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
29602 1b4c 4001 cing 2-parsed STAR dipolar coupling 521


data_1b4c_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1b4c 
    _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_1b4c   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1b4c 
    _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   1b4c   "Master copy"    parsed_1b4c   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1b4c 
    _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   1b4c.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_1b4c   1   
        1   1b4c.mr   .   .    XPLOR/CNS     2    distance                  NOE                 ambi               1780   parsed_1b4c   1   
        1   1b4c.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     340   parsed_1b4c   1   
        1   1b4c.mr   .   .    XPLOR/CNS     4    distance                  symmetry            simple                0   parsed_1b4c   1   
        1   1b4c.mr   .   .    XPLOR/CNS     5    distance                 "hydrogen bond"      simple              176   parsed_1b4c   1   
        1   1b4c.mr   .   .    XPLOR/CNS     6   "dipolar coupling"        "Not applicable"    "Not applicable"     521   parsed_1b4c   1   
        1   1b4c.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1b4c   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_6
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_1b4c 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            6 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.4400     -8.6400     -8.2400    .   .   sbm1   17   .   N    sbm1   17   .   HN    parsed_1b4c   1   
          2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.85        1.65        2.05      .   .   sbm1   19   .   N    sbm1   19   .   HN    parsed_1b4c   1   
          3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.77       -6.97       -6.57      .   .   sbm1   22   .   N    sbm1   22   .   HN    parsed_1b4c   1   
          4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.11        4.91        5.31      .   .   sbm1   23   .   N    sbm1   23   .   HN    parsed_1b4c   1   
          5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.11        8.91        9.31      .   .   sbm1   28   .   N    sbm1   28   .   HN    parsed_1b4c   1   
          6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.55       11.35       11.75      .   .   sbm1   29   .   N    sbm1   29   .   HN    parsed_1b4c   1   
          7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1000     -0.3000      0.1000    .   .   sbm1   30   .   N    sbm1   30   .   HN    parsed_1b4c   1   
          8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.1800      3.9800      4.3800    .   .   sbm1   31   .   N    sbm1   31   .   HN    parsed_1b4c   1   
          9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.6200      4.4200      4.8200    .   .   sbm1   33   .   N    sbm1   33   .   HN    parsed_1b4c   1   
         10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.4100     -2.6100     -2.2100    .   .   sbm1   34   .   N    sbm1   34   .   HN    parsed_1b4c   1   
         11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.7700      7.5700      7.9700    .   .   sbm1   35   .   N    sbm1   35   .   HN    parsed_1b4c   1   
         12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.1800     -0.0200      0.3800    .   .   sbm1   52   .   N    sbm1   52   .   HN    parsed_1b4c   1   
         13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.3400     -9.5400     -9.1400    .   .   sbm1   53   .   N    sbm1   53   .   HN    parsed_1b4c   1   
         14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.3400    -10.5400    -10.1400    .   .   sbm1   57   .   N    sbm1   57   .   HN    parsed_1b4c   1   
         15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.7900    -11.9900    -11.5900    .   .   sbm1   58   .   N    sbm1   58   .   HN    parsed_1b4c   1   
         16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.4800     -5.6800     -5.2800    .   .   sbm1   60   .   N    sbm1   60   .   HN    parsed_1b4c   1   
         17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.32      -11.52      -11.12      .   .   sbm1   61   .   N    sbm1   61   .   HN    parsed_1b4c   1   
         18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.77       -2.97       -2.57      .   .   sbm1   64   .   N    sbm1   64   .   HN    parsed_1b4c   1   
         19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.80      -10.00       -9.60      .   .   sbm1   66   .   N    sbm1   66   .   HN    parsed_1b4c   1   
         20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.9000      6.7000      7.1000    .   .   sbm1   68   .   N    sbm1   68   .   HN    parsed_1b4c   1   
         21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.8800    -11.0800    -10.6800    .   .   sbm1   70   .   N    sbm1   70   .   HN    parsed_1b4c   1   
         22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.9800    -11.1800    -10.7800    .   .   sbm1   73   .   N    sbm1   73   .   HN    parsed_1b4c   1   
         23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.4900     -9.6900     -9.2900    .   .   sbm1   74   .   N    sbm1   74   .   HN    parsed_1b4c   1   
         24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.6200     -8.8200     -8.4200    .   .   sbm1   75   .   N    sbm1   75   .   HN    parsed_1b4c   1   
         25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.5700    -11.7700    -11.3700    .   .   sbm1   77   .   N    sbm1   77   .   HN    parsed_1b4c   1   
         26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.7900     -9.9900     -9.5900    .   .   sbm1   79   .   N    sbm1   79   .   HN    parsed_1b4c   1   
         27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.4400     -8.6400     -8.2400    .   .   sbm2   17   .   N    sbm2   17   .   HN    parsed_1b4c   1   
         28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.85        1.65        2.05      .   .   sbm2   19   .   N    sbm2   19   .   HN    parsed_1b4c   1   
         29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.77       -6.97       -6.57      .   .   sbm2   22   .   N    sbm2   22   .   HN    parsed_1b4c   1   
         30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.11        4.91        5.31      .   .   sbm2   23   .   N    sbm2   23   .   HN    parsed_1b4c   1   
         31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.11        8.91        9.31      .   .   sbm2   28   .   N    sbm2   28   .   HN    parsed_1b4c   1   
         32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.55       11.35       11.75      .   .   sbm2   29   .   N    sbm2   29   .   HN    parsed_1b4c   1   
         33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1000     -0.3000      0.1000    .   .   sbm2   30   .   N    sbm2   30   .   HN    parsed_1b4c   1   
         34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.1800      3.9800      4.3800    .   .   sbm2   31   .   N    sbm2   31   .   HN    parsed_1b4c   1   
         35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.6200      4.4200      4.8200    .   .   sbm2   33   .   N    sbm2   33   .   HN    parsed_1b4c   1   
         36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.4100     -2.6100     -2.2100    .   .   sbm2   34   .   N    sbm2   34   .   HN    parsed_1b4c   1   
         37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.7700      7.5700      7.9700    .   .   sbm2   35   .   N    sbm2   35   .   HN    parsed_1b4c   1   
         38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.1800     -0.0200      0.3800    .   .   sbm2   52   .   N    sbm2   52   .   HN    parsed_1b4c   1   
         39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.3400     -9.5400     -9.1400    .   .   sbm2   53   .   N    sbm2   53   .   HN    parsed_1b4c   1   
         40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.3400    -10.5400    -10.1400    .   .   sbm2   57   .   N    sbm2   57   .   HN    parsed_1b4c   1   
         41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.7900    -11.9900    -11.5900    .   .   sbm2   58   .   N    sbm2   58   .   HN    parsed_1b4c   1   
         42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.4800     -5.6800     -5.2800    .   .   sbm2   60   .   N    sbm2   60   .   HN    parsed_1b4c   1   
         43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.32      -11.52      -11.12      .   .   sbm2   61   .   N    sbm2   61   .   HN    parsed_1b4c   1   
         44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.77       -2.97       -2.57      .   .   sbm2   64   .   N    sbm2   64   .   HN    parsed_1b4c   1   
         45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.80      -10.00       -9.60      .   .   sbm2   66   .   N    sbm2   66   .   HN    parsed_1b4c   1   
         46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.9000      6.7000      7.1000    .   .   sbm2   68   .   N    sbm2   68   .   HN    parsed_1b4c   1   
         47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.8800    -11.0800    -10.6800    .   .   sbm2   70   .   N    sbm2   70   .   HN    parsed_1b4c   1   
         48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.9800    -11.1800    -10.7800    .   .   sbm2   73   .   N    sbm2   73   .   HN    parsed_1b4c   1   
         49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.4900     -9.6900     -9.2900    .   .   sbm2   74   .   N    sbm2   74   .   HN    parsed_1b4c   1   
         50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.6200     -8.8200     -8.4200    .   .   sbm2   75   .   N    sbm2   75   .   HN    parsed_1b4c   1   
         51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.5700    -11.7700    -11.3700    .   .   sbm2   77   .   N    sbm2   77   .   HN    parsed_1b4c   1   
         52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.7900     -9.9900     -9.5900    .   .   sbm2   79   .   N    sbm2   79   .   HN    parsed_1b4c   1   
         53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm1    4   .   N    sbm1    4   .   HN    parsed_1b4c   1   
         54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.5500     -6.7500     -6.3500    .   .   sbm1    5   .   N    sbm1    5   .   HN    parsed_1b4c   1   
         55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.9000     -9.1000     -8.7000    .   .   sbm1    6   .   N    sbm1    6   .   HN    parsed_1b4c   1   
         56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.6900     -9.8900     -9.4900    .   .   sbm1    9   .   N    sbm1    9   .   HN    parsed_1b4c   1   
         57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.6000     -5.8000     -5.4000    .   .   sbm1   12   .   N    sbm1   12   .   HN    parsed_1b4c   1   
         58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.79       -4.99       -4.59      .   .   sbm1   26   .   N    sbm1   26   .   HN    parsed_1b4c   1   
         59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.30        9.10        9.50      .   .   sbm1   69   .   N    sbm1   69   .   HN    parsed_1b4c   1   
         60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm2    4   .   N    sbm2    4   .   HN    parsed_1b4c   1   
         61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.5500     -6.7500     -6.3500    .   .   sbm2    5   .   N    sbm2    5   .   HN    parsed_1b4c   1   
         62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.9000     -9.1000     -8.7000    .   .   sbm2    6   .   N    sbm2    6   .   HN    parsed_1b4c   1   
         63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.6900     -9.8900     -9.4900    .   .   sbm2    9   .   N    sbm2    9   .   HN    parsed_1b4c   1   
         64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.6000     -5.8000     -5.4000    .   .   sbm2   12   .   N    sbm2   12   .   HN    parsed_1b4c   1   
         65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.79       -4.99       -4.59      .   .   sbm2   26   .   N    sbm2   26   .   HN    parsed_1b4c   1   
         66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.30        9.10        9.50      .   .   sbm2   69   .   N    sbm2   69   .   HN    parsed_1b4c   1   
         67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.600      -7.800      -7.400     .   .   sbm1    3   .   N    sbm1    3   .   HN    parsed_1b4c   1   
         68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.000      -7.200      -6.800     .   .   sbm1   10   .   N    sbm1   10   .   HN    parsed_1b4c   1   
         69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.4300     -9.6300     -9.2300    .   .   sbm1   13   .   N    sbm1   13   .   HN    parsed_1b4c   1   
         70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.900      -9.100      -8.700     .   .   sbm1   20   .   N    sbm1   20   .   HN    parsed_1b4c   1   
         71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.7900     -4.9900     -4.5900    .   .   sbm1   26   .   N    sbm1   26   .   HN    parsed_1b4c   1   
         72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1500      1.9500      2.3500    .   .   sbm1   27   .   N    sbm1   27   .   HN    parsed_1b4c   1   
         73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.9000     11.7000     12.1000    .   .   sbm1   36   .   N    sbm1   36   .   HN    parsed_1b4c   1   
         74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.5000     13.3000     13.7000    .   .   sbm1   39   .   N    sbm1   39   .   HN    parsed_1b4c   1   
         75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.8000     -9.0000     -8.6000    .   .   sbm1   42   .   N    sbm1   42   .   HN    parsed_1b4c   1   
         76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.700       1.500       1.900     .   .   sbm1   45   .   N    sbm1   45   .   HN    parsed_1b4c   1   
         77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.000     -10.200      -9.800     .   .   sbm1   46   .   N    sbm1   46   .   HN    parsed_1b4c   1   
         78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4700     -1.6700     -1.2700    .   .   sbm1   48   .   N    sbm1   48   .   HN    parsed_1b4c   1   
         79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.3000    -10.5000    -10.1000    .   .   sbm1   50   .   N    sbm1   50   .   HN    parsed_1b4c   1   
         80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.2000    -12.4000    -12.0000    .   .   sbm1   51   .   N    sbm1   51   .   HN    parsed_1b4c   1   
         81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.5000     -3.7000     -3.3000    .   .   sbm1   56   .   N    sbm1   56   .   HN    parsed_1b4c   1   
         82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.1000     -4.3000     -3.9000    .   .   sbm1   59   .   N    sbm1   59   .   HN    parsed_1b4c   1   
         83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.6000      5.4000      5.8000    .   .   sbm1   63   .   N    sbm1   63   .   HN    parsed_1b4c   1   
         84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.060       9.860      10.260     .   .   sbm1   65   .   N    sbm1   65   .   HN    parsed_1b4c   1   
         85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.5000     11.3000     11.7000    .   .   sbm1   67   .   N    sbm1   67   .   HN    parsed_1b4c   1   
         86   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.3000      9.1000      9.5000    .   .   sbm1   69   .   N    sbm1   69   .   HN    parsed_1b4c   1   
         87   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.3300    -12.5300    -12.1300    .   .   sbm1   80   .   N    sbm1   80   .   HN    parsed_1b4c   1   
         88   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.5000    -11.7000    -11.3000    .   .   sbm1   83   .   N    sbm1   83   .   HN    parsed_1b4c   1   
         89   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.600      -7.800      -7.400     .   .   sbm2    3   .   N    sbm2    3   .   HN    parsed_1b4c   1   
         90   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.000      -7.200      -6.800     .   .   sbm2   10   .   N    sbm2   10   .   HN    parsed_1b4c   1   
         91   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.4300     -9.6300     -9.2300    .   .   sbm2   13   .   N    sbm2   13   .   HN    parsed_1b4c   1   
         92   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.900      -9.100      -8.700     .   .   sbm2   20   .   N    sbm2   20   .   HN    parsed_1b4c   1   
         93   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.7900     -4.9900     -4.5900    .   .   sbm2   26   .   N    sbm2   26   .   HN    parsed_1b4c   1   
         94   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1500      1.9500      2.3500    .   .   sbm2   27   .   N    sbm2   27   .   HN    parsed_1b4c   1   
         95   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.9000     11.7000     12.1000    .   .   sbm2   36   .   N    sbm2   36   .   HN    parsed_1b4c   1   
         96   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.500      13.300      13.700     .   .   sbm2   39   .   N    sbm2   39   .   HN    parsed_1b4c   1   
