NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type item_count
29582 1b2i 4276 cing 2-parsed STAR dihedral angle 79


data_1b2i_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1b2i 
    _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_1b2i   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1b2i 
    _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   1b2i   "Master copy"    parsed_1b2i   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1b2i 
    _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   1b2i.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_1b2i   1   
        1   1b2i.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1320   parsed_1b2i   1   
        1   1b2i.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               41   parsed_1b2i   1   
        1   1b2i.mr   .   .    n/a           4    comment                  "Not applicable"    "Not applicable"       0   parsed_1b2i   1   
        1   1b2i.mr   .   .    XPLOR/CNS     5   "dihedral angle"          "Not applicable"    "Not applicable"      79   parsed_1b2i   1   
        1   1b2i.mr   .   .    n/a           6    comment                  "Not applicable"    "Not applicable"       0   parsed_1b2i   1   
        1   1b2i.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1b2i   1   
    stop_

save_


save_CNS/XPLOR_dihedral_5
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1b2i 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            5 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    5   .   c    .    6   .   n    .    6   .   ca   .    6   .   c     parsed_1b2i   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .    6   .   c    .    7   .   n    .    7   .   ca   .    7   .   c     parsed_1b2i   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .    8   .   c    .    9   .   n    .    9   .   ca   .    9   .   c     parsed_1b2i   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   10   .   c    .   11   .   n    .   11   .   ca   .   11   .   c     parsed_1b2i   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   11   .   c    .   12   .   n    .   12   .   ca   .   12   .   c     parsed_1b2i   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   12   .   c    .   13   .   n    .   13   .   ca   .   13   .   c     parsed_1b2i   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   13   .   c    .   14   .   n    .   14   .   ca   .   14   .   c     parsed_1b2i   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   17   .   c    .   18   .   n    .   18   .   ca   .   18   .   c     parsed_1b2i   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   18   .   c    .   19   .   n    .   19   .   ca   .   19   .   c     parsed_1b2i   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   20   .   c    .   21   .   n    .   21   .   ca   .   21   .   c     parsed_1b2i   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0   -60.0   .   .   21   .   c    .   22   .   n    .   22   .   ca   .   22   .   c     parsed_1b2i   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   24   .   c    .   25   .   n    .   25   .   ca   .   25   .   c     parsed_1b2i   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   25   .   c    .   26   .   n    .   26   .   ca   .   26   .   c     parsed_1b2i   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   27   .   c    .   28   .   n    .   28   .   ca   .   28   .   c     parsed_1b2i   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   28   .   c    .   29   .   n    .   29   .   ca   .   29   .   c     parsed_1b2i   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   30   .   c    .   31   .   n    .   31   .   ca   .   31   .   c     parsed_1b2i   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   31   .   c    .   32   .   n    .   32   .   ca   .   32   .   c     parsed_1b2i   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   35   .   c    .   36   .   n    .   36   .   ca   .   36   .   c     parsed_1b2i   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   36   .   c    .   37   .   n    .   37   .   ca   .   37   .   c     parsed_1b2i   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   41   .   c    .   42   .   n    .   42   .   ca   .   42   .   c     parsed_1b2i   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -180.0   -60.0   .   .   42   .   c    .   43   .   n    .   43   .   ca   .   43   .   c     parsed_1b2i   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   43   .   c    .   44   .   n    .   44   .   ca   .   44   .   c     parsed_1b2i   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   46   .   c    .   47   .   n    .   47   .   ca   .   47   .   