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 subtype subsubtype item_count
37359 1pfj 4901 cing 2-parsed STAR distance hydrogen bond simple 70


data_1pfj_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1pfj 
    _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_1pfj   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1pfj 
    _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   1pfj   "Master copy"    parsed_1pfj   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1pfj 
    _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   1pfj.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1247   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     3    distance                  NOE                 ambi                  4   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"      simple               70   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     5    distance                  NOE                 simple                0   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     6   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_1pfj   1   
        1   1pfj.mr   .   .    XPLOR/CNS     7   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_1pfj   1   
        1   1pfj.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1pfj   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1pfj 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            4 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_1pfj   1   
         2   1   .   .   .   parsed_1pfj   1   
         3   1   .   .   .   parsed_1pfj   1   
         4   1   .   .   .   parsed_1pfj   1   
         5   1   .   .   .   parsed_1pfj   1   
         6   1   .   .   .   parsed_1pfj   1   
         7   1   .   .   .   parsed_1pfj   1   
         8   1   .   .   .   parsed_1pfj   1   
         9   1   .   .   .   parsed_1pfj   1   
        10   1   .   .   .   parsed_1pfj   1   
        11   1   .   .   .   parsed_1pfj   1   
        12   1   .   .   .   parsed_1pfj   1   
        13   1   .   .   .   parsed_1pfj   1   
        14   1   .   .   .   parsed_1pfj   1   
        15   1   .   .   .   parsed_1pfj   1   
        16   1   .   .   .   parsed_1pfj   1   
        17   1   .   .   .   parsed_1pfj   1   
        18   1   .   .   .   parsed_1pfj   1   
        19   1   .   .   .   parsed_1pfj   1   
        20   1   .   .   .   parsed_1pfj   1   
        21   1   .   .   .   parsed_1pfj   1   
        22   1   .   .   .   parsed_1pfj   1   
        23   1   .   .   .   parsed_1pfj   1   
        24   1   .   .   .   parsed_1pfj   1   
        25   1   .   .   .   parsed_1pfj   1   
        26   1   .   .   .   parsed_1pfj   1   
        27   1   .   .   .   parsed_1pfj   1   
        28   1   .   .   .   parsed_1pfj   1   
        29   1   .   .   .   parsed_1pfj   1   
        30   1   .   .   .   parsed_1pfj   1   
        31   1   .   .   .   parsed_1pfj   1   
        32   1   .   .   .   parsed_1pfj   1   
        33   1   .   .   .   parsed_1pfj   1   
        34   1   .   .   .   parsed_1pfj   1   
        35   1   .   .   .   parsed_1pfj   1   
        36   1   .   .   .   parsed_1pfj   1   
        37   1   .   .   .   parsed_1pfj   1   
        38   1   .   .   .   parsed_1pfj   1   
        39   1   .   .   .   parsed_1pfj   1   
        40   1   .   .   .   parsed_1pfj   1   
        41   1   .   .   .   parsed_1pfj   1   
        42   1   .   .   .   parsed_1pfj   1   
        43   1   .   .   .   parsed_1pfj   1   
        44   1   .   .   .   parsed_1pfj   1   
        45   1   .   .   .   parsed_1pfj   1   
        46   1   .   .   .   parsed_1pfj   1   
        47   1   .   .   .   parsed_1pfj   1   
        48   1   .   .   .   parsed_1pfj   1   
        49   1   .   .   .   parsed_1pfj   1   
        50   1   .   .   .   parsed_1pfj   1   
        51   1   .   .   .   parsed_1pfj   1   
        52   1   .   .   .   parsed_1pfj   1   
        53   1   .   .   .   parsed_1pfj   1   
        54   1   .   .   .   parsed_1pfj   1   
        55   1   .   .   .   parsed_1pfj   1   
        56   1   .   .   .   parsed_1pfj   1   
        57   1   .   .   .   parsed_1pfj   1   
        58   1   .   .   .   parsed_1pfj   1   
        59   1   .   .   .   parsed_1pfj   1   
        60   1   .   .   .   parsed_1pfj   1   
        61   1   .   .   .   parsed_1pfj   1   
        62   1   .   .   .   parsed_1pfj   1   
        63   1   .   .   .   parsed_1pfj   1   
        64   1   .   .   .   parsed_1pfj   1   
