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
618228 2ndk 26063 cing 2-parsed STAR dihedral angle 86


data_2ndk_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2ndk 
    _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_2ndk   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2ndk 
    _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   2ndk   "Master copy"    parsed_2ndk   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2ndk 
    _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   2ndk.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_2ndk   1   
        1   2ndk.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"    "Not applicable"    86   parsed_2ndk   1   
        1   2ndk.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_2ndk   1   
    stop_

save_


save_CNS/XPLOR_dihedral_2
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_2ndk 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            2 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.90   -35.02   .   .    2   .   C   .    3   .   N    .    3   .   CA   .    3   .   C   parsed_2ndk   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -72.68   -47.32   .   .    3   .   C   .    4   .   N    .    4   .   CA   .    4   .   C   parsed_2ndk   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.15   -55.97   .   .    4   .   C   .    5   .   N    .    5   .   CA   .    5   .   C   parsed_2ndk   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -99.82   -30.92   .   .    5   .   C   .    6   .   N    .    6   .   CA   .    6   .   C   parsed_2ndk   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -91.81   -41.75   .   .    6   .   C   .    7   .   N    .    7   .   CA   .    7   .   C   parsed_2ndk   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -73.80   -54.82   .   .    7   .   C   .    8   .   N    .    8   .   CA   .    8   .   C   parsed_2ndk   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.22   -54.70   .   .    8   .   C   .    9   .   N    .    9   .   CA   .    9   .   C   parsed_2ndk   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -74.49   -51.87   .   .    9   .   C   .   10   .   N    .   10   .   CA   .   10   .   C   parsed_2ndk   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -72.98   -51.82   .   .   10   .   C   .   11   .   N    .   11   .   CA   .   11   .   C   parsed_2ndk   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -73.07   -50.47   .   .   11   .   C   .   12   .   N    .   12   .   CA   .   12   .   C   parsed_2ndk   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -105.57   -40.43   .   .   12   .   C   .   13   .   N    .   13   .   CA   .   13   .   C   parsed_2ndk   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -72.62   -52.32   .   .   13   .   C   .   14   .   N    .   14   .   CA   .   14   .   C   parsed_2ndk   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -84.18   -50.10   .   .   14   .   C   .   15   .   N    .   15   .   CA   .   15   .   C   parsed_2ndk   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -81.35   -48.63   .   .   15   .   C   .   16   .   N    .   16   .   CA   .   16   .   C   parsed_2ndk   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -79.77   -45.53   .   .   16   .   C   .   17   .   N    .   17   .   CA   .   17   .   C   parsed_2ndk   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -85.57   -48.61   .   .   17   .   C   .   18   .   N    .   18   .   CA   .   18   .   C   parsed_2ndk   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -81.49   -46.21   .   .   18   .   C   .   19   .   N    .   19   .   CA   .   19   .   C   parsed_2ndk   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -85.47   -45.15   .   .   19   .   C   .   20   .   N    .   20   .   CA   .   20   .   C   parsed_2ndk   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -88.86   -45.14   .   .   20   .   C   .   21   .   N    .   21   .   CA   .   21   .   C   parsed_2ndk   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -78.72   -48.78   .   .   22   .   C   .   23   .   N    .   23   .   CA   .   23   .   C   parsed_2ndk   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.63   -53.41   .   .   23   .   C   .   24   .   N    .   24   .   CA   .   24   .   C   parsed_2ndk   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.29   -54.51   .   .   24   .   C   .   25   .   N    .   25   .   CA   .   25   .   C   parsed_2ndk   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -86.87   -47.65   .   .   25   .   C   .   26   .   N    .   26   .   CA   .   26   .   C   parsed_2ndk   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -71.51   -50.57   .   .   26   .   C   .   27   .   N    .   27   .   CA   .   27   .   C   parsed_2ndk   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -98.90   -40.02   .   .   27   .   C   .   28   .   N    .   28   .   CA   .   28   .   C   parsed_2ndk   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -102.36   -37.60   .   .   28   .   C   .   29   .   N    .   29   .   CA   .   29   .   C   parsed_2ndk   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -82.36   -47.66   .   .   29   .   C   .   30   .   N    .   30   .   CA   .   30   .   C   parsed_2ndk   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -110.96   -54.48   .   .   30   .   C   .   31   .   N    .   31   .   CA   .   31   .   C   parsed_2ndk   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -173.75   -44.11   .   .   31   .   C   .   32   .   N    .   32   .   CA   .   32   .   C   parsed_2ndk   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -75.13   -43.93   .   .   33   .   C   .   34   .   N    .   34   .   CA   .   34   .   C   parsed_2ndk   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -105.09   -30.81   .   .   34   .   C   .   35   .   N    .   35   .   CA   .   35   .   C   parsed_2ndk   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -73.57   -51.15   .   .   35   .   C   .   36   .   N    .   36   .   CA   .   36   .   C   parsed_2ndk   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -75.72   -47.84   .   .   36   .   C   .   37   .   N    .   37   .   CA   .   37   .   C   parsed_2ndk   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -93.85   -47.35   .   .   37   .   C   .   38   .   N    .   38   .   CA   .   38   .   C   parsed_2ndk   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70.75   -58.33   .   .   38   .   C   .   39   .   N    .   39   .   CA   .   39   .   C   parsed_2ndk   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -78.47   -54.25   .   .   39   .   C   .   40   .   N    .   40   .   CA   .   40   .   C   parsed_2ndk   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -74.79   -49.85   .   .   40   .   C   .   41   .   N    .   41   .   CA   .   41   .   C   parsed_2ndk   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -92.93   -40.11   .   .   41   .   C   .   42   .   N    .   42   .   CA   .   42   .   C   parsed_2ndk   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -79.20   -55.86   .   .   42   .   C   .   43   .   N    .   43   .   CA   .   43   .   C   parsed_2ndk   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.35   -50.45   .   .   43   .   C   .   44   .   N    .   44   .   CA   .   44   .   C   parsed_2ndk   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -84.35   -51.71   .   .   44   .   C   .   45   .   N    .   45   .   CA   .   45   .   C   parsed_2ndk   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -87.20   -55.88   .   .   45   .   C   .   46   .   N    .   46   .   CA   .   46   .   C   parsed_2ndk   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -104.38   -39.48   .   .   46   .   C   .   47   .   N    .   47   .   CA   .   47   .   C   parsed_2ndk   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -65.38   -20.64   .   .    3   .   N   .    3   .   CA   .    3   .   C    .    4   .   N   parsed_2ndk   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -60.36   -12.70   .   .    4   .   N   .    4   .   CA   .    4   .   