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
645726 6pvt 30646 cing 2-parsed STAR distance NOE ambi 102


data_6pvt_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_6pvt 
    _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_6pvt   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_6pvt 
    _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   6pvt   "Master copy"    parsed_6pvt   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_6pvt 
    _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   6pvt.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_6pvt   1   
        1   6pvt.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"    "Not applicable"    232   parsed_6pvt   1   
        1   6pvt.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple             152   parsed_6pvt   1   
        1   6pvt.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple               0   parsed_6pvt   1   
        1   6pvt.mr   .   .    XPLOR/CNS     5   "dipolar coupling"        "Not applicable"    "Not applicable"     92   parsed_6pvt   1   
        1   6pvt.mr   .   .    XPLOR/CNS     6    distance                  NOE                 ambi               102   parsed_6pvt   1   
        1   6pvt.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_6pvt   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_6
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_6pvt 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            6 
    _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_6pvt   1   
          2   1   .   .   .   parsed_6pvt   1   
          3   1   .   .   .   parsed_6pvt   1   
          4   1   .   .   .   parsed_6pvt   1   
          5   1   .   .   .   parsed_6pvt   1   
          6   1   .   .   .   parsed_6pvt   1   
          7   1   .   .   .   parsed_6pvt   1   
          8   1   .   .   .   parsed_6pvt   1   
          9   1   .   .   .   parsed_6pvt   1   
         10   1   .   .   .   parsed_6pvt   1   
         11   1   .   .   .   parsed_6pvt   1   
         12   1   .   .   .   parsed_6pvt   1   
         13   1   .   .   .   parsed_6pvt   1   
         14   1   .   .   .   parsed_6pvt   1   
         15   1   .   .   .   parsed_6pvt   1   
         16   1   .   .   .   parsed_6pvt   1   
         17   1   .   .   .   parsed_6pvt   1   
         18   1   .   .   .   parsed_6pvt   1   
         19   1   .   .   .   parsed_6pvt   1   
         20   1   .   .   .   parsed_6pvt   1   
         21   1   .   .   .   parsed_6pvt   1   
         22   1   .   .   .   parsed_6pvt   1   
         23   1   .   .   .   parsed_6pvt   1   
         24   1   .   .   .   parsed_6pvt   1   
         25   1   .   .   .   parsed_6pvt   1   
         26   1   .   .   .   parsed_6pvt   1   
         27   1   .   .   .   parsed_6pvt   1   
         28   1   .   .   .   parsed_6pvt   1   
         29   1   .   .   .   parsed_6pvt   1   
         30   1   .   .   .   parsed_6pvt   1   
         31   1   .   .   .   parsed_6pvt   1   
         32   1   .   .   .   parsed_6pvt   1   
         33   1   .   .   .   parsed_6pvt   1   
         34   1   .   .   .   parsed_6pvt   1   
         35   1   .   .   .   parsed_6pvt   1   
         36   1   .   .   .   parsed_6pvt   1   
         37   1   .   .   .   parsed_6pvt   1   
         38   1   .   .   .   parsed_6pvt   1   
         39   1   .   .   .   parsed_6pvt   1   
         40   1   .   .   .   parsed_6pvt   1   
         41   1   .   .   .   parsed_6pvt   1   
         42   1   .   .   .   parsed_6pvt   1   
         43   1   .   .   .   parsed_6pvt   1   
         44   1   .   .   .   parsed_6pvt   1   
         45   1   .   .   .   parsed_6pvt   1   
         46   1   .   .   .   parsed_6pvt   1   
         47   1   .   .   .   parsed_6pvt   1   
         48   1   .   .   .   parsed_6pvt   1   
         49   1   .   .   .   parsed_6pvt   1   
         50   1   .   .   .   parsed_6pvt   1   
         51   1   .   .   .   parsed_6pvt   1   
         52   1   .   .   .   parsed_6pvt   1   
         53   1   .   .   .   parsed_6pvt   1   
         54   1   .   .   .   parsed_6pvt   1   
