NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type item_count
51827 2kav 16032 cing 2-parsed STAR dipolar coupling 146


data_2kav_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2kav 
    _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_2kav   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2kav 
    _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   2kav   "Master copy"    parsed_2kav   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2kav 
    _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   2kav.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2kav   1   
        1   2kav.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1702   parsed_2kav   1   
        1   2kav.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     129   parsed_2kav   1   
        1   2kav.mr   .   .    XPLOR/CNS     4   "dipolar coupling"        "Not applicable"    "Not applicable"     146   parsed_2kav   1   
        1   2kav.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2kav   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_4
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2kav 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            4 
    _RDC_constraint_list.Details            "Generated by Wattos" 

    loop_
        _RDC_constraint.ID 
        _RDC_constraint.Assembly_atom_ID_1 
        _RDC_constraint.Entity_assembly_ID_1 
        _RDC_constraint.Entity_ID_1 
        _RDC_constraint.Comp_index_ID_1 
        _RDC_constraint.Seq_ID_1 
        _RDC_constraint.Comp_ID_1 
        _RDC_constraint.Atom_ID_1 
        _RDC_constraint.Resonance_ID_1 
        _RDC_constraint.Assembly_atom_ID_2 
        _RDC_constraint.Entity_assembly_ID_2 
        _RDC_constraint.Entity_ID_2 
        _RDC_constraint.Comp_index_ID_2 
        _RDC_constraint.Seq_ID_2 
        _RDC_constraint.Comp_ID_2 
        _RDC_constraint.Atom_ID_2 
        _RDC_constraint.Resonance_ID_2 
        _RDC_constraint.RDC_val 
        _RDC_constraint.RDC_lower_bound 
        _RDC_constraint.RDC_upper_bound 
        _RDC_constraint.RDC_val_err 
        _RDC_constraint.Source_experiment_ID 
        _RDC_constraint.Auth_asym_ID_1 
        _RDC_constraint.Auth_seq_ID_1 
        _RDC_constraint.Auth_comp_ID_1 
        _RDC_constraint.Auth_atom_ID_1 
        _RDC_constraint.Auth_asym_ID_2 
        _RDC_constraint.Auth_seq_ID_2 
        _RDC_constraint.Auth_comp_ID_2 
        _RDC_constraint.Auth_atom_ID_2 
        _RDC_constraint.Entry_ID 
        _RDC_constraint.RDC_constraint_list_ID 

          1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.0300   .   .   .   .   .   1792   .   HA    .   1792   .   CA    parsed_2kav   1   
          2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.2550   .   .   .   .   .   1793   .   HA    .   1793   .   CA    parsed_2kav   1   
          3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.4370   .   .   .   .   .   1797   .   HA    .   1797   .   CA    parsed_2kav   1   
          4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.3680   .   .   .   .   .   1798   .   HA    .   1798   .   CA    parsed_2kav   1   
          5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8190   .   .   .   .   .   1799   .   HA    .   1799   .   CA    parsed_2kav   1   
          6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.6950   .   .   .   .   .   1801   .   HA    .   1801   .   CA    parsed_2kav   1   
          7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.8300   .   .   .   .   .   1804   .   HA    .   1804   .   CA    parsed_2kav   1   
          8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0960   .   .   .   .   .   1807   .   HA    .   1807   .   CA    parsed_2kav   1   
          9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8910   .   .   .   .   .   1811   .   HA    .   1811   .   CA    parsed_2kav   1   
         10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.8930   .   .   .   .   .   1812   .   HA    .   1812   .   CA    parsed_2kav   1   
         11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8480   .   .   .   .   .   1814   .   HA    .   1814   .   CA    parsed_2kav   1   
         12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8000   .   .   .   .   .   1815   .   HA    .   1815   .   CA    parsed_2kav   1   
         13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.0400   .   .   .   .   .   1816   .   HA    .   1816   .   CA    parsed_2kav   1   
         14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.0720   .   .   .   .   .   1818   .   HA    .   1818   .   CA    parsed_2kav   1   
         15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.7040   .   .   .   .   .   1819   .   HA    .   1819   .   CA    parsed_2kav   1   