        65   1   .   .   .   parsed_1pfj   1   
        66   1   .   .   .   parsed_1pfj   1   
        67   1   .   .   .   parsed_1pfj   1   
        68   1   .   .   .   parsed_1pfj   1   
        69   1   .   .   .   parsed_1pfj   1   
        70   1   .   .   .   parsed_1pfj   1   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   .    90   .   HN   parsed_1pfj   1   
         1   1   2   .   .   .   .   .   .   .   .   .    86   .   O    parsed_1pfj   1   
         2   1   1   .   .   .   .   .   .   .   .   .    90   .   N    parsed_1pfj   1   
         2   1   2   .   .   .   .   .   .   .   .   .    86   .   O    parsed_1pfj   1   
         3   1   1   .   .   .   .   .   .   .   .   .    91   .   HN   parsed_1pfj   1   
         3   1   2   .   .   .   .   .   .   .   .   .    87   .   O    parsed_1pfj   1   
         4   1   1   .   .   .   .   .   .   .   .   .    91   .   N    parsed_1pfj   1   
         4   1   2   .   .   .   .   .   .   .   .   .    87   .   O    parsed_1pfj   1   
         5   1   1   .   .   .   .   .   .   .   .   .    92   .   HN   parsed_1pfj   1   
         5   1   2   .   .   .   .   .   .   .   .   .    88   .   O    parsed_1pfj   1   
         6   1   1   .   .   .   .   .   .   .   .   .    92   .   N    parsed_1pfj   1   
         6   1   2   .   .   .   .   .   .   .   .   .    88   .   O    parsed_1pfj   1   
         7   1   1   .   .   .   .   .   .   .   .   .    93   .   HN   parsed_1pfj   1   
         7   1   2   .   .   .   .   .   .   .   .   .    89   .   O    parsed_1pfj   1   
         8   1   1   .   .   .   .   .   .   .   .   .    93   .   N    parsed_1pfj   1   
         8   1   2   .   .   .   .   .   .   .   .   .    89   .   O    parsed_1pfj   1   
         9   1   1   .   .   .   .   .   .   .   .   .    94   .   HN   parsed_1pfj   1   
         9   1   2   .   .   .   .   .   .   .   .   .    90   .   O    parsed_1pfj   1   
        10   1   1   .   .   .   .   .   .   .   .   .    94   .   N    parsed_1pfj   1   
        10   1   2   .   .   .   .   .   .   .   .   .    90   .   O    parsed_1pfj   1   
        11   1   1   .   .   .   .   .   .   .   .   .    95   .   HN   parsed_1pfj   1   
        11   1   2   .   .   .   .   .   .   .   .   .    91   .   O    parsed_1pfj   1   
        12   1   1   .   .   .   .   .   .   .   .   .    95   .   N    parsed_1pfj   1   
        12   1   2   .   .   .   .   .   .   .   .   .    91   .   O    parsed_1pfj   1   
        13   1   1   .   .   .   .   .   .   .   .   .    96   .   HN   parsed_1pfj   1   
        13   1   2   .   .   .   .   .   .   .   .   .    92   .   O    parsed_1pfj   1   
        14   1   1   .   .   .   .   .   .   .   .   .    96   .   N    parsed_1pfj   1   
        14   1   2   .   .   .   .   .   .   .   .   .    92   .   O    parsed_1pfj   1   
        15   1   1   .   .   .   .   .   .   .   .   .    97   .   HN   parsed_1pfj   1   
        15   1   2   .   .   .   .   .   .   .   .   .    93   .   O    parsed_1pfj   1   
        16   1   1   .   .   .   .   .   .   .   .   .    97   .   N    parsed_1pfj   1   
        16   1   2   .   .   .   .   .   .   .   .   .    93   .   O    parsed_1pfj   1   
        17   1   1   .   .   .   .   .   .   .   .   .    99   .   HN   parsed_1pfj   1   
        17   1   2   .   .   .   .   .   .   .   .   .    95   .   O    parsed_1pfj   1   
        18   1   1   .   .   .   .   .   .   .   .   .    99   .   N    parsed_1pfj   1   
        18   1   2   .   .   .   .   .   .   .   .   .    95   .   O    parsed_1pfj   1   
        19   1   1   .   .   .   .   .   .   .   .   .   100   .   HN   parsed_1pfj   1   
        19   1   2   .   .   .   .   .   .   .   .   .    96   .   O    parsed_1pfj   1   
        20   1   1   .   .   .   .   .   .   .   .   .   100   .   N    parsed_1pfj   1   
        20   1   2   .   .   .   .   .   .   .   .   .    96   .   O    parsed_1pfj   1   
        21   1   1   .   .   .   .   .   .   .   .   .    10   .   HN   parsed_1pfj   1   
        21   1   2   .   .   .   .   .   .   .   .   .    26   .   O    parsed_1pfj   1   
        22   1   1   .   .   .   .   .   .   .   .   .    10   .   N    parsed_1pfj   1   
        22   1   2   .   .   .   .   .   .   .   .   .    26   .   O    parsed_1pfj   1   
        23   1   1   .   .   .   .   .   .   .   .   .    26   .   HN   parsed_1pfj   1   
        23   1   2   .   .   .   .   .   .   .   .   .    10   .   O    parsed_1pfj   1   
