NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype subsubtype item_count
28915 1a9l cing 2-parsed STAR distance hydrogen bond simple 82


data_1a9l_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1a9l 
    _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_1a9l   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1a9l 
    _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   1a9l   "Master copy"    parsed_1a9l   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1a9l 
    _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   1a9l.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_1a9l   1   
        1   1a9l.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             311   parsed_1a9l   1   
        1   1a9l.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple              82   parsed_1a9l   1   
        1   1a9l.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple               0   parsed_1a9l   1   
        1   1a9l.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1a9l   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1a9l 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _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_1a9l   1   
         2   1   .   .   .   parsed_1a9l   1   
         3   1   .   .   .   parsed_1a9l   1   
         4   1   .   .   .   parsed_1a9l   1   
         5   1   .   .   .   parsed_1a9l   1   
         6   1   .   .   .   parsed_1a9l   1   
         7   1   .   .   .   parsed_1a9l   1   
         8   1   .   .   .   parsed_1a9l   1   
         9   1   .   .   .   parsed_1a9l   1   
        10   1   .   .   .   parsed_1a9l   1   
        11   1   .   .   .   parsed_1a9l   1   
        12   1   .   .   .   parsed_1a9l   1   
        13   1   .   .   .   parsed_1a9l   1   
        14   1   .   .   .   parsed_1a9l   1   
        15   1   .   .   .   parsed_1a9l   1   
        16   1   .   .   .   parsed_1a9l   1   
        17   1   .   .   .   parsed_1a9l   1   
        18   1   .   .   .   parsed_1a9l   1   
        19   1   .   .   .   parsed_1a9l   1   
        20   1   .   .   .   parsed_1a9l   1   
        21   1   .   .   .   parsed_1a9l   1   
        22   1   .   .   .   parsed_1a9l   1   
        23   1   .   .   .   parsed_1a9l   1   
        24   1   .   .   .   parsed_1a9l   1   
        25   1   .   .   .   parsed_1a9l   1   
        26   1   .   .   .   parsed_1a9l   1   
        27   1   .   .   .   parsed_1a9l   1   
        28   1   .   .   .   parsed_1a9l   1   
        29   1   .   .   .   parsed_1a9l   1   
        30   1   .   .   .   parsed_1a9l   1   
        31   1   .   .   .   parsed_1a9l   1   
        32   1   .   .   .   parsed_1a9l   1   
        33   1   .   .   .   parsed_1a9l   1   
        34   1   .   .   .   parsed_1a9l   1   
        35   1   .   .   .   parsed_1a9l   1   
        36   1   .   .   .   parsed_1a9l   1   
        37   1   .   .   .   parsed_1a9l   1   
        38   1   .   .   .   parsed_1a9l   1   
        39   1   .   .   .   parsed_1a9l   1   
        40   1   .   .   .   parsed_1a9l   1   
        41   1   .   .   .   parsed_1a9l   1   
        42   1   .   .   .   parsed_1a9l   1   
        43   1   .   .   .   parsed_1a9l   1   
        44   1   .   .   .   parsed_1a9l   1   
        45   1   .   .   .   parsed_1a9l   1   
        46   1   .   .   .   parsed_1a9l   1   
        47   1   .   .   .   parsed_1a9l   1   
        48   1   .   .   .   parsed_1a9l   1   
        49   1   .   .   .   parsed_1a9l   1   
        50   1   .   .   .   parsed_1a9l   1   
        51   1   .   .   .   parsed_1a9l   1   
        52   1   .   .   .   parsed_1a9l   1   
        53   1   .   .   .   parsed_1a9l   1   
        54   1   .   .   .   parsed_1a9l   1   
        55   1   .   .   .   parsed_1a9l   1   
        56   1   .   .   .   parsed_1a9l   1   
        57   1   .   .   .   parsed_1a9l   1   
        58   1   .   .   .   parsed_1a9l   1   
