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
53068 2oqs cing 2-parsed STAR distance hydrogen bond simple 64


data_2oqs_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2oqs 
    _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_2oqs   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2oqs 
    _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   2oqs   "Master copy"    parsed_2oqs   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2oqs 
    _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   2oqs.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2oqs   1   
        1   2oqs.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1121   parsed_2oqs   1   
        1   2oqs.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               64   parsed_2oqs   1   
        1   2oqs.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_2oqs   1   
        1   2oqs.mr   .   .    XPLOR/CNS     5   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_2oqs   1   
        1   2oqs.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2oqs   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2oqs 
    _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_2oqs   1   
         2   1   .   .   .   parsed_2oqs   1   
         3   1   .   .   .   parsed_2oqs   1   
         4   1   .   .   .   parsed_2oqs   1   
         5   1   .   .   .   parsed_2oqs   1   
         6   1   .   .   .   parsed_2oqs   1   
         7   1   .   .   .   parsed_2oqs   1   
         8   1   .   .   .   parsed_2oqs   1   
         9   1   .   .   .   parsed_2oqs   1   
        10   1   .   .   .   parsed_2oqs   1   
        11   1   .   .   .   parsed_2oqs   1   
        12   1   .   .   .   parsed_2oqs   1   
        13   1   .   .   .   parsed_2oqs   1   
        14   1   .   .   .   parsed_2oqs   1   
        15   1   .   .   .   parsed_2oqs   1   
        16   1   .   .   .   parsed_2oqs   1   
        17   1   .   .   .   parsed_2oqs   1   
        18   1   .   .   .   parsed_2oqs   1   
        19   1   .   .   .   parsed_2oqs   1   
        20   1   .   .   .   parsed_2oqs   1   
        21   1   .   .   .   parsed_2oqs   1   
        22   1   .   .   .   parsed_2oqs   1   
        23   1   .   .   .   parsed_2oqs   1   
        24   1   .   .   .   parsed_2oqs   1   
        25   1   .   .   .   parsed_2oqs   1   
        26   1   .   .   .   parsed_2oqs   1   
        27   1   .   .   .   parsed_2oqs   1   
        28   1   .   .   .   parsed_2oqs   1   
        29   1   .   .   .   parsed_2oqs   1   
        30   1   .   .   .   parsed_2oqs   1   
        31   1   .   .   .   parsed_2oqs   1   
        32   1   .   .   .   parsed_2oqs   1   
        33   1   .   .   .   parsed_2oqs   1   
        34   1   .   .   .   parsed_2oqs   1   
        35   1   .   .   .   parsed_2oqs   1   
        36   1   .   .   .   parsed_2oqs   1   
        37   1   .   .   .   parsed_2oqs   1   
        38   1   .   .   .   parsed_2oqs   1   
        39   1   .   .   .   parsed_2oqs   1   
        40   1   .   .   .   parsed_2oqs   1   
        41   1   .   .   .   parsed_2oqs   1   
        42   1   .   .   .   parsed_2oqs   1   
        43   1   .   .   .   parsed_2oqs   1   
        44   1   .   .   .   parsed_2oqs   1   
        45   1   .   .   .   parsed_2oqs   1   
        46   1   .   .   .   parsed_2oqs   1   
        47   1   .   .   .   parsed_2oqs   1   
        48   1   .   .   .   parsed_2oqs   1   
        49   1   .   .   .   parsed_2oqs   1   
        50   1   .   .   .   parsed_2oqs   1   
        51   1   .   .   .   parsed_2oqs   1   
        52   1   .   .   .   parsed_2oqs   1   
        53   1   .   .   .   parsed_2oqs   1   
        54   1   .   .   .   parsed_2oqs   1   
        55   1   .   .   .   parsed_2oqs   1   
        56   1   .   .   .   parsed_2oqs   1   
        57   1   .   .   .   parsed_2oqs   1   
        58   1   .   .   .   parsed_2oqs   1   
        59   1   .   .   .   parsed_2oqs   1   
        60   1   .   .   .   parsed_2oqs   1   
        61   1   .   .   .   parsed_2oqs   1   
        62   1   .   .   .   parsed_2oqs   1   
        63   1   .   .   .   parsed_2oqs   1   