         55   1   .   .   .   parsed_6pvt   1   
         56   1   .   .   .   parsed_6pvt   1   
         57   1   .   .   .   parsed_6pvt   1   
         58   1   .   .   .   parsed_6pvt   1   
         59   1   .   .   .   parsed_6pvt   1   
         60   1   .   .   .   parsed_6pvt   1   
         61   1   .   .   .   parsed_6pvt   1   
         62   1   .   .   .   parsed_6pvt   1   
         63   1   .   .   .   parsed_6pvt   1   
         64   1   .   .   .   parsed_6pvt   1   
         65   1   .   .   .   parsed_6pvt   1   
         66   1   .   .   .   parsed_6pvt   1   
         67   1   .   .   .   parsed_6pvt   1   
         68   1   .   .   .   parsed_6pvt   1   
         69   1   .   .   .   parsed_6pvt   1   
         70   1   .   .   .   parsed_6pvt   1   
         71   1   .   .   .   parsed_6pvt   1   
         72   1   .   .   .   parsed_6pvt   1   
         73   1   .   .   .   parsed_6pvt   1   
         74   1   .   .   .   parsed_6pvt   1   
         75   1   .   .   .   parsed_6pvt   1   
         76   1   .   .   .   parsed_6pvt   1   
         77   1   .   .   .   parsed_6pvt   1   
         78   1   .   .   .   parsed_6pvt   1   
         79   1   .   .   .   parsed_6pvt   1   
         80   1   .   .   .   parsed_6pvt   1   
         81   1   .   .   .   parsed_6pvt   1   
         82   1   .   .   .   parsed_6pvt   1   
         83   1   .   .   .   parsed_6pvt   1   
         84   1   .   .   .   parsed_6pvt   1   
         85   1   .   .   .   parsed_6pvt   1   
         86   1   .   .   .   parsed_6pvt   1   
         87   1   .   .   .   parsed_6pvt   1   
         88   1   .   .   .   parsed_6pvt   1   
         89   1   .   .   .   parsed_6pvt   1   
         90   1   .   .   .   parsed_6pvt   1   
         91   1   .   .   .   parsed_6pvt   1   
         92   1   .   .   .   parsed_6pvt   1   
         93   1   .   .   .   parsed_6pvt   1   
         94   1   .   .   .   parsed_6pvt   1   
         95   1   .   .   .   parsed_6pvt   1   
         96   1   .   .   .   parsed_6pvt   1   
         97   1   .   .   .   parsed_6pvt   1   
         98   1   .   .   .   parsed_6pvt   1   
         99   1   .   .   .   parsed_6pvt   1   
        100   1   .   .   .   parsed_6pvt   1   
        101   1   .   .   .   parsed_6pvt   1   
        102   1   .   .   .   parsed_6pvt   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   20   .   HZ    parsed_6pvt   1   
          1   1   2   .   .   .   .   .   .   .   .   B   16   .   CB    parsed_6pvt   1   
          2   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          2   1   2   .   .   .   .   .   .   .   .   B   16   .   CB    parsed_6pvt   1   
          3   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          3   1   2   .   .   .   .   .   .   .   .   B   18   .   CD2   parsed_6pvt   1   
          4   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          4   1   2   .   .   .   .   .   .   .   .   B   18   .   CD1   parsed_6pvt   1   
          4   1   2   .   .   .   .   .   .   .   .   B   18   .   CG    parsed_6pvt   1   
          5   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          5   1   2   .   .   .   .   .   .   .   .   B   18   .   CB    parsed_6pvt   1   
          6   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          6   1   2   .   .   .   .   .   .   .   .   B   18   .   CA    parsed_6pvt   1   
          7   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          7   1   2   .   .   .   .   .   .   .   .   B   19   .   CA    parsed_6pvt   1   
          8   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          8   1   2   .   .   .   .   .   .   .   .   B   19   .   CD2   parsed_6pvt   1   
          9   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
          9   1   2   .   .   .   .   .   .   .   .   B   21   .   CA    parsed_6pvt   1   
         10   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         10   1   2   .   .   .   .   .   .   .   .   B   21   .   CB    parsed_6pvt   1   
         11   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         11   1   2   .   .   .   .   .   .   .   .   B   22   .   CA    parsed_6pvt   1   
