NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type item_count
31573 1ekd cing 2-parsed STAR dihedral angle 100


data_1ekd_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1ekd 
    _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_1ekd   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1ekd 
    _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   1ekd   "Master copy"    parsed_1ekd   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1ekd 
    _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   1ekd.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_1ekd   1   
        1   1ekd.mr   .   .    DISCOVER      2    distance                  NOE                 simple             172   parsed_1ekd   1   
        1   1ekd.mr   .   .    DISCOVER      3    distance                 "hydrogen bond"      simple              20   parsed_1ekd   1   
        1   1ekd.mr   .   .    DISCOVER      4   "dihedral angle"          "Not applicable"    "Not applicable"    100   parsed_1ekd   1   
        1   1ekd.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1ekd   1   
    stop_

save_


save_Discover_dihedral_4
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1ekd 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            4 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   1   G5'   O3'   1   2   G     P     1   2   G     O5'   1   2   G     C5'   parsed_1ekd   1   
          2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   2   G     O3'   1   3   C     P     1   3   C     O5'   1   3   C     C5'   parsed_1ekd   1   
          3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   3   C     O3'   1   4   G     P     1   4   G     O5'   1   4   G     C5'   parsed_1ekd   1   
          4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   4   G     O3'   1   5   U     P     1   5   U     O5'   1   5   U     C5'   parsed_1ekd   1   
          5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   5   U     O3'   1   6   G     P     1   6   G     O5'   1   6   G     C5'   parsed_1ekd   1   
          6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   6   G     O3'   1   7   C     P     1   7   C     O5'   1   7   C     C5'   parsed_1ekd   1   
          7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   7   C     O3'   1   8   C3'   P     1   8   C3'   O5'   1   8   C3'   C5'   parsed_1ekd   1   
          8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   2   G     P     1   2   G     O5'   1   2   G     C5'   1   2   G     C4'   parsed_1ekd   1   
          9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   3   C     P     1   3   C     O5'   1   3   C     C5'   1   3   C     C4'   parsed_1ekd   1   
         10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   4   G     P     1   4   G     O5'   1   4   G     C5'   1   4   G     C4'   parsed_1ekd   1   
         11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   5   U     P     1   5   U     O5'   1   5   U     C5'   1   5   U     C4'   parsed_1ekd   1   
         12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   6   G     P     1   6   G     O5'   1   6   G     C5'   1   6   G     C4'   parsed_1ekd   1   
         13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   7   C     P     1   7   C     O5'   1   7   C     C5'   1   7   C     C4'   parsed_1ekd   1   
         14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   8   C3'   P     1   8   C3'   O5'   1   8   C3'   C5'   1   8   C3'   C4'   parsed_1ekd   1   
         15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   1   G5'   O5'   1   1   G5'   C5'   1   1   G5'   C4'   1   1   G5'   C3'   parsed_1ekd   1   
         16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   2   G     O5'   1   2   G     C5'   1   2   G     C4'   1   2   G     C3'   parsed_1ekd   1   
         17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   3   C     O5'   1   3   C     C5'   1   3   C     C4'   1   3   C     C3'   parsed_1ekd   1   
         18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   4   G     O5'   1   4   G     C5'   1   4   G     C4'   1   4   G     C3'   parsed_1ekd   1   
         19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   5   U     O5'   1   5   U     C5'   1   5   U     C4'   1   5   U     C3'   parsed_1ekd   1   
         20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   1   6   G     O5'   1   6   G     C5'   1   6   G     C4'   1   6   G     C3'   parsed_1ekd   1   
         21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   1   G5'   C5'   1   1   G5'   C4'   1   1   G5'   C3'   1   1   G5'   O3'   parsed_1ekd   1   