         97   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.800      -9.000      -8.600     .   .   sbm2   42   .   N    sbm2   42   .   HN    parsed_1b4c   1   
         98   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.700       1.500       1.900     .   .   sbm2   45   .   N    sbm2   45   .   HN    parsed_1b4c   1   
         99   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.00      -10.20       -9.80      .   .   sbm2   46   .   N    sbm2   46   .   HN    parsed_1b4c   1   
        100   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.470      -1.670      -1.270     .   .   sbm2   48   .   N    sbm2   48   .   HN    parsed_1b4c   1   
        101   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.300     -10.500     -10.100     .   .   sbm2   50   .   N    sbm2   50   .   HN    parsed_1b4c   1   
        102   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.200     -12.400     -12.000     .   .   sbm2   51   .   N    sbm2   51   .   HN    parsed_1b4c   1   
        103   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.5000     -3.7000     -3.3000    .   .   sbm2   56   .   N    sbm2   56   .   HN    parsed_1b4c   1   
        104   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.1000     -4.3000     -3.9000    .   .   sbm2   59   .   N    sbm2   59   .   HN    parsed_1b4c   1   
        105   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.600       5.400       5.800     .   .   sbm2   63   .   N    sbm2   63   .   HN    parsed_1b4c   1   
        106   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.060       9.860      10.260     .   .   sbm2   65   .   N    sbm2   65   .   HN    parsed_1b4c   1   
        107   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.500      11.300      11.700     .   .   sbm2   67   .   N    sbm2   67   .   HN    parsed_1b4c   1   
        108   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.3000      9.1000      9.5000    .   .   sbm2   69   .   N    sbm2   69   .   HN    parsed_1b4c   1   
        109   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.330     -12.530     -12.130     .   .   sbm2   80   .   N    sbm2   80   .   HN    parsed_1b4c   1   
        110   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.500     -11.700     -11.300     .   .   sbm2   83   .   N    sbm2   83   .   HN    parsed_1b4c   1   
        111   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7800      3.5800      3.9800    .   .   sbm1    8   .   CA   sbm1    8   .   HA    parsed_1b4c   1   
        112   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5700     -2.7700     -2.3700    .   .   sbm1    9   .   CA   sbm1    9   .   HA    parsed_1b4c   1   
        113   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.4300     -3.6300     -3.2300    .   .   sbm1   14   .   CA   sbm1   14   .   HA    parsed_1b4c   1   
        114   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.6600     -8.8600     -8.4600    .   .   sbm1   16   .   CA   sbm1   16   .   HA    parsed_1b4c   1   
        115   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    28.4000     28.2000     28.6000    .   .   sbm1   19   .   CA   sbm1   19   .   HA#   parsed_1b4c   1   
        116   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    20.25       20.05       20.45      .   .   sbm1   20   .   CA   sbm1   20   .   HA    parsed_1b4c   1   
        117   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.87      -15.07      -14.67      .   .   sbm1   21   .   CA   sbm1   21   .   HA    parsed_1b4c   1   
        118   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.16       -1.36       -0.96      .   .   sbm1   22   .   CA   sbm1   22   .   HA#   parsed_1b4c   1   
        119   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.1800    -17.3800    -16.9800    .   .   sbm1   26   .   CA   sbm1   26   .   HA    parsed_1b4c   1   
        120   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.6000     -4.8000     -4.4000    .   .   sbm1   27   .   CA   sbm1   27   .   HA    parsed_1b4c   1   
        121   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    26.9200     26.7200     27.1200    .   .   sbm1   28   .   CA   sbm1   28   .   HA    parsed_1b4c   1   
        122   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.05       -4.25       -3.85      .   .   sbm1   29   .   CA   sbm1   29   .   HA    parsed_1b4c   1   
        123   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.7200      7.5200      7.9200    .   .   sbm1   31   .   CA   sbm1   31   .   HA    parsed_1b4c   1   
        124   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    24.3800     24.1800     24.5800    .   .   sbm1   32   .   CA   sbm1   32   .   HA    parsed_1b4c   1   
        125   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.2900    -22.4900    -22.0900    .   .   sbm1   33   .   CA   sbm1   33   .   HA    parsed_1b4c   1   
        126   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.7200    -15.9200    -15.5200    .   .   sbm1   34   .   CA   sbm1   34   .   HA    parsed_1b4c   1   
        127   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    31.2500     31.0500     31.4500    .   .   sbm1   35   .   CA   sbm1   35   .   HA    parsed_1b4c   1   
        128   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9600     -1.1600     -0.7600    .   .   sbm1   36   .   CA   sbm1   36   .   HA    parsed_1b4c   1   
        129   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.4300     -5.6300     -5.2300    .   .   sbm1   38   .   CA   sbm1   38   .   HA    parsed_1b4c   1   
        130   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.61        2.41        2.81      .   .   sbm1   48   .   CA   sbm1   48   .   HA    parsed_1b4c   1   
        131   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.84      -16.04      -15.64      .   .   sbm1   49   .   CA   sbm1   49   .   HA    parsed_1b4c   1   
        132   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    29.5700     29.3700     29.7700    .   .   sbm1   52   .   CA   sbm1   52   .   HA    parsed_1b4c   1   
        133   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.4800    -15.6800    -15.2800    .   .   sbm1   53   .   CA   sbm1   53   .   HA    parsed_1b4c   1   
        134   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.6100      2.4100      2.8100    .   .   sbm1   54   .   CA   sbm1   54   .   HA    parsed_1b4c   1   
        135   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.5600     11.3600     11.7600    .   .   sbm1   55   .   CA   sbm1   55   .   HA    parsed_1b4c   1   
        136   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8300      2.6300      3.0300    .   .   sbm1   56   .   CA   sbm1   56   .   HA    parsed_1b4c   1   
        137   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.2900     -9.4900     -9.0900    .   .   sbm1   57   .   CA   sbm1   57   .   HA    parsed_1b4c   1   
        138   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.9300    -15.1300    -14.7300    .   .   sbm1   58   .   CA   sbm1   58   .   HA    parsed_1b4c   1   
        139   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    31.5600     31.3600     31.7600    .   .   sbm1   59   .   CA   sbm1   59   .   HA    parsed_1b4c   1   
        140   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.3400    -12.5400    -12.1400    .   .   sbm1   60   .   CA   sbm1   60   .   HA    parsed_1b4c   1   
        141   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.71       -6.91       -6.51      .   .   sbm1   62   .   CA   sbm1   62   .   HA    parsed_1b4c   1   
        142   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.67        4.47        4.87      .   .   sbm1   63   .   CA   sbm1   63   .   HA    parsed_1b4c   1   
        143   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.54       -6.74       -6.34      .   .   sbm1   64   .   CA   sbm1   64   .   HA#   parsed_1b4c   1   
        144   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    30.94       30.74       31.14      .   .   sbm1   65   .   CA   sbm1   65   .   HA    parsed_1b4c   1   
        145   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.09      -12.29      -11.89      .   .   sbm1   66   .   CA   sbm1   66   .   HA#   parsed_1b4c   1   
        146   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.3700      3.1700      3.5700    .   .   sbm1   70   .   CA   sbm1   70   .   HA    parsed_1b4c   1   
        147   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.6900      7.4900      7.8900    .   .   sbm1   71   .   CA   sbm1   71   .   HA    parsed_1b4c   1   
        148   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.3500     -8.5500     -8.1500    .   .   sbm1   72   .   CA   sbm1   72   .   HA    parsed_1b4c   1   
        149   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.5200    -10.7200    -10.3200    .   .   sbm1   73   .   CA   sbm1   73   .   HA    parsed_1b4c   1   
        150   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    25.3300     25.1300     25.5300    .   .   sbm1   74   .   CA   sbm1   74   .   HA    parsed_1b4c   1   
        151   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.5400    -18.7400    -18.3400    .   .   sbm1   75   .   CA   sbm1   75   .   HA    parsed_1b4c   1   
        152   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.5900    -15.7900    -15.3900    .   .   sbm1   79   .   CA   sbm1   79   .   HA    parsed_1b4c   1   
        153   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.54       -0.74       -0.34      .   .   sbm1   80   .   CA   sbm1   80   .   HA    parsed_1b4c   1   
        154   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.47       -1.67       -1.27      .   .   sbm1   88   .   CA   sbm1   88   .   HA    parsed_1b4c   1   
        155   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7800      3.5800      3.9800    .   .   sbm2    8   .   CA   sbm2    8   .   HA    parsed_1b4c   1   
        156   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5700     -2.7700     -2.3700    .   .   sbm2    9   .   CA   sbm2    9   .   HA    parsed_1b4c   1   
        157   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.4300     -3.6300     -3.2300    .   .   sbm2   14   .   CA   sbm2   14   .   HA    parsed_1b4c   1   
        158   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.6600     -8.8600     -8.4600    .   .   sbm2   16   .   CA   sbm2   16   .   HA    parsed_1b4c   1   
        159   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    28.400      28.200      28.600     .   .   sbm2   19   .   CA   sbm2   19   .   HA#   parsed_1b4c   1   
        160   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    20.2500     20.0500     20.4500    .   .   sbm2   20   .   CA   sbm2   20   .   HA    parsed_1b4c   1   
        161   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.8700    -15.0700    -14.6700    .   .   sbm2   21   .   CA   sbm2   21   .   HA    parsed_1b4c   1   
        162   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1600     -1.3600     -0.9600    .   .   sbm2   22   .   CA   sbm2   22   .   HA#   parsed_1b4c   1   
        163   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.1800    -17.3800    -16.9800    .   .   sbm2   26   .   CA   sbm2   26   .   HA    parsed_1b4c   1   
        164   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.6000     -4.8000     -4.4000    .   .   sbm2   27   .   CA   sbm2   27   .   HA    parsed_1b4c   1   
        165   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    26.9200     26.7200     27.1200    .   .   sbm2   28   .   CA   sbm2   28   .   HA    parsed_1b4c   1   
        166   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.0500     -4.2500     -3.8500    .   .   sbm2   29   .   CA   sbm2   29   .   HA    parsed_1b4c   1   
        167   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.7200      7.5200      7.9200    .   .   sbm2   31   .   CA   sbm2   31   .   HA    parsed_1b4c   1   
        168   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    24.3800     24.1800     24.5800    .   .   sbm2   32   .   CA   sbm2   32   .   HA    parsed_1b4c   1   
        169   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.2900    -22.4900    -22.0900    .   .   sbm2   33   .   CA   sbm2   33   .   HA    parsed_1b4c   1   
        170   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.7200    -15.9200    -15.5200    .   .   sbm2   34   .   CA   sbm2   34   .   HA    parsed_1b4c   1   
        171   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    31.2500     31.0500     31.4500    .   .   sbm2   35   .   CA   sbm2   35   .   HA    parsed_1b4c   1   
        172   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9600     -1.1600     -0.7600    .   .   sbm2   36   .   CA   sbm2   36   .   HA    parsed_1b4c   1   
        173   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.4300     -5.6300     -5.2300    .   .   sbm2   38   .   CA   sbm2   38   .   HA    parsed_1b4c   1   
        174   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.6100      2.4100      2.8100    .   .   sbm2   48   .   CA   sbm2   48   .   HA    parsed_1b4c   1   
        175   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.8400    -16.0400    -15.6400    .   .   sbm2   49   .   CA   sbm2   49   .   HA    parsed_1b4c   1   
        176   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    29.5700     29.3700     29.7700    .   .   sbm2   52   .   CA   sbm2   52   .   HA    parsed_1b4c   1   
        177   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.4800    -15.6800    -15.2800    .   .   sbm2   53   .   CA   sbm2   53   .   HA    parsed_1b4c   1   
        178   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.6100      2.4100      2.8100    .   .   sbm2   54   .   CA   sbm2   54   .   HA    parsed_1b4c   1   
        179   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.5600     11.3600     11.7600    .   .   sbm2   55   .   CA   sbm2   55   .   HA    parsed_1b4c   1   
        180   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8300      2.6300      3.0300    .   .   sbm2   56   .   CA   sbm2   56   .   HA    parsed_1b4c   1   
        181   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.2900     -9.4900     -9.0900    .   .   sbm2   57   .   CA   sbm2   57   .   HA    parsed_1b4c   1   
        182   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.9300    -15.1300    -14.7300    .   .   sbm2   58   .   CA   sbm2   58   .   HA    parsed_1b4c   1   
        183   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    31.5600     31.3600     31.7600    .   .   sbm2   59   .   CA   sbm2   59   .   HA    parsed_1b4c   1   
        184   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.3400    -12.5400    -12.1400    .   .   sbm2   60   .   CA   sbm2   60   .   HA    parsed_1b4c   1   
        185   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.7100     -6.9100     -6.5100    .   .   sbm2   62   .   CA   sbm2   62   .   HA    parsed_1b4c   1   
        186   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.3700      3.1700      3.5700    .   .   sbm2   70   .   CA   sbm2   70   .   HA    parsed_1b4c   1   
        187   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.6900      7.4900      7.8900    .   .   sbm2   71   .   CA   sbm2   71   .   HA    parsed_1b4c   1   
        188   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.3500     -8.5500     -8.1500    .   .   sbm2   72   .   CA   sbm2   72   .   HA    parsed_1b4c   1   
        189   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.5200    -10.7200    -10.3200    .   .   sbm2   73   .   CA   sbm2   73   .   HA    parsed_1b4c   1   
        190   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    25.3300     25.1300     25.5300    .   .   sbm2   74   .   CA   sbm2   74   .   HA    parsed_1b4c   1   
        191   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.5400    -18.7400    -18.3400    .   .   sbm2   75   .   CA   sbm2   75   .   HA    parsed_1b4c   1   
        192   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.5900    -15.7900    -15.3900    .   .   sbm2   79   .   CA   sbm2   79   .   HA    parsed_1b4c   1   
        193   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5400     -0.7400     -0.3400    .   .   sbm2   80   .   CA   sbm2   80   .   HA    parsed_1b4c   1   
        194   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -26.0000    -26.2000    -25.8000    .   .   sbm1   30   .   CA   sbm1   30   .   HA    parsed_1b4c   1   
        195   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    22.1500     21.9500     22.3500    .   .   sbm1   41   .   CA   sbm1   41   .   HA    parsed_1b4c   1   
        196   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    22.5300     22.3300     22.7300    .   .   sbm1   68   .   CA   sbm1   68   .   HA    parsed_1b4c   1   
        197   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0100     -0.2100      0.1900    .   .   sbm1   76   .   CA   sbm1   76   .   HA    parsed_1b4c   1   
