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
616855 5x37 36053 cing 2-parsed STAR dihedral angle 64


data_5x37_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_5x37 
    _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_5x37   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_5x37 
    _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   5x37   "Master copy"    parsed_5x37   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_5x37 
    _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   5x37.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_5x37   1   
        1   5x37.mr   .   .    XPLOR/CNS     2    distance                  NOE                 ambi               1531   parsed_5x37   1   
        1   5x37.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"      64   parsed_5x37   1   
        1   5x37.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_5x37   1   
    stop_

save_


save_CNS/XPLOR_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_5x37 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -144.2    -67.0   .   .    1   .   C    .    2   .   N    .    2   .   CA    .    2   .   C     parsed_5x37   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    108.6    170.6   .   .    2   .   N    .    2   .   CA   .    2   .   C     .    3   .   N     parsed_5x37   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -93.8    -53.8   .   .    2   .   C    .    3   .   N    .    3   .   CA    .    3   .   C     parsed_5x37   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    113.0    176.2   .   .    3   .   N    .    3   .   CA   .    3   .   C     .    4   .   N     parsed_5x37   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     40.5     80.5   .   .    4   .   C    .    5   .   N    .    5   .   CA    .    5   .   C     parsed_5x37   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .      7.8     58.4   .   .    5   .   N    .    5   .   CA   .    5   .   C     .    6   .   N     parsed_5x37   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -109.9    -55.3   .   .    9   .   C    .   10   .   N    .   10   .   CA    .   10   .   C     parsed_5x37   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    132.0    207.0   .   .   10   .   N    .   10   .   CA   .   10   .   C     .   11   .   N     parsed_5x37   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -78.7    -38.7   .   .   10   .   C    .   11   .   N    .   11   .   CA    .   11   .   C     parsed_5x37   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    113.6    153.6   .   .   11   .   N    .   11   .   CA   .   11   .   C     .   12   .   N     parsed_5x37   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     68.7    110.9   .   .   11   .   C    .   12   .   N    .   12   .   CA    .   12   .   C     parsed_5x37   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -26.2     22.0   .   .   12   .   N    .   12   .   CA   .   12   .   C     .   13   .   N     parsed_5x37   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -127.0    -43.0   .   .   12   .   C    .   13   .   N    .   13   .   CA    .   13   .   C     parsed_5x37   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    115.6    161.8   .   .   13   .   N    .   13   .   CA   .   13   .   C     .   14   .   N     parsed_5x37   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -138.1    -60.5   .   .   16   .   C    .   17   .   N    .   17   .   CA    .   17   .   C     parsed_5x37   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -31.5     32.3   .   .   17   .   N    .   17   .   CA   .   17   .   C     .   18   .   N     parsed_5x37   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -109.7    -56.1   .   .   17   .   C    .   18   .   N    .   18   .   CA    .   18   .   C     parsed_5x37   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    110.2    150.2   .   .   18   .   N    .   18   .   CA   .   18   .   C     .   19   .   N     parsed_5x37   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -89.8    -49.8   .   .   18   .   C    .   19   .   N    .   19   .   CA    .   19   .   C     parsed_5x37   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    112.6    167.2   .   .   19   .   N    .   19   .   CA   .   19   .   C     .   20   .   N     parsed_5x37   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -77.5    -37.5   .   .   20   .   C    .   21   .   N    .   21   .   CA    .   21   .   C     parsed_5x37   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    112.6    152.6   .   .   21   .   N    .   21   .   CA   .   21   .   C     .   22   .   N     parsed_5x37   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     70.1    110.1   .   .   21   .   C    .   22   .   N    .   22   .   CA    .   22   .   C     parsed_5x37   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -19.9     20.1   .   .   22   .   N    .   22   .   CA   .   22   .   C     .   23   .   N     parsed_5x37   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150.3   -110.3   .   .   22   .   C    .   23   .   N    .   23   .   CA    .   23   .   C     parsed_5x37   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    136.9    176.9   .   .   23   .   N    .   23   .   CA   .   23   .   C     .   24   .   N     parsed_5x37   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -157.4   -100.4   .   .   23   .   C    .   24   .   N    .   24   .   CA    .   24   .   C     parsed_5x37   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    127.9    168.1   .   .   24   .   N    .   24   .   CA   .   24   .   C     .   25   .   