        64   1   .   .   .   parsed_2oqs   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   .   .   .   .   .   .   .   .   A    3   .   HN    parsed_2oqs   1   
         1   1   2   .   .   .   .   .   .   .   .   A   83   .   O     parsed_2oqs   1   
         2   1   1   .   .   .   .   .   .   .   .   A    3   .   N     parsed_2oqs   1   
         2   1   2   .   .   .   .   .   .   .   .   A   83   .   O     parsed_2oqs   1   
         3   1   1   .   .   .   .   .   .   .   .   A    3   .   O     parsed_2oqs   1   
         3   1   2   .   .   .   .   .   .   .   .   A   83   .   HN    parsed_2oqs   1   
         4   1   1   .   .   .   .   .   .   .   .   A    3   .   O     parsed_2oqs   1   
         4   1   2   .   .   .   .   .   .   .   .   A   83   .   N     parsed_2oqs   1   
         5   1   1   .   .   .   .   .   .   .   .   A    5   .   HN    parsed_2oqs   1   
         5   1   2   .   .   .   .   .   .   .   .   A   81   .   O     parsed_2oqs   1   
         6   1   1   .   .   .   .   .   .   .   .   A    5   .   N     parsed_2oqs   1   
         6   1   2   .   .   .   .   .   .   .   .   A   81   .   O     parsed_2oqs   1   
         7   1   1   .   .   .   .   .   .   .   .   A    5   .   O     parsed_2oqs   1   
         7   1   2   .   .   .   .   .   .   .   .   A   81   .   HN    parsed_2oqs   1   
         8   1   1   .   .   .   .   .   .   .   .   A    5   .   O     parsed_2oqs   1   
         8   1   2   .   .   .   .   .   .   .   .   A   81   .   N     parsed_2oqs   1   
         9   1   1   .   .   .   .   .   .   .   .   A    7   .   HN    parsed_2oqs   1   
         9   1   2   .   .   .   .   .   .   .   .   A   79   .   O     parsed_2oqs   1   
        10   1   1   .   .   .   .   .   .   .   .   A    7   .   N     parsed_2oqs   1   
        10   1   2   .   .   .   .   .   .   .   .   A   79   .   O     parsed_2oqs   1   
        11   1   1   .   .   .   .   .   .   .   .   A   15   .   HN    parsed_2oqs   1   
        11   1   2   .   .   .   .   .   .   .   .   A   35   .   O     parsed_2oqs   1   
        12   1   1   .   .   .   .   .   .   .   .   A   15   .   N     parsed_2oqs   1   
        12   1   2   .   .   .   .   .   .   .   .   A   35   .   O     parsed_2oqs   1   
        13   1   1   .   .   .   .   .   .   .   .   A   17   .   HN    parsed_2oqs   1   
        13   1   2   .   .   .   .   .   .   .   .   A   32   .   O     parsed_2oqs   1   
        14   1   1   .   .   .   .   .   .   .   .   A   17   .   N     parsed_2oqs   1   
        14   1   2   .   .   .   .   .   .   .   .   A   32   .   O     parsed_2oqs   1   
        15   1   1   .   .   .   .   .   .   .   .   A   17   .   O     parsed_2oqs   1   
        15   1   2   .   .   .   .   .   .   .   .   A   32   .   HN    parsed_2oqs   1   
        16   1   1   .   .   .   .   .   .   .   .   A   17   .   O     parsed_2oqs   1   
        16   1   2   .   .   .   .   .   .   .   .   A   32   .   HN    parsed_2oqs   1   
        17   1   1   .   .   .   .   .   .   .   .   A   18   .   HN    parsed_2oqs   1   
        17   1   2   .   .   .   .   .   .   .   .   A   22   .   O     parsed_2oqs   1   
        18   1   1   .   .   .   .   .   .   .   .   A   18   .   N     parsed_2oqs   1   
        18   1   2   .   .   .   .   .   .   .   .   A   22   .   O     parsed_2oqs   1   
        19   1   1   .   .   .   .   .   .   .   .   A   19   .   O     parsed_2oqs   1   
        19   1   2   .   .   .   .   .   .   .   .   A   22   .   HN    parsed_2oqs   1   
        20   1   1   .   .   .   .   .   .   .   .   A   19   .   O     parsed_2oqs   1   
        20   1   2   .   .   .   .   .   .   .   .   A   22   .   HN    parsed_2oqs   1   
        21   1   1   .   .   .   .   .   .   .   .   A   22   .   HN    parsed_2oqs   1   
        21   1   2   .   .   .   .   .   .   .   .   A   19   .   O     parsed_2oqs   1   
        22   1   1   .   .   .   .   .   .   .   .   A   22   .   N     parsed_2oqs   1   
        22   1   2   .   .   .   .   .   .   .   .   A   19   .   O     parsed_2oqs   1   
        23   1   1   .   .   .   .   .   .   .   .   A   31   .   HN    parsed_2oqs   1   
