NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
54041 | 2xbd | 4241 | cing | 2-parsed | STAR | dihedral angle | 110 |
data_2xbd_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2xbd _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_2xbd 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2xbd _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2xbd "Master copy" parsed_2xbd stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2xbd _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 2xbd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 2 distance NOE simple 687 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 3 distance NOE simple 7 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 52 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 5 distance NOE simple 60 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 6 distance NOE simple 151 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 7 distance NOE ambi 205 parsed_2xbd 1 1 2xbd.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_2xbd 1 1 2xbd.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 110 parsed_2xbd 1 1 2xbd.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_2xbd 1 1 2xbd.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2xbd 1 stop_ save_ save_CNS/XPLOR_dihedral_9 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2xbd _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 9 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -60.0 . . 248 . C . 249 . N . 249 . CA . 249 . C parsed_2xbd 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 249 . C . 250 . N . 250 . CA . 250 . C parsed_2xbd 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 250 . C . 251 . N . 251 . CA . 251 . C parsed_2xbd 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 252 . C . 253 . N . 253 . CA . 253 . C parsed_2xbd 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 255 . C . 256 . N . 256 . CA . 256 . C parsed_2xbd 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 257 . C . 258 . N . 258 . CA . 258 . C parsed_2xbd 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 258 . C . 259 . N . 259 . CA . 259 . C parsed_2xbd 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 260 . C . 261 . N . 261 . CA . 261 . C parsed_2xbd 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -60.0 . . 262 . C . 263 . N . 263 . CA . 263 . C parsed_2xbd 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 263 . C . 264 . N . 264 . CA . 264 . C parsed_2xbd 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 265 . C . 266 . N . 266 . CA . 266 . C parsed_2xbd 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 266 . C . 267 . N . 267 . CA . 267 . C parsed_2xbd 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 267 . C . 268 . N . 268 . CA . 268 . C parsed_2xbd 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 268 . C . 269 . N . 269 . CA . 269 . C parsed_2xbd 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 269 . C . 270 . N . 270 . CA . 270 . C parsed_2xbd 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 273 . C . 274 . N . 274 . CA . 274 . C parsed_2xbd 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 274 . C . 275 . N . 275 . CA . 275 . C parsed_2xbd 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 275 . C . 276 . N . 276 . CA . 276 . C parsed_2xbd 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 276 . C . 277 . N . 277 . CA . 277 . C parsed_2xbd 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 277 . C . 278 . N . 278 . CA . 278 . C parsed_2xbd 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 278 . C . 279 . N . 279 . CA . 279 . C parsed_2xbd 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 279 . C . 280 . N . 280 . CA . 280 . C parsed_2xbd 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -60.0 . . 280 . C . 281 . N . 281 . CA . 