N     parsed_5x37   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -91.1    -51.1   .   .   24   .   C    .   25   .   N    .   25   .   CA    .   25   .   C     parsed_5x37   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     98.2    164.4   .   .   25   .   N    .   25   .   CA   .   25   .   C     .   26   .   N     parsed_5x37   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -130.3    -51.1   .   .   25   .   C    .   26   .   N    .   26   .   CA    .   26   .   C     parsed_5x37   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    110.2    162.8   .   .   26   .   N    .   26   .   CA   .   26   .   C     .   27   .   N     parsed_5x37   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -105.0    -49.2   .   .   26   .   C    .   27   .   N    .   27   .   CA    .   27   .   C     parsed_5x37   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     94.3    167.1   .   .   27   .   N    .   27   .   CA   .   27   .   C     .   28   .   N     parsed_5x37   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -80.9    -40.9   .   .   29   .   C    .   30   .   N    .   30   .   CA    .   30   .   C     parsed_5x37   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -43.2     -3.2   .   .   30   .   N    .   30   .   CA   .   30   .   C     .   31   .   N     parsed_5x37   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -116.7    -76.7   .   .   30   .   C    .   31   .   N    .   31   .   CA    .   31   .   C     parsed_5x37   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -23.4     16.6   .   .   31   .   N    .   31   .   CA   .   31   .   C     .   32   .   N     parsed_5x37   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.7    -48.1   .   .   31   .   C    .   32   .   N    .   32   .   CA    .   32   .   C     parsed_5x37   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    116.0    156.0   .   .   32   .   N    .   32   .   CA   .   32   .   C     .   33   .   N     parsed_5x37   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -143.9    -88.3   .   .   32   .   C    .   33   .   N    .   33   .   CA    .   33   .   C     parsed_5x37   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    112.0    157.0   .   .   33   .   N    .   33   .   CA   .   33   .   C     .   34   .   N     parsed_5x37   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -153.5   -113.5   .   .   33   .   C    .   34   .   N    .   34   .   CA    .   34   .   C     parsed_5x37   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    117.8    167.2   .   .   34   .   N    .   34   .   CA   .   34   .   C     .   35   .   N     parsed_5x37   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -105.4    -61.0   .   .   34   .   C    .   35   .   N    .   35   .   CA    .   35   .   C     parsed_5x37   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    104.3    155.9   .   .   35   .   N    .   35   .   CA   .   35   .   C     .   36   .   N     parsed_5x37   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .    4   .   N    .    4   .   CA   .    4   .   CB    .    4   .   CG    parsed_5x37   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .    7   .   N    .    7   .   CA   .    7   .   CB    .    7   .   CG    parsed_5x37   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .    8   .   N    .    8   .   CA   .    8   .   CB    .    8   .   SG    parsed_5x37   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   11   .   N    .   11   .   CA   .   11   .   CB    .   11   .   CG1   parsed_5x37   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   11   .   CA   .   11   .   CB   .   11   .   CG1   .   11   .   CD1   parsed_5x37   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   13   .   N    .   13   .   CA   .   13   .   CB    .   13   .   CG    parsed_5x37   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   17   .   N    .   17   .   CA   .   17   .   CB    .   17   .   OG1   parsed_5x37   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   18   .   N    .   18   .   CA   .   18   .   CB    .   18   .   CG1   parsed_5x37   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   19   .   N    .   19   .   CA   .   19   .   CB    .   19   .   SG    parsed_5x37   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   23   .   N    .   23   .   CA   .   23   .   CB    .   23   .   OG1   parsed_5x37   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     30.0     90.0   .   .   24   .   N    .   24   .   CA   .   24   .   CB    .   24   .   OG1   parsed_5x37   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   25   .   N    .   25   .   CA   .   25   .   CB    .   25   .   SG    parsed_5x37   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   26   .   N    .   26   .   CA   .   26   .   CB    .   26   .   CG    parsed_5x37   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   27   .   N    .   27   .   CA   .   27   .   CB    .   27   .   CG1   parsed_5x37   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   31   .   N    .   31   .   CA   .   31   .   CB    .   31   .   CG    parsed_5x37   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    150.0    210.0   .   .   32   .   N    .   32   .   CA   .   32   .   CB    .   32   .   CG    parsed_5x37   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   33   .   N    .   33   .   CA   .   33   .   CB    .   33   .   OG    parsed_5x37   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -30.0   .   .   35   .   N    .   35   .   CA   .   35   .   CB    .   35   .   SG    parsed_5x37   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 -105.598  139.601   19.296   15.516    1.122 0.723 25 13 Strong"       2   1     2   73   parsed_5x37   1   