         12   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         12   1   2   .   .   .   .   .   .   .   .   B   22   .   CB    parsed_6pvt   1   
         13   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         13   1   2   .   .   .   .   .   .   .   .   B   23   .   CG    parsed_6pvt   1   
         14   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         14   1   2   .   .   .   .   .   .   .   .   B   23   .   CE3   parsed_6pvt   1   
         15   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         15   1   2   .   .   .   .   .   .   .   .   B   23   .   CH2   parsed_6pvt   1   
         16   1   1   .   .   .   .   .   .   .   .   A   20   .   HZ    parsed_6pvt   1   
         16   1   2   .   .   .   .   .   .   .   .   B   23   .   CZ3   parsed_6pvt   1   
         17   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         17   1   2   .   .   .   .   .   .   .   .   C   16   .   CB    parsed_6pvt   1   
         18   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         18   1   2   .   .   .   .   .   .   .   .   C   16   .   CB    parsed_6pvt   1   
         19   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         19   1   2   .   .   .   .   .   .   .   .   C   18   .   CD2   parsed_6pvt   1   
         20   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         20   1   2   .   .   .   .   .   .   .   .   C   18   .   CD1   parsed_6pvt   1   
         20   1   2   .   .   .   .   .   .   .   .   C   18   .   CG    parsed_6pvt   1   
         21   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         21   1   2   .   .   .   .   .   .   .   .   C   18   .   CB    parsed_6pvt   1   
         22   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         22   1   2   .   .   .   .   .   .   .   .   C   18   .   CA    parsed_6pvt   1   
         23   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         23   1   2   .   .   .   .   .   .   .   .   C   19   .   CA    parsed_6pvt   1   
         24   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         24   1   2   .   .   .   .   .   .   .   .   C   19   .   CD2   parsed_6pvt   1   
         25   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         25   1   2   .   .   .   .   .   .   .   .   C   21   .   CA    parsed_6pvt   1   
         26   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         26   1   2   .   .   .   .   .   .   .   .   C   21   .   CB    parsed_6pvt   1   
         27   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         27   1   2   .   .   .   .   .   .   .   .   C   22   .   CA    parsed_6pvt   1   
         28   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         28   1   2   .   .   .   .   .   .   .   .   C   22   .   CB    parsed_6pvt   1   
         29   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         29   1   2   .   .   .   .   .   .   .   .   C   23   .   CG    parsed_6pvt   1   
         30   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         30   1   2   .   .   .   .   .   .   .   .   C   23   .   CE3   parsed_6pvt   1   
         31   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         31   1   2   .   .   .   .   .   .   .   .   C   23   .   CH2   parsed_6pvt   1   
         32   1   1   .   .   .   .   .   .   .   .   B   20   .   HZ    parsed_6pvt   1   
         32   1   2   .   .   .   .   .   .   .   .   C   23   .   CZ3   parsed_6pvt   1   
         33   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         33   1   2   .   .   .   .   .   .   .   .   D   16   .   CB    parsed_6pvt   1   
         34   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         34   1   2   .   .   .   .   .   .   .   .   D   16   .   CB    parsed_6pvt   1   
         35   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         35   1   2   .   .   .   .   .   .   .   .   D   18   .   CD2   parsed_6pvt   1   
         36   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         36   1   2   .   .   .   .   .   .   .   .   D   18   .   CD1   parsed_6pvt   1   