C    .    5   .   N   parsed_2ndk   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -46.46   -29.72   .   .    5   .   N   .    5   .   CA   .    5   .   C    .    6   .   N   parsed_2ndk   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -74.77    -1.19   .   .    6   .   N   .    6   .   CA   .    6   .   C    .    7   .   N   parsed_2ndk   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -55.59   -25.35   .   .    7   .   N   .    7   .   CA   .    7   .   C    .    8   .   N   parsed_2ndk   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -51.91   -31.45   .   .    8   .   N   .    8   .   CA   .    8   .   C    .    9   .   N   parsed_2ndk   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.84   -18.66   .   .    9   .   N   .    9   .   CA   .    9   .   C    .   10   .   N   parsed_2ndk   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -53.11   -32.71   .   .   10   .   N   .   10   .   CA   .   10   .   C    .   11   .   N   parsed_2ndk   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.41   -29.03   .   .   11   .   N   .   11   .   CA   .   11   .   C    .   12   .   N   parsed_2ndk   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -59.31   -18.73   .   .   12   .   N   .   12   .   CA   .   12   .   C    .   13   .   N   parsed_2ndk   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -57.31   -30.69   .   .   13   .   N   .   13   .   CA   .   13   .   C    .   14   .   N   parsed_2ndk   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.32    -8.48   .   .   14   .   N   .   14   .   CA   .   14   .   C    .   15   .   N   parsed_2ndk   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.45   -18.65   .   .   15   .   N   .   15   .   CA   .   15   .   C    .   16   .   N   parsed_2ndk   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -61.32    -3.60   .   .   16   .   N   .   16   .   CA   .   16   .   C    .   17   .   N   parsed_2ndk   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -64.74   -14.24   .   .   17   .   N   .   17   .   CA   .   17   .   C    .   18   .   N   parsed_2ndk   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -52.90   -25.18   .   .   18   .   N   .   18   .   CA   .   18   .   C    .   19   .   N   parsed_2ndk   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -63.82   -16.24   .   .   19   .   N   .   19   .   CA   .   19   .   C    .   20   .   N   parsed_2ndk   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -57.50   -21.76   .   .   20   .   N   .   20   .   CA   .   20   .   C    .   21   .   N   parsed_2ndk   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -62.02   -11.14   .   .   21   .   N   .   21   .   CA   .   21   .   C    .   22   .   N   parsed_2ndk   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -53.89   -20.91   .   .   23   .   N   .   23   .   CA   .   23   .   C    .   24   .   N   parsed_2ndk   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.79   -26.99   .   .   24   .   N   .   24   .   CA   .   24   .   C    .   25   .   N   parsed_2ndk   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -50.07   -18.39   .   .   25   .   N   .   25   .   CA   .   25   .   C    .   26   .   N   parsed_2ndk   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68.52    -8.66   .   .   26   .   N   .   26   .   CA   .   26   .   C    .   27   .   N   parsed_2ndk   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -57.09   -21.09   .   .   27   .   N   .   27   .   CA   .   27   .   C    .   28   .   N   parsed_2ndk   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -66.29    -9.01   .   .   28   .   N   .   28   .   CA   .   28   .   C    .   29   .   N   parsed_2ndk   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68.40    -0.04   .   .   29   .   N   .   29   .   CA   .   29   .   C    .   30   .   N   parsed_2ndk   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -56.80    -5.74   .   .   30   .   N   .   30   .   CA   .   30   .   C    .   31   .   N   parsed_2ndk   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -28.96     6.66   .   .   31   .   N   .   31   .   CA   .   31   .   C    .   32   .   N   parsed_2ndk   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     79.14   232.56   .   .   32   .   N   .   32   .   CA   .   32   .   C    .   33   .   N   parsed_2ndk   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58.93    -6.39   .   .   34   .   N   .   34   .   CA   .   34   .   C    .   35   .   N   parsed_2ndk   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -78.00     7.70   .   .   35   .   N   .   35   .   CA   .   35   .   C    .   36   .   N   parsed_2ndk   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -56.30   -27.38   .   .   36   .   N   .   36   .   CA   .   36   .   C    .   37   .   N   parsed_2ndk   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -59.65   -23.09   .   .   37   .   N   .   37   .   CA   .   37   .   C    .   38   .   N   parsed_2ndk   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -52.37   -21.93   .   .   38   .   N   .   38   .   CA   .   38   .   C    .   39   .   N   parsed_2ndk   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -50.65   -27.45   .   .   39   .   N   .   39   .   CA   .   39   .   C    .   40   .   N   parsed_2ndk   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -55.55   -29.51   .   .   40   .   N   .   40   .   CA   .   40   .   C    .   41   .   N   parsed_2ndk   1   
        80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -56.32   -16.74   .   .   41   .   N   .   41   .   CA   .   41   .   C    .   42   .   N   parsed_2ndk   1   
        81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -54.79   -24.13   .   .   42   .   N   .   42   .   CA   .   42   .   C    .   43   .   N   parsed_2ndk   1   
        82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -55.68   -29.12   .   .   43   .   N   .   43   .   CA   .   43   .   C    .   44   .   N   parsed_2ndk   1   
        83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -57.38   -17.08   .   .   44   .   N   .   44   .   CA   .   44   .   C    .   45   .   N   parsed_2ndk   1   
        84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -63.06     2.02   .   .   45   .   N   .   45   .   CA   .   45   .   C    .   46   .   N   parsed_2ndk   1   
        85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -61.42     3.08   .   .   46   .   N   .   46   .   CA   .   46   .   C    .   47   .   N   parsed_2ndk   1   
        86   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -60.67   -19.33   .   .   47   .   N   .   47   .   CA   .   47   .   C    .   48   .   N   parsed_2ndk   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   "1. L 3 Phi -56.46 +/- 21.44 (-77.90 to -35.03)"          1   1     1   49   parsed_2ndk   1   
         2   "2. L 4 Phi -60.00 +/- 12.68 (-72.68 to -47.31)"          6   1     6   49   parsed_2ndk   1   
         3   "3. E 5 Phi -66.56 +/- 10.59 (-77.15 to -55.96)"         11   1    11   49   parsed_2ndk   1   
         4   "4. K 6 Phi -65.37 +/- 34.45 (-99.82 to -30.91)"         16   1    16   49   parsed_2ndk   1   
         5   "5. G 7 Phi -66.78 +/- 25.03 (-91.81 to -41.76)"         21   1    21   49   parsed_2ndk   1   
         6   "6. L 8 Phi -64.31 +/- 9.49 (-73.80 to -54.83)"          26   1    26   48   parsed_2ndk   1   
         7   "7. D 9 Phi -62.46 +/- 7.76 (-70.22 to -54.69)"          31   1    31   48   parsed_2ndk   1   
         8   "8. G 10 Phi -63.18 +/- 11.31 (-74.49 to -51.86)"        36   1    36   50   parsed_2ndk   1   
         9   "9. A 11 Phi -62.40 +/- 10.58 (-72.98 to -51.83)"        41   1    41   50   parsed_2ndk   1   
        10   "10. K 12 Phi -61.77 +/- 11.30 (-73.07 to -50.47)"       46   1    46   51   parsed_2ndk   1   
        11   "11. K 13 Phi -73.00 +/- 32.57 (-105.56 to -40.43)"      51   1    51   52   parsed_2ndk   1   
        12   "12. A 14 Phi -62.47 +/- 10.15 (-72.61 to -52.32)"       56   1    56   51   parsed_2ndk   1   
        13   "13. V 15 Phi -67.14 +/- 17.04 (-84.18 to -50.10)"       61   1    61   51   parsed_2ndk   1   