        59   1   .   .   .   parsed_1a9l   1   
        60   1   .   .   .   parsed_1a9l   1   
        61   1   .   .   .   parsed_1a9l   1   
        62   1   .   .   .   parsed_1a9l   1   
        63   1   .   .   .   parsed_1a9l   1   
        64   1   .   .   .   parsed_1a9l   1   
        65   1   .   .   .   parsed_1a9l   1   
        66   1   .   .   .   parsed_1a9l   1   
        67   1   .   .   .   parsed_1a9l   1   
        68   1   .   .   .   parsed_1a9l   1   
        69   1   .   .   .   parsed_1a9l   1   
        70   1   .   .   .   parsed_1a9l   1   
        71   1   .   .   .   parsed_1a9l   1   
        72   1   .   .   .   parsed_1a9l   1   
        73   1   .   .   .   parsed_1a9l   1   
        74   1   .   .   .   parsed_1a9l   1   
        75   1   .   .   .   parsed_1a9l   1   
        76   1   .   .   .   parsed_1a9l   1   
        77   1   .   .   .   parsed_1a9l   1   
        78   1   .   .   .   parsed_1a9l   1   
        79   1   .   .   .   parsed_1a9l   1   
        80   1   .   .   .   parsed_1a9l   1   
        81   1   .   .   .   parsed_1a9l   1   
        82   1   .   .   .   parsed_1a9l   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   .   .   .   .   .   .   .   .   .    1   .   H1     parsed_1a9l   1   
         1   1   2   .   .   .   .   .   .   .   .   .   38   .   N3     parsed_1a9l   1   
         2   1   1   .   .   .   .   .   .   .   .   .    1   .   O6     parsed_1a9l   1   
         2   1   2   .   .   .   .   .   .   .   .   .   38   .   H42    parsed_1a9l   1   
         3   1   1   .   .   .   .   .   .   .   .   .    1   .   H22    parsed_1a9l   1   
         3   1   2   .   .   .   .   .   .   .   .   .   38   .   O2     parsed_1a9l   1   
         4   1   1   .   .   .   .   .   .   .   .   .    1   .   N1     parsed_1a9l   1   
         4   1   2   .   .   .   .   .   .   .   .   .   38   .   N3     parsed_1a9l   1   
         5   1   1   .   .   .   .   .   .   .   .   .    1   .   O6     parsed_1a9l   1   
         5   1   2   .   .   .   .   .   .   .   .   .   38   .   N4     parsed_1a9l   1   
         6   1   1   .   .   .   .   .   .   .   .   .    1   .   N2     parsed_1a9l   1   
         6   1   2   .   .   .   .   .   .   .   .   .   38   .   O2     parsed_1a9l   1   
         7   1   1   .   .   .   .   .   .   .   .   .    2   .   H1     parsed_1a9l   1   
         7   1   2   .   .   .   .   .   .   .   .   .   37   .   N3     parsed_1a9l   1   
         8   1   1   .   .   .   .   .   .   .   .   .    2   .   O6     parsed_1a9l   1   
         8   1   2   .   .   .   .   .   .   .   .   .   37   .   H42    parsed_1a9l   1   
         9   1   1   .   .   .   .   .   .   .   .   .    2   .   H22    parsed_1a9l   1   
         9   1   2   .   .   .   .   .   .   .   .   .   37   .   O2     parsed_1a9l   1   
        10   1   1   .   .   .   .   .   .   .   .   .    2   .   N1     parsed_1a9l   1   
        10   1   2   .   .   .   .   .   .   .   .   .   37   .   N3     parsed_1a9l   1   
        11   1   1   .   .   .   .   .   .   .   .   .    2   .   O6     parsed_1a9l   1   
        11   1   2   .   .   .   .   .   .   .   .   .   37   .   N4     parsed_1a9l   1   
        12   1   1   .   .   .   .   .   .   .   .   .    2   .   N2     parsed_1a9l   1   
        12   1   2   .   .   .   .   .   .   .   .   .   37   .   O2     parsed_1a9l   1   
        13   1   1   .   .   .   .   .   .   .   .   .    3   .   H1     parsed_1a9l   1   
        13   1   2   .   .   .   .   .   .   .   .   .   36   .   N3     parsed_1a9l   1   
        14   1   1   .   .   .   .   .   .   .   .   .    3   .   O6     parsed_1a9l   1   
        14   1   2   .   .   .   .   .   .   .   .   .   36   .   H42    parsed_1a9l   1   
        15   1   1   .   .   .   .   .   .   .   .   .    3   .   H22    parsed_1a9l   1   
        15   1   2   .   .   .   .   .   .   .   .   .   36   .   O2     parsed_1a9l   1   