        23   1   2   .   .   .   .   .   .   .   .   A   62   .   O     parsed_2oqs   1   
        24   1   1   .   .   .   .   .   .   .   .   A   31   .   N     parsed_2oqs   1   
        24   1   2   .   .   .   .   .   .   .   .   A   62   .   O     parsed_2oqs   1   
        25   1   1   .   .   .   .   .   .   .   .   A   31   .   O     parsed_2oqs   1   
        25   1   2   .   .   .   .   .   .   .   .   A   54   .   HN    parsed_2oqs   1   
        26   1   1   .   .   .   .   .   .   .   .   A   31   .   O     parsed_2oqs   1   
        26   1   2   .   .   .   .   .   .   .   .   A   54   .   N     parsed_2oqs   1   
        27   1   1   .   .   .   .   .   .   .   .   A   33   .   HN    parsed_2oqs   1   
        27   1   2   .   .   .   .   .   .   .   .   A   52   .   O     parsed_2oqs   1   
        28   1   1   .   .   .   .   .   .   .   .   A   33   .   N     parsed_2oqs   1   
        28   1   2   .   .   .   .   .   .   .   .   A   52   .   O     parsed_2oqs   1   
        29   1   1   .   .   .   .   .   .   .   .   A   40   .   HN    parsed_2oqs   1   
        29   1   2   .   .   .   .   .   .   .   .   A   37   .   O     parsed_2oqs   1   
        30   1   1   .   .   .   .   .   .   .   .   A   40   .   N     parsed_2oqs   1   
        30   1   2   .   .   .   .   .   .   .   .   A   37   .   O     parsed_2oqs   1   
        31   1   1   .   .   .   .   .   .   .   .   A   44   .   HN    parsed_2oqs   1   
        31   1   2   .   .   .   .   .   .   .   .   A   40   .   O     parsed_2oqs   1   
        32   1   1   .   .   .   .   .   .   .   .   A   44   .   N     parsed_2oqs   1   
        32   1   2   .   .   .   .   .   .   .   .   A   40   .   O     parsed_2oqs   1   
        33   1   1   .   .   .   .   .   .   .   .   A   45   .   HN    parsed_2oqs   1   
        33   1   2   .   .   .   .   .   .   .   .   A   41   .   O     parsed_2oqs   1   
        34   1   1   .   .   .   .   .   .   .   .   A   45   .   N     parsed_2oqs   1   
        34   1   2   .   .   .   .   .   .   .   .   A   41   .   O     parsed_2oqs   1   
        35   1   1   .   .   .   .   .   .   .   .   A   46   .   HN    parsed_2oqs   1   
        35   1   2   .   .   .   .   .   .   .   .   A   42   .   O     parsed_2oqs   1   
        36   1   1   .   .   .   .   .   .   .   .   A   46   .   N     parsed_2oqs   1   
        36   1   2   .   .   .   .   .   .   .   .   A   42   .   O     parsed_2oqs   1   
        37   1   1   .   .   .   .   .   .   .   .   A   49   .   O     parsed_2oqs   1   
        37   1   2   .   .   .   .   .   .   .   .   A   52   .   HN    parsed_2oqs   1   
        38   1   1   .   .   .   .   .   .   .   .   A   49   .   O     parsed_2oqs   1   
        38   1   2   .   .   .   .   .   .   .   .   A   52   .   N     parsed_2oqs   1   
        39   1   1   .   .   .   .   .   .   .   .   A   49   .   HN    parsed_2oqs   1   
        39   1   2   .   .   .   .   .   .   .   .   A   52   .   OD2   parsed_2oqs   1   
        40   1   1   .   .   .   .   .   .   .   .   A   49   .   N     parsed_2oqs   1   
        40   1   2   .   .   .   .   .   .   .   .   A   52   .   OD2   parsed_2oqs   1   
        41   1   1   .   .   .   .   .   .   .   .   A   55   .   O     parsed_2oqs   1   
        41   1   2   .   .   .   .   .   .   .   .   A   62   .   HN    parsed_2oqs   1   
        42   1   1   .   .   .   .   .   .   .   .   A   55   .   O     parsed_2oqs   1   
        42   1   2   .   .   .   .   .   .   .   .   A   62   .   N     parsed_2oqs   1   
        43   1   1   .   .   .   .   .   .   .   .   A   55   .   HN    parsed_2oqs   1   
        43   1   2   .   .   .   .   .   .   .   .   A   84   .   O     parsed_2oqs   1   
        44   1   1   .   .   .   .   .   .   .   .   A   55   .   N     parsed_2oqs   1   
        44   1   2   .   .   .   .   .   .   .   .   A   84   .   O     parsed_2oqs   1   
        45   1   1   .   .   .   .   .   .   .   .   A   56   .   HN    parsed_2oqs   1   
        45   1   2   .   .   .   .   .   .   .   .   A   84   .   O     parsed_2oqs   1   
        46   1   1   .   .   .   .   .   .   .   .   A   56   .   N     parsed_2oqs   1   