         16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.3680   .   .   .   .   .   1821   .   HA    .   1821   .   CA    parsed_2kav   1   
         17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.4780   .   .   .   .   .   1822   .   HA    .   1822   .   CA    parsed_2kav   1   
         18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.3370   .   .   .   .   .   1823   .   HA    .   1823   .   CA    parsed_2kav   1   
         19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1010   .   .   .   .   .   1825   .   HA    .   1825   .   CA    parsed_2kav   1   
         20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.0440   .   .   .   .   .   1827   .   HA    .   1827   .   CA    parsed_2kav   1   
         21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.3730   .   .   .   .   .   1829   .   HA    .   1829   .   CA    parsed_2kav   1   
         22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.0410   .   .   .   .   .   1830   .   HA    .   1830   .   CA    parsed_2kav   1   
         23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.1990   .   .   .   .   .   1832   .   HA    .   1832   .   CA    parsed_2kav   1   
         24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.5850   .   .   .   .   .   1833   .   HA    .   1833   .   CA    parsed_2kav   1   
         25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.8310   .   .   .   .   .   1834   .   HA    .   1834   .   CA    parsed_2kav   1   
         26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.7730   .   .   .   .   .   1836   .   HA    .   1836   .   CA    parsed_2kav   1   
         27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7290   .   .   .   .   .   1837   .   HA    .   1837   .   CA    parsed_2kav   1   
         28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.2710   .   .   .   .   .   1840   .   HA    .   1840   .   CA    parsed_2kav   1   
         29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7000   .   .   .   .   .   1841   .   HA    .   1841   .   CA    parsed_2kav   1   
         30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.7210   .   .   .   .   .   1842   .   HA    .   1842   .   CA    parsed_2kav   1   
         31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7710   .   .   .   .   .   1845   .   HA    .   1845   .   CA    parsed_2kav   1   
         32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.1550   .   .   .   .   .   1846   .   HA    .   1846   .   CA    parsed_2kav   1   
         33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4930   .   .   .   .   .   1848   .   HA    .   1848   .   CA    parsed_2kav   1   
         34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.2280   .   .   .   .   .   1853   .   HA    .   1853   .   CA    parsed_2kav   1   
         35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.2700   .   .   .   .   .   1854   .   HA    .   1854   .   CA    parsed_2kav   1   
         36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1540   .   .   .   .   .   1857   .   HA    .   1857   .   CA    parsed_2kav   1   
         37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.8820   .   .   .   .   .   1858   .   HA    .   1858   .   CA    parsed_2kav   1   
         38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.2400   .   .   .   .   .   1860   .   HA    .   1860   .   CA    parsed_2kav   1   
         39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.3490   .   .   .   .   .   1861   .   HA    .   1861   .   CA    parsed_2kav   1   
         40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2300   .   .   .   .   .   1862   .   HA    .   1862   .   CA    parsed_2kav   1   
         41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.8410   .   .   .   .   .   1863   .   HA    .   1863   .   CA    parsed_2kav   1   
         42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.7070   .   .   .   .   .   1864   .   HA    .   1864   .   CA    parsed_2kav   1   
         43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.8430   .   .   .   .   .   1865   .   HA    .   1865   .   CA    parsed_2kav   1   
         44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1830   .   .   .   .   .   1866   .   HA    .   1866   .   CA    parsed_2kav   1   
         45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2380   .   .   .   .   .   1789   .   C     .   1790   .   N     parsed_2kav   1   
         46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.1200   .   .   .   .   .   1790   .   C     .   1791   .   N     parsed_2kav   1   
         47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2610   .   .   .   .   .   1792   .   C     .   1793   .   N     parsed_2kav   1   