281 . C parsed_2xbd 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 281 . C . 282 . N . 282 . CA . 282 . C parsed_2xbd 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 283 . C . 284 . N . 284 . CA . 284 . C parsed_2xbd 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -20.0 . . 284 . C . 285 . N . 285 . CA . 285 . C parsed_2xbd 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 285 . C . 286 . N . 286 . CA . 286 . C parsed_2xbd 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 287 . C . 288 . N . 288 . CA . 288 . C parsed_2xbd 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -60.0 . . 288 . C . 289 . N . 289 . CA . 289 . C parsed_2xbd 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 289 . C . 290 . N . 290 . CA . 290 . C parsed_2xbd 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 290 . C . 291 . N . 291 . CA . 291 . C parsed_2xbd 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 291 . C . 292 . N . 292 . CA . 292 . C parsed_2xbd 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 293 . C . 294 . N . 294 . CA . 294 . C parsed_2xbd 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 294 . C . 295 . N . 295 . CA . 295 . C parsed_2xbd 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 297 . C . 298 . N . 298 . CA . 298 . C parsed_2xbd 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 300 . C . 301 . N . 301 . CA . 301 . C parsed_2xbd 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 301 . C . 302 . N . 302 . CA . 302 . C parsed_2xbd 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 303 . C . 304 . N . 304 . CA . 304 . C parsed_2xbd 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 304 . C . 305 . N . 305 . CA . 305 . C parsed_2xbd 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 306 . C . 307 . N . 307 . CA . 307 . C parsed_2xbd 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 307 . C . 308 . N . 308 . CA . 308 . C parsed_2xbd 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 308 . C . 309 . N . 309 . CA . 309 . C parsed_2xbd 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -300.0 -60.0 . . 309 . C . 310 . N . 310 . CA . 310 . C parsed_2xbd 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 310 . C . 311 . N . 311 . CA . 311 . C parsed_2xbd 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 311 . C . 312 . N . 312 . CA . 312 . C parsed_2xbd 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 313 . C . 314 . N . 314 . CA . 314 . C parsed_2xbd 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 314 . C . 315 . N . 315 . CA . 315 . C parsed_2xbd 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 315 . C . 316 . N . 316 . CA . 316 . C parsed_2xbd 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 316 . C . 317 . N . 317 . CA . 317 . C parsed_2xbd 1 50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 317 . C . 318 . N . 318 . CA . 318 . C parsed_2xbd 1 51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -20.0 . . 318 . C . 319 . N . 319 . CA . 319 . C parsed_2xbd 1 52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 319 . C . 320 . N . 320 . CA . 320 . C parsed_2xbd 1 53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 320 . C . 321 . N . 321 . CA . 321 . C parsed_2xbd 1 54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 321 . C . 322 . N . 322 . CA . 322 . C parsed_2xbd 1 55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -20.0 . . 324 . C . 325 . N . 325 . CA . 325 . C parsed_2xbd 1 56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 327 . C . 328 . N . 328 . CA . 328 . C parsed_2xbd 1 57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 328 . C . 329 . N . 329 . CA . 329 . C parsed_2xbd 1 58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 329 . C . 330 . N . 330 . CA . 330 . C parsed_2xbd 1 59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 330 . C . 331 . N . 331 . CA . 