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
616831 5x34 36050 cing 2-parsed STAR dihedral angle 66


data_5x34_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_5x34 
    _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_5x34   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_5x34 
    _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   5x34   "Master copy"    parsed_5x34   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_5x34 
    _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   5x34.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_5x34   1   
        1   5x34.mr   .   .    XPLOR/CNS     2    distance                  NOE                 ambi               1681   parsed_5x34   1   
        1   5x34.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"      66   parsed_5x34   1   
        1   5x34.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_5x34   1   
    stop_

save_


save_CNS/XPLOR_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_5x34 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            3 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -142.1    -58.5   .   .    1   .   C    .    2   .   N    .    2   .   CA    .    2   .   C     parsed_5x34   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    108.1    170.1   .   .    2   .   N    .    2   .   CA   .    2   .   C     .    3   .   N     parsed_5x34   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -94.2    -54.2   .   .    2   .   C    .    3   .   N    .    3   .   CA    .    3   .   C     parsed_5x34   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    114.7    177.1   .   .    3   .   N    .    3   .   CA   .    3   .   C     .    4   .   N     parsed_5x34   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.9     80.9   .   .    4   .   C    .    5   .   N    .    5   .   CA    .    5   .   C     parsed_5x34   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .      9.7     56.3   .   .    5   .   N    .    5   .   CA   .    5   .   C     .    6   .   N     parsed_5x34   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -109.2    -54.6   .   .    9   .   C    .   10   .   N    .   10   .   CA    .   10   .   C     parsed_5x34   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    132.5    201.5   .   .   10   .   N    .   10   .   CA   .   10   .   C     .   11   .   N     parsed_5x34   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.4    -37.4   .   .   10   .   C    .   11   .   N    .   11   .   CA    .   11   .   C     parsed_5x34   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    109.4    149.4   .   .   11   .   N    .   11   .   CA   .   11   .   C     .   12   .   N     parsed_5x34   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     65.3    112.9   .   .   11   .   C    .   12   .   N    .   12   .   CA    .   12   .   C     parsed_5x34   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -29.6     25.4   .   .   12   .   N    .   12   .   CA   .   12   .   C     .   13   .   N     parsed_5x34   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -113.5    -32.1   .   .   12   .   C    .   13   .   N    .   13   .   CA    .   13   .   C     parsed_5x34   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    112.1    152.1   .   .   13   .   N    .   13   .   CA   .   13   .   C     .   14   .   N     parsed_5x34   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -141.1    -88.9   .   .   13   .   C    .   14   .   N    .   14   .   CA    .   14   .   C     parsed_5x34   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -23.2     30.0   .   .   14   .   N    .   14   .   CA   .   14   .   C     .   15   .   N     parsed_5x34   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -119.6    -49.0   .   .   17   .   C    .   18   .   N    .   18   .   CA    .   18   .   C     parsed_5x34   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    110.0    150.0   .   .   18   .   N    .   18   .   CA   .   18   .   C     .   19   .   N     parsed_5x34   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -92.6    -52.6   .   .   18   .   C    .   19   .   N    .   19   .   CA    .   19   .   C     parsed_5x34   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    112.5    168.5   .   .   19   .   N    .   19   .   CA   .   19   .   C     .   20   .   N     parsed_5x34   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -75.1    -35.1   .   .   20   .   C    .   21   .   N    .   21   .   CA    .   21   .   C     parsed_5x34   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    111.4    151.4   .   .   21   .   N    .   21   .   CA   .   21   .   C     .   22   .   N     parsed_5x34   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.5    110.5   .   .   21   .   C    .   22   .   N    .   22   .   CA    .   22   .   C     parsed_5x34   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -26.3     13.7   .   .   22   .   N    .   22   .   CA   .   22   .   C     .   23   .   N     parsed_5x34   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -133.4    -21.6   .   .   22   .   C    .   23   .   N    .   23   .   CA    .   23   .   C     parsed_5x34   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    116.3    176.3   .   .   23   .   N    .   23   .   CA   .   23   .   C     .   24   .   N     parsed_5x34   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -163.7    -94.9   .   .   23   .   C    .   24   .   N    .   24   .   CA    .   24   .   C     parsed_5x34   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    132.8    172.8   .   .   24   .   N    .   24   .   CA   .   24   .   C     .   25   .   N     parsed_5x34   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -112.9    -47.7   .   .   24   .   C    .   25   .   N    .   25   .   CA    .   25   .   C     parsed_5x34   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    107.3    156.3   .   .   25   .   N    .   25   .   CA   .   25   .   C     .   26   .   N     parsed_5x34   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -144.4    -40.2   .   .   25   .   C    .   26   .   N    .   26   .   CA    .   26   .   C     parsed_5x34   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    115.0    159.4   .   .   26   .   N    .   26   .   CA   .   26   .   C     .   27   .   N     parsed_5x34   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -106.2    -47.2   .   .   26   .   C    .   27   .   N    .   27   .   CA    .   27   .   C     parsed_5x34   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     96.4    167.2   .   .   27   .   N    .   27   .   CA   .   27   .   C     .   28   .   N     parsed_5x34   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.5    -40.5   .   .   29   .   C    .   30   .   N    .   30   .   CA    .   30   .   C     parsed_5x34   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -43.9     -3.9   .   .   30   .   N    .   30   .   CA   .   30   .   C     .   31   .   N     parsed_5x34   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -116.4    -76.4   .   .   30   .   C    .   31   .   N    .   31   .   CA    .   31   .   C     parsed_5x34   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -22.4     17.6   .   .   31   .   N    .   31   .   CA   .   31   .   C     .   32   .   N     parsed_5x34   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -101.5    -41.7   .   .   31   .   C    .   32   .   N    .   32   .   CA    .   32   .   C     parsed_5x34   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    114.9    154.9   .   .   32   .   N    .   32   .   CA   .   32   .   C     .   33   .   N     parsed_5x34   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -142.2    -88.6   .   .   32   .   C    .   33   .   N    .   33   .   CA    .   33   .   C     parsed_5x34   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    111.3    157.1   .   .   33   .   N    .   33   .   CA   .   33   .   C     .   34   .   N     parsed_5x34   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -152.6   -112.4   .   .   33   .   C    .   34   .   N    .   34   .   CA    .   34   .   C     parsed_5x34   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    116.8    168.0   .   .   34   .   N    .   34   .   CA   .   34   .   C     .   35   .   N     parsed_5x34   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -114.3    -64.9   .   .   34   .   C    .   35   .   N    .   35   .   CA    .   35   .   C     parsed_5x34   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    106.9    153.9   .   .   35   .   N    .   35   .   CA   .   35   .   C     .   36   .   N     parsed_5x34   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .    4   .   N    .    4   .   CA   .    4   .   CB    .    4   .   CG    parsed_5x34   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .    5   .   N    .    5   .   CA   .    5   .   CB    .    5   .   CG    parsed_5x34   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .    7   .   N    .    7   .   CA   .    7   .   CB    .    7   .   CG    parsed_5x34   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .    8   .   N    .    8   .   