         48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.4310   .   .   .   .   .   1793   .   C     .   1794   .   N     parsed_2kav   1   
         49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.7320   .   .   .   .   .   1794   .   C     .   1795   .   N     parsed_2kav   1   
         50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7870   .   .   .   .   .   1795   .   C     .   1796   .   N     parsed_2kav   1   
         51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.4440   .   .   .   .   .   1796   .   C     .   1797   .   N     parsed_2kav   1   
         52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.7530   .   .   .   .   .   1797   .   C     .   1798   .   N     parsed_2kav   1   
         53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.0950   .   .   .   .   .   1798   .   C     .   1799   .   N     parsed_2kav   1   
         54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3040   .   .   .   .   .   1799   .   C     .   1800   .   N     parsed_2kav   1   
         55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.1160   .   .   .   .   .   1800   .   C     .   1801   .   N     parsed_2kav   1   
         56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.3550   .   .   .   .   .   1801   .   C     .   1802   .   N     parsed_2kav   1   
         57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8120   .   .   .   .   .   1802   .   C     .   1803   .   N     parsed_2kav   1   
         58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.4030   .   .   .   .   .   1803   .   C     .   1804   .   N     parsed_2kav   1   
         59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.6670   .   .   .   .   .   1804   .   C     .   1805   .   N     parsed_2kav   1   
         60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.1250   .   .   .   .   .   1805   .   C     .   1806   .   N     parsed_2kav   1   
         61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.4460   .   .   .   .   .   1807   .   C     .   1808   .   N     parsed_2kav   1   
         62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.9580   .   .   .   .   .   1808   .   C     .   1809   .   N     parsed_2kav   1   
         63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.6820   .   .   .   .   .   1809   .   C     .   1810   .   N     parsed_2kav   1   
         64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.2030   .   .   .   .   .   1810   .   C     .   1811   .   N     parsed_2kav   1   
         65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.6060   .   .   .   .   .   1811   .   C     .   1812   .   N     parsed_2kav   1   
         66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.9190   .   .   .   .   .   1812   .   C     .   1813   .   N     parsed_2kav   1   
         67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.1240   .   .   .   .   .   1813   .   C     .   1814   .   N     parsed_2kav   1   
         68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.2820   .   .   .   .   .   1814   .   C     .   1815   .   N     parsed_2kav   1   
         69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7850   .   .   .   .   .   1815   .   C     .   1816   .   N     parsed_2kav   1   
         70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.1270   .   .   .   .   .   1816   .   C     .   1817   .   N     parsed_2kav   1   
         71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.3000   .   .   .   .   .   1817   .   C     .   1818   .   N     parsed_2kav   1   
         72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    24.3740   .   .   .   .   .   1819   .   C     .   1820   .   N     parsed_2kav   1   
         73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.1350   .   .   .   .   .   1820   .   C     .   1821   .   N     parsed_2kav   1   
         74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.0820   .   .   .   .   .   1821   .   C     .   1822   .   N     parsed_2kav   1   
         75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.2670   .   .   .   .   .   1822   .   C     .   1823   .   N     parsed_2kav   1   
         76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1830   .   .   .   .   .   1823   .   C     .   1824   .   N     parsed_2kav   1   
         77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.0400   .   .   .   .   .   1824   .   C     .   1825   .   N     parsed_2kav   1   
         78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.0740   .   .   .   .   .   1825   .   C     .   1826   .   N     parsed_2kav   1   
         79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.4850   .   .   .   .   .   1828   .   C     .   1829   .   N     parsed_2kav   1   
         80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.6310   .   .   .   .   .   1829   .   C     .   1830   .   N     parsed_2kav   1   