         36   1   2   .   .   .   .   .   .   .   .   D   18   .   CG    parsed_6pvt   1   
         37   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         37   1   2   .   .   .   .   .   .   .   .   D   18   .   CB    parsed_6pvt   1   
         38   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         38   1   2   .   .   .   .   .   .   .   .   D   18   .   CA    parsed_6pvt   1   
         39   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         39   1   2   .   .   .   .   .   .   .   .   D   19   .   CA    parsed_6pvt   1   
         40   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         40   1   2   .   .   .   .   .   .   .   .   D   19   .   CD2   parsed_6pvt   1   
         41   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         41   1   2   .   .   .   .   .   .   .   .   D   21   .   CA    parsed_6pvt   1   
         42   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         42   1   2   .   .   .   .   .   .   .   .   D   21   .   CB    parsed_6pvt   1   
         43   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         43   1   2   .   .   .   .   .   .   .   .   D   22   .   CA    parsed_6pvt   1   
         44   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         44   1   2   .   .   .   .   .   .   .   .   D   22   .   CB    parsed_6pvt   1   
         45   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         45   1   2   .   .   .   .   .   .   .   .   D   23   .   CG    parsed_6pvt   1   
         46   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         46   1   2   .   .   .   .   .   .   .   .   D   23   .   CE3   parsed_6pvt   1   
         47   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         47   1   2   .   .   .   .   .   .   .   .   D   23   .   CH2   parsed_6pvt   1   
         48   1   1   .   .   .   .   .   .   .   .   C   20   .   HZ    parsed_6pvt   1   
         48   1   2   .   .   .   .   .   .   .   .   D   23   .   CZ3   parsed_6pvt   1   
         49   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         49   1   2   .   .   .   .   .   .   .   .   A   16   .   CB    parsed_6pvt   1   
         50   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         50   1   2   .   .   .   .   .   .   .   .   A   16   .   CB    parsed_6pvt   1   
         51   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         51   1   2   .   .   .   .   .   .   .   .   A   18   .   CD2   parsed_6pvt   1   
         52   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         52   1   2   .   .   .   .   .   .   .   .   A   18   .   CD1   parsed_6pvt   1   
         52   1   2   .   .   .   .   .   .   .   .   A   18   .   CG    parsed_6pvt   1   
         53   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         53   1   2   .   .   .   .   .   .   .   .   A   18   .   CB    parsed_6pvt   1   
         54   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         54   1   2   .   .   .   .   .   .   .   .   A   18   .   CA    parsed_6pvt   1   
         55   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         55   1   2   .   .   .   .   .   .   .   .   A   19   .   CA    parsed_6pvt   1   
         56   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         56   1   2   .   .   .   .   .   .   .   .   A   19   .   CD2   parsed_6pvt   1   
         57   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         57   1   2   .   .   .   .   .   .   .   .   A   21   .   CA    parsed_6pvt   1   
         58   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         58   1   2   .   .   .   .   .   .   .   .   A   21   .   CB    parsed_6pvt   1   
         59   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         59   1   2   .   .   .   .   .   .   .   .   A   22   .   CA    parsed_6pvt   1   
         60   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         60   1   2   .   .   .   .   .   .   .   .   A   22   .   CB    parsed_6pvt   1   
         61   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         61   1   2   .   .   .   .   .   .   .   .   A   23   .   CG    parsed_6pvt   1   
