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
540612 2lcw 17635 cing 2-parsed STAR dihedral angle 94


data_2lcw_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2lcw 
    _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_2lcw   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2lcw 
    _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   2lcw   "Master copy"    parsed_2lcw   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2lcw 
    _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   2lcw.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2lcw   1   
        1   2lcw.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1658   parsed_2lcw   1   
        1   2lcw.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               18   parsed_2lcw   1   
        1   2lcw.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"      94   parsed_2lcw   1   
        1   2lcw.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2lcw   1   
    stop_

save_


save_CNS/XPLOR_dihedral_4
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_2lcw 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            4 
    _Torsion_angle_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Torsion_angle_constraint.ID 
        _Torsion_angle_constraint.Torsion_angle_name 
        _Torsion_angle_constraint.Assembly_atom_ID_1 
        _Torsion_angle_constraint.Entity_assembly_ID_1 
        _Torsion_angle_constraint.Entity_ID_1 
        _Torsion_angle_constraint.Comp_index_ID_1 
        _Torsion_angle_constraint.Seq_ID_1 
        _Torsion_angle_constraint.Comp_ID_1 
        _Torsion_angle_constraint.Atom_ID_1 
        _Torsion_angle_constraint.Resonance_ID_1 
        _Torsion_angle_constraint.Assembly_atom_ID_2 
        _Torsion_angle_constraint.Entity_assembly_ID_2 
        _Torsion_angle_constraint.Entity_ID_2 
        _Torsion_angle_constraint.Comp_index_ID_2 
        _Torsion_angle_constraint.Seq_ID_2 
        _Torsion_angle_constraint.Comp_ID_2 
        _Torsion_angle_constraint.Atom_ID_2 
        _Torsion_angle_constraint.Resonance_ID_2 
        _Torsion_angle_constraint.Assembly_atom_ID_3 
        _Torsion_angle_constraint.Entity_assembly_ID_3 
        _Torsion_angle_constraint.Entity_ID_3 
        _Torsion_angle_constraint.Comp_index_ID_3 
        _Torsion_angle_constraint.Seq_ID_3 
        _Torsion_angle_constraint.Comp_ID_3 
        _Torsion_angle_constraint.Atom_ID_3 
        _Torsion_angle_constraint.Resonance_ID_3 
        _Torsion_angle_constraint.Assembly_atom_ID_4 
        _Torsion_angle_constraint.Entity_assembly_ID_4 
        _Torsion_angle_constraint.Entity_ID_4 
        _Torsion_angle_constraint.Comp_index_ID_4 
        _Torsion_angle_constraint.Seq_ID_4 
        _Torsion_angle_constraint.Comp_ID_4 
        _Torsion_angle_constraint.Atom_ID_4 
        _Torsion_angle_constraint.Resonance_ID_4 
        _Torsion_angle_constraint.Angle_lower_bound_val 
        _Torsion_angle_constraint.Angle_upper_bound_val 
        _Torsion_angle_constraint.Source_experiment_ID 
        _Torsion_angle_constraint.Auth_asym_ID_1 
        _Torsion_angle_constraint.Auth_seq_ID_1 
        _Torsion_angle_constraint.Auth_comp_ID_1 
        _Torsion_angle_constraint.Auth_atom_ID_1 
        _Torsion_angle_constraint.Auth_asym_ID_2 
        _Torsion_angle_constraint.Auth_seq_ID_2 
        _Torsion_angle_constraint.Auth_comp_ID_2 
        _Torsion_angle_constraint.Auth_atom_ID_2 
        _Torsion_angle_constraint.Auth_asym_ID_3 
        _Torsion_angle_constraint.Auth_seq_ID_3 
        _Torsion_angle_constraint.Auth_comp_ID_3 
        _Torsion_angle_constraint.Auth_atom_ID_3 
        _Torsion_angle_constraint.Auth_asym_ID_4 
        _Torsion_angle_constraint.Auth_seq_ID_4 
        _Torsion_angle_constraint.Auth_comp_ID_4 
        _Torsion_angle_constraint.Auth_atom_ID_4 
        _Torsion_angle_constraint.Entry_ID 
        _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 