         81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.5330   .   .   .   .   .   1830   .   C     .   1831   .   N     parsed_2kav   1   
         82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3270   .   .   .   .   .   1831   .   C     .   1832   .   N     parsed_2kav   1   
         83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.6090   .   .   .   .   .   1832   .   C     .   1833   .   N     parsed_2kav   1   
         84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.5180   .   .   .   .   .   1836   .   C     .   1837   .   N     parsed_2kav   1   
         85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2400   .   .   .   .   .   1837   .   C     .   1838   .   N     parsed_2kav   1   
         86   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.6100   .   .   .   .   .   1838   .   C     .   1839   .   N     parsed_2kav   1   
         87   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.7880   .   .   .   .   .   1839   .   C     .   1840   .   N     parsed_2kav   1   
         88   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.5810   .   .   .   .   .   1840   .   C     .   1841   .   N     parsed_2kav   1   
         89   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.7290   .   .   .   .   .   1841   .   C     .   1842   .   N     parsed_2kav   1   
         90   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.4010   .   .   .   .   .   1842   .   C     .   1843   .   N     parsed_2kav   1   
         91   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.0320   .   .   .   .   .   1845   .   C     .   1846   .   N     parsed_2kav   1   
         92   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.4410   .   .   .   .   .   1846   .   C     .   1847   .   N     parsed_2kav   1   
         93   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.8050   .   .   .   .   .   1849   .   C     .   1850   .   N     parsed_2kav   1   
         94   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1940   .   .   .   .   .   1851   .   C     .   1852   .   N     parsed_2kav   1   
         95   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.8550   .   .   .   .   .   1853   .   C     .   1854   .   N     parsed_2kav   1   
         96   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.4250   .   .   .   .   .   1855   .   C     .   1856   .   N     parsed_2kav   1   
         97   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.1220   .   .   .   .   .   1856   .   C     .   1857   .   N     parsed_2kav   1   
         98   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.5420   .   .   .   .   .   1857   .   C     .   1858   .   N     parsed_2kav   1   
         99   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6680   .   .   .   .   .   1858   .   C     .   1859   .   N     parsed_2kav   1   
        100   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.1790   .   .   .   .   .   1859   .   C     .   1860   .   N     parsed_2kav   1   
        101   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.9120   .   .   .   .   .   1860   .   C     .   1861   .   N     parsed_2kav   1   
        102   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2020   .   .   .   .   .   1862   .   C     .   1863   .   N     parsed_2kav   1   
        103   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.5370   .   .   .   .   .   1863   .   C     .   1864   .   N     parsed_2kav   1   
        104   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9460   .   .   .   .   .   1864   .   C     .   1865   .   N     parsed_2kav   1   
        105   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.4370   .   .   .   .   .   1865   .   C     .   1866   .   N     parsed_2kav   1   
        106   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.3700   .   .   .   .   .   1791   .   HN    .   1791   .   N     parsed_2kav   1   
        107   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.7300   .   .   .   .   .   1793   .   HN    .   1793   .   N     parsed_2kav   1   
        108   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1000   .   .   .   .   .   1795   .   HN    .   1795   .   N     parsed_2kav   1   
        109   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.5400   .   .   .   .   .   1796   .   HN    .   1796   .   N     parsed_2kav   1   
        110   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.2400   .   .   .   .   .   1800   .   HN    .   1800   .   N     parsed_2kav   1   
        111   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100   .   .   .   .   .   1802   .   HN    .   1802   .   N     parsed_2kav   1   