        14   "14. G 16 Phi -64.99 +/- 16.36 (-81.34 to -48.63)"       66   1    66   51   parsed_2ndk   1   
        15   "15. G 17 Phi -62.65 +/- 17.12 (-79.77 to -45.53)"       71   1    71   51   parsed_2ndk   1   
        16   "16. L 18 Phi -67.09 +/- 18.48 (-85.57 to -48.61)"       76   1    76   51   parsed_2ndk   1   
        17   "17. G 19 Phi -63.85 +/- 15.64 (-79.49 to -48.20)"       81   1    81   51   parsed_2ndk   1   
        18   "18. K 20 Phi -65.31 +/- 17.16 (-82.47 to -48.14)"       86   1    86   51   parsed_2ndk   1   
        19   "19. L 21 Phi -67.00 +/- 21.86 (-88.86 to -45.14)"       91   1    91   51   parsed_2ndk   1   
        20   "20. K 23 Phi -63.75 +/- 14.97 (-78.72 to -48.78)"       96   1    96   51   parsed_2ndk   1   
        21   "21. D 24 Phi -62.02 +/- 8.61 (-70.63 to -53.40)"       101   1   101   50   parsed_2ndk   1   
        22   "22. A 25 Phi -65.90 +/- 11.39 (-77.29 to -54.51)"      106   1   106   51   parsed_2ndk   1   
        23   "23. V 26 Phi -67.26 +/- 19.61 (-86.88 to -47.65)"      111   1   111   51   parsed_2ndk   1   
        24   "24. E 27 Phi -61.04 +/- 10.47 (-71.51 to -50.57)"      116   1   116   51   parsed_2ndk   1   
        25   "25. D 28 Phi -69.46 +/- 29.44 (-98.90 to -40.02)"      121   1   121   51   parsed_2ndk   1   
        26   "26. L 29 Phi -69.98 +/- 32.38 (-102.36 to -37.60)"     126   1   126   52   parsed_2ndk   1   
        27   "27. E 30 Phi -65.01 +/- 17.35 (-82.36 to -47.66)"      131   1   131   51   parsed_2ndk   1   
        28   "28. S 31 Phi -82.72 +/- 25.24 (-107.96 to -57.47)"     136   1   136   52   parsed_2ndk   1   
        29   "29. V 32 Phi -108.93 +/- 64.82 (-173.75 to -44.11)"    141   1   141   53   parsed_2ndk   1   
        30   "30. K 34 Phi -59.53 +/- 15.60 (-75.13 to -43.92)"      146   1   146   51   parsed_2ndk   1   
        31   "31. G 35 Phi -67.95 +/- 37.14 (-105.10 to -30.81)"     151   1   151   52   parsed_2ndk   1   
        32   "32. A 36 Phi -62.36 +/- 11.21 (-73.57 to -51.16)"      156   1   156   51   parsed_2ndk   1   
        33   "33. V 37 Phi -61.78 +/- 13.94 (-75.72 to -47.85)"      161   1   161   51   parsed_2ndk   1   
        34   "34. H 38 Phi -70.60 +/- 23.25 (-93.84 to -47.35)"      166   1   166   51   parsed_2ndk   1   
        35   "35. D 39 Phi -64.54 +/- 6.21 (-70.76 to -58.33)"       171   1   171   50   parsed_2ndk   1   
        36   "36. V 40 Phi -66.36 +/- 12.11 (-78.47 to -54.25)"      176   1   176   51   parsed_2ndk   1   
        37   "37. K 41 Phi -62.32 +/- 12.47 (-74.79 to -49.86)"      181   1   181   51   parsed_2ndk   1   
        38   "38. D 42 Phi -66.52 +/- 26.41 (-92.92 to -40.11)"      186   1   186   51   parsed_2ndk   1   
        39   "39. V 43 Phi -67.53 +/- 11.67 (-79.20 to -55.86)"      191   1   191   51   parsed_2ndk   1   
        40   "40. L 44 Phi -63.90 +/- 13.45 (-77.34 to -50.45)"      196   1   196   51   parsed_2ndk   1   
        41   "41. D 45 Phi -68.03 +/- 16.32 (-84.35 to -51.72)"      201   1   201   51   parsed_2ndk   1   
        42   "42. S 46 Phi -71.54 +/- 15.66 (-87.20 to -55.88)"      206   1   206   51   parsed_2ndk   1   
        43   "43. V 47 Phi -71.93 +/- 32.45 (-104.38 to -39.48)"     211   1   211   52   parsed_2ndk   1   
        44   "44. L 3 Psi -43.01 +/- 22.37 (-65.38 to -20.64)"       217   1   217   50   parsed_2ndk   1   
        45   "45. L 4 Psi -36.53 +/- 23.83 (-60.36 to -12.70)"       222   1   222   50   parsed_2ndk   1   
        46   "46. E 5 Psi -38.09 +/- 8.37 (-46.46 to -29.73)"        227   1   227   49   parsed_2ndk   1   
        47   "47. K 6 Psi -37.98 +/- 36.79 (-74.77 to -1.19)"        232   1   232   49   parsed_2ndk   1   
        48   "48. G 7 Psi -40.47 +/- 15.12 (-55.59 to -25.35)"       237   1   237   50   parsed_2ndk   1   
        49   "49. L 8 Psi -41.68 +/- 10.23 (-51.90 to -31.45)"       242   1   242   50   parsed_2ndk   1   
        50   "50. D 9 Psi -38.75 +/- 20.09 (-58.84 to -18.66)"       247   1   247   50   parsed_2ndk   1   