        198   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -26.0000    -26.2000    -25.8000    .   .   sbm2   30   .   CA   sbm2   30   .   HA    parsed_1b4c   1   
        199   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    22.1500     21.9500     22.3500    .   .   sbm2   41   .   CA   sbm2   41   .   HA    parsed_1b4c   1   
        200   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    22.5300     22.3300     22.7300    .   .   sbm2   68   .   CA   sbm2   68   .   HA    parsed_1b4c   1   
        201   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0100     -0.2100      0.1900    .   .   sbm2   76   .   CA   sbm2   76   .   HA    parsed_1b4c   1   
        202   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    30.9700     30.7700     31.1700    .   .   sbm1    4   .   CA   sbm1    4   .   HA    parsed_1b4c   1   
        203   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.7000    -23.9000    -23.5000    .   .   sbm1    5   .   CA   sbm1    5   .   HA    parsed_1b4c   1   
        204   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.4700      3.2700      3.6700    .   .   sbm1    6   .   CA   sbm1    6   .   HA    parsed_1b4c   1   
        205   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.32      -16.52      -16.12      .   .   sbm1   10   .   CA   sbm1   10   .   HA    parsed_1b4c   1   
        206   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.32      -16.52      -16.12      .   .   sbm2   10   .   CA   sbm2   10   .   HA    parsed_1b4c   1   
        207   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    32.7000     32.5000     32.9000    .   .   sbm1   11   .   CA   sbm1   11   .   HA    parsed_1b4c   1   
        208   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -25.1000    -25.3000    -24.9000    .   .   sbm1   12   .   CA   sbm1   12   .   HA    parsed_1b4c   1   
        209   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.7000      4.5000      4.9000    .   .   sbm1   13   .   CA   sbm1   13   .   HA    parsed_1b4c   1   
        210   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.5100    -29.7100    -29.3100    .   .   sbm1   37   .   CA   sbm1   37   .   HA    parsed_1b4c   1   
        211   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.2000     15.0000     15.4000    .   .   sbm1   67   .   CA   sbm1   67   .   HA    parsed_1b4c   1   
        212   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    30.9700     30.7700     31.1700    .   .   sbm2    4   .   CA   sbm2    4   .   HA    parsed_1b4c   1   
        213   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.7000    -23.9000    -23.5000    .   .   sbm2    5   .   CA   sbm2    5   .   HA    parsed_1b4c   1   
        214   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.4700      3.2700      3.6700    .   .   sbm2    6   .   CA   sbm2    6   .   HA    parsed_1b4c   1   
        215   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    32.7000     32.5000     32.9000    .   .   sbm2   11   .   CA   sbm2   11   .   HA    parsed_1b4c   1   
        216   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -25.1000    -25.3000    -24.9000    .   .   sbm2   12   .   CA   sbm2   12   .   HA    parsed_1b4c   1   
        217   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.7000      4.5000      4.9000    .   .   sbm2   13   .   CA   sbm2   13   .   HA    parsed_1b4c   1   
        218   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.5100    -29.7100    -29.3100    .   .   sbm2   37   .   CA   sbm2   37   .   HA    parsed_1b4c   1   
        219   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.2000     15.0000     15.4000    .   .   sbm2   67   .   CA   sbm2   67   .   HA    parsed_1b4c   1   
        220   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    61.6900     11.6900     61.8900    .   .   sbm1    1   .   CA   sbm1    1   .   HA    parsed_1b4c   1   
        221   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -55.62      -55.82       -5.62      .   .   sbm1   24   .   CA   sbm1   24   .   HA    parsed_1b4c   1   
        222   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    65.63       15.63       65.83      .   .   sbm1   25   .   CA   sbm1   25   .   HA    parsed_1b4c   1   
        223   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    55.50        5.50       55.70      .   .   sbm1   50   .   CA   sbm1   50   .   HA    parsed_1b4c   1   
        224   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -63.27      -63.47      -13.27      .   .   sbm1   51   .   CA   sbm1   51   .   HA    parsed_1b4c   1   
        225   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    50.7800      0.7800     50.9800    .   .   sbm1   89   .   CA   sbm1   89   .   HA    parsed_1b4c   1   
        226   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    57.62        7.62       57.82      .   .   sbm1   90   .   CA   sbm1   90   .   HA    parsed_1b4c   1   
        227   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    67.7        17.7        67.9       .   .   sbm2    1   .   CA   sbm2    1   .   HA    parsed_1b4c   1   
        228   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -55.6200    -55.8200     -5.6200    .   .   sbm2   24   .   CA   sbm2   24   .   HA    parsed_1b4c   1   
        229   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    65.6300     15.6300     65.8300    .   .   sbm2   25   .   CA   sbm2   25   .   HA    parsed_1b4c   1   
        230   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    55.5000      5.5000     55.7000    .   .   sbm2   50   .   CA   sbm2   50   .   HA    parsed_1b4c   1   
        231   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -63.2700    -63.4700    -13.2700    .   .   sbm2   51   .   CA   sbm2   51   .   HA    parsed_1b4c   1   
        232   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -51.4700    -51.6700     -1.4700    .   .   sbm2   88   .   CA   sbm2   88   .   HA    parsed_1b4c   1   
        233   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    57.6200      7.6200     57.8200    .   .   sbm2   90   .   CA   sbm2   90   .   HA    parsed_1b4c   1   
        234   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7300      1.5300      1.9300    .   .   sbm1    6   .   C    sbm1    6   .   CA    parsed_1b4c   1   
        235   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7300      1.5300      1.9300    .   .   sbm2    6   .   C    sbm2    6   .   CA    parsed_1b4c   1   
        236   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0500     -0.1500      0.2500    .   .   sbm1   15   .   C    sbm1   15   .   CA    parsed_1b4c   1   
        237   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0500     -0.1500      0.2500    .   .   sbm2   15   .   C    sbm2   15   .   CA    parsed_1b4c   1   
        238   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8200      0.6200      1.0200    .   .   sbm1   16   .   C    sbm1   16   .   CA    parsed_1b4c   1   
        239   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8200      0.6200      1.0200    .   .   sbm2   16   .   C    sbm2   16   .   CA    parsed_1b4c   1   
        240   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2000     -1.4000     -1.0000    .   .   sbm1   19   .   C    sbm1   19   .   CA    parsed_1b4c   1   
        241   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2000     -1.4000     -1.0000    .   .   sbm2   19   .   C    sbm2   19   .   CA    parsed_1b4c   1   
        242   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4900     -0.6900     -0.2900    .   .   sbm1   20   .   C    sbm1   20   .   CA    parsed_1b4c   1   
        243   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4900     -0.6900     -0.2900    .   .   sbm2   20   .   C    sbm2   20   .   CA    parsed_1b4c   1   
        244   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5300      0.3300      0.7300    .   .   sbm1   21   .   C    sbm1   21   .   CA    parsed_1b4c   1   
        245   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5300      0.3300      0.7300    .   .   sbm2   21   .   C    sbm2   21   .   CA    parsed_1b4c   1   
        246   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0500     -1.2500     -0.8500    .   .   sbm1   22   .   C    sbm1   22   .   CA    parsed_1b4c   1   
        247   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0500     -1.2500     -0.8500    .   .   sbm2   22   .   C    sbm2   22   .   CA    parsed_1b4c   1   
        248   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3400     -1.5400     -1.1400    .   .   sbm1   24   .   C    sbm1   24   .   CA    parsed_1b4c   1   
        249   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3400     -1.5400     -1.1400    .   .   sbm2   24   .   C    sbm2   24   .   CA    parsed_1b4c   1   
        250   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2300      0.0300      0.4300    .   .   sbm1   25   .   C    sbm1   25   .   CA    parsed_1b4c   1   
        251   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2300      0.0300      0.4300    .   .   sbm2   25   .   C    sbm2   25   .   CA    parsed_1b4c   1   
        252   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1700     -0.3700      0.0300    .   .   sbm1   26   .   C    sbm1   26   .   CA    parsed_1b4c   1   
        253   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1700     -0.3700      0.0300    .   .   sbm2   26   .   C    sbm2   26   .   CA    parsed_1b4c   1   
        254   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7200      1.5200      1.9200    .   .   sbm1   27   .   C    sbm1   27   .   CA    parsed_1b4c   1   
        255   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7200      1.5200      1.9200    .   .   sbm2   27   .   C    sbm2   27   .   CA    parsed_1b4c   1   
        256   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.5500     -3.7500     -3.3500    .   .   sbm1   28   .   C    sbm1   28   .   CA    parsed_1b4c   1   
        257   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.5500     -3.7500     -3.3500    .   .   sbm2   28   .   C    sbm2   28   .   CA    parsed_1b4c   1   
        258   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.6300      3.4300      3.8300    .   .   sbm1   30   .   C    sbm1   30   .   CA    parsed_1b4c   1   
        259   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.6300      3.4300      3.8300    .   .   sbm2   30   .   C    sbm2   30   .   CA    parsed_1b4c   1   
        260   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3400     -1.5400     -1.1400    .   .   sbm1   31   .   C    sbm1   31   .   CA    parsed_1b4c   1   
        261   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3400     -1.5400     -1.1400    .   .   sbm2   31   .   C    sbm2   31   .   CA    parsed_1b4c   1   
        262   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2200     -1.4200     -1.0200    .   .   sbm1   32   .   C    sbm1   32   .   CA    parsed_1b4c   1   
        263   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2200     -1.4200     -1.0200    .   .   sbm2   32   .   C    sbm2   32   .   CA    parsed_1b4c   1   
        264   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.2500      3.0500      3.4500    .   .   sbm1   33   .   C    sbm1   33   .   CA    parsed_1b4c   1   
        265   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.2500      3.0500      3.4500    .   .   sbm2   33   .   C    sbm2   33   .   CA    parsed_1b4c   1   
        266   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4000      0.2000      0.6000    .   .   sbm1   34   .   C    sbm1   34   .   CA    parsed_1b4c   1   
        267   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4000      0.2000      0.6000    .   .   sbm2   34   .   C    sbm2   34   .   CA    parsed_1b4c   1   
        268   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1100      0.9100      1.3100    .   .   sbm1   36   .   C    sbm1   36   .   CA    parsed_1b4c   1   
        269   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1100      0.9100      1.3100    .   .   sbm2   36   .   C    sbm2   36   .   CA    parsed_1b4c   1   
        270   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.3000      3.1000      3.5000    .   .   sbm1   37   .   C    sbm1   37   .   CA    parsed_1b4c   1   
        271   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.3000      3.1000      3.5000    .   .   sbm2   37   .   C    sbm2   37   .   CA    parsed_1b4c   1   
        272   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3400     -0.5400     -0.1400    .   .   sbm1   38   .   C    sbm1   38   .   CA    parsed_1b4c   1   
        273   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3400     -0.5400     -0.1400    .   .   sbm2   38   .   C    sbm2   38   .   CA    parsed_1b4c   1   
        274   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4700     -1.6700     -1.2700    .   .   sbm1   49   .   C    sbm1   49   .   CA    parsed_1b4c   1   
        275   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4700     -1.6700     -1.2700    .   .   sbm2   49   .   C    sbm2   49   .   CA    parsed_1b4c   1   
        276   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.0400      1.8400      2.2400    .   .   sbm1   50   .   C    sbm1   50   .   CA    parsed_1b4c   1   
        277   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.0400      1.8400      2.2400    .   .   sbm2   50   .   C    sbm2   50   .   CA    parsed_1b4c   1   
        278   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.7600     -1.9600     -1.5600    .   .   sbm1   51   .   C    sbm1   51   .   CA    parsed_1b4c   1   
        279   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.7600     -1.9600     -1.5600    .   .   sbm2   51   .   C    sbm2   51   .   CA    parsed_1b4c   1   
        280   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1900     -1.3900     -0.9900    .   .   sbm1   52   .   C    sbm1   52   .   CA    parsed_1b4c   1   
        281   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1900     -1.3900     -0.9900    .   .   sbm2   52   .   C    sbm2   52   .   CA    parsed_1b4c   1   
        282   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5800      0.3800      0.7800    .   .   sbm1   53   .   C    sbm1   53   .   CA    parsed_1b4c   1   
        283   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5800      0.3800      0.7800    .   .   sbm2   53   .   C    sbm2   53   .   CA    parsed_1b4c   1   
        284   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0400     -0.1600      0.2400    .   .   sbm1   54   .   C    sbm1   54   .   CA    parsed_1b4c   1   
        285   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0400     -0.1600      0.2400    .   .   sbm2   54   .   C    sbm2   54   .   CA    parsed_1b4c   1   
        286   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6600     -1.8600     -1.4600    .   .   sbm1   55   .   C    sbm1   55   .   CA    parsed_1b4c   1   
        287   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6600     -1.8600     -1.4600    .   .   sbm2   55   .   C    sbm2   55   .   CA    parsed_1b4c   1   
        288   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6100     -1.8100     -1.4100    .   .   sbm1   56   .   C    sbm1   56   .   CA    parsed_1b4c   1   
        289   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6100     -1.8100     -1.4100    .   .   sbm2   56   .   C    sbm2   56   .   CA    parsed_1b4c   1   
        290   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1100      1.9100      2.3100    .   .   sbm1   57   .   C    sbm1   57   .   CA    parsed_1b4c   1   
        291   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1100      1.9100      2.3100    .   .   sbm2   57   .   C    sbm2   57   .   CA    parsed_1b4c   1   
        292   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2000     -1.4000     -1.0000    .   .   sbm1   58   .   C    sbm1   58   .   CA    parsed_1b4c   1   
        293   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2000     -1.4000     -1.0000    .   .   sbm2   58   .   C    sbm2   58   .   CA    parsed_1b4c   1   
        294   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.0600     -2.2600     -1.8600    .   .   sbm1   62   .   C    sbm1   62   .   CA    parsed_1b4c   1   
        295   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.0600     -2.2600     -1.8600    .   .   sbm2   62   .   C    sbm2   62   .   CA    parsed_1b4c   1   
        296   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3100      2.1100      2.5100    .   .   sbm1   63   .   C    sbm1   63   .   CA    parsed_1b4c   1   
        297   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3100      2.1100      2.5100    .   .   sbm2   63   .   C    sbm2   63   .   CA    parsed_1b4c   1   
        298   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1400     -2.3400     -1.9400    .   .   sbm1   64   .   C    sbm1   64   .   CA    parsed_1b4c   1   
        299   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1400     -2.3400     -1.9400    .   .   sbm2   64   .   C    sbm2   64   .   CA    parsed_1b4c   1   