         1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -105    -37   .   .     4   .   C   .     5   .   N    .     5   .   CA   .     5   .   C   parsed_2lcw   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -143    -55   .   .     5   .   C   .     6   .   N    .     6   .   CA   .     6   .   C   parsed_2lcw   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -159    -87   .   .     9   .   C   .    10   .   N    .    10   .   CA   .    10   .   C   parsed_2lcw   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    -86   .   .    10   .   C   .    11   .   N    .    11   .   CA   .    11   .   C   parsed_2lcw   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -145    -79   .   .    11   .   C   .    12   .   N    .    12   .   CA   .    12   .   C   parsed_2lcw   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -151   -109   .   .    12   .   C   .    13   .   N    .    13   .   CA   .    13   .   C   parsed_2lcw   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -164    -76   .   .    19   .   C   .    20   .   N    .    20   .   CA   .    20   .   C   parsed_2lcw   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -71    -47   .   .    20   .   C   .    21   .   N    .    21   .   CA   .    21   .   C   parsed_2lcw   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -66    -52   .   .    21   .   C   .    22   .   N    .    22   .   CA   .    22   .   C   parsed_2lcw   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -74    -56   .   .    22   .   C   .    23   .   N    .    23   .   CA   .    23   .   C   parsed_2lcw   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68    -50   .   .    24   .   C   .    25   .   N    .    25   .   CA   .    25   .   C   parsed_2lcw   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -74    -50   .   .    25   .   C   .    26   .   N    .    26   .   CA   .    26   .   C   parsed_2lcw   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -109    -37   .   .    26   .   C   .    27   .   N    .    27   .   CA   .    27   .   C   parsed_2lcw   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -120    -52   .   .    32   .   C   .    33   .   N    .    33   .   CA   .    33   .   C   parsed_2lcw   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -126    -72   .   .    33   .   C   .    34   .   N    .    34   .   CA   .    34   .   C   parsed_2lcw   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -131    -49   .   .    34   .   C   .    35   .   N    .    35   .   CA   .    35   .   C   parsed_2lcw   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -148    -52   .   .    35   .   C   .    36   .   N    .    36   .   CA   .    36   .   C   parsed_2lcw   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -124    -52   .   .    41   .   C   .    42   .   N    .    42   .   CA   .    42   .   C   parsed_2lcw   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -147    -45   .   .    42   .   C   .    43   .   N    .    43   .   CA   .    43   .   C   parsed_2lcw   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -123    -55   .   .    43   .   C   .    44   .   N    .    44   .   CA   .    44   .   C   parsed_2lcw   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -143    -89   .   .    44   .   C   .    45   .   N    .    45   .   CA   .    45   .   C   parsed_2lcw   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -136    -66   .   .    45   .   C   .    46   .   N    .    46   .   CA   .    46   .   C   parsed_2lcw   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -156    -40   .   .    47   .   C   .    48   .   N    .    48   .   CA   .    48   .   C   parsed_2lcw   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -147    -77   .   .    48   .   C   .    49   .   N    .    49   .   CA   .    49   .   C   parsed_2lcw   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -172    -62   .   .    49   .   C   .    50   .   N    .    50   .   CA   .    50   .   C   parsed_2lcw   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160   -118   .   .    58   .   C   .    59   .   N    .    59   .   CA   .    59   .   C   parsed_2lcw   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -165   -127   .   .    59   .   C   .    60   .   N    .    60   .   CA   .    60   .   C   parsed_2lcw   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -150    -86   .   .    60   .   C   .    61   .   N    .    61   .   CA   .    61   .   C   parsed_2lcw   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -167    -65   .   .    61   .   C   .    62   .   N    .    62   .   CA   .    62   .   C   parsed_2lcw   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -139    -63   .   .    62   .   C   .    63   .   N    .    63   .   CA   .    63   .   C   parsed_2lcw   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -75    -53   .   .    67   .   C   .    68   .   N    .    68   .   CA   .    68   .   C   parsed_2lcw   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -79    -55   .   .    68   .   C   .    69   .   N    .    69   .   CA   .    69   .   C   parsed_2lcw   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -82    -42   .   .    69   .   C   .    70   .   N    .    70   .   CA   .    70   .   C   parsed_2lcw   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -99    -33   .   .    70   .   C   .    71   .   N    .    71   .   CA   .    71   .   C   parsed_2lcw   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -91    -45   .   .    71   .   C   .    72   .   N    .    72   .   CA   .    72   .   C   parsed_2lcw   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68    -56   .   .    72   .   C   .    73   .   N    .    73   .   CA   .    73   .   C   parsed_2lcw   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -75    -53   .   .    73   .   C   .    74   .   N    .    74   .   CA   .    74   .   C   parsed_2lcw   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90    -38   .   .    74   .   C   .    75   .   N    .    75   .   CA   .    75   .   C   parsed_2lcw   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -107    -53   .   .    75   .   C   .    76   .   N    .    76   .   CA   .    76   .   C   parsed_2lcw   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -172   -114   .   .    80   .   C   .    81   .   N    .    81   .   CA   .    81   .   C   parsed_2lcw   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -149    -77   .   .    81   .   C   .    82   .   N    .    82   .   CA   .    82   .   C   parsed_2lcw   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -129    -45   .   .    84   .   C   .    85   .   N    .    85   .   CA   .    85   .   C   parsed_2lcw   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -172    -76   .   .    86   .   C   .    87   .   N    .    87   .   CA   .    87   .   C   parsed_2lcw   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -148   -110   .   .    87   .   C   .    88   .   N    .    88   .   CA   .    88   .   C   parsed_2lcw   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -139    -85   .   .    88   .   C   .    89   .   N    .    89   .   CA   .    89   .   C   parsed_2lcw   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -140    -46   .   .    89   .   C   .    90   .   N    .    90   .   CA   .    90   .   C   parsed_2lcw   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -140    -24   .   .   105   .   C   .   106   .   N    .   106   .   CA   .   106   .   C   parsed_2lcw   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70     24   .   .     5   .   N   .     5   .   CA   .     5   .   C    .     6   .   N   parsed_2lcw   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -35     31   .   .     6   .   N   .     6   .   CA   .     6   .   C    .     7   .   N   parsed_2lcw   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    125    173   .   .    10   .   N   .    10   .   CA   .    10   .   C    .    11   .   N   parsed_2lcw   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    101    147   .   .    11   .   N   .    11   .   CA   .    11   .   C    .    12   .   N   parsed_2lcw   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    115    165   .   .    12   .   N   .    12   .   CA   .    12   .   C    .    13   .   N   parsed_2lcw   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    131    177   .   .    13   .   N   .    13   .   CA   .    13   .   C    .    14   .   N   parsed_2lcw   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    147    179   .   .    20   .   N   .    20   .   CA   .    20   .   C    .    21   .   N   parsed_2lcw   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -48    -30   .   .    21   .   N   .    21   .   CA   .    21   .   C    .    22   .   N   parsed_2lcw   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -43    -31   .   .    22   .   N   .    22   .   CA   .    22   .   C    .    23   .   N   parsed_2lcw   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -49    -29   .   .    23   .   N   .    23   .   CA   .    23   .   C    .    24   .   N   parsed_2lcw   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -48    -30   .   .    25   .   N   .    25   .   CA   .    25   .   C    .    26   .   N   parsed_2lcw   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -49    -25   .   .    26   .   N   .    26   .   CA   .    26   .   C    .    27   .   N   parsed_2lcw   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -70    -20   .   .    27   .   N   .    27   .   CA   .    27   .   C    .    28   .   N   parsed_2lcw   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    100    144   .   .    33   .   N   .    33   .   CA   .    33   .   C    .    34   .   N   parsed_2lcw   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     91    139   .   .    34   .   N   .    34   .   CA   .    34   .   C    .    35   .   N   parsed_2lcw   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     92    164   .   .    35   .   N   .    35   .   CA   .    35   .   C    .    36   .   N   parsed_2lcw   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     78    182   .   .    36   .   N   .    36   .   CA   .    36   .   C    .    37   .   N   parsed_2lcw   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    126    176   .   .    42   .   N   .    42   .   CA   .    42   .   C    .    43   .   N   parsed_2lcw   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     92    162   .   .    43   .   N   .    43   .   CA   .    43   .   C    .    44   .   N   parsed_2lcw   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     93    149   .   .    44   .   N   .    44   .   CA   .    44   .   C    .    45   .   N   parsed_2lcw   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    116    152   .   .    45   .   N   .    45   .   CA   .    45   .   C    .    46   .   N   parsed_2lcw   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    116    148   .   .    46   .   N   .    46   .   CA   .    46   .   C    .    47   .   N   parsed_2lcw   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     88    164   .   .    48   .   N   .    48   .   CA   .    48   .   C    .    49   .   N   parsed_2lcw   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    114    176   .   .    49   .   N   .    49   .   CA   .    49   .   C    .    50   .   N   parsed_2lcw   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    100    148   .   .    50   .   N   .    50   .   CA   .    50   .   C    .    51   .   N   parsed_2lcw   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    132    178   .   .    59   .   N   .    59   .   CA   .    59   .   C    .    60   .   N   parsed_2lcw   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    129    179   .   .    60   .   N   .    60   .   CA   .    60   .   C    .    61   .   N   parsed_2lcw   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    108    190   .   .    61   .   N   .    61   .   CA   .    61   .   C    .    62   .   N   parsed_2lcw   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    109    165   .   .    62   .   N   .    62   .   CA   .    62   .   C    .    63   .   N   parsed_2lcw   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    109    153   .   .    63   .   N   .    63   .   CA   .    63   .   C    .    64   .   N   parsed_2lcw   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -49    -31   .   .    68   .   N   .    68   .   CA   .    68   .   C    .    69   .   N   parsed_2lcw   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -57    -29   .   .    69   .   N   .    69   .   CA   .    69   .   C    .    70   .   N   parsed_2lcw   1   
        80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -66     -6   .   .    70   .   N   .    70   .   CA   .    70   .   C    .    71   .   N   parsed_2lcw   1   
        81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -65      5   .   .    71   .   N   .    71   .   CA   .    71   .   C    .    72   .   N   parsed_2lcw   1   
        82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -51    -21   .   .    72   .   N   .    72   .   CA   .    72   .   C    .    73   .   N   parsed_2lcw   1   
        83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -56    -30   .   .    73   .   N   .    73   .   CA   .    73   .   C    .    74   .   N   parsed_2lcw   1   
        84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -58    -30   .   .    74   .   N   .    74   .   CA   .    74   .   C    .    75   .   N   parsed_2lcw   1   
        85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -51    -27   .   .    75   .   N   .    75   .   CA   .    75   .   C    .    76   .   N   parsed_2lcw   1   
        86   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -68     -6   .   .    76   .   N   .    76   .   CA   .    76   .   C    .    77   .   N   parsed_2lcw   1   
        87   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    129    153   .   .    81   .   N   .    81   .   CA   .    81   .   C    .    82   .   N   parsed_2lcw   1   
        88   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    102    148   .   .    82   .   N   .    82   .   CA   .    82   .   C    .    83   .   N   parsed_2lcw   1   
        89   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    105    173   .   .    85   .   N   .    85   .   CA   .    85   .   C    .    86   .   N   parsed_2lcw   1   
        90   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    127    181   .   .    87   .   N   .    87   .   CA   .    87   .   C    .    88   .   N   parsed_2lcw   1   