        46   1   2   .   .   .   .   .   .   .   .   A   84   .   O     parsed_2oqs   1   
        47   1   1   .   .   .   .   .   .   .   .   A   56   .   O     parsed_2oqs   1   
        47   1   2   .   .   .   .   .   .   .   .   A   84   .   HN    parsed_2oqs   1   
        48   1   1   .   .   .   .   .   .   .   .   A   56   .   N     parsed_2oqs   1   
        48   1   2   .   .   .   .   .   .   .   .   A   84   .   O     parsed_2oqs   1   
        49   1   1   .   .   .   .   .   .   .   .   A   57   .   HN    parsed_2oqs   1   
        49   1   2   .   .   .   .   .   .   .   .   A   60   .   O     parsed_2oqs   1   
        50   1   1   .   .   .   .   .   .   .   .   A   57   .   N     parsed_2oqs   1   
        50   1   2   .   .   .   .   .   .   .   .   A   60   .   O     parsed_2oqs   1   
        51   1   1   .   .   .   .   .   .   .   .   A   57   .   O     parsed_2oqs   1   
        51   1   2   .   .   .   .   .   .   .   .   A   60   .   HN    parsed_2oqs   1   
        52   1   1   .   .   .   .   .   .   .   .   A   57   .   O     parsed_2oqs   1   
        52   1   2   .   .   .   .   .   .   .   .   A   60   .   N     parsed_2oqs   1   
        53   1   1   .   .   .   .   .   .   .   .   A   66   .   O     parsed_2oqs   1   
        53   1   2   .   .   .   .   .   .   .   .   A   70   .   HN    parsed_2oqs   1   
        54   1   1   .   .   .   .   .   .   .   .   A   66   .   O     parsed_2oqs   1   
        54   1   2   .   .   .   .   .   .   .   .   A   70   .   N     parsed_2oqs   1   
        55   1   1   .   .   .   .   .   .   .   .   A   67   .   O     parsed_2oqs   1   
        55   1   2   .   .   .   .   .   .   .   .   A   71   .   HN    parsed_2oqs   1   
        56   1   1   .   .   .   .   .   .   .   .   A   67   .   O     parsed_2oqs   1   
        56   1   2   .   .   .   .   .   .   .   .   A   71   .   N     parsed_2oqs   1   
        57   1   1   .   .   .   .   .   .   .   .   A   68   .   O     parsed_2oqs   1   
        57   1   2   .   .   .   .   .   .   .   .   A   72   .   HN    parsed_2oqs   1   
        58   1   1   .   .   .   .   .   .   .   .   A   68   .   O     parsed_2oqs   1   
        58   1   2   .   .   .   .   .   .   .   .   A   72   .   N     parsed_2oqs   1   
        59   1   1   .   .   .   .   .   .   .   .   A   69   .   O     parsed_2oqs   1   
        59   1   2   .   .   .   .   .   .   .   .   A   73   .   HN    parsed_2oqs   1   
        60   1   1   .   .   .   .   .   .   .   .   A   69   .   O     parsed_2oqs   1   
        60   1   2   .   .   .   .   .   .   .   .   A   73   .   N     parsed_2oqs   1   
        61   1   1   .   .   .   .   .   .   .   .   A   70   .   O     parsed_2oqs   1   
        61   1   2   .   .   .   .   .   .   .   .   A   74   .   HN    parsed_2oqs   1   
        62   1   1   .   .   .   .   .   .   .   .   A   70   .   O     parsed_2oqs   1   
        62   1   2   .   .   .   .   .   .   .   .   A   74   .   N     parsed_2oqs   1   
        63   1   1   .   .   .   .   .   .   .   .   A   71   .   O     parsed_2oqs   1   
        63   1   2   .   .   .   .   .   .   .   .   A   75   .   HN    parsed_2oqs   1   
        64   1   1   .   .   .   .   .   .   .   .   A   71   .   O     parsed_2oqs   1   
        64   1   2   .   .   .   .   .   .   .   .   A   75   .   N     parsed_2oqs   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   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
         2   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
         3   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
         4   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
         5   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
         6   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
         7   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
         8   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