         22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   2   G     C5'   1   2   G     C4'   1   2   G     C3'   1   2   G     O3'   parsed_1ekd   1   
         23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   3   C     C5'   1   3   C     C4'   1   3   C     C3'   1   3   C     O3'   parsed_1ekd   1   
         24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   4   G     C5'   1   4   G     C4'   1   4   G     C3'   1   4   G     O3'   parsed_1ekd   1   
         25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   5   U     C5'   1   5   U     C4'   1   5   U     C3'   1   5   U     O3'   parsed_1ekd   1   
         26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   6   G     C5'   1   6   G     C4'   1   6   G     C3'   1   6   G     O3'   parsed_1ekd   1   
         27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   7   C     C5'   1   7   C     C4'   1   7   C     C3'   1   7   C     O3'   parsed_1ekd   1   
         28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   1   8   C3'   C5'   1   8   C3'   C4'   1   8   C3'   C3'   1   8   C3'   O3'   parsed_1ekd   1   
         29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   1   G5'   C4'   1   1   G5'   C3'   1   1   G5'   O3'   1   2   G     P     parsed_1ekd   1   
         30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   2   G     C4'   1   2   G     C3'   1   2   G     O3'   1   3   C     P     parsed_1ekd   1   
         31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   3   C     C4'   1   3   C     C3'   1   3   C     O3'   1   4   G     P     parsed_1ekd   1   
         32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   4   G     C4'   1   4   G     C3'   1   4   G     O3'   1   5   U     P     parsed_1ekd   1   
         33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   5   U     C4'   1   5   U     C3'   1   5   U     O3'   1   6   G     P     parsed_1ekd   1   
         34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   6   G     C4'   1   6   G     C3'   1   6   G     O3'   1   7   C     P     parsed_1ekd   1   
         35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   1   7   C     C4'   1   7   C     C3'   1   7   C     O3'   1   8   C3'   P     parsed_1ekd   1   
         36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   1   G5'   C3'   1   1   G5'   O3'   1   2   G     P     1   2   G     O5'   parsed_1ekd   1   
         37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   2   G     C3'   1   2   G     O3'   1   3   C     P     1   3   C     O5'   parsed_1ekd   1   
         38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   3   C     C3'   1   3   C     O3'   1   4   G     P     1   4   G     O5'   parsed_1ekd   1   
         39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   4   G     C3'   1   4   G     O3'   1   5   U     P     1   5   U     O5'   parsed_1ekd   1   
         40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   5   U     C3'   1   5   U     O3'   1   6   G     P     1   6   G     O5'   parsed_1ekd   1   
         41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   6   G     C3'   1   6   G     O3'   1   7   C     P     1   7   C     O5'   parsed_1ekd   1   
         42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   1   7   C     C3'   1   7   C     O3'   1   8   C3'   P     1   8   C3'   O5'   parsed_1ekd   1   
         43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   1   G5'   O4'   1   1   G5'   C1'   1   1   G5'   N9    1   1   G5'   C4    parsed_1ekd   1   
         44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   2   G     O4'   1   2   G     C1'   1   2   G     N9    1   2   G     C4    parsed_1ekd   1   
         45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   3   C     O4'   1   3   C     C1'   1   3   C     N1    1   3   C     C2    parsed_1ekd   1   
         46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   4   G     O4'   1   4   G     C1'   1   4   G     N9    1   4   G     C4    parsed_1ekd   1   
         47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   5   U     O4'   1   5   U     C1'   1   5   U     N1    1   5   U     C2    parsed_1ekd   1   
         48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   6   G     O4'   1   6   G     C1'   1   6   G     N9    1   6   G     C4    parsed_1ekd   1   
         49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   7   C     O4'   1   7   C     C1'   1   7   C     N1    1   7   C     C2    parsed_1ekd   1   
         50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   1   8   C3'   O4'   1   8   C3'   C1'   1   8   C3'   N1    1   8   C3'   C2    parsed_1ekd   1   
         51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   1   G5'   O3'   B   2   G     P     B   2   G     O5'   B   2   G     C5'   parsed_1ekd   1   