        112   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.2700   .   .   .   .   .   1802   .   HE1   .   1802   .   NE1   parsed_2kav   1   
        113   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2800   .   .   .   .   .   1803   .   HN    .   1803   .   N     parsed_2kav   1   
        114   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.6600   .   .   .   .   .   1804   .   HN    .   1804   .   N     parsed_2kav   1   
        115   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.3000   .   .   .   .   .   1805   .   HN    .   1805   .   N     parsed_2kav   1   
        116   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4300   .   .   .   .   .   1806   .   HN    .   1806   .   N     parsed_2kav   1   
        117   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.4600   .   .   .   .   .   1808   .   HN    .   1808   .   N     parsed_2kav   1   
        118   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.5200   .   .   .   .   .   1810   .   HN    .   1810   .   N     parsed_2kav   1   
        119   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.6600   .   .   .   .   .   1811   .   HN    .   1811   .   N     parsed_2kav   1   
        120   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.6900   .   .   .   .   .   1812   .   HN    .   1812   .   N     parsed_2kav   1   
        121   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.9200   .   .   .   .   .   1813   .   HN    .   1813   .   N     parsed_2kav   1   
        122   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.8400   .   .   .   .   .   1814   .   HN    .   1814   .   N     parsed_2kav   1   
        123   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7400   .   .   .   .   .   1815   .   HN    .   1815   .   N     parsed_2kav   1   
        124   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.5800   .   .   .   .   .   1817   .   HN    .   1817   .   N     parsed_2kav   1   
        125   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.1300   .   .   .   .   .   1820   .   HN    .   1820   .   N     parsed_2kav   1   
        126   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.6800   .   .   .   .   .   1822   .   HN    .   1822   .   N     parsed_2kav   1   
        127   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.9100   .   .   .   .   .   1823   .   HN    .   1823   .   N     parsed_2kav   1   
        128   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3100   .   .   .   .   .   1824   .   HN    .   1824   .   N     parsed_2kav   1   
        129   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1600   .   .   .   .   .   1825   .   HN    .   1825   .   N     parsed_2kav   1   
        130   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.5800   .   .   .   .   .   1829   .   HN    .   1829   .   N     parsed_2kav   1   
        131   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7500   .   .   .   .   .   1830   .   HN    .   1830   .   N     parsed_2kav   1   
        132   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    20.7800   .   .   .   .   .   1831   .   HN    .   1831   .   N     parsed_2kav   1   
        133   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.7300   .   .   .   .   .   1832   .   HN    .   1832   .   N     parsed_2kav   1   
        134   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.8300   .   .   .   .   .   1837   .   HN    .   1837   .   N     parsed_2kav   1   
        135   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.4900   .   .   .   .   .   1840   .   HN    .   1840   .   N     parsed_2kav   1   
        136   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.1300   .   .   .   .   .   1841   .   HN    .   1841   .   N     parsed_2kav   1   
        137   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3900   .   .   .   .   .   1842   .   HN    .   1842   .   N     parsed_2kav   1   
        138   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.9800   .   .   .   .   .   1850   .   HN    .   1850   .   N     parsed_2kav   1   
        139   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.4700   .   .   .   .   .   1852   .   HN    .   1852   .   N     parsed_2kav   1   
        140   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.6900   .   .   .   .   .   1854   .   HN    .   1854   .   N     parsed_2kav   1   
        141   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.8200   .   .   .   .   .   1858   .   HN    .   1858   .   N     parsed_2kav   1   
        142   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.5900   .   .   .   .   .   1859   .   HN    .   1859   .   N     parsed_2kav   1   
        143   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.0100   .   .   .   .   .   1861   .   HN    .   1861   .   N     parsed_2kav   1   