         9   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        10   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        11   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        12   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        13   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        14   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        15   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        16   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        17   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        18   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        19   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        20   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        21   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        22   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        23   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        24   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        25   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        26   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        27   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        28   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        29   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        30   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        31   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        32   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        33   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        34   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        35   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        36   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        37   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        38   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        39   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        40   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        41   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        42   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        43   1   .   .   .   .   .   1.90   1.60   2.70   parsed_2oqs   1   
        44   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        45   1   .   .   .   .   .   1.90   1.60   2.80   parsed_2oqs   1   
        46   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        47   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        48   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        49   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        50   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        51   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        52   1   .   .   .   .   .   2.80   2.40   3.70   parsed_2oqs   1   
        53   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        54   1   .   .   .   .   .   2.80   2.40   3.70   parsed_2oqs   1   
        55   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        56   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        57   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        58   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        59   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        60   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        61   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        62   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   1   
        63   1   .   .   .   .   .   1.90   1.60   2.40   parsed_2oqs   1   
        64   1   .   .   .   .   .   2.80   2.40   3.50   parsed_2oqs   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-bond              1   90    1    99   parsed_2oqs   1   
         2    H-bond              2   89    2    97   parsed_2oqs   1   
         3    H-bond              3   90    3    98   parsed_2oqs   1   
         4    H-bond              4   89    4    97   parsed_2oqs   1   
         5    H-bond              5   90    5    98   parsed_2oqs   1   
         6    H-bond              6   89    6    97   parsed_2oqs   1   
         7    H-bond              7   90    7    98   parsed_2oqs   1   
         8    H-bond              8   89    8    97   parsed_2oqs   1   