         62   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         62   1   2   .   .   .   .   .   .   .   .   A   23   .   CE3   parsed_6pvt   1   
         63   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         63   1   2   .   .   .   .   .   .   .   .   A   23   .   CH2   parsed_6pvt   1   
         64   1   1   .   .   .   .   .   .   .   .   D   20   .   HZ    parsed_6pvt   1   
         64   1   2   .   .   .   .   .   .   .   .   A   23   .   CZ3   parsed_6pvt   1   
         65   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         65   1   2   .   .   .   .   .   .   .   .   B    4   .   CA    parsed_6pvt   1   
         66   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         66   1   2   .   .   .   .   .   .   .   .   B    4   .   CD    parsed_6pvt   1   
         67   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         67   1   2   .   .   .   .   .   .   .   .   B    7   .   CD1   parsed_6pvt   1   
         68   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         68   1   2   .   .   .   .   .   .   .   .   B    7   .   CG2   parsed_6pvt   1   
         69   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         69   1   2   .   .   .   .   .   .   .   .   B    7   .   CG1   parsed_6pvt   1   
         70   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         70   1   2   .   .   .   .   .   .   .   .   B    7   .   CB    parsed_6pvt   1   
         71   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         71   1   2   .   .   .   .   .   .   .   .   B    7   .   CA    parsed_6pvt   1   
         72   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         72   1   2   .   .   .   .   .   .   .   .   C    4   .   CA    parsed_6pvt   1   
         73   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         73   1   2   .   .   .   .   .   .   .   .   C    4   .   CD    parsed_6pvt   1   
         74   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         74   1   2   .   .   .   .   .   .   .   .   C    7   .   CD1   parsed_6pvt   1   
         75   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         75   1   2   .   .   .   .   .   .   .   .   C    7   .   CG2   parsed_6pvt   1   
         76   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         76   1   2   .   .   .   .   .   .   .   .   C    7   .   CG1   parsed_6pvt   1   
         77   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         77   1   2   .   .   .   .   .   .   .   .   C    7   .   CB    parsed_6pvt   1   
         78   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
         78   1   2   .   .   .   .   .   .   .   .   C    7   .   CA    parsed_6pvt   1   
         79   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         79   1   2   .   .   .   .   .   .   .   .   D    4   .   CA    parsed_6pvt   1   
         80   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         80   1   2   .   .   .   .   .   .   .   .   D    4   .   CD    parsed_6pvt   1   
         81   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         81   1   2   .   .   .   .   .   .   .   .   D    7   .   CD1   parsed_6pvt   1   
         82   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         82   1   2   .   .   .   .   .   .   .   .   D    7   .   CG2   parsed_6pvt   1   
         83   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         83   1   2   .   .   .   .   .   .   .   .   D    7   .   CG1   parsed_6pvt   1   
         84   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         84   1   2   .   .   .   .   .   .   .   .   D    7   .   CB    parsed_6pvt   1   
         85   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
         85   1   2   .   .   .   .   .   .   .   .   D    7   .   CA    parsed_6pvt   1   
         86   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         86   1   2   .   .   .   .   .   .   .   .   A    4   .   CA    parsed_6pvt   1   
         87   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         87   1   2   .   .   .   .   .   .   .   .   A    4   .   CD    parsed_6pvt   1   