331 . C parsed_2xbd 1 60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 332 . C . 333 . N . 333 . CA . 333 . C parsed_2xbd 1 61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 251 . N . 251 . CA . 251 . CB . 251 . CG1 parsed_2xbd 1 62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 265 . N . 265 . CA . 265 . CB . 265 . CG1 parsed_2xbd 1 63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 269 . N . 269 . CA . 269 . CB . 269 . CG1 parsed_2xbd 1 64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 277 . N . 277 . CA . 277 . CB . 277 . CG1 parsed_2xbd 1 65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 295 . N . 295 . CA . 295 . CB . 295 . CG1 parsed_2xbd 1 66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 304 . N . 304 . CA . 304 . CB . 304 . CG1 parsed_2xbd 1 67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 315 . N . 315 . CA . 315 . CB . 315 . CG1 parsed_2xbd 1 68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 317 . N . 317 . CA . 317 . CB . 317 . CG1 parsed_2xbd 1 69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . . 252 . N . 252 . CA . 252 . CB . 252 . OG1 parsed_2xbd 1 70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . . 254 . N . 254 . CA . 254 . CB . 254 . OG1 parsed_2xbd 1 71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 266 . N . 266 . CA . 266 . CB . 266 . OG1 parsed_2xbd 1 72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 276 . N . 276 . CA . 276 . CB . 276 . OG1 parsed_2xbd 1 73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 286 . N . 286 . CA . 286 . CB . 286 . OG1 parsed_2xbd 1 74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 296 . N . 296 . CA . 296 . CB . 296 . OG1 parsed_2xbd 1 75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 301 . N . 301 . CA . 301 . CB . 301 . OG1 parsed_2xbd 1 76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 303 . N . 303 . CA . 303 . CB . 303 . OG1 parsed_2xbd 1 77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 305 . N . 305 . CA . 305 . CB . 305 . OG1 parsed_2xbd 1 78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 312 . N . 312 . CA . 312 . CB . 312 . OG1 parsed_2xbd 1 79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 316 . N . 316 . CA . 316 . CB . 316 . OG1 parsed_2xbd 1 80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 324 . N . 324 . CA . 324 . CB . 324 . OG1 parsed_2xbd 1 81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 325 . N . 325 . CA . 325 . CB . 325 . OG1 parsed_2xbd 1 82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 329 . N . 329 . CA . 329 . CB . 329 . OG1 parsed_2xbd 1 83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 287 . N . 287 . CA . 287 . CB . 287 . CG1 parsed_2xbd 1 84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 249 . N . 249 . CA . 249 . CB . 249 . SG parsed_2xbd 1 85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 259 . N . 259 . CA . 259 . CB . 259 . CG parsed_2xbd 1 86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . . 260 . N . 260 . CA . 260 . CB . 260 . OG parsed_2xbd 1 87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 261 . N . 261 . CA . 261 . CB . 261 . CG parsed_2xbd 1 88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 263 . N . 263 . CA . 263 . CB . 263 . CG parsed_2xbd 1 89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 264 . N . 264 . CA . 264 . CB . 264 . CG parsed_2xbd 1 90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 267 . N . 267 . CA . 267 . CB . 267 . CG parsed_2xbd 1 91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 275 . N . 275 . CA . 275 . CB . 275 . CG parsed_2xbd 1 92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -30.0 . . 278 . N . 278 . CA . 278 . CB . 278 . CG parsed_2xbd 1 93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . . 284 . N . 284 . CA . 284 . CB . 