c     parsed_1b2i   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   49   .   c    .   50   .   n    .   50   .   ca   .   50   .   c     parsed_1b2i   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   51   .   c    .   52   .   n    .   52   .   ca   .   52   .   c     parsed_1b2i   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   53   .   c    .   54   .   n    .   54   .   ca   .   54   .   c     parsed_1b2i   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -170.0   -70.0   .   .   55   .   c    .   56   .   n    .   56   .   ca   .   56   .   c     parsed_1b2i   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   57   .   c    .   58   .   n    .   58   .   ca   .   58   .   c     parsed_1b2i   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   59   .   c    .   60   .   n    .   60   .   ca   .   60   .   c     parsed_1b2i   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   60   .   c    .   61   .   n    .   61   .   ca   .   61   .   c     parsed_1b2i   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -110.0   -10.0   .   .   61   .   c    .   62   .   n    .   62   .   ca   .   62   .   c     parsed_1b2i   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   63   .   c    .   64   .   n    .   64   .   ca   .   64   .   c     parsed_1b2i   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   65   .   c    .   66   .   n    .   66   .   ca   .   66   .   c     parsed_1b2i   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   66   .   c    .   67   .   n    .   67   .   ca   .   67   .   c     parsed_1b2i   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   70   .   c    .   71   .   n    .   71   .   ca   .   71   .   c     parsed_1b2i   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   71   .   c    .   72   .   n    .   72   .   ca   .   72   .   c     parsed_1b2i   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   72   .   c    .   73   .   n    .   73   .   ca   .   73   .   c     parsed_1b2i   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -110.0   -10.0   .   .   73   .   c    .   74   .   n    .   74   .   ca   .   74   .   c     parsed_1b2i   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   75   .   c    .   76   .   n    .   76   .   ca   .   76   .   c     parsed_1b2i   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   76   .   c    .   77   .   n    .   77   .   ca   .   77   .   c     parsed_1b2i   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   77   .   c    .   78   .   n    .   78   .   ca   .   78   .   c     parsed_1b2i   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0   -80.0   .   .   78   .   c    .   79   .   n    .   79   .   ca   .   79   .   c     parsed_1b2i   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   80   .   c    .   81   .   n    .   81   .   ca   .   81   .   c     parsed_1b2i   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   81   .   c    .   82   .   n    .   82   .   ca   .   82   .   c     parsed_1b2i   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .    5   .   ha   .    5   .   ca   .    5   .   cb   .    5   .   hb1   parsed_1b2i   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -95.0   -25.0   .   .    6   .   ha   .    6   .   ca   .    6   .   cb   .    6   .   hb1   parsed_1b2i   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .    7   .   ha   .    7   .   ca   .    7   .   cb   .    7   .   hb1   parsed_1b2i   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0   200.0   .   .   12   .   ha   .   12   .   ca   .   12   .   cb   .   12   .   hb1   parsed_1b2i   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   16   .   ha   .   16   .   ca   .   16   .   cb   .   16   .   hb1   parsed_1b2i   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   21   .   ha   .   21   .   ca   .   21   .   cb   .   21   .   hb1   parsed_1b2i   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   24   .   ha   .   24   .   ca   .   24   .   cb   .   24   .   hb1   parsed_1b2i   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   26   .   ha   .   26   .   ca   .   26   .   cb   .   26   .   hb1   parsed_1b2i   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0   210.0   .   .   27   .   ha   .   27   .   ca   .   27   .   cb   .   27   .   hb1   parsed_1b2i   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   29   .   ha   .   29   .   ca   .   29   .   cb   .   29   .   hb1   parsed_1b2i   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0   200.0   .   .   31   .   ha   .   31   .   ca   .   31   .   cb   .   31   .   hb1   parsed_1b2i   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   37   .   ha   .   37   .   ca   .   37   .   