         2   "3 S  -73.808  144.631    9.920   15.809    1.005 0.758 25 15 Strong"       8   1     8   73   parsed_5x37   1   
         3   "5 Y   60.538   33.117    6.924   12.633    1.712 0.773 25 14 Strong"      14   1    14   73   parsed_5x37   1   
         4   "10 G  -82.609  169.468   13.668   18.730    1.176 0.807 25 13 Strong"     20   1    20   73   parsed_5x37   1   
         5   "11 I  -58.664  133.557    7.112    7.214    0.542 0.772 25 13 Strong"     26   1    26   73   parsed_5x37   1   
         6   "12 G   89.754   -2.060   10.532   12.051    0.548 0.774 25 14 Strong"     32   1    32   73   parsed_5x37   1   
         7   "13 Y  -85.001  138.687   20.988   11.550    0.826 0.775 25 14 Strong"     38   1    38   73   parsed_5x37   1   
         8   
;
14 S -134.473  162.589   14.923    9.128    1.154 0.797 25 14 Strong
assign (resid   13 and name C    ) (resid   14 and name N    )
(resid   14 and name CA   ) (resid   14 and name C    )    1.0 -134.5   29.8 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
(resid   14 and name C    ) (resid   15 and name N    )    1.0  162.6   20.0 2
17 T  -99.294    0.368   12.924   10.628    0.981 0.661 10 13 Generous
;
    44   1    50   75   parsed_5x37   1   
         9   "18 V  -82.940  130.194   13.415    7.733    0.651 0.699 25 15 Strong"     56   1    56   73   parsed_5x37   1   
        10   "19 c  -69.803  139.943    8.596   13.641    0.655 0.803 25 15 Strong"     62   1    62   73   parsed_5x37   1   
        11   "21 S  -57.547  132.586    5.735    6.671    0.278 0.769 25 14 Strong"     68   1    68   73   parsed_5x37   1   
        12   "22 G   90.067    0.055    7.438    7.926    0.234 0.757 25 14 Strong"     74   1    74   73   parsed_5x37   1   
        13   "23 T -130.258  156.878    9.171    9.391    0.368 0.792 25 14 Strong"     80   1    80   73   parsed_5x37   1   
        14   "24 T -128.884  147.959   14.248   10.069    0.405 0.808 25 15 Strong"     86   1    86   73   parsed_5x37   1   
        15   "25 c  -71.110  131.342    7.699   16.550    0.544 0.814 25 15 Strong"     92   1    92   73   parsed_5x37   1   
        16   "26 Q  -90.683  136.467   19.801   13.140    0.552 0.805 25 15 Strong"     98   1    98   73   parsed_5x37   1   
        17   "27 V  -77.077  130.696   13.968   18.216    0.520 0.800 25 15 Strong"    104   1   104   73   parsed_5x37   1   
        18   "30 P  -60.892  -23.154    5.066    8.398    0.765 0.804 25 13 Strong"    110   1   110   73   parsed_5x37   1   
        19   "31 Y  -96.710   -3.404    8.638    9.747    0.666 0.818 25 13 Strong"    116   1   116   73   parsed_5x37   1   
        20   "32 Y  -69.415  135.981   10.674    6.939    0.858 0.848 25 15 Strong"    122   1   122   73   parsed_5x37   1   
        21   "33 S -116.055  134.452   13.902   11.250    0.908 0.877 25 15 Strong"    128   1   128   73   parsed_5x37   1   
        22   "34 Q -133.546  142.472    9.996   12.340    1.044 0.886 25 15 Strong"    134   1   134   73   parsed_5x37   1   
        23   "35 c  -83.187  130.087   11.097   12.906    1.447 0.883 25 15 Strong"    140   1   140   73   parsed_5x37   1   
        24   "4 H Chi1 t  180+-30deg"                                                  147   1   147   28   parsed_5x37   1   
        25   "7 Q Chi1 t  180+-30deg"                                                  150   1   150   28   parsed_5x37   1   
        26   "8 c Chi1 g+   60+-30deg"                                                 153   1   153   29   parsed_5x37   1   
        27   "11 I Chi1 g- -60+-30deg"                                                 156   1   156   28   parsed_5x37   1   
        28   "11 I Chi2 t  180+-30deg"                                                 159   1   159   28   parsed_5x37   1   
        29   "13 Y Chi1 t  180+-30deg"                                                 162   1   162   28   parsed_5x37   1   
        30   "17 T Chi1 g+  60+-30deg"                                                 165   1   165   28   parsed_5x37   1   
        31   "18 V Chi1 t  180+-30deg"                                                 168   1   168   28   parsed_5x37   1   
        32   "19 c Chi1 g- -60+-30deg"                                                 171   1   171   28   parsed_5x37   1   
        33   "23 T Chi1 g+  60+-30deg"                                                 174   1   174   28   parsed_5x37   1   
        34   "24 T Chi1 g+  60+-30deg"                                                 177   1   177   28   parsed_5x37   1   
        35   "25 c Chi1 t  180+-30deg"                                                 180   1   180   28   parsed_5x37   1   
        36   "26 Q Chi1 g- -60+-30deg"                                                 183   1   183   28   parsed_5x37   1   
        37   "27 V Chi1 t  180+-30deg"                                                 186   1   186   28   parsed_5x37   1   
        38   "31 Y Chi1 g- -60+-30deg"                                                 189   1   189   28   parsed_5x37   1   
        39   "32 Y Chi1 t  180+-30deg"                                                 192   1   192   28   parsed_5x37   1   
        40   "33 S Chi1 g- -60+-30deg"                                                 195   1   195   28   parsed_5x37   1   
        41   "35 c Chi1 g- -60+-30deg"                                                 198   1   198   28   parsed_5x37   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_5x37   1   
    stop_

save_





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