        300   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4600     -0.6600     -0.2600    .   .   sbm1   65   .   C    sbm1   65   .   CA    parsed_1b4c   1   
        301   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4600     -0.6600     -0.2600    .   .   sbm2   65   .   C    sbm2   65   .   CA    parsed_1b4c   1   
        302   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7800      2.5800      2.9800    .   .   sbm1   66   .   C    sbm1   66   .   CA    parsed_1b4c   1   
        303   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7800      2.5800      2.9800    .   .   sbm2   66   .   C    sbm2   66   .   CA    parsed_1b4c   1   
        304   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.5600     -1.7600     -1.3600    .   .   sbm1   67   .   C    sbm1   67   .   CA    parsed_1b4c   1   
        305   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.5600     -1.7600     -1.3600    .   .   sbm2   67   .   C    sbm2   67   .   CA    parsed_1b4c   1   
        306   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2300     -1.4300     -1.0300    .   .   sbm1   70   .   C    sbm1   70   .   CA    parsed_1b4c   1   
        307   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2300     -1.4300     -1.0300    .   .   sbm2   70   .   C    sbm2   70   .   CA    parsed_1b4c   1   
        308   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6600     -0.8600     -0.4600    .   .   sbm1   71   .   C    sbm1   71   .   CA    parsed_1b4c   1   
        309   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6600     -0.8600     -0.4600    .   .   sbm2   71   .   C    sbm2   71   .   CA    parsed_1b4c   1   
        310   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9900      0.7900      1.1900    .   .   sbm1   72   .   C    sbm1   72   .   CA    parsed_1b4c   1   
        311   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9900      0.7900      1.1900    .   .   sbm2   72   .   C    sbm2   72   .   CA    parsed_1b4c   1   
        312   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.4100     -2.6100     -2.2100    .   .   sbm1   73   .   C    sbm1   73   .   CA    parsed_1b4c   1   
        313   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.4100     -2.6100     -2.2100    .   .   sbm2   73   .   C    sbm2   73   .   CA    parsed_1b4c   1   
        314   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0100     -0.2100      0.1900    .   .   sbm1   74   .   C    sbm1   74   .   CA    parsed_1b4c   1   
        315   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0100     -0.2100      0.1900    .   .   sbm2   74   .   C    sbm2   74   .   CA    parsed_1b4c   1   
        316   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2000     -2.4000     -2.0000    .   .   sbm1   77   .   C    sbm1   77   .   CA    parsed_1b4c   1   
        317   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2000     -2.4000     -2.0000    .   .   sbm2   77   .   C    sbm2   77   .   CA    parsed_1b4c   1   
        318   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9000     -1.1000     -0.7000    .   .   sbm1   78   .   C    sbm1   78   .   CA    parsed_1b4c   1   
        319   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9000     -1.1000     -0.7000    .   .   sbm2   78   .   C    sbm2   78   .   CA    parsed_1b4c   1   
        320   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7700      0.5700      0.9700    .   .   sbm1   79   .   C    sbm1   79   .   CA    parsed_1b4c   1   
        321   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7700      0.5700      0.9700    .   .   sbm2   79   .   C    sbm2   79   .   CA    parsed_1b4c   1   
        322   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.0800      0.8800      1.2800    .   .   sbm1   80   .   C    sbm1   80   .   CA    parsed_1b4c   1   
        323   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.0800      0.8800      1.2800    .   .   sbm2   80   .   C    sbm2   80   .   CA    parsed_1b4c   1   
        324   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0700     -0.2700      0.1300    .   .   sbm1    4   .   C    sbm1    4   .   CA    parsed_1b4c   1   
        325   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0700     -0.2700      0.1300    .   .   sbm2    4   .   C    sbm2    4   .   CA    parsed_1b4c   1   
        326   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8100      2.6100      3.0100    .   .   sbm1    9   .   C    sbm1    9   .   CA    parsed_1b4c   1   
        327   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8100      2.6100      3.0100    .   .   sbm2    9   .   C    sbm2    9   .   CA    parsed_1b4c   1   
        328   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7600      1.5600      1.9600    .   .   sbm1   13   .   C    sbm1   13   .   CA    parsed_1b4c   1   
        329   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7600      1.5600      1.9600    .   .   sbm2   13   .   C    sbm2   13   .   CA    parsed_1b4c   1   
        330   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2400     -2.4400     -2.0400    .   .   sbm1   39   .   C    sbm1   39   .   CA    parsed_1b4c   1   
        331   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2400     -2.4400     -2.0400    .   .   sbm2   39   .   C    sbm2   39   .   CA    parsed_1b4c   1   
        332   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2700     -1.4700     -1.0700    .   .   sbm1   40   .   C    sbm1   40   .   CA    parsed_1b4c   1   
        333   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2700     -1.4700     -1.0700    .   .   sbm2   40   .   C    sbm2   40   .   CA    parsed_1b4c   1   
        334   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.3400     -3.5400     -3.1400    .   .   sbm1    0   .   C    sbm1    0   .   CA    parsed_1b4c   1   
        335   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.3400     -3.5400     -3.1400    .   .   sbm2    0   .   C    sbm2    0   .   CA    parsed_1b4c   1   
        336   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8700     -1.0700     -0.6700    .   .   sbm1    1   .   C    sbm1    1   .   CA    parsed_1b4c   1   
        337   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8700     -1.0700     -0.6700    .   .   sbm2    1   .   C    sbm2    1   .   CA    parsed_1b4c   1   
        338   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3200      1.1200      1.5200    .   .   sbm1    2   .   C    sbm1    2   .   CA    parsed_1b4c   1   
        339   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3200      1.1200      1.5200    .   .   sbm2    2   .   C    sbm2    2   .   CA    parsed_1b4c   1   
        340   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8100     -2.0100     -1.6100    .   .   sbm1    3   .   C    sbm1    3   .   CA    parsed_1b4c   1   
        341   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8100     -2.0100     -1.6100    .   .   sbm2    3   .   C    sbm2    3   .   CA    parsed_1b4c   1   
        342   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.420       0.220       0.620     .   .   sbm1    5   .   C    sbm1    5   .   CA    parsed_1b4c   1   
        343   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.420       0.220       0.620     .   .   sbm2    5   .   C    sbm2    5   .   CA    parsed_1b4c   1   
        344   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6200     -1.8200     -1.4200    .   .   sbm1    7   .   C    sbm1    7   .   CA    parsed_1b4c   1   
        345   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6200     -1.8200     -1.4200    .   .   sbm2    7   .   C    sbm2    7   .   CA    parsed_1b4c   1   
        346   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1900     -0.3900      0.0100    .   .   sbm1   12   .   C    sbm1   12   .   CA    parsed_1b4c   1   
        347   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1900     -0.3900      0.0100    .   .   sbm2   12   .   C    sbm2   12   .   CA    parsed_1b4c   1   
        348   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6800     -0.8800     -0.4800    .   .   sbm1   29   .   C    sbm1   29   .   CA    parsed_1b4c   1   
        349   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6800     -0.8800     -0.4800    .   .   sbm2   29   .   C    sbm2   29   .   CA    parsed_1b4c   1   
        350   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1400     -2.3400     -1.9400    .   .   sbm1   35   .   C    sbm1   35   .   CA    parsed_1b4c   1   
        351   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1400     -2.3400     -1.9400    .   .   sbm2   35   .   C    sbm2   35   .   CA    parsed_1b4c   1   
        352   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4100     -1.6100     -1.2100    .   .   sbm1   41   .   C    sbm1   41   .   CA    parsed_1b4c   1   
        353   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4100     -1.6100     -1.2100    .   .   sbm2   41   .   C    sbm2   41   .   CA    parsed_1b4c   1   
        354   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4900     -1.6900     -1.2900    .   .   sbm1   43   .   C    sbm1   43   .   CA    parsed_1b4c   1   
        355   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4900     -1.6900     -1.2900    .   .   sbm2   43   .   C    sbm2   43   .   CA    parsed_1b4c   1   
        356   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1500     -1.3500     -0.9500    .   .   sbm1   45   .   C    sbm1   45   .   CA    parsed_1b4c   1   
        357   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1500     -1.3500     -0.9500    .   .   sbm2   45   .   C    sbm2   45   .   CA    parsed_1b4c   1   
        358   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2300     -1.4300     -1.0300    .   .   sbm1   59   .   C    sbm1   59   .   CA    parsed_1b4c   1   
        359   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2300     -1.4300     -1.0300    .   .   sbm2   59   .   C    sbm2   59   .   CA    parsed_1b4c   1   
        360   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2400     -1.4400     -1.0400    .   .   sbm1   60   .   C    sbm1   60   .   CA    parsed_1b4c   1   
        361   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2400     -1.4400     -1.0400    .   .   sbm2   60   .   C    sbm2   60   .   CA    parsed_1b4c   1   
        362   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6100     -1.8100     -1.4100    .   .   sbm1   75   .   C    sbm1   75   .   CA    parsed_1b4c   1   
        363   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6100     -1.8100     -1.4100    .   .   sbm2   75   .   C    sbm2   75   .   CA    parsed_1b4c   1   
        364   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2600      0.0600      0.4600    .   .   sbm1   88   .   C    sbm1   88   .   CA    parsed_1b4c   1   
        365   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2600      0.0600      0.4600    .   .   sbm2   88   .   C    sbm2   88   .   CA    parsed_1b4c   1   
        366   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3900     -0.5900     -0.1900    .   .   sbm1   89   .   C    sbm1   89   .   CA    parsed_1b4c   1   
        367   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3900     -0.5900     -0.1900    .   .   sbm2   89   .   C    sbm2   89   .   CA    parsed_1b4c   1   
        368   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7900     -0.9900     -0.5900    .   .   sbm1   90   .   C    sbm1   90   .   CA    parsed_1b4c   1   
        369   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7900     -0.9900     -0.5900    .   .   sbm2   90   .   C    sbm2   90   .   CA    parsed_1b4c   1   
        370   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0300     -0.2300      0.1700    .   .   sbm1   16   .   C    sbm1   17   .   HN    parsed_1b4c   1   
        371   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.0800      2.8800      3.2800    .   .   sbm1   18   .   C    sbm1   19   .   HN    parsed_1b4c   1   
        372   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.8900     -4.0900     -3.6900    .   .   sbm1   21   .   C    sbm1   22   .   HN    parsed_1b4c   1   
        373   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.9000     -2.1000     -1.7000    .   .   sbm1   25   .   C    sbm1   26   .   HN    parsed_1b4c   1   
        374   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.8600      4.6600      5.0600    .   .   sbm1   28   .   C    sbm1   29   .   HN    parsed_1b4c   1   
        375   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1000     -2.3000     -1.9000    .   .   sbm1   30   .   C    sbm1   31   .   HN    parsed_1b4c   1   
        376   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5900     -2.7900     -2.3900    .   .   sbm1   33   .   C    sbm1   34   .   HN    parsed_1b4c   1   
        377   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7800      0.5800      0.9800    .   .   sbm1   34   .   C    sbm1   35   .   HN    parsed_1b4c   1   
        378   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1000      0.9000      1.3000    .   .   sbm1   51   .   C    sbm1   52   .   HN    parsed_1b4c   1   
        379   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7500      1.5500      1.9500    .   .   sbm1   52   .   C    sbm1   53   .   HN    parsed_1b4c   1   
        380   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.6700      3.4700      3.8700    .   .   sbm1   55   .   C    sbm1   56   .   HN    parsed_1b4c   1   
        381   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6200     -1.8200     -1.4200    .   .   sbm1   57   .   C    sbm1   58   .   HN    parsed_1b4c   1   
        382   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.1800      2.9800      3.3800    .   .   sbm1   59   .   C    sbm1   60   .   HN    parsed_1b4c   1   
        383   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.6100     -2.8100     -2.4100    .   .   sbm1   60   .   C    sbm1   61   .   HN    parsed_1b4c   1   
        384   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4800     -0.6800     -0.2800    .   .   sbm1   63   .   C    sbm1   64   .   HN    parsed_1b4c   1   
        385   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.35000     4.15000     4.55000   .   .   sbm1   67   .   C    sbm1   68   .   HN    parsed_1b4c   1   
        386   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9000     -1.1000     -0.7000    .   .   sbm1   69   .   C    sbm1   70   .   HN    parsed_1b4c   1   
        387   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm1   72   .   C    sbm1   73   .   HN    parsed_1b4c   1   
        388   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8500     -2.0500     -1.6500    .   .   sbm1   73   .   C    sbm1   74   .   HN    parsed_1b4c   1   
        389   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.6500      1.4500      1.8500    .   .   sbm1   74   .   C    sbm1   75   .   HN    parsed_1b4c   1   
        390   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0300     -0.2300      0.1700    .   .   sbm2   16   .   C    sbm2   17   .   HN    parsed_1b4c   1   
        391   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.0800      2.8800      3.2800    .   .   sbm2   18   .   C    sbm2   19   .   HN    parsed_1b4c   1   
        392   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.8900     -4.0900     -3.6900    .   .   sbm2   21   .   C    sbm2   22   .   HN    parsed_1b4c   1   
        393   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.9000     -2.1000     -1.7000    .   .   sbm2   25   .   C    sbm2   26   .   HN    parsed_1b4c   1   
        394   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.8600      4.6600      5.0600    .   .   sbm2   28   .   C    sbm2   29   .   HN    parsed_1b4c   1   
        395   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1000     -2.3000     -1.9000    .   .   sbm2   30   .   C    sbm2   31   .   HN    parsed_1b4c   1   
        396   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5900     -2.7900     -2.3900    .   .   sbm2   33   .   C    sbm2   34   .   HN    parsed_1b4c   1   
        397   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7800      0.5800      0.9800    .   .   sbm2   34   .   C    sbm2   35   .   HN    parsed_1b4c   1   
        398   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1000      0.9000      1.3000    .   .   sbm2   51   .   C    sbm2   52   .   HN    parsed_1b4c   1   
        399   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7500      1.5500      1.9500    .   .   sbm2   52   .   C    sbm2   53   .   HN    parsed_1b4c   1   
        400   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.6700      3.4700      3.8700    .   .   sbm2   55   .   C    sbm2   56   .   HN    parsed_1b4c   1   
        401   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.6200     -1.8200     -1.4200    .   .   sbm2   57   .   C    sbm2   58   .   HN    parsed_1b4c   1   
        402   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.1800      2.9800      3.3800    .   .   sbm2   59   .   C    sbm2   60   .   HN    parsed_1b4c   1   