         52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   2   G     O3'   B   3   C     P     B   3   C     O5'   B   3   C     C5'   parsed_1ekd   1   
         53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   3   C     O3'   B   4   G     P     B   4   G     O5'   B   4   G     C5'   parsed_1ekd   1   
         54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   4   G     O3'   B   5   U     P     B   5   U     O5'   B   5   U     C5'   parsed_1ekd   1   
         55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   5   U     O3'   B   6   G     P     B   6   G     O5'   B   6   G     C5'   parsed_1ekd   1   
         56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   6   G     O3'   B   7   C     P     B   7   C     O5'   B   7   C     C5'   parsed_1ekd   1   
         57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   7   C     O3'   B   8   C3'   P     B   8   C3'   O5'   B   8   C3'   C5'   parsed_1ekd   1   
         58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   2   G     P     B   2   G     O5'   B   2   G     C5'   B   2   G     C4'   parsed_1ekd   1   
         59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   3   C     P     B   3   C     O5'   B   3   C     C5'   B   3   C     C4'   parsed_1ekd   1   
         60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   4   G     P     B   4   G     O5'   B   4   G     C5'   B   4   G     C4'   parsed_1ekd   1   
         61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   5   U     P     B   5   U     O5'   B   5   U     C5'   B   5   U     C4'   parsed_1ekd   1   
         62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   6   G     P     B   6   G     O5'   B   6   G     C5'   B   6   G     C4'   parsed_1ekd   1   
         63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   7   C     P     B   7   C     O5'   B   7   C     C5'   B   7   C     C4'   parsed_1ekd   1   
         64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   8   C3'   P     B   8   C3'   O5'   B   8   C3'   C5'   B   8   C3'   C4'   parsed_1ekd   1   
         65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   1   G5'   O5'   B   1   G5'   C5'   B   1   G5'   C4'   B   1   G5'   C3'   parsed_1ekd   1   
         66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   2   G     O5'   B   2   G     C5'   B   2   G     C4'   B   2   G     C3'   parsed_1ekd   1   
         67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   3   C     O5'   B   3   C     C5'   B   3   C     C4'   B   3   C     C3'   parsed_1ekd   1   
         68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   4   G     O5'   B   4   G     C5'   B   4   G     C4'   B   4   G     C3'   parsed_1ekd   1   
         69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   5   U     O5'   B   5   U     C5'   B   5   U     C4'   B   5   U     C3'   parsed_1ekd   1   
         70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30     90   .   B   6   G     O5'   B   6   G     C5'   B   6   G     C4'   B   6   G     C3'   parsed_1ekd   1   
         71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   1   G5'   C5'   B   1   G5'   C4'   B   1   G5'   C3'   B   1   G5'   O3'   parsed_1ekd   1   
         72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   2   G     C5'   B   2   G     C4'   B   2   G     C3'   B   2   G     O3'   parsed_1ekd   1   
         73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   3   C     C5'   B   3   C     C4'   B   3   C     C3'   B   3   C     O3'   parsed_1ekd   1   
         74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   4   G     C5'   B   4   G     C4'   B   4   G     C3'   B   4   G     O3'   parsed_1ekd   1   
         75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   5   U     C5'   B   5   U     C4'   B   5   U     C3'   B   5   U     O3'   parsed_1ekd   1   
         76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   6   G     C5'   B   6   G     C4'   B   6   G     C3'   B   6   G     O3'   parsed_1ekd   1   
         77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   7   C     C5'   B   7   C     C4'   B   7   C     C3'   B   7   C     O3'   parsed_1ekd   1   
         78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70    110   .   B   8   C3'   C5'   B   8   C3'   C4'   B   8   C3'   C3'   B   8   C3'   O3'   parsed_1ekd   1   
         79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   1   G5'   C4'   B   1   G5'   C3'   B   1   G5'   O3'   B   2   G     P     parsed_1ekd   1   
         80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   2   G     C4'   B   2   G     C3'   B   2   G     O3'   B   3   C     P     parsed_1ekd   1   