        144   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.4200   .   .   .   .   .   1864   .   HN    .   1864   .   N     parsed_2kav   1   
        145   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.8900   .   .   .   .   .   1865   .   HN    .   1865   .   N     parsed_2kav   1   
        146   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.9500   .   .   .   .   .   1867   .   HN    .   1867   .   N     parsed_2kav   1   
    stop_


    loop_
        _RDC_constraint_comment_org.ID 
        _RDC_constraint_comment_org.Comment_text 
        _RDC_constraint_comment_org.Comment_begin_line 
        _RDC_constraint_comment_org.Comment_begin_column 
        _RDC_constraint_comment_org.Comment_end_line 
        _RDC_constraint_comment_org.Comment_end_column 
        _RDC_constraint_comment_org.Entry_ID 
        _RDC_constraint_comment_org.RDC_constraint_list_ID 

          1   "1792 (39 in construct)"        1   1      1   25   parsed_2kav   1   
          2   "1793 (40 in construct)"        8   1      8   25   parsed_2kav   1   
          3   "1797 (44 in construct)"       15   1     15   25   parsed_2kav   1   
          4   "1798 (45 in construct)"       22   1     22   25   parsed_2kav   1   
          5   "1799 (46 in construct)"       29   1     29   25   parsed_2kav   1   
          6   "1801 (48 in construct)"       36   1     36   25   parsed_2kav   1   
          7   "1804 (51 in construct)"       43   1     43   25   parsed_2kav   1   
          8   "1807 (54 in construct)"       50   1     50   25   parsed_2kav   1   
          9   "1811 (58 in construct)"       57   1     57   25   parsed_2kav   1   
         10   "1812 (59 in construct)"       64   1     64   25   parsed_2kav   1   
         11   "1814 (61 in construct)"       71   1     71   25   parsed_2kav   1   
         12   "1815 (62 in construct)"       78   1     78   25   parsed_2kav   1   
         13   "1816 (63 in construct)"       85   1     85   25   parsed_2kav   1   
         14   "1818 (65 in construct)"       92   1     92   25   parsed_2kav   1   
         15   "1819 (66 in construct)"       99   1     99   25   parsed_2kav   1   
         16   "1821 (68 in construct)"      106   1    106   25   parsed_2kav   1   
         17   "1822 (69 in construct)"      113   1    113   25   parsed_2kav   1   
         18   "1823 (70 in construct)"      120   1    120   25   parsed_2kav   1   
         19   "1825 (72 in construct)"      127   1    127   25   parsed_2kav   1   
         20   "1827 (74 in construct)"      134   1    134   25   parsed_2kav   1   
         21   "1829 (76 in construct)"      141   1    141   25   parsed_2kav   1   
         22   "1830 (77 in construct)"      148   1    148   25   parsed_2kav   1   
         23   "1832 (79 in construct)"      155   1    155   25   parsed_2kav   1   
         24   "1833 (80 in construct)"      162   1    162   25   parsed_2kav   1   
         25   "1834 (81 in construct)"      169   1    169   25   parsed_2kav   1   
         26   "1836 (83 in construct)"      176   1    176   25   parsed_2kav   1   
         27   "1837 (84 in construct)"      183   1    183   25   parsed_2kav   1   
         28   "1840 (87 in construct)"      190   1    190   25   parsed_2kav   1   
         29   "1841 (88 in construct)"      197   1    197   25   parsed_2kav   1   
         30   "1842 (89 in construct)"      204   1    204   25   parsed_2kav   1   
         31   "1845 (92 in construct)"      211   1    211   25   parsed_2kav   1   
         32   "1846 (93 in construct)"      218   1    218   25   parsed_2kav   1   
         33   "1848 (95 in construct)"      225   1    225   25   parsed_2kav   1   
         34   "1853 (100 in construct)"     232   1    232   26   parsed_2kav   1   
         35   "1854 (101 in construct)"     239   1    239   26   parsed_2kav   1   
         36   "1857 (104 in construct)"     246   1    246   26   parsed_2kav   1   
         37   "1858 (105 in construct)"     253   1    253   26   parsed_2kav   1   
         38   "1860 (107 in construct)"     260   1    260   26   parsed_2kav   1   
         39   "1861 (108 in construct)"     267   1    267   26   parsed_2kav   1   
         40   "1862 (109 in construct)"     274   1    274   26   parsed_2kav   1   
         41   "1863 (110 in construct)"     281   1    281   26   parsed_2kav   1   
         42   "1864 (111 in construct)"     288   1    288   26   parsed_2kav   1   
         43   "1865 (112 in construct)"     295   1    295   26   parsed_2kav   1   
         44   "1866 (113 in construct)"     302   1    302   26   parsed_2kav   1   
         45   "1790 (37 in construct)"      309   1    309   25   parsed_2kav   1   