        91   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    101    151   .   .    88   .   N   .    88   .   CA   .    88   .   C    .    89   .   N   parsed_2lcw   1   
        92   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    106    146   .   .    89   .   N   .    89   .   CA   .    89   .   C    .    90   .   N   parsed_2lcw   1   
        93   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    118    204   .   .    90   .   N   .    90   .   CA   .    90   .   C    .    91   .   N   parsed_2lcw   1   
        94   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    111    189   .   .   106   .   N   .   106   .   CA   .   106   .   C    .   107   .   N   parsed_2lcw   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   
;
phi and psi dihedral restraint file generated by Talos2Aria.py

TALOS filename:
pred.tab

settings: min phiError=None, min psiError=None, errorFactor=2.0

Talos derived phi restraint:
;
     1   1     9   31   parsed_2lcw   1   
         2   "Talos derived phi restraint:"     16   1    16   31   parsed_2lcw   1   
         3   "Talos derived phi restraint:"     23   1    23   31   parsed_2lcw   1   
         4   "Talos derived phi restraint:"     30   1    30   31   parsed_2lcw   1   
         5   "Talos derived phi restraint:"     37   1    37   31   parsed_2lcw   1   
         6   "Talos derived phi restraint:"     44   1    44   31   parsed_2lcw   1   
         7   "Talos derived phi restraint:"     51   1    51   31   parsed_2lcw   1   
         8   "Talos derived phi restraint:"     58   1    58   31   parsed_2lcw   1   
         9   "Talos derived phi restraint:"     65   1    65   31   parsed_2lcw   1   
        10   "Talos derived phi restraint:"     72   1    72   31   parsed_2lcw   1   
        11   "Talos derived phi restraint:"     79   1    79   31   parsed_2lcw   1   
        12   "Talos derived phi restraint:"     86   1    86   31   parsed_2lcw   1   
        13   "Talos derived phi restraint:"     93   1    93   31   parsed_2lcw   1   
        14   "Talos derived phi restraint:"    100   1   100   31   parsed_2lcw   1   
        15   "Talos derived phi restraint:"    107   1   107   31   parsed_2lcw   1   
        16   "Talos derived phi restraint:"    114   1   114   31   parsed_2lcw   1   
        17   "Talos derived phi restraint:"    121   1   121   31   parsed_2lcw   1   
        18   "Talos derived phi restraint:"    128   1   128   31   parsed_2lcw   1   
        19   "Talos derived phi restraint:"    135   1   135   31   parsed_2lcw   1   
        20   "Talos derived phi restraint:"    142   1   142   31   parsed_2lcw   1   
        21   "Talos derived phi restraint:"    149   1   149   31   parsed_2lcw   1   
        22   "Talos derived phi restraint:"    156   1   156   31   parsed_2lcw   1   
        23   "Talos derived phi restraint:"    163   1   163   31   parsed_2lcw   1   
        24   "Talos derived phi restraint:"    170   1   170   31   parsed_2lcw   1   
        25   "Talos derived phi restraint:"    177   1   177   31   parsed_2lcw   1   
        26   "Talos derived phi restraint:"    184   1   184   31   parsed_2lcw   1   
        27   "Talos derived phi restraint:"    191   1   191   31   parsed_2lcw   1   
        28   "Talos derived phi restraint:"    198   1   198   31   parsed_2lcw   1   
        29   "Talos derived phi restraint:"    205   1   205   31   parsed_2lcw   1   
        30   "Talos derived phi restraint:"    212   1   212   31   parsed_2lcw   1   
        31   "Talos derived phi restraint:"    219   1   219   31   parsed_2lcw   1   
        32   "Talos derived phi restraint:"    226   1   226   31   parsed_2lcw   1   
        33   "Talos derived phi restraint:"    233   1   233   31   parsed_2lcw   1   
        34   "Talos derived phi restraint:"    240   1   240   31   parsed_2lcw   1   
        35   "Talos derived phi restraint:"    247   1   247   31   parsed_2lcw   1   
        36   "Talos derived phi restraint:"    254   1   254   31   parsed_2lcw   1   
        37   "Talos derived phi restraint:"    261   1   261   31   parsed_2lcw   1   
        38   "Talos derived phi restraint:"    268   1   268   31   parsed_2lcw   1   
        39   "Talos derived phi restraint:"    275   1   275   31   parsed_2lcw   1   
        40   "Talos derived phi restraint:"    282   1   282   31   parsed_2lcw   1   
        41   "Talos derived phi restraint:"    289   1   289   31   parsed_2lcw   1   
        42   "Talos derived phi restraint:"    296   1   296   31   parsed_2lcw   1   