        16   1   1   .   .   .   .   .   .   .   .   .    3   .   N1     parsed_1a9l   1   
        16   1   2   .   .   .   .   .   .   .   .   .   36   .   N3     parsed_1a9l   1   
        17   1   1   .   .   .   .   .   .   .   .   .    3   .   O6     parsed_1a9l   1   
        17   1   2   .   .   .   .   .   .   .   .   .   36   .   N4     parsed_1a9l   1   
        18   1   1   .   .   .   .   .   .   .   .   .    3   .   N2     parsed_1a9l   1   
        18   1   2   .   .   .   .   .   .   .   .   .   36   .   O2     parsed_1a9l   1   
        19   1   1   .   .   .   .   .   .   .   .   .   35   .   N1     parsed_1a9l   1   
        19   1   2   .   .   .   .   .   .   .   .   .    4   .   H3     parsed_1a9l   1   
        20   1   1   .   .   .   .   .   .   .   .   .   35   .   H62    parsed_1a9l   1   
        20   1   2   .   .   .   .   .   .   .   .   .    4   .   O4     parsed_1a9l   1   
        21   1   1   .   .   .   .   .   .   .   .   .   35   .   N1     parsed_1a9l   1   
        21   1   2   .   .   .   .   .   .   .   .   .    4   .   N3     parsed_1a9l   1   
        22   1   1   .   .   .   .   .   .   .   .   .   35   .   N6     parsed_1a9l   1   
        22   1   2   .   .   .   .   .   .   .   .   .    4   .   O4     parsed_1a9l   1   
        23   1   1   .   .   .   .   .   .   .   .   .    5   .   H1     parsed_1a9l   1   
        23   1   2   .   .   .   .   .   .   .   .   .   34   .   N3     parsed_1a9l   1   
        24   1   1   .   .   .   .   .   .   .   .   .    5   .   O6     parsed_1a9l   1   
        24   1   2   .   .   .   .   .   .   .   .   .   34   .   H42    parsed_1a9l   1   
        25   1   1   .   .   .   .   .   .   .   .   .    5   .   H22    parsed_1a9l   1   
        25   1   2   .   .   .   .   .   .   .   .   .   34   .   O2     parsed_1a9l   1   
        26   1   1   .   .   .   .   .   .   .   .   .    5   .   N1     parsed_1a9l   1   
        26   1   2   .   .   .   .   .   .   .   .   .   34   .   N3     parsed_1a9l   1   
        27   1   1   .   .   .   .   .   .   .   .   .    5   .   O6     parsed_1a9l   1   
        27   1   2   .   .   .   .   .   .   .   .   .   34   .   N4     parsed_1a9l   1   
        28   1   1   .   .   .   .   .   .   .   .   .    5   .   N2     parsed_1a9l   1   
        28   1   2   .   .   .   .   .   .   .   .   .   34   .   O2     parsed_1a9l   1   
        29   1   1   .   .   .   .   .   .   .   .   .    6   .   N1     parsed_1a9l   1   
        29   1   2   .   .   .   .   .   .   .   .   .   33   .   H3     parsed_1a9l   1   
        30   1   1   .   .   .   .   .   .   .   .   .    6   .   H62    parsed_1a9l   1   
        30   1   2   .   .   .   .   .   .   .   .   .   33   .   O4     parsed_1a9l   1   
        31   1   1   .   .   .   .   .   .   .   .   .    6   .   N1     parsed_1a9l   1   
        31   1   2   .   .   .   .   .   .   .   .   .   33   .   N3     parsed_1a9l   1   
        32   1   1   .   .   .   .   .   .   .   .   .    6   .   N6     parsed_1a9l   1   
        32   1   2   .   .   .   .   .   .   .   .   .   33   .   O4     parsed_1a9l   1   
        33   1   1   .   .   .   .   .   .   .   .   .   29   .   H1     parsed_1a9l   1   
        33   1   2   .   .   .   .   .   .   .   .   .    7   .   N3     parsed_1a9l   1   
        34   1   1   .   .   .   .   .   .   .   .   .   29   .   O6     parsed_1a9l   1   
        34   1   2   .   .   .   .   .   .   .   .   .    7   .   H42    parsed_1a9l   1   
        35   1   1   .   .   .   .   .   .   .   .   .   29   .   H22    parsed_1a9l   1   
        35   1   2   .   .   .   .   .   .   .   .   .    7   .   O2     parsed_1a9l   1   
        36   1   1   .   .   .   .   .   .   .   .   .   29   .   N1     parsed_1a9l   1   
        36   1   2   .   .   .   .   .   .   .   .   .    7   .   N3     parsed_1a9l   1   
        37   1   1   .   .   .   .   .   .   .   .   .   29   .   O6     parsed_1a9l   1   
        37   1   2   .   .   .   .   .   .   .   .   .    7   .   N4     parsed_1a9l   1   