        51   "51. G 10 Psi -42.91 +/- 10.20 (-53.11 to -32.70)"      252   1   252   51   parsed_2ndk   1   
        52   "52. A 11 Psi -43.72 +/- 14.69 (-58.41 to -29.02)"      257   1   257   51   parsed_2ndk   1   
        53   "53. K 12 Psi -39.02 +/- 20.29 (-59.32 to -18.73)"      262   1   262   51   parsed_2ndk   1   
        54   "54. K 13 Psi -44.00 +/- 13.31 (-57.31 to -30.69)"      267   1   267   51   parsed_2ndk   1   
        55   "55. A 14 Psi -33.40 +/- 24.92 (-58.32 to -8.47)"       272   1   272   50   parsed_2ndk   1   
        56   "56. V 15 Psi -38.55 +/- 19.90 (-58.46 to -18.65)"      277   1   277   51   parsed_2ndk   1   
        57   "57. G 16 Psi -32.46 +/- 28.86 (-61.32 to -3.61)"       282   1   282   50   parsed_2ndk   1   
        58   "58. G 17 Psi -39.49 +/- 25.25 (-64.74 to -14.23)"      287   1   287   51   parsed_2ndk   1   
        59   "59. L 18 Psi -39.04 +/- 13.86 (-52.89 to -25.18)"      292   1   292   51   parsed_2ndk   1   
        60   "60. G 19 Psi -40.03 +/- 20.79 (-60.82 to -19.23)"      297   1   297   51   parsed_2ndk   1   
        61   "61. K 20 Psi -39.63 +/- 11.87 (-51.51 to -27.76)"      302   1   302   51   parsed_2ndk   1   
        62   "62. L 21 Psi -36.58 +/- 25.44 (-62.02 to -11.14)"      307   1   307   51   parsed_2ndk   1   
        63   "63. K 23 Psi -37.40 +/- 16.49 (-53.89 to -20.91)"      312   1   312   51   parsed_2ndk   1   
        64   "64. D 24 Psi -42.89 +/- 15.90 (-58.79 to -26.98)"      317   1   317   51   parsed_2ndk   1   
        65   "65. A 25 Psi -34.23 +/- 15.84 (-50.07 to -18.39)"      322   1   322   51   parsed_2ndk   1   
        66   "66. V 26 Psi -38.59 +/- 29.93 (-68.52 to -8.66)"       327   1   327   50   parsed_2ndk   1   
        67   "67. E 27 Psi -39.09 +/- 18.00 (-57.09 to -21.10)"      332   1   332   51   parsed_2ndk   1   
        68   "68. D 28 Psi -37.65 +/- 28.64 (-66.29 to -9.00)"       337   1   337   50   parsed_2ndk   1   
        69   "69. L 29 Psi -34.22 +/- 34.18 (-68.41 to -0.04)"       342   1   342   50   parsed_2ndk   1   
        70   "70. E 30 Psi -31.27 +/- 25.53 (-56.80 to -5.74)"       347   1   347   50   parsed_2ndk   1   
        71   "71. S 31 Psi -11.15 +/- 17.81 (-28.95 to 6.66)"        352   1   352   49   parsed_2ndk   1   
        72   "72. V 32 Psi 155.85 +/- 60.71 (95.14 to 216.56)"       357   1   357   50   parsed_2ndk   1   
        73   "73. K 34 Psi -32.66 +/- 26.27 (-58.93 to -6.38)"       362   1   362   50   parsed_2ndk   1   
        74   "74. G 35 Psi -35.15 +/- 42.85 (-78.01 to 7.70)"        367   1   367   49   parsed_2ndk   1   
        75   "75. A 36 Psi -41.84 +/- 14.46 (-56.30 to -27.38)"      372   1   372   51   parsed_2ndk   1   
        76   "76. V 37 Psi -41.37 +/- 18.28 (-59.65 to -23.10)"      377   1   377   51   parsed_2ndk   1   
        77   "77. H 38 Psi -37.15 +/- 15.22 (-52.37 to -21.93)"      382   1   382   51   parsed_2ndk   1   
        78   "78. D 39 Psi -39.05 +/- 11.60 (-50.65 to -27.45)"      387   1   387   51   parsed_2ndk   1   
        79   "79. V 40 Psi -42.53 +/- 13.02 (-55.55 to -29.51)"      392   1   392   51   parsed_2ndk   1   
        80   "80. K 41 Psi -36.53 +/- 19.79 (-56.32 to -16.74)"      397   1   397   51   parsed_2ndk   1   
        81   "81. D 42 Psi -39.46 +/- 15.33 (-54.79 to -24.13)"      402   1   402   51   parsed_2ndk   1   
        82   "82. V 43 Psi -42.40 +/- 13.28 (-55.68 to -29.12)"      407   1   407   51   parsed_2ndk   1   
        83   "83. L 44 Psi -37.23 +/- 20.15 (-57.38 to -17.08)"      412   1   412   51   parsed_2ndk   1   
        84   "84. D 45 Psi -30.52 +/- 32.54 (-63.06 to 2.02)"        417   1   417   49   parsed_2ndk   1   
        85   "85. S 46 Psi -29.17 +/- 32.25 (-61.43 to 3.08)"        422   1   422   49   parsed_2ndk   1   
        86   "86. V 47 Psi -40.00 +/- 20.67 (-60.68 to -19.33)"      427   1   427   51   parsed_2ndk   1   
    stop_

save_





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