         81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   3   C     C4'   B   3   C     C3'   B   3   C     O3'   B   4   G     P     parsed_1ekd   1   
         82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   4   G     C4'   B   4   G     C3'   B   4   G     O3'   B   5   U     P     parsed_1ekd   1   
         83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   5   U     C4'   B   5   U     C3'   B   5   U     O3'   B   6   G     P     parsed_1ekd   1   
         84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   6   G     C4'   B   6   G     C3'   B   6   G     O3'   B   7   C     P     parsed_1ekd   1   
         85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -100   .   B   7   C     C4'   B   7   C     C3'   B   7   C     O3'   B   8   C3'   P     parsed_1ekd   1   
         86   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   1   G5'   C3'   B   1   G5'   O3'   B   2   G     P     B   2   G     O5'   parsed_1ekd   1   
         87   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   2   G     C3'   B   2   G     O3'   B   3   C     P     B   3   C     O5'   parsed_1ekd   1   
         88   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   3   C     C3'   B   3   C     O3'   B   4   G     P     B   4   G     O5'   parsed_1ekd   1   
         89   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   4   G     C3'   B   4   G     O3'   B   5   U     P     B   5   U     O5'   parsed_1ekd   1   
         90   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   5   U     C3'   B   5   U     O3'   B   6   G     P     B   6   G     O5'   parsed_1ekd   1   
         91   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   6   G     C3'   B   6   G     O3'   B   7   C     P     B   7   C     O5'   parsed_1ekd   1   
         92   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    150   .   B   7   C     C3'   B   7   C     O3'   B   8   C3'   P     B   8   C3'   O5'   parsed_1ekd   1   
         93   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   1   G5'   O4'   B   1   G5'   C1'   B   1   G5'   N9    B   1   G5'   C4    parsed_1ekd   1   
         94   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   2   G     O4'   B   2   G     C1'   B   2   G     N9    B   2   G     C4    parsed_1ekd   1   
         95   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   3   C     O4'   B   3   C     C1'   B   3   C     N1    B   3   C     C2    parsed_1ekd   1   
         96   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   4   G     O4'   B   4   G     C1'   B   4   G     N9    B   4   G     C4    parsed_1ekd   1   
         97   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   5   U     O4'   B   5   U     C1'   B   5   U     N1    B   5   U     C2    parsed_1ekd   1   
         98   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   6   G     O4'   B   6   G     C1'   B   6   G     N9    B   6   G     C4    parsed_1ekd   1   
         99   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   7   C     O4'   B   7   C     C1'   B   7   C     N1    B   7   C     C2    parsed_1ekd   1   
        100   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150   -150   .   B   8   C3'   O4'   B   8   C3'   C1'   B   8   C3'   N1    B   8   C3'   C2    parsed_1ekd   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   
;
NMR_dihedral
alpha
;
     1   1     2   6   parsed_1ekd   1   
         2    Belta       10   1    10   6   parsed_1ekd   1   
         3    Gamma       18   1    18   6   parsed_1ekd   1   
         4   
;
1:C_7:O5'   1:C_7:C5'     1:C_7:C4'       1:C_7:C3'   30   90 25 25 1000
1:C3'_8:O5'   1:C3'_8:C5'     1:C3'_8:C4'       1:C3'_8:C3'   30   90 25 25 1000
Delta
;
    25   1    27   6   parsed_1ekd   1   
         5    Episilon    36   1    36   9   parsed_1ekd   1   
         6    kesi        44   1    44   5   parsed_1ekd   1   
         7    Chi         52   1    52   4   parsed_1ekd   1   
         8   
;
second copy begins here

alpha
;
    61   1    64   6   parsed_1ekd   1   
         9    Belta       72   1    72   6   parsed_1ekd   1   
        10    Gamma       80   1    80   6   parsed_1ekd   1   
        11   
;
1:C_7B:O5'   1:C_7B:C5'     1:C_7B:C4'       1:C_7B:C3'   30   90 25 25 1000
1:C3'_8B:O5'   1:C3'_8B:C5'     1:C3'_8B:C4'       1:C3'_8B:C3'   30   90 25 25 1000
Delta
;
    87   1    89   6   parsed_1ekd   1   
        12    Episilon    98   1    98   9   parsed_1ekd   1   
        13    kesi       106   1   106   5   parsed_1ekd   1   
        14    Chi        114   1   114   4   parsed_1ekd   1   
    stop_

save_





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