        24   1   1   .   .   .   .   .   .   .   .   .    26   .   N    parsed_1pfj   1   
        24   1   2   .   .   .   .   .   .   .   .   .    10   .   O    parsed_1pfj   1   
        25   1   1   .   .   .   .   .   .   .   .   .    12   .   HN   parsed_1pfj   1   
        25   1   2   .   .   .   .   .   .   .   .   .    24   .   O    parsed_1pfj   1   
        26   1   1   .   .   .   .   .   .   .   .   .    12   .   N    parsed_1pfj   1   
        26   1   2   .   .   .   .   .   .   .   .   .    24   .   O    parsed_1pfj   1   
        27   1   1   .   .   .   .   .   .   .   .   .    24   .   HN   parsed_1pfj   1   
        27   1   2   .   .   .   .   .   .   .   .   .    12   .   O    parsed_1pfj   1   
        28   1   1   .   .   .   .   .   .   .   .   .    24   .   N    parsed_1pfj   1   
        28   1   2   .   .   .   .   .   .   .   .   .    12   .   O    parsed_1pfj   1   
        29   1   1   .   .   .   .   .   .   .   .   .    15   .   HN   parsed_1pfj   1   
        29   1   2   .   .   .   .   .   .   .   .   .    22   .   O    parsed_1pfj   1   
        30   1   1   .   .   .   .   .   .   .   .   .    15   .   N    parsed_1pfj   1   
        30   1   2   .   .   .   .   .   .   .   .   .    22   .   O    parsed_1pfj   1   
        31   1   1   .   .   .   .   .   .   .   .   .    16   .   HN   parsed_1pfj   1   
        31   1   2   .   .   .   .   .   .   .   .   .    78   .   O    parsed_1pfj   1   
        32   1   1   .   .   .   .   .   .   .   .   .    16   .   N    parsed_1pfj   1   
        32   1   2   .   .   .   .   .   .   .   .   .    78   .   O    parsed_1pfj   1   
        33   1   1   .   .   .   .   .   .   .   .   .    78   .   HN   parsed_1pfj   1   
        33   1   2   .   .   .   .   .   .   .   .   .    16   .   O    parsed_1pfj   1   
        34   1   1   .   .   .   .   .   .   .   .   .    78   .   N    parsed_1pfj   1   
        34   1   2   .   .   .   .   .   .   .   .   .    16   .   O    parsed_1pfj   1   
        35   1   1   .   .   .   .   .   .   .   .   .    23   .   HN   parsed_1pfj   1   
        35   1   2   .   .   .   .   .   .   .   .   .    34   .   O    parsed_1pfj   1   
        36   1   1   .   .   .   .   .   .   .   .   .    23   .   N    parsed_1pfj   1   
        36   1   2   .   .   .   .   .   .   .   .   .    34   .   O    parsed_1pfj   1   
        37   1   1   .   .   .   .   .   .   .   .   .    34   .   HN   parsed_1pfj   1   
        37   1   2   .   .   .   .   .   .   .   .   .    23   .   O    parsed_1pfj   1   
        38   1   1   .   .   .   .   .   .   .   .   .    34   .   N    parsed_1pfj   1   
        38   1   2   .   .   .   .   .   .   .   .   .    23   .   O    parsed_1pfj   1   
        39   1   1   .   .   .   .   .   .   .   .   .    25   .   HN   parsed_1pfj   1   
        39   1   2   .   .   .   .   .   .   .   .   .    32   .   O    parsed_1pfj   1   
        40   1   1   .   .   .   .   .   .   .   .   .    25   .   N    parsed_1pfj   1   
        40   1   2   .   .   .   .   .   .   .   .   .    32   .   O    parsed_1pfj   1   
        41   1   1   .   .   .   .   .   .   .   .   .    32   .   HN   parsed_1pfj   1   
        41   1   2   .   .   .   .   .   .   .   .   .    25   .   O    parsed_1pfj   1   
        42   1   1   .   .   .   .   .   .   .   .   .    32   .   N    parsed_1pfj   1   
        42   1   2   .   .   .   .   .   .   .   .   .    25   .   O    parsed_1pfj   1   
        43   1   1   .   .   .   .   .   .   .   .   .    27   .   HN   parsed_1pfj   1   
        43   1   2   .   .   .   .   .   .   .   .   .    30   .   O    parsed_1pfj   1   
        44   1   1   .   .   .   .   .   .   .   .   .    27   .   N    parsed_1pfj   1   
        44   1   2   .   .   .   .   .   .   .   .   .    30   .   O    parsed_1pfj   1   
        45   1   1   .   .   .   .   .   .   .   .   .    30   .   HN   parsed_1pfj   1   
        45   1   2   .   .   .   .   .   .   .   .   .    27   .   O    parsed_1pfj   1   
        46   1   1   .   .   .   .   .   .   .   .   .    30   .   N    parsed_1pfj   1   
        46   1   2   .   .   .   .   .   .   .   .   .    27   .   O    parsed_1pfj   1   
        47   1   1   .   .   .   .   .   .   .   .   .    47   .   HN   parsed_1pfj   1   
        47   1   2   .   .   .   .   .   .   .   .   .    29   .   O    parsed_1pfj   1   
        48   1   1   .   .   .   .   .   .   .   .   .    47   .   N    parsed_1pfj   1   
        48   1   2   .   .   .   .   .   .   .   .   .    29   .   O    parsed_1pfj   1   