        403   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.6100     -2.8100     -2.4100    .   .   sbm2   60   .   C    sbm2   61   .   HN    parsed_1b4c   1   
        404   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4800     -0.6800     -0.2800    .   .   sbm2   63   .   C    sbm2   64   .   HN    parsed_1b4c   1   
        405   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.35000     4.15000     4.55000   .   .   sbm2   67   .   C    sbm2   68   .   HN    parsed_1b4c   1   
        406   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9000     -1.1000     -0.7000    .   .   sbm2   69   .   C    sbm2   70   .   HN    parsed_1b4c   1   
        407   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm2   72   .   C    sbm2   73   .   HN    parsed_1b4c   1   
        408   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8500     -2.0500     -1.6500    .   .   sbm2   73   .   C    sbm2   74   .   HN    parsed_1b4c   1   
        409   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.6500      1.4500      1.8500    .   .   sbm2   74   .   C    sbm2   75   .   HN    parsed_1b4c   1   
        410   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.8100     -4.0100     -3.6100    .   .   sbm1    8   .   C    sbm1    9   .   HN    parsed_1b4c   1   
        411   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1000     -2.3000     -1.9000    .   .   sbm1    9   .   C    sbm1   10   .   HN    parsed_1b4c   1   
        412   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.8800     -3.0800     -2.6800    .   .   sbm1   29   .   C    sbm1   30   .   HN    parsed_1b4c   1   
        413   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.4000      4.2000      4.6000    .   .   sbm1   35   .   C    sbm1   36   .   HN    parsed_1b4c   1   
        414   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.3600     -2.5600     -2.1600    .   .   sbm1   76   .   C    sbm1   77   .   HN    parsed_1b4c   1   
        415   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.8100     -4.0100     -3.6100    .   .   sbm2    8   .   C    sbm2    9   .   HN    parsed_1b4c   1   
        416   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.1000     -2.3000     -1.9000    .   .   sbm2    9   .   C    sbm2   10   .   HN    parsed_1b4c   1   
        417   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.8800     -3.0800     -2.6800    .   .   sbm2   29   .   C    sbm2   30   .   HN    parsed_1b4c   1   
        418   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.4000      4.2000      4.6000    .   .   sbm2   35   .   C    sbm2   36   .   HN    parsed_1b4c   1   
        419   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.3600     -2.5600     -2.1600    .   .   sbm2   76   .   C    sbm2   77   .   HN    parsed_1b4c   1   
        420   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2500     -0.4500     -0.0500    .   .   sbm1    3   .   C    sbm1    4   .   N     parsed_1b4c   1   
        421   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2100      1.0100      1.4100    .   .   sbm1    4   .   C    sbm1    5   .   N     parsed_1b4c   1   
        422   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2800     -2.4800     -2.0800    .   .   sbm1    8   .   C    sbm1    9   .   N     parsed_1b4c   1   
        423   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8700      0.6700      1.0700    .   .   sbm1    9   .   C    sbm1   10   .   N     parsed_1b4c   1   
        424   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm1   12   .   C    sbm1   13   .   N     parsed_1b4c   1   
        425   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2700      0.0700      0.4700    .   .   sbm1   13   .   C    sbm1   14   .   N     parsed_1b4c   1   
        426   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm1   27   .   C    sbm1   28   .   N     parsed_1b4c   1   
        427   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm1   29   .   C    sbm1   30   .   N     parsed_1b4c   1   
        428   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5200     -0.7200     -0.3200    .   .   sbm1   32   .   C    sbm1   33   .   N     parsed_1b4c   1   
        429   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9100      0.7100      1.1100    .   .   sbm1   35   .   C    sbm1   36   .   N     parsed_1b4c   1   
        430   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.14000    -0.34000     0.06000   .   .   sbm1   41   .   C    sbm1   42   .   N     parsed_1b4c   1   
        431   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3600      0.1600      0.5600    .   .   sbm1   76   .   C    sbm1   77   .   N     parsed_1b4c   1   
        432   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7900      0.5900      0.9900    .   .   sbm1   78   .   C    sbm1   79   .   N     parsed_1b4c   1   
        433   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5700     -0.7700     -0.3700    .   .   sbm1   79   .   C    sbm1   80   .   N     parsed_1b4c   1   
        434   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2500     -0.4500     -0.0500    .   .   sbm2    3   .   C    sbm2    4   .   N     parsed_1b4c   1   
        435   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2100      1.0100      1.4100    .   .   sbm2    4   .   C    sbm2    5   .   N     parsed_1b4c   1   
        436   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2800     -2.4800     -2.0800    .   .   sbm2    8   .   C    sbm2    9   .   N     parsed_1b4c   1   
        437   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8700      0.6700      1.0700    .   .   sbm2    9   .   C    sbm2   10   .   N     parsed_1b4c   1   
        438   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm2   12   .   C    sbm2   13   .   N     parsed_1b4c   1   
        439   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2700      0.0700      0.4700    .   .   sbm2   13   .   C    sbm2   14   .   N     parsed_1b4c   1   
        440   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm2   27   .   C    sbm2   28   .   N     parsed_1b4c   1   
        441   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm2   29   .   C    sbm2   30   .   N     parsed_1b4c   1   
        442   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5200     -0.7200     -0.3200    .   .   sbm2   32   .   C    sbm2   33   .   N     parsed_1b4c   1   
        443   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9100      0.7100      1.1100    .   .   sbm2   35   .   C    sbm2   36   .   N     parsed_1b4c   1   
        444   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.14000    -0.34000     0.06000   .   .   sbm2   41   .   C    sbm2   42   .   N     parsed_1b4c   1   
        445   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3600      0.1600      0.5600    .   .   sbm2   76   .   C    sbm2   77   .   N     parsed_1b4c   1   
        446   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7900      0.5900      0.9900    .   .   sbm2   78   .   C    sbm2   79   .   N     parsed_1b4c   1   
        447   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5700     -0.7700     -0.3700    .   .   sbm2   79   .   C    sbm2   80   .   N     parsed_1b4c   1   
        448   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3800     -1.5800     -1.1800    .   .   sbm1    1   .   C    sbm1    2   .   N     parsed_1b4c   1   
        449   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.0400      0.8400      1.2400    .   .   sbm1   16   .   C    sbm1   17   .   N     parsed_1b4c   1   
        450   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.4700      1.2700      1.6700    .   .   sbm1   18   .   C    sbm1   19   .   N     parsed_1b4c   1   
        451   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4900     -0.6900     -0.2900    .   .   sbm1   21   .   C    sbm1   22   .   N     parsed_1b4c   1   
        452   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7500     -0.9500     -0.5500    .   .   sbm1   25   .   C    sbm1   26   .   N     parsed_1b4c   1   
        453   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.800       0.600       1.000     .   .   sbm1   28   .   C    sbm1   29   .   N     parsed_1b4c   1   
        454   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7100     -0.9100     -0.5100    .   .   sbm1   30   .   C    sbm1   31   .   N     parsed_1b4c   1   
        455   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm1   33   .   C    sbm1   34   .   N     parsed_1b4c   1   
        456   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5900     -0.7900     -0.3900    .   .   sbm1   34   .   C    sbm1   35   .   N     parsed_1b4c   1   
        457   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3900      0.1900      0.5900    .   .   sbm1   51   .   C    sbm1   52   .   N     parsed_1b4c   1   
        458   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8200      0.6200      1.0200    .   .   sbm1   52   .   C    sbm1   53   .   N     parsed_1b4c   1   
        459   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3600      1.1600      1.5600    .   .   sbm1   55   .   C    sbm1   56   .   N     parsed_1b4c   1   
        460   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm1   56   .   C    sbm1   57   .   N     parsed_1b4c   1   
        461   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4100      0.2100      0.6100    .   .   sbm1   57   .   C    sbm1   58   .   N     parsed_1b4c   1   
        462   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1300      1.9300      2.3300    .   .   sbm1   59   .   C    sbm1   60   .   N     parsed_1b4c   1   
        463   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7300     -0.9300     -0.5300    .   .   sbm1   60   .   C    sbm1   61   .   N     parsed_1b4c   1   
        464   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2900     -0.4900     -0.0900    .   .   sbm1   63   .   C    sbm1   64   .   N     parsed_1b4c   1   
        465   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5000      0.3000      0.7000    .   .   sbm1   67   .   C    sbm1   68   .   N     parsed_1b4c   1   
        466   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3500      0.1500      0.5500    .   .   sbm1   69   .   C    sbm1   70   .   N     parsed_1b4c   1   
        467   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.71000     0.51000     0.91000   .   .   sbm1   72   .   C    sbm1   73   .   N     parsed_1b4c   1   
        468   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9500     -1.1500     -0.7500    .   .   sbm1   73   .   C    sbm1   74   .   N     parsed_1b4c   1   
        469   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.2200      2.0200      2.4200    .   .   sbm1   74   .   C    sbm1   75   .   N     parsed_1b4c   1   
        470   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2800      0.0800      0.4800    .   .   sbm1   88   .   C    sbm1   89   .   N     parsed_1b4c   1   
        471   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.3800     -1.5800     -1.1800    .   .   sbm2    1   .   C    sbm2    2   .   N     parsed_1b4c   1   
        472   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.0400      0.8400      1.2400    .   .   sbm2   16   .   C    sbm2   17   .   N     parsed_1b4c   1   
        473   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.4700      1.2700      1.6700    .   .   sbm2   18   .   C    sbm2   19   .   N     parsed_1b4c   1   
        474   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.4900     -0.6900     -0.2900    .   .   sbm2   21   .   C    sbm2   22   .   N     parsed_1b4c   1   
        475   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7500     -0.9500     -0.5500    .   .   sbm2   25   .   C    sbm2   26   .   N     parsed_1b4c   1   
        476   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.800       0.600       1.000     .   .   sbm2   28   .   C    sbm2   29   .   N     parsed_1b4c   1   
        477   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7100     -0.9100     -0.5100    .   .   sbm2   30   .   C    sbm2   31   .   N     parsed_1b4c   1   
        478   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm2   33   .   C    sbm2   34   .   N     parsed_1b4c   1   
        479   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5900     -0.7900     -0.3900    .   .   sbm2   34   .   C    sbm2   35   .   N     parsed_1b4c   1   
        480   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3900      0.1900      0.5900    .   .   sbm2   51   .   C    sbm2   52   .   N     parsed_1b4c   1   
        481   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8200      0.6200      1.0200    .   .   sbm2   52   .   C    sbm2   53   .   N     parsed_1b4c   1   
        482   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3600      1.1600      1.5600    .   .   sbm2   55   .   C    sbm2   56   .   N     parsed_1b4c   1   
        483   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm2   56   .   C    sbm2   57   .   N     parsed_1b4c   1   
        484   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4100      0.2100      0.6100    .   .   sbm2   57   .   C    sbm2   58   .   N     parsed_1b4c   1   
        485   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.1300      1.9300      2.3300    .   .   sbm2   59   .   C    sbm2   60   .   N     parsed_1b4c   1   
        486   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7300     -0.9300     -0.5300    .   .   sbm2   60   .   C    sbm2   61   .   N     parsed_1b4c   1   
        487   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2900     -0.4900     -0.0900    .   .   sbm2   63   .   C    sbm2   64   .   N     parsed_1b4c   1   
        488   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5000      0.3000      0.7000    .   .   sbm2   67   .   C    sbm2   68   .   N     parsed_1b4c   1   
        489   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3500      0.1500      0.5500    .   .   sbm2   69   .   C    sbm2   70   .   N     parsed_1b4c   1   
        490   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.71000     0.51000     0.91000   .   .   sbm2   72   .   C    sbm2   73   .   N     parsed_1b4c   1   
        491   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9500     -1.1500     -0.7500    .   .   sbm2   73   .   C    sbm2   74   .   N     parsed_1b4c   1   
        492   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.2200      2.0200      2.4200    .   .   sbm2   74   .   C    sbm2   75   .   N     parsed_1b4c   1   
        493   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2800      0.0800      0.4800    .   .   sbm2   88   .   C    sbm2   89   .   N     parsed_1b4c   1   
        494   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2500     -0.4500     -0.0500    .   .   sbm1    3   .   C    sbm1    4   .   N     parsed_1b4c   1   
        495   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2100      1.0100      1.4100    .   .   sbm1    4   .   C    sbm1    5   .   N     parsed_1b4c   1   
        496   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2800     -2.4800     -2.0800    .   .   sbm1    8   .   C    sbm1    9   .   N     parsed_1b4c   1   
        497   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8700      0.6700      1.0700    .   .   sbm1    9   .   C    sbm1   10   .   N     parsed_1b4c   1   
        498   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm1   12   .   C    sbm1   13   .   N     parsed_1b4c   1   
        499   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2700      0.0700      0.4700    .   .   sbm1   13   .   C    sbm1   14   .   N     parsed_1b4c   1   
        500   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm1   27   .   C    sbm1   28   .   N     parsed_1b4c   1   
        501   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm1   29   .   C    sbm1   30   .   N     parsed_1b4c   1   
        502   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5200     -0.7200     -0.3200    .   .   sbm1   32   .   C    sbm1   33   .   N     parsed_1b4c   1   
        503   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9100      0.7100      1.1100    .   .   sbm1   35   .   C    sbm1   36   .   N     parsed_1b4c   1   
        504   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.14000    -0.34000     0.06000   .   .   sbm1   41   .   C    sbm1   42   .   N     parsed_1b4c   1   
        505   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3600      0.1600      0.5600    .   .   sbm1   76   .   C    sbm1   77   .   N     parsed_1b4c   1   
        506   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7900      0.5900      0.9900    .   .   sbm1   78   .   C    sbm1   79   .   N     parsed_1b4c   1   
        507   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5700     -0.7700     -0.3700    .   .   sbm1   79   .   C    sbm1   80   .   N     parsed_1b4c   1   
        508   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2500     -0.4500     -0.0500    .   .   sbm2    3   .   C    sbm2    4   .   N     parsed_1b4c   1   
        509   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2100      1.0100      1.4100    .   .   sbm2    4   .   C    sbm2    5   .   N     parsed_1b4c   1   