CA   .    8   .   CB    .    8   .   SG    parsed_5x34   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   11   .   N    .   11   .   CA   .   11   .   CB    .   11   .   CG1   parsed_5x34   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   11   .   CA   .   11   .   CB   .   11   .   CG1   .   11   .   CD1   parsed_5x34   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   13   .   N    .   13   .   CA   .   13   .   CB    .   13   .   CG    parsed_5x34   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   14   .   N    .   14   .   CA   .   14   .   CB    .   14   .   OG    parsed_5x34   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   18   .   N    .   18   .   CA   .   18   .   CB    .   18   .   CG1   parsed_5x34   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   19   .   N    .   19   .   CA   .   19   .   CB    .   19   .   SG    parsed_5x34   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   23   .   N    .   23   .   CA   .   23   .   CB    .   23   .   OG1   parsed_5x34   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   24   .   N    .   24   .   CA   .   24   .   CB    .   24   .   OG1   parsed_5x34   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   25   .   N    .   25   .   CA   .   25   .   CB    .   25   .   SG    parsed_5x34   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   26   .   N    .   26   .   CA   .   26   .   CB    .   26   .   CG    parsed_5x34   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   27   .   N    .   27   .   CA   .   27   .   CB    .   27   .   CG1   parsed_5x34   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   28   .   CA   .   28   .   CB   .   28   .   CG    .   28   .   CD1   parsed_5x34   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   31   .   N    .   31   .   CA   .   31   .   CB    .   31   .   CG    parsed_5x34   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   32   .   N    .   32   .   CA   .   32   .   CB    .   32   .   CG    parsed_5x34   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   33   .   N    .   33   .   CA   .   33   .   CB    .   33   .   OG    parsed_5x34   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   35   .   N    .   35   .   CA   .   35   .   CB    .   35   .   SG    parsed_5x34   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   "2 Q -100.285  139.138   20.890   15.521    1.173 0.702 25 13 Strong"         2   1     2   73   parsed_5x34   1   
         2   "3 S  -74.205  145.919    9.812   15.581    1.025 0.738 25 15 Strong"         8   1     8   73   parsed_5x34   1   
         3   "5 Y   60.917   33.012    7.328   11.639    1.552 0.756 25 14 Strong"        14   1    14   73   parsed_5x34   1   
         4   
;
7 Q  -72.604  -20.631   11.928   15.896    2.710 0.789 10 14 Generous
assign (resid    6 and name C    ) (resid    7 and name N    )
(resid    7 and name CA   ) (resid    7 and name C    )    1.0  -72.6   35.8 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
(resid    7 and name C    ) (resid    8 and name N    )    1.0  -20.6   47.7 2
8 c -107.479  145.655   32.136    9.630    0.000 0.832 10 14 Generous
assign (resid    7 and name C    ) (resid    8 and name N    )
(resid    8 and name CA   ) (resid    8 and name C    )    1.0 -107.5   96.4 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
(resid    8 and name C    ) (resid    9 and name N    )    1.0  145.7   30.0 2
10 G  -81.857  166.995   13.630   17.261    1.386 0.802 25 13 Strong
;
    20   1    32   73   parsed_5x34   1   
         5   "11 I  -57.429  129.360    6.435    4.884    0.878 0.769 25 13 Strong"       38   1    38   73   parsed_5x34   1   
         6   "12 G   89.091   -2.116   11.902   13.746    0.517 0.737 25 14 Strong"       44   1    44   73   parsed_5x34   1   
         7   "13 Y  -72.809  132.143   20.359    7.770    0.859 0.714 25 14 Strong"       50   1    50   73   parsed_5x34   1   
         8   "14 S -115.015    3.439   13.059   13.304    1.041 0.712 25 14 Strong"       56   1    56   73   parsed_5x34   1   
         9   "18 V  -84.293  130.044   17.674    6.960    0.944 0.712 25 15 Strong"       62   1    62   73   parsed_5x34   1   
        10   "19 c  -72.597  140.452    6.830   13.987    0.604 0.803 25 15 Strong"       68   1    68   73   parsed_5x34   1   
        11   "21 S  -55.087  131.383    2.453    4.943    0.270 0.761 25 14 Strong"       74   1    74   73   parsed_5x34   1   
        12   "22 G   90.474   -6.333    7.505    9.309    0.261 0.742 25 14 Strong"       80   1    80   73   parsed_5x34   1   