         88   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         88   1   2   .   .   .   .   .   .   .   .   A    7   .   CD1   parsed_6pvt   1   
         89   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         89   1   2   .   .   .   .   .   .   .   .   A    7   .   CG2   parsed_6pvt   1   
         90   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         90   1   2   .   .   .   .   .   .   .   .   A    7   .   CG1   parsed_6pvt   1   
         91   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         91   1   2   .   .   .   .   .   .   .   .   A    7   .   CB    parsed_6pvt   1   
         92   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
         92   1   2   .   .   .   .   .   .   .   .   A    7   .   CA    parsed_6pvt   1   
         93   1   1   .   .   .   .   .   .   .   .   A   23   .   HZ3   parsed_6pvt   1   
         93   1   2   .   .   .   .   .   .   .   .   B   23   .   HZ3   parsed_6pvt   1   
         94   1   1   .   .   .   .   .   .   .   .   A   23   .   HZ3   parsed_6pvt   1   
         94   1   2   .   .   .   .   .   .   .   .   C   23   .   HZ3   parsed_6pvt   1   
         95   1   1   .   .   .   .   .   .   .   .   B   23   .   HZ3   parsed_6pvt   1   
         95   1   2   .   .   .   .   .   .   .   .   C   23   .   HZ3   parsed_6pvt   1   
         96   1   1   .   .   .   .   .   .   .   .   B   23   .   HZ3   parsed_6pvt   1   
         96   1   2   .   .   .   .   .   .   .   .   D   23   .   HZ3   parsed_6pvt   1   
         97   1   1   .   .   .   .   .   .   .   .   C   23   .   HZ3   parsed_6pvt   1   
         97   1   2   .   .   .   .   .   .   .   .   D   23   .   HZ3   parsed_6pvt   1   
         98   1   1   .   .   .   .   .   .   .   .   D   23   .   HZ3   parsed_6pvt   1   
         98   1   2   .   .   .   .   .   .   .   .   A   23   .   HZ3   parsed_6pvt   1   
         99   1   1   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   1   
         99   1   2   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
        100   1   1   .   .   .   .   .   .   .   .   B    5   .   HZ    parsed_6pvt   1   
        100   1   2   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
        101   1   1   .   .   .   .   .   .   .   .   C    5   .   HZ    parsed_6pvt   1   
        101   1   2   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
        102   1   1   .   .   .   .   .   .   .   .   D    5   .   HZ    parsed_6pvt   1   
        102   1   2   .   .   .   .   .   .   .   .   A    5   .   HZ    parsed_6pvt   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   .   .   .   .   .    6.2    4.7    8.6   parsed_6pvt   1   
          2   1   .   .   .   .   .    6.3    4.8    9.0   parsed_6pvt   1   
          3   1   .   .   .   .   .    7.3    6.1    8.8   parsed_6pvt   1   
          4   1   .   .   .   .   .    5.6    4.6    6.8   parsed_6pvt   1   
          5   1   .   .   .   .   .    5.6    4.6    6.6   parsed_6pvt   1   
          6   1   .   .   .   .   .    6.3    5.1    8.1   parsed_6pvt   1   
          7   1   .   .   .   .   .    7.0    4.6   11.0   parsed_6pvt   1   
          8   1   .   .   .   .   .    5.4    3.9    7.5   parsed_6pvt   1   
          9   1   .   .   .   .   .    7.5    6.5    9.0   parsed_6pvt   1   
         10   1   .   .   .   .   .    6.6    4.6    8.6   parsed_6pvt   1   
         11   1   .   .   .   .   .    6.5    5.0    8.9   parsed_6pvt   1   
         12   1   .   .   .   .   .    7.6    6.4    8.8   parsed_6pvt   1   
         13   1   .   .   .   .   .    6.1    5.1    7.1   parsed_6pvt   1   
         14   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         15   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         16   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         17   1   .   .   .   .   .    6.2    4.7    8.6   parsed_6pvt   1   
         18   1   .   .   .   .   .    6.3    4.8    9.0   parsed_6pvt   1   
         19   1   .   .   .   .   .    7.3    6.1    8.8   parsed_6pvt   1   
         20   1   .   .   .   .   .    5.6    4.6    6.8   parsed_6pvt   1   