cb   .   37   .   hb1   parsed_1b2i   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   43   .   ha   .   43   .   ca   .   43   .   cb   .   43   .   hb1   parsed_1b2i   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   44   .   ha   .   44   .   ca   .   44   .   cb   .   44   .   hb1   parsed_1b2i   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   48   .   ha   .   48   .   ca   .   48   .   cb   .   48   .   hb1   parsed_1b2i   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   49   .   ha   .   49   .   ca   .   49   .   cb   .   49   .   hb1   parsed_1b2i   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    140.0   220.0   .   .   50   .   ha   .   50   .   ca   .   50   .   cb   .   50   .   hb1   parsed_1b2i   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -100.0   -20.0   .   .   51   .   ha   .   51   .   ca   .   51   .   cb   .   51   .   hb1   parsed_1b2i   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   53   .   ha   .   53   .   ca   .   53   .   cb   .   53   .   hb1   parsed_1b2i   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   54   .   ha   .   54   .   ca   .   54   .   cb   .   54   .   hb1   parsed_1b2i   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   55   .   ha   .   55   .   ca   .   55   .   cb   .   55   .   hb1   parsed_1b2i   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   58   .   ha   .   58   .   ca   .   58   .   cb   .   58   .   hb1   parsed_1b2i   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    140.0   220.0   .   .   61   .   ha   .   61   .   ca   .   61   .   cb   .   61   .   hb1   parsed_1b2i   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    140.0   220.0   .   .   62   .   ha   .   62   .   ca   .   62   .   cb   .   62   .   hb1   parsed_1b2i   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   64   .   ha   .   64   .   ca   .   64   .   cb   .   64   .   hb1   parsed_1b2i   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     20.0   100.0   .   .   65   .   ha   .   65   .   ca   .   65   .   cb   .   65   .   hb1   parsed_1b2i   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   66   .   ha   .   66   .   ca   .   66   .   cb   .   66   .   hb1   parsed_1b2i   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0   200.0   .   .   69   .   ha   .   69   .   ca   .   69   .   cb   .   69   .   hb1   parsed_1b2i   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   71   .   ha   .   71   .   ca   .   71   .   cb   .   71   .   hb1   parsed_1b2i   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    160.0   200.0   .   .   72   .   ha   .   72   .   ca   .   72   .   cb   .   72   .   hb1   parsed_1b2i   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.0    80.0   .   .   74   .   ha   .   74   .   ca   .   74   .   cb   .   74   .   hb1   parsed_1b2i   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   76   .   ha   .   76   .   ca   .   76   .   cb   .   76   .   hb1   parsed_1b2i   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0   -30.0   .   .   77   .   ha   .   77   .   ca   .   77   .   cb   .   77   .   hb1   parsed_1b2i   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    140.0   220.0   .   .   78   .   ha   .   78   .   ca   .   78   .   cb   .   78   .   hb1   parsed_1b2i   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.0   -40.0   .   .   82   .   ha   .   82   .   ca   .   82   .   cb   .   82   .   hb1   parsed_1b2i   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   "*J-HN-HA > 8 Hz*"      1   1     1   1   parsed_1b2i   1   
         2   "*J-HN-HA < 6 Hz*"      4   1     4   1   parsed_1b2i   1   
         3   "*J-HN-HA > 8 Hz*"      7   1     7   1   parsed_1b2i   1   
         4   "*J-HN-HA < 6 Hz*"     10   1    10   1   parsed_1b2i   1   
         5   "*J-HN-HA > 8 Hz*"     13   1    13   1   parsed_1b2i   1   
         6   "*J-HN-HA < 6 Hz*"     16   1    16   1   parsed_1b2i   1   
         7   "*J-HN-HA > 8 Hz*"     19   1    19   1   parsed_1b2i   1   
         8   "*J-HN-HA > 8 Hz*"     22   1    22   1   parsed_1b2i   1   
         9   "*J-HN-HA > 8 Hz*"     25   1    25   1   parsed_1b2i   1   
        10   "*J-HN-HA < 6 Hz*"     28   1    28   1   parsed_1b2i   1   
        11   "*J-HN-HA > 8 Hz*"     31   1    31   1   parsed_1b2i   1   
        12   "*J-HN-HA < 6 Hz*"     34   1    34   1   parsed_1b2i   1   
        13   "*J-HN-HA < 6 Hz*"     37   1    37   1   parsed_1b2i   1   
        14   "*J-HN-HA < 6 Hz*"     40   1    40   1   parsed_1b2i   1   
        15   "*J-HN-HA < 6 Hz*"     43   1    43   1   parsed_1b2i   1   
        16   "*J-HN-HA > 8 Hz*"     46   1    46   1   parsed_1b2i   1   