        13   "23 T  -77.518  146.265   18.636    7.718    0.422 0.769 10 14 Generous"     86   1    86   75   parsed_5x34   1   
        14   "24 T -129.303  152.796   17.206    5.462    0.481 0.793 25 15 Strong"       92   1    92   73   parsed_5x34   1   
        15   "25 c  -80.273  131.804   16.310   12.273    1.007 0.808 25 15 Strong"       98   1    98   73   parsed_5x34   1   
        16   "26 Q  -92.297  137.154   26.045   11.123    0.625 0.805 25 15 Strong"      104   1   104   73   parsed_5x34   1   
        17   "27 V  -76.701  131.789   14.768   17.706    0.528 0.800 25 15 Strong"      110   1   110   73   parsed_5x34   1   
        18   "30 P  -60.546  -23.938    5.187    8.534    0.764 0.803 25 13 Strong"      116   1   116   73   parsed_5x34   1   
        19   "31 Y  -96.365   -2.392    8.304    8.383    0.667 0.817 25 13 Strong"      122   1   122   73   parsed_5x34   1   
        20   "32 Y  -71.591  134.929   14.966    7.493    0.821 0.847 25 15 Strong"      128   1   128   73   parsed_5x34   1   
        21   "33 S -115.438  134.163   13.377   11.426    0.855 0.877 25 15 Strong"      134   1   134   73   parsed_5x34   1   
        22   "34 Q -132.486  142.425   10.062   12.817    0.963 0.885 25 15 Strong"      140   1   140   73   parsed_5x34   1   
        23   "35 c  -89.628  130.415   12.373   11.727    1.296 0.881 25 15 Strong"      146   1   146   73   parsed_5x34   1   
        24   "4 H Chi1 t  180+-30deg"                                                    152   1   152   28   parsed_5x34   1   
        25   "5 Y Chi1 g- -60+-30deg"                                                    155   1   155   28   parsed_5x34   1   
        26   "7 Q Chi1 t  180+-30deg"                                                    158   1   158   28   parsed_5x34   1   
        27   "8 c Chi1 g+   60+-30deg"                                                   161   1   161   29   parsed_5x34   1   
        28   "11 I Chi1 g- -60+-30deg"                                                   164   1   164   28   parsed_5x34   1   
        29   "11 I Chi2 t  180+-30deg"                                                   167   1   167   28   parsed_5x34   1   
        30   "13 Y Chi1 t  180+-30deg"                                                   170   1   170   28   parsed_5x34   1   
        31   "14 S Chi1 g+  60+-30deg"                                                   173   1   173   28   parsed_5x34   1   
        32   "18 V Chi1 t  180+-30deg"                                                   176   1   176   28   parsed_5x34   1   
        33   "19 c Chi1 g- -60+-30deg"                                                   179   1   179   28   parsed_5x34   1   
        34   "23 T Chi1 g+  60+-30deg"                                                   182   1   182   28   parsed_5x34   1   
        35   "24 T Chi1 g+  60+-30deg"                                                   185   1   185   28   parsed_5x34   1   
        36   "25 c Chi1 t  180+-30deg"                                                   188   1   188   28   parsed_5x34   1   
        37   "26 Q Chi1 g- -60+-30deg"                                                   191   1   191   28   parsed_5x34   1   
        38   "27 V Chi1 t  180+-30deg"                                                   194   1   194   28   parsed_5x34   1   
        39   "28 L Chi2 t  180+-30deg"                                                   197   1   197   28   parsed_5x34   1   
        40   "31 Y Chi1 g- -60+-30deg"                                                   200   1   200   28   parsed_5x34   1   
        41   "32 Y Chi1 t  180+-30deg"                                                   203   1   203   28   parsed_5x34   1   
        42   "33 S Chi1 g- -60+-30deg"                                                   206   1   206   28   parsed_5x34   1   
        43   "35 c Chi1 g- -60+-30deg"                                                   209   1   209   28   parsed_5x34   1   
    stop_


    loop_
        _TA_constraint_parse_err.ID 
        _TA_constraint_parse_err.Content 
        _TA_constraint_parse_err.Begin_line 
        _TA_constraint_parse_err.Begin_column 
        _TA_constraint_parse_err.End_line 
        _TA_constraint_parse_err.End_column 
        _TA_constraint_parse_err.Entry_ID 
        _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 

        1   "# Restraints file 2: talos.tbl"    1   1   1   30   parsed_5x34   1   
    stop_

save_





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