         21   1   .   .   .   .   .    5.6    4.6    6.6   parsed_6pvt   1   
         22   1   .   .   .   .   .    6.3    5.1    8.1   parsed_6pvt   1   
         23   1   .   .   .   .   .    7.0    4.6   11.0   parsed_6pvt   1   
         24   1   .   .   .   .   .    5.4    3.9    7.5   parsed_6pvt   1   
         25   1   .   .   .   .   .    7.5    6.5    9.0   parsed_6pvt   1   
         26   1   .   .   .   .   .    6.6    4.6    8.6   parsed_6pvt   1   
         27   1   .   .   .   .   .    6.5    5.0    8.9   parsed_6pvt   1   
         28   1   .   .   .   .   .    7.6    6.4    8.8   parsed_6pvt   1   
         29   1   .   .   .   .   .    6.1    5.1    7.1   parsed_6pvt   1   
         30   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         31   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         32   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         33   1   .   .   .   .   .    6.2    4.7    8.6   parsed_6pvt   1   
         34   1   .   .   .   .   .    6.3    4.8    9.0   parsed_6pvt   1   
         35   1   .   .   .   .   .    7.3    6.1    8.8   parsed_6pvt   1   
         36   1   .   .   .   .   .    5.6    4.6    6.8   parsed_6pvt   1   
         37   1   .   .   .   .   .    5.6    4.6    6.6   parsed_6pvt   1   
         38   1   .   .   .   .   .    6.3    5.1    8.1   parsed_6pvt   1   
         39   1   .   .   .   .   .    7.0    4.6   11.0   parsed_6pvt   1   
         40   1   .   .   .   .   .    5.4    3.9    7.5   parsed_6pvt   1   
         41   1   .   .   .   .   .    7.5    6.5    9.0   parsed_6pvt   1   
         42   1   .   .   .   .   .    6.6    4.6    8.6   parsed_6pvt   1   
         43   1   .   .   .   .   .    6.5    5.0    8.9   parsed_6pvt   1   
         44   1   .   .   .   .   .    7.6    6.4    8.8   parsed_6pvt   1   
         45   1   .   .   .   .   .    6.1    5.1    7.1   parsed_6pvt   1   
         46   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         47   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         48   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         49   1   .   .   .   .   .    6.2    4.7    8.6   parsed_6pvt   1   
         50   1   .   .   .   .   .    6.3    4.8    9.0   parsed_6pvt   1   
         51   1   .   .   .   .   .    7.3    6.1    8.8   parsed_6pvt   1   
         52   1   .   .   .   .   .    5.6    4.6    6.8   parsed_6pvt   1   
         53   1   .   .   .   .   .    5.6    4.6    6.6   parsed_6pvt   1   
         54   1   .   .   .   .   .    6.3    5.1    8.1   parsed_6pvt   1   
         55   1   .   .   .   .   .    7.0    4.6   11.0   parsed_6pvt   1   
         56   1   .   .   .   .   .    5.4    3.9    7.5   parsed_6pvt   1   
         57   1   .   .   .   .   .    7.5    6.5    9.0   parsed_6pvt   1   
         58   1   .   .   .   .   .    6.6    4.6    8.6   parsed_6pvt   1   
         59   1   .   .   .   .   .    6.5    5.0    8.9   parsed_6pvt   1   
         60   1   .   .   .   .   .    7.6    6.4    8.8   parsed_6pvt   1   
         61   1   .   .   .   .   .    6.1    5.1    7.1   parsed_6pvt   1   
         62   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         63   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         64   1   .   .   .   .   .   16.4    8.4   24.4   parsed_6pvt   1   
         65   1   .   .   .   .   .   16.9    6.9   26.9   parsed_6pvt   1   
         66   1   .   .   .   .   .   16.4    6.4   26.4   parsed_6pvt   1   
         67   1   .   .   .   .   .    5.5    4.5    6.5   parsed_6pvt   1   
         68   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         69   1   .   .   .   .   .    5.8    4.8    6.8   parsed_6pvt   1   
         70   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         71   1   .   .   .   .   .    5.9    4.4    7.4   parsed_6pvt   1   
         72   1   .   .   .   .   .   16.9    6.9   26.9   parsed_6pvt   1   
         73   1   .   .   .   .   .   16.4    6.4   26.4   parsed_6pvt   1   
         74   1   .   .   .   .   .    5.5    4.5    6.5   parsed_6pvt   1   
         75   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         76   1   .   .   .   .   .    5.8    4.8    6.8   parsed_6pvt   1   