284 . OG parsed_2xbd 1 94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 291 . N . 291 . CA . 291 . CB . 291 . CG parsed_2xbd 1 95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 294 . N . 294 . CA . 294 . CB . 294 . CG parsed_2xbd 1 96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 307 . N . 307 . CA . 307 . CB . 307 . CG parsed_2xbd 1 97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 311 . N . 311 . CA . 311 . CB . 311 . CG parsed_2xbd 1 98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 313 . N . 313 . CA . 313 . CB . 313 . CG parsed_2xbd 1 99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 320 . N . 320 . CA . 320 . CB . 320 . CG parsed_2xbd 1 100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 255 . N . 255 . CA . 255 . CB . 255 . CG parsed_2xbd 1 101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 257 . N . 257 . CA . 257 . CB . 257 . CG parsed_2xbd 1 102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 262 . N . 262 . CA . 262 . CB . 262 . CG parsed_2xbd 1 103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 279 . N . 279 . CA . 279 . CB . 279 . CG parsed_2xbd 1 104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 281 . N . 281 . CA . 281 . CB . 281 . CG parsed_2xbd 1 105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 285 . N . 285 . CA . 285 . CB . 285 . CG parsed_2xbd 1 106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -30.0 . . 288 . N . 288 . CA . 288 . CB . 288 . CG parsed_2xbd 1 107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 302 . N . 302 . CA . 302 . CB . 302 . CG parsed_2xbd 1 108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 318 . N . 318 . CA . 318 . CB . 318 . CG parsed_2xbd 1 109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 319 . N . 319 . CA . 319 . CB . 319 . CG parsed_2xbd 1 110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 279 . ca . 279 . cb . 279 . cg . 279 . cd1 parsed_2xbd 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 "MANUAL CONSTRAINT" 1 1 2 19 parsed_2xbd 1 2 "RESIDUE s 250 , J= 9.32487" 5 1 7 2 parsed_2xbd 1 3 "RESIDUE v 251 , J= 9.85606" 10 1 12 2 parsed_2xbd 1 4 "RESIDUE a 253 , J= 8.32704" 15 1 17 2 parsed_2xbd 1 5 ; RESIDUE r 255 , J= 5.98807 residue 255 not included (averaging?) RESIDUE a 256 , J= 10.1132 ; 20 1 26 2 parsed_2xbd 1 6 "RESIDUE e 258 , J= 8.24499" 29 1 31 2 parsed_2xbd 1 7 "RESIDUE w 259 , J= 10.3911" 34 1 36 2 parsed_2xbd 1 8 "RESIDUE d 261 , J= 9.19614" 39 1 41 2 parsed_2xbd 1 9 "RESIDUE f 263 , J= 7.68504" 44 1 46 2 parsed_2xbd 1 10 "RESIDUE n 264 , J= 9.29819" 49 1 51 2 parsed_2xbd 1 11 "RESIDUE t 266 , J= 10.5556" 54 1 56 2 parsed_2xbd 1 12 "RESIDUE y 267 , J= 10.3098" 59 1 61 2 parsed_2xbd 1 13 "RESIDUE s 268 , J= 10.5153" 64 1 66 2 parsed_2xbd 1 14 "RESIDUE v 269 , J= 8.83689" 69 1 71 2 parsed_2xbd 1 15 "RESIDUE s 270 , J= 9.90783" 74 1 76 2 parsed_2xbd 1 16 "RESIDUE a 274 , J= 9.66204" 79 1 81 2 parsed_2xbd 1 17 "RESIDUE w 275 , J= 8.29659" 84 1 86 2 parsed_2xbd 1 18 "RESIDUE t 276 , J= 9.75026" 89 1 91 2 parsed_2xbd 1 19 "RESIDUE v 277 , J= 9.95814" 94 1 96 2 parsed_2xbd 1 20 "RESIDUE n 278 , J= 10.4758" 99 1 101 2 parsed_2xbd 1 21 "RESIDUE l 279 , J= 10.3049" 104 1 106 2 parsed_2xbd 1 22 "RESIDUE a 280 , J= 9.53692" 109 1 111 2 parsed_2xbd 1 23 "RESIDUE l 281 , J= 7.46576" 114 1 116 2 parsed_2xbd 1 24 "RESIDUE n 282 , J= 9.40987" 119 1 121 2 parsed_2xbd 1 25 "RESIDUE s 284 , J= 9.81298" 124 1 126 2 parsed_2xbd 1 26 "RESIDUE q 285 , J= 3.1265" 129 1 131 2 parsed_2xbd 1 27 "RESIDUE t 286 , J= 8.95684" 134 1 136 2 parsed_2xbd 1 28 "RESIDUE q 288 , J= 8.13875" 139 1 141 2 parsed_2xbd 1 29 "RESIDUE a 289 , J= 7.08301" 144 1 146 2 parsed_2xbd 1 30 "RESIDUE s 290 , J= 8.01297" 149 1 151 2 parsed_2xbd 1 31 "RESIDUE w 291 , J= 8.66724" 154 1 156 2 parsed_2xbd 1 32 ; RESIDUE n 292 , J= 7.20071 POSITIVE PHI ANGLE! ; 159 1 162 21 parsed_2xbd 1 33 "RESIDUE n 294 , J= 