        43   "Talos derived phi restraint:"    303   1   303   31   parsed_2lcw   1   
        44   "Talos derived phi restraint:"    310   1   310   31   parsed_2lcw   1   
        45   "Talos derived phi restraint:"    317   1   317   31   parsed_2lcw   1   
        46   "Talos derived phi restraint:"    324   1   324   31   parsed_2lcw   1   
        47   "Talos derived phi restraint:"    331   1   331   31   parsed_2lcw   1   
        48   "Talos derived psi restraint:"    338   1   338   31   parsed_2lcw   1   
        49   "Talos derived psi restraint:"    345   1   345   31   parsed_2lcw   1   
        50   "Talos derived psi restraint:"    352   1   352   31   parsed_2lcw   1   
        51   "Talos derived psi restraint:"    359   1   359   31   parsed_2lcw   1   
        52   "Talos derived psi restraint:"    366   1   366   31   parsed_2lcw   1   
        53   "Talos derived psi restraint:"    373   1   373   31   parsed_2lcw   1   
        54   "Talos derived psi restraint:"    380   1   380   31   parsed_2lcw   1   
        55   "Talos derived psi restraint:"    387   1   387   31   parsed_2lcw   1   
        56   "Talos derived psi restraint:"    394   1   394   31   parsed_2lcw   1   
        57   "Talos derived psi restraint:"    401   1   401   31   parsed_2lcw   1   
        58   "Talos derived psi restraint:"    408   1   408   31   parsed_2lcw   1   
        59   "Talos derived psi restraint:"    415   1   415   31   parsed_2lcw   1   
        60   "Talos derived psi restraint:"    422   1   422   31   parsed_2lcw   1   
        61   "Talos derived psi restraint:"    429   1   429   31   parsed_2lcw   1   
        62   "Talos derived psi restraint:"    436   1   436   31   parsed_2lcw   1   
        63   "Talos derived psi restraint:"    443   1   443   31   parsed_2lcw   1   
        64   "Talos derived psi restraint:"    450   1   450   31   parsed_2lcw   1   
        65   "Talos derived psi restraint:"    457   1   457   31   parsed_2lcw   1   
        66   "Talos derived psi restraint:"    464   1   464   31   parsed_2lcw   1   
        67   "Talos derived psi restraint:"    471   1   471   31   parsed_2lcw   1   
        68   "Talos derived psi restraint:"    478   1   478   31   parsed_2lcw   1   
        69   "Talos derived psi restraint:"    485   1   485   31   parsed_2lcw   1   
        70   "Talos derived psi restraint:"    492   1   492   31   parsed_2lcw   1   
        71   "Talos derived psi restraint:"    499   1   499   31   parsed_2lcw   1   
        72   "Talos derived psi restraint:"    506   1   506   31   parsed_2lcw   1   
        73   "Talos derived psi restraint:"    513   1   513   31   parsed_2lcw   1   
        74   "Talos derived psi restraint:"    520   1   520   31   parsed_2lcw   1   
        75   "Talos derived psi restraint:"    527   1   527   31   parsed_2lcw   1   
        76   "Talos derived psi restraint:"    534   1   534   31   parsed_2lcw   1   
        77   "Talos derived psi restraint:"    541   1   541   31   parsed_2lcw   1   
        78   "Talos derived psi restraint:"    548   1   548   31   parsed_2lcw   1   
        79   "Talos derived psi restraint:"    555   1   555   31   parsed_2lcw   1   
        80   "Talos derived psi restraint:"    562   1   562   31   parsed_2lcw   1   
        81   "Talos derived psi restraint:"    569   1   569   31   parsed_2lcw   1   
        82   "Talos derived psi restraint:"    576   1   576   31   parsed_2lcw   1   
        83   "Talos derived psi restraint:"    583   1   583   31   parsed_2lcw   1   
        84   "Talos derived psi restraint:"    590   1   590   31   parsed_2lcw   1   
        85   "Talos derived psi restraint:"    597   1   597   31   parsed_2lcw   1   
        86   "Talos derived psi restraint:"    604   1   604   31   parsed_2lcw   1   
        87   "Talos derived psi restraint:"    611   1   611   31   parsed_2lcw   1   
        88   "Talos derived psi restraint:"    618   1   618   31   parsed_2lcw   1   
        89   "Talos derived psi restraint:"    625   1   625   31   parsed_2lcw   1   
        90   "Talos derived psi restraint:"    632   1   632   31   parsed_2lcw   1   
        91   "Talos derived psi restraint:"    639   1   639   31   parsed_2lcw   1   
        92   "Talos derived psi restraint:"    646   1   646   31   parsed_2lcw   1   
        93   "Talos derived psi restraint:"    653   1   653   31   parsed_2lcw   1   
        94   "Talos derived psi restraint:"    660   1   660   31   parsed_2lcw   1   
    stop_

save_





Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Saturday, June 1, 2024 3:17:46 AM GMT (wattos1)