        510   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.2800     -2.4800     -2.0800    .   .   sbm2    8   .   C    sbm2    9   .   N     parsed_1b4c   1   
        511   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.8700      0.6700      1.0700    .   .   sbm2    9   .   C    sbm2   10   .   N     parsed_1b4c   1   
        512   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0700     -1.2700     -0.8700    .   .   sbm2   12   .   C    sbm2   13   .   N     parsed_1b4c   1   
        513   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2700      0.0700      0.4700    .   .   sbm2   13   .   C    sbm2   14   .   N     parsed_1b4c   1   
        514   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0100     -1.2100     -0.8100    .   .   sbm2   27   .   C    sbm2   28   .   N     parsed_1b4c   1   
        515   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8400     -2.0400     -1.6400    .   .   sbm2   29   .   C    sbm2   30   .   N     parsed_1b4c   1   
        516   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5200     -0.7200     -0.3200    .   .   sbm2   32   .   C    sbm2   33   .   N     parsed_1b4c   1   
        517   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9100      0.7100      1.1100    .   .   sbm2   35   .   C    sbm2   36   .   N     parsed_1b4c   1   
        518   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.14000    -0.34000     0.06000   .   .   sbm2   41   .   C    sbm2   42   .   N     parsed_1b4c   1   
        519   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.3600      0.1600      0.5600    .   .   sbm2   76   .   C    sbm2   77   .   N     parsed_1b4c   1   
        520   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7900      0.5900      0.9900    .   .   sbm2   78   .   C    sbm2   79   .   N     parsed_1b4c   1   
        521   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5700     -0.7700     -0.3700    .   .   sbm2   79   .   C    sbm2   80   .   N     parsed_1b4c   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   
;
Dipolar Coupling Constraints
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 2    and name N   )
( segid="sbm1" and resid 2    and name HN  ) -54.165 45.835
was -8.33 0
;
      1   1      9   13   parsed_1b4c   1   
          2   "was 1.85"                                                                 24   1     24   11   parsed_1b4c   1   
          3   "was -6.77 0"                                                              32   1     32   14   parsed_1b4c   1   
          4   "was 5.11 0.0"                                                             40   1     40   14   parsed_1b4c   1   
          5   "was 9.11 0.0"                                                             48   1     48   14   parsed_1b4c   1   
          6   "was 11.55 0"                                                              56   1     56   13   parsed_1b4c   1   
          7   "was -11.32 0"                                                            134   1    134   14   parsed_1b4c   1   
          8   "was -2.77 0, but it was out"                                             142   1    142   29   parsed_1b4c   1   
          9   "was -9.800 0, but it was out"                                            150   1    150   30   parsed_1b4c   1   
         10   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 89   and name N   )
( segid="sbm1" and resid 89   and name HN  )  52.0000 48.0000
was 4.0000 0
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 91   and name N   )
( segid="sbm1" and resid 91   and name HN  )  50.4000 49.6000
was 0.8 0
second subunit
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 2    and name N   )
( segid="sbm2" and resid 2    and name HN  )  -54.1650 45.8350
;
    201   1    224   71   parsed_1b4c   1   
         11   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 89   and name N   )
( segid="sbm2" and resid 89   and name HN  )  52.0000 48.0000
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 91   and name N   )
( segid="sbm2" and resid 91   and name HN  )  50.4000 49.6000
Residues transferred over from table 2
;
    408   1    422   40   parsed_1b4c   1   
         12   
;
residues 4,5,6,9,12,26,69 were moved to #1 category on 6/9/98
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 1    and name N   )
( segid="sbm1" and resid 1    and name HN  )  8.2000  0.2  0.2
;
    523   1    530   71   parsed_1b4c   1   
         13   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 4    and name N   )
( segid="sbm1" and resid 4    and name HN  )  -1.8400  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 5    and name N   )
( segid="sbm1" and resid 5    and name HN  )  -6.5500  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 6    and name N   )
( segid="sbm1" and resid 6    and name HN  )  -8.9000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 9    and name N   )
( segid="sbm1" and resid 9    and name HN  )  -9.6900  0.2  0.2
;
    539   1    565   72   parsed_1b4c   1   
         14   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 12   and name N   )
( segid="sbm1" and resid 12   and name HN  )  -5.6000  0.2  0.2
;
    574   1    579   72   parsed_1b4c   1   
         15   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 14   and name N   )
( segid="sbm1" and resid 14   and name HN  )  -6.4000  0.2  0.2
back in 980211, poor peak shape/very weak in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 15   and name N   )
( segid="sbm1" and resid 15   and name HN  )  -3.8200  0.2  0.2
back in 980211, very poor peak shape and weak in LC
back out 980227 - vios
;
    588   1    603   24   parsed_1b4c   1   
         16   
;
back in 980205, out again 980206 b/c RAMA vio
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 25   and name N   )
( segid="sbm1" and resid 25   and name HN  )  1.700  0.2  0.2
back in 980205
;
    611   1    619   16   parsed_1b4c   1   
         17   "overlap with 11/13 could be a real problem here"                         641   1    641   49   parsed_1b4c   1   
         18   
;
back in 980205
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 40   and name N   )
( segid="sbm1" and resid 40   and name HN  )  -0.9000  0.2  0.2
back in 980205, out 980312
;
    649   1    657   28   parsed_1b4c   1   
         19   "back in 980205"                                                          672   1    672   16   parsed_1b4c   1   
         20   
;
back in 980205
back out 980227 - vios
;
    680   1    681   24   parsed_1b4c   1   
         21   "back in 980211, poor pk shape/weak in LC"                                689   1    689   42   parsed_1b4c   1   
         22   "back in 980205, out 980311 b/c vios"                                     704   1    704   37   parsed_1b4c   1   
         23   
;
ovlps A9 in LC, causes RAMA vios, no b/c RAMA vios w/o it
out 980227 - vios
;
    712   1    713   20   parsed_1b4c   1   
         24   "back in 980205, out 980311 - talos vios"                                 728   1    728   41   parsed_1b4c   1   
         25   "back in 980211"                                                          736   1    736   16   parsed_1b4c   1   
         26   "back in 980205, out 980311 - vios"                                       744   1    744   35   parsed_1b4c   1   
         27   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 71   and name N   )
( segid="sbm2" and resid 71   and name HN  )  -6.3400  0.2  0.2
back in 980211, ovlps 76 in LC
out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 76   and name N   )
( segid="sbm1" and resid 76   and name HN  )  -8.0000  0.2  0.2
overlap in LC data
;
    753   1    768   20   parsed_1b4c   1   
         28   "poor peak shape in both LC & iso, out 980312"                            776   1    776   46   parsed_1b4c   1   
         29   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 88   and name N   )
( segid="sbm1" and resid 88   and name HN  )  -3.2000  0.2  0.2
wk peaks in LC, remove 980313 vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 90   and name N   )
( segid="sbm1" and resid 90   and name HN  )  51.0500 48.9500
second subunit
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 1    and name N   )
( segid="sbm2" and resid 1    and name HN  )  54.1000 45.9000
;
    785   1    809   70   parsed_1b4c   1   
         30   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 4    and name N   )
( segid="sbm2" and resid 4    and name HN  )  -1.8400  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 5    and name N   )
( segid="sbm2" and resid 5    and name HN  )  -6.5500  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 6    and name N   )
( segid="sbm2" and resid 6    and name HN  )  -8.9000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 9    and name N   )
( segid="sbm2" and resid 9    and name HN  )  -9.6900  0.2  0.2
;
    818   1    844   72   parsed_1b4c   1   
         31   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 12   and name N   )
( segid="sbm2" and resid 12   and name HN  )  -5.6000  0.2  0.2
;
    853   1    858   72   parsed_1b4c   1   
         32   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 14   and name N   )
( segid="sbm2" and resid 14   and name HN  )  -6.4000  0.2  0.2
back in 980211, poor peak shape/very weak in LC, out 980312
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 15   and name N   )
( segid="sbm2" and resid 15   and name HN  )  -3.8200  0.2  0.2
back in 980211, very poor peak shape and weak in LC
back out 980227 - vios
;
    867   1    882   24   parsed_1b4c   1   
         33   
;
back in 980205, out again 980206 b/c RAMA vio
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 25   and name N   )
( segid="sbm2" and resid 25   and name HN  ) 1.70  0.2  0.2
back in 980205
;
    890   1    898   16   parsed_1b4c   1   
         34   
;
back in 980205
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 40   and name N   )
( segid="sbm2" and resid 40   and name HN  )  -0.9000  0.2  0.2
back in 980205, out 980312
;
    927   1    935   28   parsed_1b4c   1   
         35   "back in 980205"                                                          950   1    950   16   parsed_1b4c   1   
         36   
;
back in 980205
back out 980227 - vios
;
    958   1    959   24   parsed_1b4c   1   
         37   "back in 980211, poor pk shape/weak in LC"                                967   1    967   42   parsed_1b4c   1   
         38   "overlap with K24 for this peak DJW removed"                              975   1    977    2   parsed_1b4c   1   
         39   "back in 980205, out 980311 - vios"                                       984   1    984   35   parsed_1b4c   1   
         40   
;
ovlps A9 in LC, causes RAMA vios, no b/c RAMA vios w/o it
out 980227 - vios
;
    992   1    993   20   parsed_1b4c   1   
         41   "back in 980205, out 980312"                                             1008   1   1008   28   parsed_1b4c   1   
         42   "back in 980211"                                                         1016   1   1016   16   parsed_1b4c   1   
         43   "back in 980205, out 980311 - vios"                                      1024   1   1024   35   parsed_1b4c   1   
         44   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 71   and name N   )
( segid="sbm2" and resid 71   and name HN  )  -6.3400  0.2  0.2
back in 980211, ovlps 76 in LC
out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 76   and name N   )
( segid="sbm2" and resid 76   and name HN  )  -8.0000  0.2  0.2
;
   1033   1   1047   72   parsed_1b4c   1   
         45   "poor peak shape in both LC & iso, out 980312"                           1055   1   1055   46   parsed_1b4c   1   
         46   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 88   and name N   )
( segid="sbm2" and resid 88   and name HN  )  -3.2000  0.2  0.2
out 980313, wk pk in lc, vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 90   and name N   )
( segid="sbm2" and resid 90   and name HN  )  51.0500 48.9500
This is a test file
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 1    and name CA  )
( segid="sbm1" and resid 1    and name HA  )  57.6900 42.3100
;
   1064   1   1086   71   parsed_1b4c   1   
         47    GLY                                                                     1116   1   1116    5   parsed_1b4c   1   
         48   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 24   and name CA  )
( segid="sbm1" and resid 24   and name HA  )  -5.62 0.2 0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 25   and name CA  )
( segid="sbm1" and resid 25   and name HA  )  15.63 0.2 0.2
residues 22-25 out since this region is flexible based on Keith's data (DJW removed)
;
   1146   1   1160   86   parsed_1b4c   1   
         49   "use ave of PIPP and nmrD values - was 24.68"                            1203   1   1203   45   parsed_1b4c   1   
         50   "used ave of nmrD and PIPP - PIPP = 31.95"                               1225   1   1225   42   parsed_1b4c   1   
         51   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 50   and name CA  )
( segid="sbm1" and resid 50   and name HA  )  5.50  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 51   and name CA  )
( segid="sbm1" and resid 51   and name HA  )  -13.27  0.2  0.2
;
   1255   1   1267   72   parsed_1b4c   1   
         52   "checked it 980125 - OK"                                                 1317   1   1317   24   parsed_1b4c   1   
         53   
;
checked it 980125 - OK
GLY
;
   1346   1   1348    5   parsed_1b4c   1   
         54    GLY                                                                     1363   1   1363    5   parsed_1b4c   1   
         55   "checked it 980125 - OK"                                                 1398   1   1398   24   parsed_1b4c   1   
         56   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 89   and name CA  )
( segid="sbm1" and resid 89   and name HA  )  0.7800  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 90   and name CA  )
( segid="sbm1" and resid 90   and name HA  )  53.8100 46.1900
SECOND SUBUNIT
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 1    and name CA  )
( segid="sbm2" and resid 1    and name HA  )  57.6900 42.3100
;
   1435   1   1457   70   parsed_1b4c   1   
         57    GLY                                                                     1487   1   1487    5   parsed_1b4c   1   
         58    GLY                                                                     1509   1   1509    5   parsed_1b4c   1   
         59   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 24   and name CA  )
( segid="sbm2" and resid 24   and name HA  )  -5.6200  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 25   and name CA  )
( segid="sbm2" and resid 25   and name HA  )  15.6300  0.2  0.2
;
   1517   1   1529   72   parsed_1b4c   1   
         60   "use ave of PIPP and nmrD values - was 24.68"                            1572   1   1572   45   parsed_1b4c   1   
         61   "used ave of nmrD and PIPP - PIPP = 31.95"                               1594   1   1594   42   parsed_1b4c   1   
         62   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 50   and name CA  )
( segid="sbm2" and resid 50   and name HA  )  5.5000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 51   and name CA  )
( segid="sbm2" and resid 51   and name HA  )  -13.2700  0.2  0.2
;
   1624   1   1636   73   parsed_1b4c   1   
         63   "checked it 980125 - OK"                                                 1686   1   1686   24   parsed_1b4c   1   
         64   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 63   and name CA  )
( segid="sbm2" and resid 63   and name HA  )  4.6500  0.2  0.2
checked it 980125 - OK
GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 64   and name CA  )
( segid="sbm2" and resid 64   and name HA#  )  -6.5400  0.2  0.2
In flexible region w/o Ca (DJW removed)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 65   and name CA  )
( segid="sbm2" and resid 65   and name HA  )  30.9400  0.2  0.2
GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 66   and name CA  )
( segid="sbm2" and resid 66   and name HA#  )  -12.0900  0.2  0.2
;
   1709   1   1740    2   parsed_1b4c   1   
         65   "checked it 980125 - OK"                                                 1768   1   1768   24   parsed_1b4c   1   
         66   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 88   and name CA  )
( segid="sbm2" and resid 88   and name HA  )  -50.7350 49.2650         ! -1.4700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 89   and name CA  )
( segid="sbm2" and resid 89   and name HA  )  0.7800  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 90   and name CA  )
( segid="sbm2" and resid 90   and name HA  ) 53.8100 46.1900            ! 7.6200  0.2  0.2
residues from the 2nd tier that are now 1st tier (6/9/98)
;
   1798   1   1819   59   parsed_1b4c   1   
         67   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 0    and name CA  )
( segid="sbm1" and resid 0    and name HA  )  55.8600 44.1400        !11.7200  0.2  0.2
S1a gives 13.24, S1b gives 10.20, ave = 11.72
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 2    and name CA  )