        49   1   1   .   .   .   .   .   .   .   .   .    31   .   HN   parsed_1pfj   1   
        49   1   2   .   .   .   .   .   .   .   .   .    45   .   O    parsed_1pfj   1   
        50   1   1   .   .   .   .   .   .   .   .   .    31   .   N    parsed_1pfj   1   
        50   1   2   .   .   .   .   .   .   .   .   .    45   .   O    parsed_1pfj   1   
        51   1   1   .   .   .   .   .   .   .   .   .    45   .   HN   parsed_1pfj   1   
        51   1   2   .   .   .   .   .   .   .   .   .    31   .   O    parsed_1pfj   1   
        52   1   1   .   .   .   .   .   .   .   .   .    45   .   N    parsed_1pfj   1   
        52   1   2   .   .   .   .   .   .   .   .   .    31   .   O    parsed_1pfj   1   
        53   1   1   .   .   .   .   .   .   .   .   .    33   .   HN   parsed_1pfj   1   
        53   1   2   .   .   .   .   .   .   .   .   .    43   .   O    parsed_1pfj   1   
        54   1   1   .   .   .   .   .   .   .   .   .    33   .   N    parsed_1pfj   1   
        54   1   2   .   .   .   .   .   .   .   .   .    43   .   O    parsed_1pfj   1   
        55   1   1   .   .   .   .   .   .   .   .   .    49   .   HN   parsed_1pfj   1   
        55   1   2   .   .   .   .   .   .   .   .   .    46   .   O    parsed_1pfj   1   
        56   1   1   .   .   .   .   .   .   .   .   .    49   .   N    parsed_1pfj   1   
        56   1   2   .   .   .   .   .   .   .   .   .    46   .   O    parsed_1pfj   1   
        57   1   1   .   .   .   .   .   .   .   .   .    50   .   HN   parsed_1pfj   1   
        57   1   2   .   .   .   .   .   .   .   .   .    47   .   O    parsed_1pfj   1   
        58   1   1   .   .   .   .   .   .   .   .   .    50   .   N    parsed_1pfj   1   
        58   1   2   .   .   .   .   .   .   .   .   .    47   .   O    parsed_1pfj   1   
        59   1   1   .   .   .   .   .   .   .   .   .    51   .   HN   parsed_1pfj   1   
        59   1   2   .   .   .   .   .   .   .   .   .    68   .   O    parsed_1pfj   1   
        60   1   1   .   .   .   .   .   .   .   .   .    51   .   N    parsed_1pfj   1   
        60   1   2   .   .   .   .   .   .   .   .   .    68   .   O    parsed_1pfj   1   
        61   1   1   .   .   .   .   .   .   .   .   .    65   .   HN   parsed_1pfj   1   
        61   1   2   .   .   .   .   .   .   .   .   .    77   .   O    parsed_1pfj   1   
        62   1   1   .   .   .   .   .   .   .   .   .    65   .   N    parsed_1pfj   1   
        62   1   2   .   .   .   .   .   .   .   .   .    77   .   O    parsed_1pfj   1   
        63   1   1   .   .   .   .   .   .   .   .   .    77   .   HN   parsed_1pfj   1   
        63   1   2   .   .   .   .   .   .   .   .   .    65   .   O    parsed_1pfj   1   
        64   1   1   .   .   .   .   .   .   .   .   .    77   .   N    parsed_1pfj   1   
        64   1   2   .   .   .   .   .   .   .   .   .    65   .   O    parsed_1pfj   1   
        65   1   1   .   .   .   .   .   .   .   .   .    67   .   HN   parsed_1pfj   1   
        65   1   2   .   .   .   .   .   .   .   .   .    75   .   O    parsed_1pfj   1   
        66   1   1   .   .   .   .   .   .   .   .   .    67   .   N    parsed_1pfj   1   
        66   1   2   .   .   .   .   .   .   .   .   .    75   .   O    parsed_1pfj   1   
        67   1   1   .   .   .   .   .   .   .   .   .    68   .   HN   parsed_1pfj   1   
        67   1   2   .   .   .   .   .   .   .   .   .    52   .   O    parsed_1pfj   1   
        68   1   1   .   .   .   .   .   .   .   .   .    68   .   N    parsed_1pfj   1   
        68   1   2   .   .   .   .   .   .   .   .   .    52   .   O    parsed_1pfj   1   
        69   1   1   .   .   .   .   .   .   .   .   .    69   .   HN   parsed_1pfj   1   
        69   1   2   .   .   .   .   .   .   .   .   .    73   .   O    parsed_1pfj   1   
        70   1   1   .   .   .   .   .   .   .   .   .    69   .   N    parsed_1pfj   1   
        70   1   2   .   .   .   .   .   .   .   .   .    73   .   O    parsed_1pfj   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
         2   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
         3   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
         4   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
         5   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
         6   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
         7   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