        38   1   1   .   .   .   .   .   .   .   .   .   29   .   N2     parsed_1a9l   1   
        38   1   2   .   .   .   .   .   .   .   .   .    7   .   O2     parsed_1a9l   1   
        39   1   1   .   .   .   .   .   .   .   .   .   28   .   N1     parsed_1a9l   1   
        39   1   2   .   .   .   .   .   .   .   .   .    8   .   H3     parsed_1a9l   1   
        40   1   1   .   .   .   .   .   .   .   .   .   28   .   H62    parsed_1a9l   1   
        40   1   2   .   .   .   .   .   .   .   .   .    8   .   O4     parsed_1a9l   1   
        41   1   1   .   .   .   .   .   .   .   .   .   28   .   N1     parsed_1a9l   1   
        41   1   2   .   .   .   .   .   .   .   .   .    8   .   N3     parsed_1a9l   1   
        42   1   1   .   .   .   .   .   .   .   .   .   28   .   N6     parsed_1a9l   1   
        42   1   2   .   .   .   .   .   .   .   .   .    8   .   O4     parsed_1a9l   1   
        43   1   1   .   .   .   .   .   .   .   .   .   27   .   H1     parsed_1a9l   1   
        43   1   2   .   .   .   .   .   .   .   .   .    9   .   N3     parsed_1a9l   1   
        44   1   1   .   .   .   .   .   .   .   .   .   27   .   O6     parsed_1a9l   1   
        44   1   2   .   .   .   .   .   .   .   .   .    9   .   H42    parsed_1a9l   1   
        45   1   1   .   .   .   .   .   .   .   .   .   27   .   H22    parsed_1a9l   1   
        45   1   2   .   .   .   .   .   .   .   .   .    9   .   O2     parsed_1a9l   1   
        46   1   1   .   .   .   .   .   .   .   .   .   27   .   N1     parsed_1a9l   1   
        46   1   2   .   .   .   .   .   .   .   .   .    9   .   N3     parsed_1a9l   1   
        47   1   1   .   .   .   .   .   .   .   .   .   27   .   O6     parsed_1a9l   1   
        47   1   2   .   .   .   .   .   .   .   .   .    9   .   N4     parsed_1a9l   1   
        48   1   1   .   .   .   .   .   .   .   .   .   27   .   N2     parsed_1a9l   1   
        48   1   2   .   .   .   .   .   .   .   .   .    9   .   O2     parsed_1a9l   1   
        49   1   1   .   .   .   .   .   .   .   .   .   26   .   H1     parsed_1a9l   1   
        49   1   2   .   .   .   .   .   .   .   .   .   10   .   N3     parsed_1a9l   1   
        50   1   1   .   .   .   .   .   .   .   .   .   26   .   O6     parsed_1a9l   1   
        50   1   2   .   .   .   .   .   .   .   .   .   10   .   H42    parsed_1a9l   1   
        51   1   1   .   .   .   .   .   .   .   .   .   26   .   H22    parsed_1a9l   1   
        51   1   2   .   .   .   .   .   .   .   .   .   10   .   O2     parsed_1a9l   1   
        52   1   1   .   .   .   .   .   .   .   .   .   26   .   N1     parsed_1a9l   1   
        52   1   2   .   .   .   .   .   .   .   .   .   10   .   N3     parsed_1a9l   1   
        53   1   1   .   .   .   .   .   .   .   .   .   26   .   O6     parsed_1a9l   1   
        53   1   2   .   .   .   .   .   .   .   .   .   10   .   N4     parsed_1a9l   1   
        54   1   1   .   .   .   .   .   .   .   .   .   26   .   N2     parsed_1a9l   1   
        54   1   2   .   .   .   .   .   .   .   .   .   10   .   O2     parsed_1a9l   1   
        55   1   1   .   .   .   .   .   .   .   .   .   14   .   H1     parsed_1a9l   1   
        55   1   2   .   .   .   .   .   .   .   .   .   25   .   N3     parsed_1a9l   1   
        56   1   1   .   .   .   .   .   .   .   .   .   14   .   O6     parsed_1a9l   1   
        56   1   2   .   .   .   .   .   .   .   .   .   25   .   H42    parsed_1a9l   1   
        57   1   1   .   .   .   .   .   .   .   .   .   14   .   H22    parsed_1a9l   1   
        57   1   2   .   .   .   .   .   .   .   .   .   25   .   O2     parsed_1a9l   1   
        58   1   1   .   .   .   .   .   .   .   .   .   14   .   N1     parsed_1a9l   1   
        58   1   2   .   .   .   .   .   .   .   .   .   25   .   N3     parsed_1a9l   1   
        59   1   1   .   .   .   .   .   .   .   .   .   14   .   O6     parsed_1a9l   1   