        17   "*J-HN-HA > 8 Hz*"     49   1    49   1   parsed_1b2i   1   
        18   "*J-HN-HA < 6 Hz*"     52   1    52   1   parsed_1b2i   1   
        19   "*J-HN-HA < 6 Hz*"     55   1    55   1   parsed_1b2i   1   
        20   "*J-HN-HA < 6 Hz*"     58   1    58   1   parsed_1b2i   1   
        21   "*J-HN-HA > 8 Hz*"     61   1    61   1   parsed_1b2i   1   
        22   "*J-HN-HA > 8 Hz*"     64   1    64   1   parsed_1b2i   1   
        23   "*J-HN-HA > 8 Hz*"     67   1    67   1   parsed_1b2i   1   
        24   "*J-HN-HA > 8 Hz*"     70   1    70   1   parsed_1b2i   1   
        25   "*J-HN-HA > 8 Hz*"     73   1    73   1   parsed_1b2i   1   
        26   "*J-HN-HA < 6 Hz*"     76   1    76   1   parsed_1b2i   1   
        27   "*J-HN-HA > 8 Hz*"     79   1    79   1   parsed_1b2i   1   
        28   "*J-HN-HA > 8 Hz*"     82   1    82   1   parsed_1b2i   1   
        29   "*J-HN-HA < 6 Hz*"     85   1    85   1   parsed_1b2i   1   
        30   "*J-HN-HA < 6 Hz*"     88   1    88   1   parsed_1b2i   1   
        31   "*J-HN-HA < 6 Hz*"     91   1    91   1   parsed_1b2i   1   
        32   "*J-HN-HA > 8 Hz*"     94   1    94   1   parsed_1b2i   1   
        33   "*J-HN-HA < 6 Hz*"     97   1    97   1   parsed_1b2i   1   
        34   "*J-HN-HA > 8 Hz*"    100   1   100   1   parsed_1b2i   1   
        35   "*J-HN-HA > 8 Hz*"    103   1   103   1   parsed_1b2i   1   
        36   "*J-HN-HA > 8 Hz*"    106   1   106   1   parsed_1b2i   1   
        37   "*J-HN-HA < 6 Hz*"    109   1   109   1   parsed_1b2i   1   
        38   "*J-HN-HA < 6 Hz*"    112   1   112   1   parsed_1b2i   1   
        39   "*J-HN-HA < 6 Hz*"    115   1   115   1   parsed_1b2i   1   
        40   "*J-HN-HA < 6 Hz*"    118   1   118   1   parsed_1b2i   1   
        41   "*J-HN-HA > 8 Hz*"    121   1   121   1   parsed_1b2i   1   
        42   "*J-HN-HA > 8 Hz*"    124   1   124   1   parsed_1b2i   1   
        43   "*J-HN-HA < 6 Hz*"    127   1   127   1   parsed_1b2i   1   
        44   "*J-HN-HA < 6 Hz*"    130   1   130   1   parsed_1b2i   1   
        45   "*HA-HB1  60*"        133   1   133   1   parsed_1b2i   1   
        46   "*HA-HB1  -60*"       136   1   136   1   parsed_1b2i   1   
        47   "*HA-HB1  -60*"       139   1   139   1   parsed_1b2i   1   
        48   "*HA-HB1  180*"       142   1   142   1   parsed_1b2i   1   
        49   "*HA-HB1  -60*"       145   1   145   1   parsed_1b2i   1   
        50   "*HA-HB1  60*"        148   1   148   1   parsed_1b2i   1   
        51   "*HA-HB1  -60*"       151   1   151   1   parsed_1b2i   1   
        52   "*HA-HB1  -60*"       154   1   154   1   parsed_1b2i   1   
        53   "*HA-HB1  180*"       157   1   157   1   parsed_1b2i   1   
        54   "*HA-HB1  -60*"       160   1   160   1   parsed_1b2i   1   
        55   "*HA-HB1  180*"       163   1   163   1   parsed_1b2i   1   
        56   "*HA-HB1  60*"        166   1   166   1   parsed_1b2i   1   
        57   "*HA-HB1  -60*"       169   1   169   1   parsed_1b2i   1   
        58   "*HA-HB1  -60*"       172   1   172   1   parsed_1b2i   1   
        59   "*HA-HB1  60*"        175   1   175   1   parsed_1b2i   1   
        60   "*HA-HB1  -60*"       178   1   178   1   parsed_1b2i   1   
        61   "*HA-HB1  180*"       181   1   181   1   parsed_1b2i   1   
        62   "*HA-HB1  -60*"       184   1   184   1   parsed_1b2i   1   
        63   "*HA-HB1  -60*"       187   1   187   1   parsed_1b2i   1   
        64   "*HA-HB1  -60*"       190   1   190   1   parsed_1b2i   1   
        65   "*HA-HB1  -60*"       193   1   193   1   parsed_1b2i   1   
        66   "*HA-HB1  60*"        196   1   196   1   parsed_1b2i   1   
        67   "*HA-HB1  180*"       199   1   199   1   parsed_1b2i   1   
        68   "*HA-HB1  180*"       202   1   202   1   parsed_1b2i   1   
        69   "*HA-HB1  60*"        205   1   205   1   parsed_1b2i   1   
        70   "*HA-HB1  60*"        208   1   208   1   parsed_1b2i   1   
        71   "*HA-HB1  -60*"       211   1   211   1   parsed_1b2i   1   
        72   "*HA-HB1  180*"       214   1   214   1   parsed_1b2i   1   
        73   "*HA-HB1  -60*"       217   1   217   1   parsed_1b2i   1   
        74   "*HA-HB1  180*"       220   1   220   1   parsed_1b2i   1   
        75   "*HA-HB1  60*"        223   1   223   1   parsed_1b2i   1   
        76   "*HA-HB1  -60*"       226   1   226   1   parsed_1b2i   1   
        77   "*HA-HB1  -60*"       229   1   229   1   parsed_1b2i   1   
        78   "*HA-HB1  180*"       232   1   232   1   parsed_1b2i   1   
        79   "*HA-HB1  -60*"       235   1   235   1   parsed_1b2i   1   
    stop_

save_





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