9.64394" 166 1 168 2 parsed_2xbd 1 34 "RESIDUE v 295 , J= 9.99516" 171 1 173 2 parsed_2xbd 1 35 "RESIDUE s 298 , J= 8.86279" 176 1 178 2 parsed_2xbd 1 36 "RESIDUE t 301 , J= 9.31959" 181 1 183 2 parsed_2xbd 1 37 "RESIDUE r 302 , J= 9.37125" 186 1 188 2 parsed_2xbd 1 38 "RESIDUE v 304 , J= 10.331" 191 1 193 2 parsed_2xbd 1 39 "RESIDUE t 305 , J= 9.23342" 196 1 198 2 parsed_2xbd 1 40 "RESIDUE n 307 , J= 10.2322" 201 1 203 2 parsed_2xbd 1 41 "RESIDUE g 308 , MANUAL CONSTRAINT" 206 1 208 2 parsed_2xbd 1 42 "RESIDUE s 309 , J= 9.18526" 211 1 213 2 parsed_2xbd 1 43 "RESIDUE g 310 , MANUAL CONSTRAINT" 216 1 218 2 parsed_2xbd 1 44 "RESIDUE n 311 , J= 8.94041" 221 1 223 2 parsed_2xbd 1 45 "RESIDUE t 312 , J= 10.3194" 226 1 228 2 parsed_2xbd 1 46 "RESIDUE g 314 , MANUAL CONSTRAINT" 231 1 233 2 parsed_2xbd 1 47 "RESIDUE v 315 , J= 9.20745" 236 1 238 2 parsed_2xbd 1 48 "RESIDUE t 316 , J= 10.7782" 241 1 243 2 parsed_2xbd 1 49 "RESIDUE v 317 , J= 9.71963" 246 1 248 2 parsed_2xbd 1 50 "RESIDUE m 318 , J= 8.81615" 251 1 253 2 parsed_2xbd 1 51 "RESIDUE k 319 , J= 3.97355" 256 1 258 2 parsed_2xbd 1 52 ; RESIDUE n 320 , J= 6.71343 POSITIVE PHI ANGLE! ; 261 1 264 21 parsed_2xbd 1 53 "RESIDUE g 321 , MANUAL CONSTRAINT" 269 1 271 2 parsed_2xbd 1 54 "RESIDUE s 322 , J= 9.95454" 274 1 276 2 parsed_2xbd 1 55 ; RESIDUE s 323 , J= 6.91934 residue 323 not included (averaging?) RESIDUE t 325 , J= 2.87215 ; 279 1 285 2 parsed_2xbd 1 56 ; RESIDUE a 327 , J= 6.40207 residue 327 not included (averaging?) RESIDUE a 328 , J= 9.47504 ; 288 1 294 2 parsed_2xbd 1 57 "RESIDUE t 329 , J= 9.98202" 297 1 299 2 parsed_2xbd 1 58 "RESIDUE c 330 , J= 9.14034" 302 1 304 2 parsed_2xbd 1 59 "RESIDUE a 331 , J= 8.6369" 307 1 309 2 parsed_2xbd 1 60 "RESIDUE s 333 , J= 8.69409" 312 1 314 2 parsed_2xbd 1 61 ; Chi1s added manually below 05mar98 VALINES ; 317 1 321 9 parsed_2xbd 1 62 VAL 323 80 323 84 parsed_2xbd 1 63 VAL 325 80 325 84 parsed_2xbd 1 64 VAL 327 80 327 84 parsed_2xbd 1 65 VAL 329 80 329 84 parsed_2xbd 1 66 VAL 331 80 331 84 parsed_2xbd 1 67 VAL 333 80 333 84 parsed_2xbd 1 68 VAL 335 80 335 84 parsed_2xbd 1 69 ; VAL THREONINES ; 337 80 339 12 parsed_2xbd 1 70 THR 341 79 341 83 parsed_2xbd 1 71 THR 343 79 343 83 parsed_2xbd 1 72 THR 345 80 345 84 parsed_2xbd 1 73 THR 347 80 347 84 parsed_2xbd 1 74 THR 349 79 349 83 parsed_2xbd 1 75 THR 351 79 351 83 parsed_2xbd 1 76 THR 353 79 353 83 parsed_2xbd 1 77 THR 355 80 355 84 parsed_2xbd 1 78 THR 357 79 357 83 parsed_2xbd 1 79 THR 359 80 359 84 parsed_2xbd 1 80 THR 361 80 361 84 parsed_2xbd 1 81 THR 363 80 363 84 parsed_2xbd 1 82 THR 365 79 365 83 parsed_2xbd 1 83 ; THR ISOLEUCINE ; 367 79 369 12 parsed_2xbd 1 84 ; ILE AMX ; 371 79 373 5 parsed_2xbd 1 85 CYS 375 78 375 82 parsed_2xbd 1 86 TRP 377 79 377 83 parsed_2xbd 1 87 SER 379 78 379 82 parsed_2xbd 1 88 ASP 381 78 381 82 parsed_2xbd 1 89 PHE 383 78 383 82 parsed_2xbd 1 90 ASN 385 79 385 83 parsed_2xbd 1 91 TYR 387 79 387 83 parsed_2xbd 1 92 TRP 389 78 389 82 parsed_2xbd 1 93 ASN 391 80 391 84 parsed_2xbd 1 94 SER 393 78 393 82 parsed_2xbd 1 95 TRP 395 78 395 82 parsed_2xbd 1 96 ASN 397 79 397 83 parsed_2xbd 1 97 ASN 399 78 399 82 parsed_2xbd 1 98 ASN 401 79 401 83 parsed_2xbd 1 99 PHE 403 78 403 82 parsed_2xbd 1 100 ; ASN assign (resid 330 and name N) (resid 330 and name CA) (resid 330 and name CB) (resid 330 and name SG) 1.0 180.0 30.0 2 !CYS OTHERS ; 405 79 409 8 parsed_2xbd 1 101 ARG 411 78 411 82 parsed_2xbd 1 102 GLU 413 79 413 83 parsed_2xbd 1 103 ARG 415 78 415 82 parsed_2xbd 1 104 LEU 417 79 417 83 parsed_2xbd 1 105 LEU 419 79 419 83 parsed_2xbd 1 106 GLN 421 79 421 83 parsed_2xbd 1 107 GLN 423 80 423 84 parsed_2xbd 1 108 ARG 425 79 425 83 parsed_2xbd 1 109 MET 427 79 427 83 parsed_2xbd 1 110 ; LYS Chi2s added manually below ; 429 79 432 2 parsed_2xbd 1 stop_ save_
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