         77   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         78   1   .   .   .   .   .    5.9    4.4    7.4   parsed_6pvt   1   
         79   1   .   .   .   .   .   16.9    6.9   26.9   parsed_6pvt   1   
         80   1   .   .   .   .   .   16.4    6.4   26.4   parsed_6pvt   1   
         81   1   .   .   .   .   .    5.5    4.5    6.5   parsed_6pvt   1   
         82   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         83   1   .   .   .   .   .    5.8    4.8    6.8   parsed_6pvt   1   
         84   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         85   1   .   .   .   .   .    5.9    4.4    7.4   parsed_6pvt   1   
         86   1   .   .   .   .   .   16.9    6.9   26.9   parsed_6pvt   1   
         87   1   .   .   .   .   .   16.4    6.4   26.4   parsed_6pvt   1   
         88   1   .   .   .   .   .    5.5    4.5    6.5   parsed_6pvt   1   
         89   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         90   1   .   .   .   .   .    5.8    4.8    6.8   parsed_6pvt   1   
         91   1   .   .   .   .   .    6.0    5.0    7.0   parsed_6pvt   1   
         92   1   .   .   .   .   .    5.9    4.4    7.4   parsed_6pvt   1   
         93   1   .   .   .   .   .   10.5    8.5   12.5   parsed_6pvt   1   
         94   1   .   .   .   .   .   14.8   12.8   16.8   parsed_6pvt   1   
         95   1   .   .   .   .   .   10.5    8.5   12.5   parsed_6pvt   1   
         96   1   .   .   .   .   .   14.8   12.8   16.8   parsed_6pvt   1   
         97   1   .   .   .   .   .   10.5    8.5   12.5   parsed_6pvt   1   
         98   1   .   .   .   .   .   10.5    8.5   12.5   parsed_6pvt   1   
         99   1   .   .   .   .   .    9.4    7.4   14.4   parsed_6pvt   1   
        100   1   .   .   .   .   .    9.4    7.4   14.4   parsed_6pvt   1   
        101   1   .   .   .   .   .    9.4    7.4   14.4   parsed_6pvt   1   
        102   1   .   .   .   .   .    9.4    7.4   14.4   parsed_6pvt   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   
;
!  Intermolecular NOEs for BM2
!  NOE  distances  obtained  from  13C-19F REDOR and 19F-19F CODEX
!  numbers  specify:  distance,  lower error,  upper error
F20-X contacts
=====================================================================A-B
;
     2   1     8   74   parsed_6pvt   1   
         2    =====================================================================B-C    25   1    25   74   parsed_6pvt   1   
         3    =====================================================================C-D    42   1    42   74   parsed_6pvt   1   
         4    =====================================================================D-A    59   1    59   74   parsed_6pvt   1   
         5   
;
F5-X contacts
=====================================================================A-B
;
    77   1    78   74   parsed_6pvt   1   
         6    =====================================================================B-C    86   1    86   74   parsed_6pvt   1   
         7    =====================================================================C-D    94   1    94   74   parsed_6pvt   1   
         8    =====================================================================D-A   102   1   102   74   parsed_6pvt   1   
         9   
;
CODEX restraints
=====================================================================W23
;
   113   1   114   74   parsed_6pvt   1   
        10    =====================================================================F5    121   1   121   73   parsed_6pvt   1   
    stop_


    loop_
        _Dist_constraint_parse_err.ID 
        _Dist_constraint_parse_err.Content 
        _Dist_constraint_parse_err.Begin_line 
        _Dist_constraint_parse_err.Begin_column 
        _Dist_constraint_parse_err.End_line 
        _Dist_constraint_parse_err.End_column 
        _Dist_constraint_parse_err.Entry_ID 
        _Dist_constraint_parse_err.Distance_constraint_list_ID 

        1   "# Restraints file 9: D_1000243177_mr_P1.xplor-nih.V1"    1   1   1   52   parsed_6pvt   1   
    stop_

save_





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