         46   "1791 (38 in construct)"      316   1    316   25   parsed_2kav   1   
         47   "1793 (40 in construct)"      323   1    323   25   parsed_2kav   1   
         48   "1794 (41 in construct)"      330   1    330   25   parsed_2kav   1   
         49   "1795 (42 in construct)"      337   1    337   25   parsed_2kav   1   
         50   "1796 (43 in construct)"      344   1    344   25   parsed_2kav   1   
         51   "1797 (44 in construct)"      351   1    351   25   parsed_2kav   1   
         52   "1798 (45 in construct)"      358   1    358   25   parsed_2kav   1   
         53   "1799 (46 in construct)"      365   1    365   25   parsed_2kav   1   
         54   "1800 (47 in construct)"      372   1    372   25   parsed_2kav   1   
         55   "1801 (48 in construct)"      379   1    379   25   parsed_2kav   1   
         56   "1802 (49 in construct)"      386   1    386   25   parsed_2kav   1   
         57   "1803 (50 in construct)"      393   1    393   25   parsed_2kav   1   
         58   "1804 (51 in construct)"      400   1    400   25   parsed_2kav   1   
         59   "1805 (52 in construct)"      407   1    407   25   parsed_2kav   1   
         60   "1806 (53 in construct)"      414   1    414   25   parsed_2kav   1   
         61   "1808 (55 in construct)"      421   1    421   25   parsed_2kav   1   
         62   "1809 (56 in construct)"      428   1    428   25   parsed_2kav   1   
         63   "1810 (57 in construct)"      435   1    435   25   parsed_2kav   1   
         64   "1811 (58 in construct)"      442   1    442   25   parsed_2kav   1   
         65   "1812 (59 in construct)"      449   1    449   25   parsed_2kav   1   
         66   "1813 (60 in construct)"      456   1    456   25   parsed_2kav   1   
         67   "1814 (61 in construct)"      463   1    463   25   parsed_2kav   1   
         68   "1815 (62 in construct)"      470   1    470   25   parsed_2kav   1   
         69   "1816 (63 in construct)"      477   1    477   25   parsed_2kav   1   
         70   "1817 (64 in construct)"      484   1    484   25   parsed_2kav   1   
         71   "1818 (65 in construct)"      491   1    491   25   parsed_2kav   1   
         72   
;
1819 (66 in construct) - LARGE ERROR
assign ( resid 999 and name   OO )
( resid 999 and name    Z )
( resid 999 and name    Y )
( resid 999 and name    X )
( resid 1818 and name    C )
( resid 1819 and name    N )  -21.2910   4.3220
1820 (67 in construct)
;
    499   1    507   25   parsed_2kav   1   
         73   "1821 (68 in construct)"      514   1    514   25   parsed_2kav   1   
         74   "1822 (69 in construct)"      521   1    521   25   parsed_2kav   1   
         75   "1823 (70 in construct)"      528   1    528   25   parsed_2kav   1   
         76   "1824 (71 in construct)"      535   1    535   25   parsed_2kav   1   
         77   "1825 (72 in construct)"      542   1    542   25   parsed_2kav   1   
         78   "1826 (73 in construct)"      549   1    549   25   parsed_2kav   1   
         79   "1829 (76 in construct)"      556   1    556   25   parsed_2kav   1   
         80   "1830 (77 in construct)"      563   1    563   25   parsed_2kav   1   
         81   "1831 (78 in construct)"      570   1    570   25   parsed_2kav   1   
         82   "1832 (79 in construct)"      577   1    577   25   parsed_2kav   1   
         83   "1833 (80 in construct)"      584   1    584   25   parsed_2kav   1   
         84   "1837 (84 in construct)"      591   1    591   25   parsed_2kav   1   
         85   "1838 (85 in construct)"      598   1    598   25   parsed_2kav   1   
         86   "1839 (86 in construct)"      605   1    605   25   parsed_2kav   1   
         87   "1840 (87 in construct)"      612   1    612   25   parsed_2kav   1   
         88   "1841 (88 in construct)"      619   1    619   25   parsed_2kav   1   
         89   "1842 (89 in construct)"      626   1    626   25   parsed_2kav   1   
         90   "1843 (90 in construct)"      633   1    633   25   parsed_2kav   1   
         91   "1846 (93 in construct)"      640   1    640   25   parsed_2kav   1   
         92   "1847 (94 in construct)"      647   1    647   25   parsed_2kav   1   
         93   "1850 (97 in construct)"      654   1    654   25   parsed_2kav   1   
         94   
;
1851 (98 in construct) - LARGE ERROR
assign ( resid 999 and name   OO )
( resid 999 and name    Z )
( resid 999 and name    Y )
( resid 999 and name    X )
( resid 1850 and name    C )
( resid 1851 and name    N )  -28.6790   3.5160
1852 (99 in construct)
;
    662   1    670   25   parsed_2kav   1   
         95   
;
1853 (100 in construct) - LARGE ERROR
assign ( resid 999 and name   OO )
( resid 999 and name    Z )
( resid 999 and name    Y )
( resid 999 and name    X )