        59   1   2   .   .   .   .   .   .   .   .   .   25   .   N4     parsed_1a9l   1   
        60   1   1   .   .   .   .   .   .   .   .   .   14   .   N2     parsed_1a9l   1   
        60   1   2   .   .   .   .   .   .   .   .   .   25   .   O2     parsed_1a9l   1   
        61   1   1   .   .   .   .   .   .   .   .   .   15   .   H1     parsed_1a9l   1   
        61   1   2   .   .   .   .   .   .   .   .   .   24   .   N3     parsed_1a9l   1   
        62   1   1   .   .   .   .   .   .   .   .   .   15   .   O6     parsed_1a9l   1   
        62   1   2   .   .   .   .   .   .   .   .   .   24   .   H42    parsed_1a9l   1   
        63   1   1   .   .   .   .   .   .   .   .   .   15   .   H22    parsed_1a9l   1   
        63   1   2   .   .   .   .   .   .   .   .   .   24   .   O2     parsed_1a9l   1   
        64   1   1   .   .   .   .   .   .   .   .   .   15   .   N1     parsed_1a9l   1   
        64   1   2   .   .   .   .   .   .   .   .   .   24   .   N3     parsed_1a9l   1   
        65   1   1   .   .   .   .   .   .   .   .   .   15   .   O6     parsed_1a9l   1   
        65   1   2   .   .   .   .   .   .   .   .   .   24   .   N4     parsed_1a9l   1   
        66   1   1   .   .   .   .   .   .   .   .   .   15   .   N2     parsed_1a9l   1   
        66   1   2   .   .   .   .   .   .   .   .   .   24   .   O2     parsed_1a9l   1   
        67   1   1   .   .   .   .   .   .   .   .   .   23   .   N1     parsed_1a9l   1   
        67   1   2   .   .   .   .   .   .   .   .   .   16   .   H3     parsed_1a9l   1   
        68   1   1   .   .   .   .   .   .   .   .   .   23   .   H62    parsed_1a9l   1   
        68   1   2   .   .   .   .   .   .   .   .   .   16   .   O4     parsed_1a9l   1   
        69   1   1   .   .   .   .   .   .   .   .   .   23   .   N1     parsed_1a9l   1   
        69   1   2   .   .   .   .   .   .   .   .   .   16   .   N3     parsed_1a9l   1   
        70   1   1   .   .   .   .   .   .   .   .   .   23   .   N6     parsed_1a9l   1   
        70   1   2   .   .   .   .   .   .   .   .   .   16   .   O4     parsed_1a9l   1   
        71   1   1   .   .   .   .   .   .   .   .   .   22   .   H1     parsed_1a9l   1   
        71   1   2   .   .   .   .   .   .   .   .   .   17   .   N3     parsed_1a9l   1   
        72   1   1   .   .   .   .   .   .   .   .   .   22   .   O6     parsed_1a9l   1   
        72   1   2   .   .   .   .   .   .   .   .   .   17   .   H42    parsed_1a9l   1   
        73   1   1   .   .   .   .   .   .   .   .   .   22   .   H22    parsed_1a9l   1   
        73   1   2   .   .   .   .   .   .   .   .   .   17   .   O2     parsed_1a9l   1   
        74   1   1   .   .   .   .   .   .   .   .   .   22   .   N1     parsed_1a9l   1   
        74   1   2   .   .   .   .   .   .   .   .   .   17   .   N3     parsed_1a9l   1   
        75   1   1   .   .   .   .   .   .   .   .   .   22   .   O6     parsed_1a9l   1   
        75   1   2   .   .   .   .   .   .   .   .   .   17   .   N4     parsed_1a9l   1   
        76   1   1   .   .   .   .   .   .   .   .   .   22   .   N2     parsed_1a9l   1   
        76   1   2   .   .   .   .   .   .   .   .   .   17   .   O2     parsed_1a9l   1   
        77   1   1   .   .   .   .   .   .   .   .   .   18   .   N3     parsed_1a9l   1   
        77   1   2   .   .   .   .   .   .   .   .   .   21   .   H61    parsed_1a9l   1   
        78   1   1   .   .   .   .   .   .   .   .   .   18   .   N3     parsed_1a9l   1   
        78   1   2   .   .   .   .   .   .   .   .   .   21   .   N6     parsed_1a9l   1   
        79   1   1   .   .   .   .   .   .   .   .   .   18   .   H21    parsed_1a9l   1   
        79   1   2   .   .   .   .   .   .   .   .   .   21   .   N7     parsed_1a9l   1   
        80   1   1   .   .   .   .   .   .   .   .   .   18   .   N2     parsed_1a9l   1   
        80   1   2   .   .   .   .   .   .   .   .   .   21   .   N7     parsed_1a9l   1   
