.823 3.206 1.00 . C A . 75 ARG HE 1 1 1 1784 3 3 75 ARG HG2 H 16.601 -3.563 0.507 1.00 . C A . 75 ARG HG2 1 1 1 1785 3 3 75 ARG HG3 H 15.383 -3.963 1.715 1.00 . C A . 75 ARG HG3 1 1 1 1786 3 3 75 ARG HH11 H 18.490 -4.402 0.358 1.00 . C A . 75 ARG HH11 1 1 1 1787 3 3 75 ARG HH12 H 19.675 -3.466 1.203 1.00 . C A . 75 ARG HH12 1 1 1 1788 3 3 75 ARG HH21 H 18.702 -4.603 4.336 1.00 . C A . 75 ARG HH21 1 1 1 1789 3 3 75 ARG HH22 H 19.790 -3.576 3.464 1.00 . C A . 75 ARG HH22 1 1 1 1790 3 3 75 ARG N N 12.495 -4.444 -0.853 1.00 . C A . 75 ARG N 1 1 1 1791 3 3 75 ARG NE N 17.461 -5.395 2.366 1.00 . C A . 75 ARG NE 1 1 1 1792 3 3 75 ARG NH1 N 18.906 -4.104 1.217 1.00 . C A . 75 ARG NH1 1 1 1 1793 3 3 75 ARG NH2 N 19.027 -4.219 3.471 1.00 . C A . 75 ARG NH2 1 1 1 1794 3 3 75 ARG O O 12.858 -1.523 -0.783 1.00 . C A . 75 ARG O 1 1 stop_ save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 2:40:31 AM GMT (wattos1)