( resid 1852 and name    C )
( resid 1853 and name    N )  -14.4660   2.7610
1854 (101 in construct)
;
    678   1    686   26   parsed_2kav   1   
         96   "1856 (103 in construct)"     693   1    693   26   parsed_2kav   1   
         97   "1857 (104 in construct)"     700   1    700   26   parsed_2kav   1   
         98   "1858 (105 in construct)"     707   1    707   26   parsed_2kav   1   
         99   "1859 (106 in construct)"     714   1    714   26   parsed_2kav   1   
        100   "1860 (107 in construct)"     721   1    721   26   parsed_2kav   1   
        101   "1861 (108 in construct)"     728   1    728   26   parsed_2kav   1   
        102   "1863 (110 in construct)"     735   1    735   26   parsed_2kav   1   
        103   "1864 (111 in construct)"     742   1    742   26   parsed_2kav   1   
        104   "1865 (112 in construct)"     749   1    749   26   parsed_2kav   1   
        105   "1866 (113 in construct)"     756   1    756   26   parsed_2kav   1   
        106   
;
1868 (115 in construct) - LARGE ERROR
assign ( resid 999 and name   OO )
( resid 999 and name    Z )
( resid 999 and name    Y )
( resid 999 and name    X )
( resid 1867 and name    C )
( resid 1868 and name    N )    6.4300   3.9220
1791 (38 in construct)
;
    764   1    771   25   parsed_2kav   1   
        107   "1793 (40 in construct)"      778   1    778   25   parsed_2kav   1   
        108   "1795 (42 in construct)"      785   1    785   25   parsed_2kav   1   
        109   "1796 (43 in construct)"      792   1    792   25   parsed_2kav   1   
        110   "1800 (47 in construct)"      799   1    799   25   parsed_2kav   1   
        111   "1802 (49 in construct)"      806   1    806   25   parsed_2kav   1   
        112   "1802 (49 in construct)"      813   1    813   25   parsed_2kav   1   
        113   "1803 (50 in construct)"      820   1    820   25   parsed_2kav   1   
        114   "1804 (51 in construct)"      827   1    827   25   parsed_2kav   1   
        115   "1805 (52 in construct)"      834   1    834   25   parsed_2kav   1   
        116   "1806 (53 in construct)"      841   1    841   25   parsed_2kav   1   
        117   "1808 (55 in construct)"      848   1    848   25   parsed_2kav   1   
        118   "1810 (57 in construct)"      855   1    855   25   parsed_2kav   1   
        119   "1811 (58 in construct)"      862   1    862   25   parsed_2kav   1   
        120   "1812 (59 in construct)"      869   1    869   25   parsed_2kav   1   
        121   "1813 (60 in construct)"      876   1    876   25   parsed_2kav   1   
        122   "1814 (61 in construct)"      883   1    883   25   parsed_2kav   1   
        123   "1815 (62 in construct)"      890   1    890   25   parsed_2kav   1   
        124   "1817 (64 in construct)"      897   1    897   25   parsed_2kav   1   
        125   "1820 (67 in construct)"      904   1    904   25   parsed_2kav   1   
        126   "1822 (69 in construct)"      911   1    911   25   parsed_2kav   1   
        127   "1823 (70 in construct)"      918   1    918   25   parsed_2kav   1   
        128   "1824 (71 in construct)"      925   1    925   25   parsed_2kav   1   
        129   "1825 (72 in construct)"      932   1    932   25   parsed_2kav   1   
        130   "1829 (76 in construct)"      939   1    939   25   parsed_2kav   1   
        131   "1830 (77 in construct)"      946   1    946   25   parsed_2kav   1   
        132   "1831 (78 in construct)"      953   1    953   25   parsed_2kav   1   
        133   "1832 (79 in construct)"      960   1    960   25   parsed_2kav   1   
        134   "1837 (84 in construct)"      967   1    967   25   parsed_2kav   1   
        135   "1840 (87 in construct)"      974   1    974   25   parsed_2kav   1   
        136   "1841 (88 in construct)"      981   1    981   25   parsed_2kav   1   
        137   "1842 (89 in construct)"      988   1    988   25   parsed_2kav   1   
        138   "1850 (97 in construct)"      995   1    995   25   parsed_2kav   1   
        139   "1852 (99 in construct)"     1002   1   1002   25   parsed_2kav   1   
        140   "1854 (101 in construct)"    1009   1   1009   26   parsed_2kav   1   
        141   "1858 (105 in construct)"    1016   1   1016   26   parsed_2kav   1   
        142   "1859 (106 in construct)"    1023   1   1023   26   parsed_2kav   1   
        143   "1861 (108 in construct)"    1030   1   1030   26   parsed_2kav   1   
        144   "1864 (111 in construct)"    1037   1   1037   26   parsed_2kav   1   
        145   "1865 (112 in construct)"    1044   1   1044   26   parsed_2kav   1   
        146   "1867 (114 in construct)"    1051   1   1051   26   parsed_2kav   1   
    stop_

save_





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