         9    H-bond              9   90    9    98   parsed_2oqs   1   
        10    H-bond             10   89   10    97   parsed_2oqs   1   
        11    H-bond             11   91   11    99   parsed_2oqs   1   
        12    H-bond             12   90   12    98   parsed_2oqs   1   
        13    H-bond             13   91   13    99   parsed_2oqs   1   
        14    H-bond             14   90   14    98   parsed_2oqs   1   
        15    H-bond             15   91   15    99   parsed_2oqs   1   
        16    H-bond             16   91   16    99   parsed_2oqs   1   
        17    H-bond             17   91   17    99   parsed_2oqs   1   
        18    H-bond             18   90   18    98   parsed_2oqs   1   
        19    H-bond             19   91   19    99   parsed_2oqs   1   
        20    H-bond             20   91   20    99   parsed_2oqs   1   
        21    H-bond             21   91   21    99   parsed_2oqs   1   
        22    H-bond             22   90   22    98   parsed_2oqs   1   
        23    H-bond             23   91   23    99   parsed_2oqs   1   
        24    H-bond             24   90   24    98   parsed_2oqs   1   
        25    H-bond             25   91   25    99   parsed_2oqs   1   
        26    H-bond             26   91   26    99   parsed_2oqs   1   
        27    H-bond             27   92   27   100   parsed_2oqs   1   
        28    H-bond             28   91   28    99   parsed_2oqs   1   
        29    H-bond             29   92   29   100   parsed_2oqs   1   
        30    H-bond             30   91   30    99   parsed_2oqs   1   
        31    H-bond             31   92   31   100   parsed_2oqs   1   
        32    H-bond             32   91   32    99   parsed_2oqs   1   
        33    H-bond             33   92   33   100   parsed_2oqs   1   
        34    H-bond             34   91   34    99   parsed_2oqs   1   
        35    H-bond             35   92   35   100   parsed_2oqs   1   
        36    H-bond             36   91   36    99   parsed_2oqs   1   
        37   "Q49/33, H-bond"    37   92   37   110   parsed_2oqs   1   
        38   "Q49/33, H-bond"    38   92   38   110   parsed_2oqs   1   
        39    H-bond             39   93   39   101   parsed_2oqs   1   
        40    H-bond             40   93   40   101   parsed_2oqs   1   
        41    H-bond             41   91   41    99   parsed_2oqs   1   
        42    H-bond             42   91   42    99   parsed_2oqs   1   
        43    H-bond,            43   92   43   102   parsed_2oqs   1   
        44    H-bond,            44   91   44   101   parsed_2oqs   1   
        45    H-bond             45   92   45   100   parsed_2oqs   1   
        46    H-bond             46   90   46    98   parsed_2oqs   1   
        47    H-bond             47   92   47   100   parsed_2oqs   1   
        48    H-bond             48   91   48    99   parsed_2oqs   1   
        49    H-bond             49   91   49    99   parsed_2oqs   1   
        50    H-bond             50   91   50    99   parsed_2oqs   1   
        51    H-bond             51   91   51    99   parsed_2oqs   1   
        52    H-bond             52   91   52    99   parsed_2oqs   1   
        53    H-bond             53   91   53    99   parsed_2oqs   1   
        54    H-bond             54   91   54    99   parsed_2oqs   1   
        55    H-bond             55   91   55    99   parsed_2oqs   1   
        56    H-bond             56   91   56    99   parsed_2oqs   1   
        57    H-bond             57   91   57    99   parsed_2oqs   1   
        58    H-bond             58   91   58    99   parsed_2oqs   1   
        59    H-bond             59   91   59    99   parsed_2oqs   1   
        60    H-bond             60   91   60    99   parsed_2oqs   1   
        61    H-bond             61   91   61    99   parsed_2oqs   1   
        62    H-bond             62   91   62    99   parsed_2oqs   1   
        63    H-bond             63   91   63    99   parsed_2oqs   1   
        64    H-bond             64   91   64    99   parsed_2oqs   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, July 6, 2024 4:26:14 AM GMT (wattos1)