        81   1   1   .   .   .   .   .   .   .   .   .   18   .   HO2'   parsed_1a9l   1   
        81   1   2   .   .   .   .   .   .   .   .   .   20   .   N7     parsed_1a9l   1   
        82   1   1   .   .   .   .   .   .   .   .   .   18   .   O2'    parsed_1a9l   1   
        82   1   2   .   .   .   .   .   .   .   .   .   20   .   N7     parsed_1a9l   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   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
         2   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
         3   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
         4   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
         5   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
         6   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
         7   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
         8   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
         9   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        10   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        11   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        12   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        13   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        14   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        15   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        16   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        17   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        18   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        19   1   .   .   .   .   .   1.82   1.72   1.92   parsed_1a9l   1   
        20   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        21   1   .   .   .   .   .   2.82   2.72   2.92   parsed_1a9l   1   
        22   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        23   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        24   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        25   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        26   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        27   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        28   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        29   1   .   .   .   .   .   1.82   1.72   1.92   parsed_1a9l   1   
        30   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        31   1   .   .   .   .   .   2.82   2.72   2.92   parsed_1a9l   1   
        32   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        33   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        34   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        35   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        36   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        37   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        38   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        39   1   .   .   .   .   .   1.82   1.72   1.92   parsed_1a9l   1   
        40   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        41   1   .   .   .   .   .   2.82   2.72   2.92   parsed_1a9l   1   
        42   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        43   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        44   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        45   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        46   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        47   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        48   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        49   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        50   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        51   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        52   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        53   