         8   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
         9   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        10   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        11   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        12   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        13   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        14   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        15   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        16   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        17   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        18   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        19   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        20   1   .   .   .   .   .   2.900   2.600   3.400   parsed_1pfj   1   
        21   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        22   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        23   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        24   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        25   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        26   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        27   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        28   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        29   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        30   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        31   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        32   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        33   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        34   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        35   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        36   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        37   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        38   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        39   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        40   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        41   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        42   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        43   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        44   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        45   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        46   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        47   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        48   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        49   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        50   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        51   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        52   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        53   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        54   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        55   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        56   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        57   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        58   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        59   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        60   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        61   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        62   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        63   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        64   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        65   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        66   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        67   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        68   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
        69   1   .   .   .   .   .   1.900   1.400   2.000   parsed_1pfj   1   
        70   1   .   .   .   .   .   2.900   2.600   3.200   parsed_1pfj   1   
    stop_


    loop_
        _Dist_constraint_comment_org.ID 
        _Dist_constraint_comment_org.Comment_text 
        _Dist_constraint_comment_org.Comment_begin_line 
        _Dist_constraint_comment_org.Comment_begin_column 
        _Dist_constraint_comment_org.Comment_end_line 
        _Dist_constraint_comment_org.Comment_end_column 
        _Dist_constraint_comment_org.Entry_ID 
        _Dist_constraint_comment_org.Distance_constraint_list_ID 

         1   
;
! H-BONDS:
! A-helix:
;
    2    1    3   12   parsed_1pfj   1   
         2    Hbon    4   91    4   98   parsed_1pfj   1   
         3    Hbon    5   91    5   98   parsed_1pfj   1   
         4    Hbon    6   91    6   98   parsed_1pfj   1   
         5    Hbon    7   91    7   98   parsed_1pfj   1   
         6    Hbon    8   91    8   98   parsed_1pfj   1   
         7    Hbon    9   91    9   98   parsed_1pfj   1   
         8    Hbon   10   91   10   98   parsed_1pfj   1   
         9    Hbon   11   91   11   98   parsed_1pfj   1   
        10    Hbon   12   91   12   98   parsed_1pfj   1   
        11    Hbon   13   91   13   98   parsed_1pfj   1   
        12    Hbon   14   91   14   98   parsed_1pfj   1   
        13    Hbon   15   91   15   98   parsed_1pfj   1   
        14    Hbon   16   91   16   98   parsed_1pfj   1   
        15    Hbon   17   91   17   98   parsed_1pfj   1   
        16    Hbon   18   91   18   98   parsed_1pfj   1   
        17    Hbon   19   91   19   98   parsed_1pfj   1   
        18    Hbon   20   91   20   98   parsed_1pfj   1   
        19    Hbon   21   91   21   98   parsed_1pfj   1   
        20    Hbon   22   91   22   98   parsed_1pfj   1   
        21   
;
Hbon
! B-sheets:
;
   23   91   25   13   parsed_1pfj   1   
        22    Hbon   26   91   26   98   parsed_1pfj   1   
        23    Hbon   27   91   27   98   parsed_1pfj   1   
        24    Hbon   28   91   28   98   parsed_1pfj   1   
        25    Hbon   29   91   29   98   parsed_1pfj   1   
        26    Hbon   30   91   30   98   parsed_1pfj   1   
        27    Hbon   31   91   31   98   parsed_1pfj   1   
        28    Hbon   32   91   32   98   parsed_1pfj   1   
        29    Hbon   33   91   33   98   parsed_1pfj   1   
        30    Hbon   34   91   34   98   parsed_1pfj   1   
        31    Hbon   35   91   35   98   parsed_1pfj   1   
        32    Hbon   36   91   36   98   parsed_1pfj   1   
        33    Hbon   37   91   37   98   parsed_1pfj   1   
        34    Hbon   38   91   38   98   parsed_1pfj   1   
        35    Hbon   39   91   39   98   parsed_1pfj   1   
        36    Hbon   40   91   40   98   parsed_1pfj   1   
        37    Hbon   41   91   41   98   parsed_1pfj   1   
        38    Hbon   42   91   42   98   parsed_1pfj   1   
        39    Hbon   43   91   43   98   parsed_1pfj   1   
        40    Hbon   44   91   44   98   parsed_1pfj   1   
        41    Hbon   45   91   45   98   parsed_1pfj   1   
        42    Hbon   46   91   46   98   parsed_1pfj   1   
        43    Hbon   47   91   47   98   parsed_1pfj   1   
        44    Hbon   48   91   48   98   parsed_1pfj   1   
        45    Hbon   49   91   49   98   parsed_1pfj   1   
        46    Hbon   50   91   50   98   parsed_1pfj   1   
        47    Hbon   51   91   51   98   parsed_1pfj   1   
        48    Hbon   52   91   52   98   parsed_1pfj   1   
        49    Hbon   53   91   53   98   parsed_1pfj   1   
        50    Hbon   54   91   54   98   parsed_1pfj   1   
        51    Hbon   55   91   55   98   parsed_1pfj   1   
        52    Hbon   56   91   56   98   parsed_1pfj   1   
        53    Hbon   57   91   57   98   parsed_1pfj   1   
        54    Hbon   58   91   58   98   parsed_1pfj   1   
        55    Hbon   59   91   59   98   parsed_1pfj   1   
        56    Hbon   60   91   60   98   parsed_1pfj   1   
        57    Hbon   61   91   61   98   parsed_1pfj   1   
        58    Hbon   62   91   62   98   parsed_1pfj   1   
        59    Hbon   63   91   63   98   parsed_1pfj   1   
        60    Hbon   64   91   64   98   parsed_1pfj   1   
        61    Hbon   65   91   65   98   parsed_1pfj   1   
        62    Hbon   66   91   66   98   parsed_1pfj   1   
        63    Hbon   67   91   67   98   parsed_1pfj   1   
        64    Hbon   68   91   68   98   parsed_1pfj   1   
        65    Hbon   69   91   69   98   parsed_1pfj   1   
        66    Hbon   70   91   70   98   parsed_1pfj   1   
        67    Hbon   71   91   71   98   parsed_1pfj   1   
        68    Hbon   72   91   72   98   parsed_1pfj   1   
        69    Hbon   73   91   73   98   parsed_1pfj   1   
        70    Hbon   74   91   74   98   parsed_1pfj   1   
        71    Hbon   75   91   75   98   parsed_1pfj   1   
    stop_

save_





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