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        54   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        55   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        56   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        57   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        58   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        59   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        60   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        61   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        62   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        63   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        64   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        65   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        66   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        67   1   .   .   .   .   .   1.82   1.72   1.92   parsed_1a9l   1   
        68   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        69   1   .   .   .   .   .   2.82   2.72   2.92   parsed_1a9l   1   
        70   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        71   1   .   .   .   .   .   1.95   1.85   2.05   parsed_1a9l   1   
        72   1   .   .   .   .   .   1.91   1.81   2.01   parsed_1a9l   1   
        73   1   .   .   .   .   .   1.86   1.76   1.96   parsed_1a9l   1   
        74   1   .   .   .   .   .   2.95   2.85   3.05   parsed_1a9l   1   
        75   1   .   .   .   .   .   2.91   2.81   3.01   parsed_1a9l   1   
        76   1   .   .   .   .   .   2.86   2.76   2.96   parsed_1a9l   1   
        77   1   .   .   .   .   .   2.00   1.90   2.10   parsed_1a9l   1   
        78   1   .   .   .   .   .   3.00   2.90   3.10   parsed_1a9l   1   
        79   1   .   .   .   .   .   2.00   1.90   2.10   parsed_1a9l   1   
        80   1   .   .   .   .   .   3.00   2.90   3.10   parsed_1a9l   1   
        81   1   .   .   .   .   .   2.00   1.80   2.20   parsed_1a9l   1   
        82   1   .   .   .   .   .   3.00   2.80   3.20   parsed_1a9l   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   
;
basepair distances for hydrogen bonds

1-38 GC WC
;
     1   1     4   13   parsed_1a9l   1   
         2   "2-37 GC WC"                                                    12   1    13   13   parsed_1a9l   1   
         3   "3-36 GC WC"                                                    20   1    21   13   parsed_1a9l   1   
         4   "4-35 AU WC"                                                    28   1    29   12   parsed_1a9l   1   
         5   "5-34 GC WC"                                                    34   1    35   13   parsed_1a9l   1   
         6   "6-33 AU WC"                                                    42   1    44   12   parsed_1a9l   1   
         7   "7-29 CG WC"                                                    49   1    51   13   parsed_1a9l   1   
         8   "8-28 UA WC"                                                    58   1    60   12   parsed_1a9l   1   
         9   "9-27 CG WC"                                                    65   1    67   13   parsed_1a9l   1   
        10   "10-26 CG WC"                                                   74   1    76   14   parsed_1a9l   1   
        11   "14-25 GC WC"                                                   83   1    85   14   parsed_1a9l   1   
        12   "15-24 GC WC"                                                   92   1    94   14   parsed_1a9l   1   
        13   "16-23 AU WC"                                                  101   1   103   13   parsed_1a9l   1   
        14   "17-22 GC WC"                                                  108   1   110   14   parsed_1a9l   1   
        15   "18-21 GA (G18-A21) based on Jucker et al JMB 264 p968-980"    117   1   119   59   parsed_1a9l   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. Friday, April 19, 2024 1:04:06 AM GMT (wattos1)