( segid="sbm1" and resid 2    and name HA  )  52.6600 47.3400         !7.5600  0.2  0.2
ave of 3a=5.32 and 3b=9.8 I took the lower one for the limit setting (5.32)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 3    and name CA  )
( segid="sbm1" and resid 3    and name HA  )  -55.9700 44.0300         !-11.94  0.2  0.2
pks for 4b too wk in LC - use 4a only - changed from 15.0 acd
out 980227 - vios
;
   1877   1   1900   19   parsed_1b4c   1   
         68   
;
viol/amb - 3 sets pks give different values
out 980227 - vios
;
   1908   1   1909   19   parsed_1b4c   1   
         69   "slight ovlp w/ 38HN (37CaHa)"                                           1924   1   1924   30   parsed_1b4c   1   
         70   "very weak peak, should probably remove later"                           1940   1   1940   46   parsed_1b4c   1   
         71   "AMB - upfield pk in LC ovlped - out 980227"                             1948   1   1948   44   parsed_1b4c   1   
         72   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 30   and name CA  )
( segid="sbm1" and resid 30   and name HA  )  -26.0000  0.2  0.2
peak wk and poor shape proton shift off by 6 Hz when top and bottom pk compared
;
   1964   1   1970   81   parsed_1b4c   1   
         73   
;
slight ovlp with 7HN (6CaHa)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 39   and name CA  )
( segid="sbm1" and resid 39   and name HA  )  68.6650 31.3350         !37.3300  0.2  0.2
remove b/c larege vios, back in 980211, back out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 40   and name CA  )
( segid="sbm1" and resid 40   and name HA  )  7.8000  0.2  0.2
amb assignment for 3 multiples of S41
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 41   and name CA  )
( segid="sbm1" and resid 41   and name HA  )  22.1500  0.2  0.2
moved to 1st tier
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 44   and name CA  )
( segid="sbm1" and resid 44   and name HA  )  58.0800 41.9200        !16.1600  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 45   and name CA  )
( segid="sbm1" and resid 45   and name HA  )  -51.975 48.025          !-3.9500  0.2  0.2
;
   1978   1   2016   97   parsed_1b4c   1   
         74   
;
wk peak in LC - out 031198
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 68   and name CA  )
( segid="sbm1" and resid 68   and name HA  )  22.5300  0.2  0.2
very wk & poor pk shape in LC; but still ok and moved to 1st tier
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 69   and name CA  )
( segid="sbm1" and resid 69   and name HA  )  -52.1400 47.8600         !-4.2800  0.2  0.2
wk and poor pk shape in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 76   and name CA  )
( segid="sbm1" and resid 76   and name HA  )  -0.0100  0.2  0.2
wk and poor pk shape in LC; also 8Hz diff in proton peaks here
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 77   and name CA  )
( segid="sbm1" and resid 77   and name HA  )  -10.0300  0.2  0.2
vio - pks max at different planes and slightly ovlped in LC
back in 980211, back out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 0   and name CA  )
( segid="sbm2" and resid 0   and name HA  )   55.8600 44.1400
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 2   and name CA  )
( segid="sbm2" and resid 2   and name HA  )   52.6600 47.3400
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 3    and name CA  )
( segid="sbm2" and resid 3    and name HA  ) -55.9700 44.0300      ! -11.94  0.2  0.2
pks for 4b too wk in LC - use 4a only - changed from 15.0 acd
out 980227 - vios
;
   2024   1   2081   19   parsed_1b4c   1   
         75   
;
viol/amb - 3 sets pks give different values
out 980227 - vios
;
   2089   1   2090   19   parsed_1b4c   1   
         76   "slight ovlp w/ 38HN (37CaHa)"                                           2105   1   2105   30   parsed_1b4c   1   
         77   "AMB - upfield pk in LC ovlped - out 980227"                             2113   1   2113   44   parsed_1b4c   1   
         78   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 30   and name CA  )
( segid="sbm2" and resid 30   and name HA  )  -26.0000  0.2  0.2
peak wk and poor shape
;
   2129   1   2135   24   parsed_1b4c   1   
         79   
;
slight ovlp with 7HN (6CaHa)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 39   and name CA  )
( segid="sbm2" and resid 39   and name HA  )  68.6650 31.3350          !37.3300  0.2  0.2
remove b/c larege vios, back in 980211, back out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 40   and name CA  )
( segid="sbm2" and resid 40   and name HA  )  7.8000  0.2  0.2
amb assignment for 3 multiples of S41
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 41   and name CA  )
( segid="sbm2" and resid 41   and name HA  )  22.1500  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 44   and name CA  )
( segid="sbm2" and resid 44   and name HA  )  58.0800 41.9200        !16.1600  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 45   and name CA  )
( segid="sbm2" and resid 45   and name HA  )  -51.9750 48.0250        !-3.9500  0.2  0.2
;
   2143   1   2180   97   parsed_1b4c   1   
         80   
;
wk peak in LC - out 031198
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 68   and name CA  )
( segid="sbm2" and resid 68   and name HA  )  22.5300  0.2  0.2
very wk & poor pk shape in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 69   and name CA  )
( segid="sbm2" and resid 69   and name HA  )  -52.1400 47.8600        !-4.2800  0.2  0.2
wk and poor pk shape in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 76   and name CA  )
( segid="sbm2" and resid 76   and name HA  )  -0.0100  0.2  0.2
wk and poor pk shape in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 77   and name CA  )
( segid="sbm2" and resid 77   and name HA  )  -10.0300  0.2  0.2
vio - pks max at different planes and slightly ovlped in LC
back in 980211, back out 980227
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 78   and name CA  )
( segid="sbm2" and resid 78   and name HA  )  27.8200  0.2  0.2
;
   2188   1   2228   72   parsed_1b4c   1   
         81   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 8    and name CA  )
( segid="sbm1" and resid 8    and name HA  )  3.7800  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 9    and name CA  )
( segid="sbm1" and resid 9    and name HA  )  -2.5700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 14   and name CA  )
( segid="sbm1" and resid 14   and name HA  )  -3.4300  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 16   and name CA  )
( segid="sbm1" and resid 16   and name HA  )  -8.6600  0.2  0.2
GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 19   and name CA  )
( segid="sbm1" and resid 19   and name HA#  )  28.4000 0.2 0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 20   and name CA  )
( segid="sbm1" and resid 20   and name HA  )  20.25 0.2 0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 21   and name CA  )
( segid="sbm1" and resid 21   and name HA  )  -14.87 0.2 0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 22   and name CA  )
( segid="sbm1" and resid 22   and name HA#  )  -1.16 0.2 0.2
;
   2238   1   2295   70   parsed_1b4c   1   
         82   
;
residues 22-25 out since this region is flexible based on Keith's data (DJW removed)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 26   and name CA  )
( segid="sbm1" and resid 26   and name HA  )  -17.1800  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 27   and name CA  )
( segid="sbm1" and resid 27   and name HA  )  -4.6000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 28   and name CA  )
( segid="sbm1" and resid 28   and name HA  )  26.9200  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 29   and name CA  )
( segid="sbm1" and resid 29   and name HA  )  -4.05  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 31   and name CA  )
( segid="sbm1" and resid 31   and name HA  )  7.7200  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 32   and name CA  )
( segid="sbm1" and resid 32   and name HA  )  24.3800  0.2  0.2
!use ave of PIPP and nmrD values - was 24.68
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 33   and name CA  )
( segid="sbm1" and resid 33   and name HA  )  -22.2900  0.2  0.2

iassign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 34   and name CA  )
( segid="sbm1" and resid 34   and name HA  )  -15.7200  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 35   and name CA  )
( segid="sbm1" and resid 35   and name HA  )  31.2500  0.2  0.2
used ave of nmrD and PIPP - PIPP = 31.95
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 36   and name CA  )
( segid="sbm1" and resid 36   and name HA  )  -0.9600  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 38   and name CA  )
( segid="sbm1" and resid 38   and name HA  )  -5.4300  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 48   and name CA  )
( segid="sbm1" and resid 48   and name HA  )  2.61  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 49   and name CA  )
( segid="sbm1" and resid 49   and name HA  )  -15.84  0.2  0.2
;
   2311   1   2404   73   parsed_1b4c   1   
         83   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 52   and name CA  )
( segid="sbm1" and resid 52   and name HA  )  29.5700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 53   and name CA  )
( segid="sbm1" and resid 53   and name HA  )  -15.4800  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 54   and name CA  )
( segid="sbm1" and resid 54   and name HA  )  2.6100  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 55   and name CA  )
( segid="sbm1" and resid 55   and name HA  )  11.5600  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 56   and name CA  )
( segid="sbm1" and resid 56   and name HA  )  2.8300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 57   and name CA  )
( segid="sbm1" and resid 57   and name HA  )  -9.2900  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 58   and name CA  )
( segid="sbm1" and resid 58   and name HA  )  -14.9300  0.2  0.2
checked it 980125 - OK
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 59   and name CA  )
( segid="sbm1" and resid 59   and name HA  )  31.5600  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 60   and name CA  )
( segid="sbm1" and resid 60   and name HA  )  -12.3400  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 62   and name CA  )
( segid="sbm1" and resid 62   and name HA  )  -56.71  0.2 50

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 63   and name CA  )
( segid="sbm1" and resid 63   and name HA  )  54.67  50 0.2
checked it 980125 - OK
GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 64   and name CA  )
( segid="sbm1" and resid 64   and name HA# )  -56.54 0.2 50

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 65   and name CA  )
( segid="sbm1" and resid 65   and name HA  )  80.94  50  0.2

GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 66   and name CA  )
( segid="sbm1" and resid 66   and name HA# )  -62.09  0.2  50
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 70   and name CA  )
( segid="sbm1" and resid 70   and name HA  )  3.3700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 71   and name CA  )
( segid="sbm1" and resid 71   and name HA  )  7.6900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 72   and name CA  )
( segid="sbm1" and resid 72   and name HA  )  -8.3500  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 73   and name CA  )
( segid="sbm1" and resid 73   and name HA  )  -10.5200  0.2  0.2
checked it 980125 - OK
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 74   and name CA  )
( segid="sbm1" and resid 74   and name HA  )  25.3300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 75   and name CA  )
( segid="sbm1" and resid 75   and name HA  )  -18.5400  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 79   and name CA  )
( segid="sbm1" and resid 79   and name HA  )  -15.5900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 80   and name CA  )
( segid="sbm1" and resid 80   and name HA  )  -0.54  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 88   and name CA  )
( segid="sbm1" and resid 88   and name HA  )  -1.47  0.2  0.2
;
   2420   1   2585    2   parsed_1b4c   1   
         84   "SECOND SUBUNIT"                                                         2601   1   2601   16   parsed_1b4c   1   
         85   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 8    and name CA  )
( segid="sbm2" and resid 8    and name HA  )  3.7800  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 9    and name CA  )
( segid="sbm2" and resid 9    and name HA  )  -2.5700  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 14   and name CA  )
( segid="sbm2" and resid 14   and name HA  )  -3.4300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 16   and name CA  )
( segid="sbm2" and resid 16   and name HA  )  -8.6600  0.2  0.2

!GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 19   and name CA  )
( segid="sbm2" and resid 19   and name HA#  ) 28.400  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 20   and name CA  )
( segid="sbm2" and resid 20   and name HA  )  20.2500  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 21   and name CA  )
( segid="sbm2" and resid 21   and name HA  )  -14.8700  0.2  0.2

!GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 22   and name CA  )
( segid="sbm2" and resid 22   and name HA#  )  -1.1600  0.2  0.2
;
   2610   1   2667    2   parsed_1b4c   1   
         86   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 26   and name CA  )
( segid="sbm2" and resid 26   and name HA  )  -17.1800  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 27   and name CA  )
( segid="sbm2" and resid 27   and name HA  )  -4.6000  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 28   and name CA  )
( segid="sbm2" and resid 28   and name HA  )  26.9200  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 29   and name CA  )
( segid="sbm2" and resid 29   and name HA  )  -4.0500  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 31   and name CA  )
( segid="sbm2" and resid 31   and name HA  )  7.7200  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 32   and name CA  )
( segid="sbm2" and resid 32   and name HA  )  24.3800  0.2  0.2
!use ave of PIPP and nmrD values - was 24.68

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 33   and name CA  )
( segid="sbm2" and resid 33   and name HA  )  -22.2900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 34   and name CA  )
( segid="sbm2" and resid 34   and name HA  )  -15.7200  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 35   and name CA  )
( segid="sbm2" and resid 35   and name HA  )  31.2500  0.2  0.2
!used ave of nmrD and PIPP - PIPP = 31.95

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 36   and name CA  )
( segid="sbm2" and resid 36   and name HA  )  -0.9600  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 38   and name CA  )
( segid="sbm2" and resid 38   and name HA  )  -5.4300  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 48   and name CA  )
( segid="sbm2" and resid 48   and name HA  )  2.6100  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 49   and name CA  )
( segid="sbm2" and resid 49   and name HA  )  -15.8400  0.2  0.2
;
   2682   1   2774    2   parsed_1b4c   1   
         87   
;
assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 52   and name CA  )
( segid="sbm2" and resid 52   and name HA  )  29.5700  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 53   and name CA  )
( segid="sbm2" and resid 53   and name HA  )  -15.4800  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 54   and name CA  )
( segid="sbm2" and resid 54   and name HA  )  2.6100  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 55   and name CA  )
( segid="sbm2" and resid 55   and name HA  )  11.5600  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 56   and name CA  )
( segid="sbm2" and resid 56   and name HA  )  2.8300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 57   and name CA  )
( segid="sbm2" and resid 57   and name HA  )  -9.2900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 58   and name CA  )
( segid="sbm2" and resid 58   and name HA  )  -14.9300  0.2  0.2
!checked it 980125 - OK

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 59   and name CA  )
( segid="sbm2" and resid 59   and name HA  )  31.5600  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 60   and name CA  )
( segid="sbm2" and resid 60   and name HA  )  -12.3400  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 62   and name CA  )
( segid="sbm2" and resid 62   and name HA  )  -56.7100  0.2 50

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 63   and name CA  )
( segid="sbm2" and resid 63   and name HA  )  54.6500  50  0.2
checked it 980125 - OK
GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 64   and name CA  )
( segid="sbm2" and resid 64   and name HA#  )  -56.5400  0.2 50
In flexible region w/o Ca (DJW removed)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 65   and name CA  )
( segid="sbm2" and resid 65   and name HA  )  80.9400 50 0.2

!GLY
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 66   and name CA  )
( segid="sbm2" and resid 66   and name HA#  )  -62.0900  0.2 50
!
!assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 70   and name CA  )
( segid="sbm2" and resid 70   and name HA  )  3.3700  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 71   and name CA  )
( segid="sbm2" and resid 71   and name HA  )  7.6900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 72   and name CA  )
( segid="sbm2" and resid 72   and name HA  )  -8.3500  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 73   and name CA  )
( segid="sbm2" and resid 73   and name HA  )  -10.5200  0.2  0.2
checked it 980125 - OK
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 74   and name CA  )
( segid="sbm2" and resid 74   and name HA  )  25.3300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 75   and name CA  )
( segid="sbm2" and resid 75   and name HA  )  -18.5400  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 79   and name CA  )
( segid="sbm2" and resid 79   and name HA  )  -15.5900  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 80   and name CA  )
( segid="sbm2" and resid 80   and name HA  )  -0.5400  0.2  0.2
;
   2789   1   2948    2   parsed_1b4c   1   
         88   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 89   and name CA  )
( segid="sbm2" and resid 89   and name HA  )  50.78
;
   2956   1   2961   60   parsed_1b4c   1   
         89   
;
residues from the 2nd tier that are now 1st tier (6/9/98)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 30   and name CA  )
( segid="sbm1" and resid 30   and name HA  )  -26.0000  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 41   and name CA  )
( segid="sbm1" and resid 41   and name HA  )  22.1500  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 68   and name CA  )
( segid="sbm1" and resid 68   and name HA  )  22.5300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 76   and name CA  )
( segid="sbm1" and resid 76   and name HA  )  -0.0100  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 30   and name CA  )
( segid="sbm2" and resid 30   and name HA  )  -26.0000  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 41   and name CA  )
( segid="sbm2" and resid 41   and name HA  )  22.1500  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 68   and name CA  )
( segid="sbm2" and resid 68   and name HA  )  22.5300  0.2  0.2

assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 76   and name CA  )
( segid="sbm2" and resid 76   and name HA  )  -0.0100  0.2  0.2
;
   2970   1   3027    2   parsed_1b4c   1   
         90   "checked 980125 - looks OK"                                              3082   1   3082   27   parsed_1b4c   1   
         91   "overlap with 37 in hnco is somewhat problematic"                        3097   1   3097   50   parsed_1b4c   1   
         92   "checked 980125 - looks OK"                                              3124   1   3124   27   parsed_1b4c   1   
         93   "overlap in LC to some degree for 31 in hnco"                            3217   1   3217   45   parsed_1b4c   1   
         94   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 59   and name C   )
( segid="sbm1" and resid 59   and name CA  )  -1.2300  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 59   and name C   )
( segid="sbm2" and resid 59   and name CA  )  -1.2300  0.2  0.2
iso splitting quite low (51.2), out 980311 - vios
;
   3427   1   3439   52   parsed_1b4c   1   
         95   "low iso value (51.1) makes it suspect, 66psi/67phi vios"                3506   1   3506   58   parsed_1b4c   1   
         96   "from 2nd tier"                                                          3638   1   3638   15   parsed_1b4c   1   
         97   "out 980311 - vios,multiples"                                            3717   1   3717   30   parsed_1b4c   1   
         98   "some ovlp of pks in iso"                                                3731   1   3731   25   parsed_1b4c   1   
         99   "DJW removed"                                                            3745   1   3745   13   parsed_1b4c   1   
        100   
;
only 4a seen, 4b missing
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 4    and name C   )
( segid="sbm1" and resid 4    and name CA  )  -0.0700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 4    and name C   )
( segid="sbm2" and resid 4    and name CA  )  -0.0700  0.2  0.2
;
   3759   1   3772   72   parsed_1b4c   1   
        101   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 8    and name C   )
( segid="sbm1" and resid 8    and name CA  )  -1.9100  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 8    and name C   )
( segid="sbm2" and resid 8    and name CA  )  -1.9100  0.2  0.2
poor peak shape in LC and iso - vios, back in 980211, out 980227 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 9   and name C   )
( segid="sbm1" and resid 9   and name CA  )  2.8100  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 9   and name C   )
( segid="sbm2" and resid 9   and name CA  )  2.8100  0.2  0.2
;
   3800   1   3825   70   parsed_1b4c   1   
        102   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 13   and name C   )
( segid="sbm1" and resid 13   and name CA  )  1.7600  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 13   and name C   )
( segid="sbm2" and resid 13   and name CA  )  1.7600  0.2  0.2
;
   3840   1   3851   71   parsed_1b4c   1   
        103   "poor peak shape both LC & iso, back in 980211, out 980227 - vios"       3866   1   3866   66   parsed_1b4c   1   
        104   
;
peaks ovlped in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 39   and name C   )
( segid="sbm1" and resid 39   and name CA  )  -2.2400  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 39   and name C   )
( segid="sbm2" and resid 39   and name CA  )  -2.2400  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 40   and name C   )
( segid="sbm1" and resid 40   and name CA  )  -1.2700  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 40   and name C   )
( segid="sbm2" and resid 40   and name CA  )  -1.2700  0.2  0.2
;
   3880   1   3906   72   parsed_1b4c   1   
        105   
;
amb - only 1/3 pks for 44 in LC data and its a poor pk, back in 980212
out 980227 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 44   and name C   )
( segid="sbm1" and resid 44   and name CA  )  -2.8800  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 44   and name C   )
( segid="sbm2" and resid 44   and name CA  )  -2.8800  0.2  0.2
out 980311, poor peak shape both - multiples, vios
;
   3933   1   3948   53   parsed_1b4c   1   
        106   
;
value from 46e(LC)-46def(iso)
amb assign ( resid 500  and name OO  )
amb       ( resid 500  and name Z   )
amb       ( resid 500  and name X   )
amb       ( resid 500  and name Y   )
amb       ( segid="sbm1" and resid 48   and name C   )
amb       ( segid="sbm1" and resid 48   and name CA  )  4.1900  0.2  0.2
amb assign ( resid 500  and name OO  )
amb       ( resid 500  and name Z   )
amb       ( resid 500  and name X   )
amb       ( resid 500  and name Y   )
amb       ( segid="sbm2" and resid 48   and name C   )
amb       ( segid="sbm2" and resid 48   and name CA  )  4.1900  0.2  0.2
amb    lower peak ovlped in iso data
;
   3962   1   3976   38   parsed_1b4c   1   
        107   "1.35 with PIPP and 1.12 with nmrDraw - ave = 1.24, LC pk ovlped"        4004   1   4004   66   parsed_1b4c   1   
        108   
;
weak peak in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 76   and name C   )
( segid="sbm1" and resid 76   and name CA  )  4.1900  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 76   and name C   )
( segid="sbm2" and resid 76   and name CA  )  4.1900  0.2  0.2
amb - 77 ovlped in both LC and iso, dont use
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 82   and name C   )
( segid="sbm1" and resid 82   and name CA  )  -4.2300  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 82   and name C   )
( segid="sbm2" and resid 82   and name CA  )  -4.2300  0.2  0.2
- very weak pks in LC, and amb, bad peak in iso
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 87   and name C   )
( segid="sbm1" and resid 87   and name CA  )  3.1500  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 87   and name C   )
( segid="sbm2" and resid 87   and name CA  )  3.1500  0.2  0.2
amb - poor peak shape and quite weak in LC and iso
;
   4019   1   4061   52   parsed_1b4c   1   
        109   "amb - poor peak shape in LC, low spiltting in iso (51.2), some vios"    4075   1   4075   69   parsed_1b4c   1   
        110   
;
- very poor pk in iso
out 980227 - vios
;
   4089   1   4090   20   parsed_1b4c   1   
        111   
;
poor peak shape LC & iso, and two LC peaks max at different planes
this is a test table
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 1    and name C   )
( segid="sbm1" and resid 2    and name HN  )  -3.8800  0.2  0.2
;
   4104   1   4113   72   parsed_1b4c   1   
        112   "nmrDraw= -1.90, PIPP= -2.51"                                            4142   1   4142   29   parsed_1b4c   1   
        113   
;
vio in Rama plot for 56??
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 56   and name C   )
( segid="sbm1" and resid 57   and name HN  )  -1.8000  0.2  0.2
out 980312, poor peak shape LC, talos vio
;
   4192   1   4200   44   parsed_1b4c   1   
        114   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 88   and name C  )
( segid="sbm1" and resid 89   and name HN   )  1.8300  0.2  0.2
second subunit
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 1    and name C   )
( segid="sbm2" and resid 2    and name HN  )  -3.8800  0.2  0.2
;
   4265   1   4281   72   parsed_1b4c   1   
        115   "nmrDraw= -1.90, PIPP= -2.51"                                            4310   1   4310   29   parsed_1b4c   1   
        116   
;
vio in Rama plot for 56??
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 56   and name C   )
( segid="sbm2" and resid 57   and name HN  )  -1.8000  0.2  0.2
out 980312, poor peak shape LC, talos vios
;
   4360   1   4368   45   parsed_1b4c   1   
        117   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 88   and name C  )
( segid="sbm2" and resid 89   and name HN   )  1.8300  0.2  0.2
dipos from 2nd category that were promoted to #1
;
   4433   1   4440   50   parsed_1b4c   1   
        118   "back in 980210"                                                         4448   1   4448   16   parsed_1b4c   1   
        119   "back in 980210"                                                         4484   1   4484   16   parsed_1b4c   1   
        120   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 0    and name C   )
( segid="sbm1" and resid 1    and name N   )  1.7500  0.2  0.2
1a 2.13, 1b 1.37, ave = 1.75
;
   4513   1   4521   30   parsed_1b4c   1   
        121   
;
ave of 3 multiples is 1.21 +/- 0.56 ,  5c ovlps 77
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 5    and name C   )
( segid="sbm1" and resid 6    and name N   )  -0.1500  0.2  0.2
ave of -0.42(6a) and 0.12(6b), out 980311
;
   4536   1   4545   43   parsed_1b4c   1   
        122   "back in 980210,  ovlps 79"                                              4553   1   4553   27   parsed_1b4c   1   
        123   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 11   and name C   )
( segid="sbm1" and resid 12   and name N   )  2.7000  0.2  0.2
very wk pk
;
   4561   1   4569   12   parsed_1b4c   1   
        124   "back in 980210"                                                         4577   1   4577   16   parsed_1b4c   1   
        125   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 14   and name C   )
( segid="sbm1" and resid 15   and name N   )  -0.7500  0.2  0.2
very poor pk shape and weak
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 22   and name C   )
( segid="sbm1" and resid 23   and name N   )  -0.2700  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 24   and name C   )
( segid="sbm1" and resid 25   and name N   )  1.7400  0.2  0.2
ovlps 51 in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 26   and name C   )
( segid="sbm1" and resid 27   and name N   )  -1.6400  0.2  0.2
back in 980210, out 980313, ovlps 54 some in LC
;
   4585   1   4617   49   parsed_1b4c   1   
        126   "peaks in LC ovlp slightly"                                              4625   1   4625   27   parsed_1b4c   1   
        127   "back in 980210"                                                         4633   1   4633   16   parsed_1b4c   1   
        128   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 38   and name C   )
( segid="sbm1" and resid 39   and name N   )  -0.2900  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 40   and name C   )
( segid="sbm1" and resid 41   and name N   )  -0.06500  0.2  0.2
back in 980210, ave of 41d and 41e, out 980311 - vios
;
   4649   1   4663   55   parsed_1b4c   1   
        129   
;
back in 980210, ave of 42d (0.03) and 42e(-0.30)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 43   and name C   )
( segid="sbm1" and resid 44   and name N   )  -0.1000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 49   and name C   )
( segid="sbm1" and resid 50   and name N   )  -1.8000  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 50   and name C   )
( segid="sbm1" and resid 51   and name N   )  0.6100  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 58   and name C   )
( segid="sbm1" and resid 59   and name N   )  -1.8200  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 65   and name C   )
( segid="sbm1" and resid 66   and name N   )  -1.4200  0.2  0.2
own peaks ovlp in LC, out 980311
;
   4671   1   4710   34   parsed_1b4c   1   
        130   "back in 980210"                                                         4718   1   4718   16   parsed_1b4c   1   
        131   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 89   and name C   )
( segid="sbm1" and resid 90   and name N   )  0.12000  0.2  0.2
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 90   and name C   )
( segid="sbm1" and resid 91   and name N   )  0.1600  0.2  0.2
SECOND SUBUNIT
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 0    and name C   )
( segid="sbm2" and resid 1    and name N   )  1.7500  0.2  0.2
1a 2.13, 1b 1.37, ave = 1.75
;
   4733   1   4761   30   parsed_1b4c   1   
        132   
;
ave of 3 multiples is 1.21 +/- 0.56 ,  5c ovlps 77
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 5    and name C   )
( segid="sbm2" and resid 6    and name N   )  -0.1500  0.2  0.2
ave of -0.42(6a) and 0.12(6b), out 980311
;
   4776   1   4785   43   parsed_1b4c   1   
        133   "back in 980210,  ovlps 79"                                              4793   1   4793   27   parsed_1b4c   1   
        134   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 11   and name C   )
( segid="sbm2" and resid 12   and name N   )  2.7000  0.2  0.2
very wk pk
;
   4801   1   4809   12   parsed_1b4c   1   
        135   "back in 980210"                                                         4817   1   4817   16   parsed_1b4c   1   
        136   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 14   and name C   )
( segid="sbm2" and resid 15   and name N   )  -0.7500  0.2  0.2
very poor pk shape and weak
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 22   and name C   )
( segid="sbm2" and resid 23   and name N   )  -0.2700  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 24   and name C   )
( segid="sbm2" and resid 25   and name N   )  1.7400  0.2  0.2
ovlps 51 in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 26   and name C   )
( segid="sbm2" and resid 27   and name N   )  -1.6400  0.2  0.2
back in 980210, ovlps 54 some in LC
;
   4825   1   4857   37   parsed_1b4c   1   
        137   "peaks in LC ovlp slightly"                                              4865   1   4865   27   parsed_1b4c   1   
        138   "back in 980210"                                                         4873   1   4873   16   parsed_1b4c   1   
        139   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 38   and name C   )
( segid="sbm2" and resid 39   and name N   )  -0.2900  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 40   and name C   )
( segid="sbm2" and resid 41   and name N   )  -0.06500  0.2  0.2
back in 980210, ave of 41d and 41e, out 980311 - vios
;
   4889   1   4903   55   parsed_1b4c   1   
        140   
;
back in 980210, ave of 42d (0.03) and 42e(-0.30)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 43   and name C   )
( segid="sbm2" and resid 44   and name N   )  -0.1000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 49   and name C   )
( segid="sbm2" and resid 50   and name N   )  -1.8000  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 50   and name C   )
( segid="sbm2" and resid 51   and name N   )  0.6100  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 58   and name C   )
( segid="sbm2" and resid 59   and name N   )  -1.8200  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 65   and name C   )
( segid="sbm2" and resid 66   and name N   )  -1.4200  0.2  0.2
own peaks ovlp in LC, out 980311 - vios
;
   4911   1   4950   41   parsed_1b4c   1   
        141   "back in 980210"                                                         4958   1   4958   16   parsed_1b4c   1   
        142   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 89   and name C   )
( segid="sbm2" and resid 90   and name N   )  0.12000  0.2  0.2
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 90   and name C   )
( segid="sbm2" and resid 91   and name N   )  0.1600  0.2  0.2
This is a test file
;
   4973   1   4990   21   parsed_1b4c   1   
        143   "checked 980126 - looks OK - -0.75 w/nmrDraw"                            5026   1   5026   45   parsed_1b4c   1   
        144   "checked 980126 - looks OK"                                              5055   1   5055   27   parsed_1b4c   1   
        145   "out 980312, poor peak shape"                                            5084   1   5084   29   parsed_1b4c   1   
        146   "checked 980126 - looks OK but peak is oblong"                           5113   1   5113   46   parsed_1b4c   1   
        147   "some ovlp in LC of own 2 pks, ie too much to pick w/nmrDraw"            5149   1   5149   61   parsed_1b4c   1   
        148   "SECOND SUBUNIT"                                                         5159   1   5159   16   parsed_1b4c   1   
        149   "checked 980126 - looks OK - -0.75 w/nmrDraw"                            5195   1   5195   45   parsed_1b4c   1   
        150   "checked 980126 - looks OK"                                              5224   1   5224   27   parsed_1b4c   1   
        151   "out 980312, poor peak shape"                                            5253   1   5253   30   parsed_1b4c   1   
        152   "checked 980126 - looks OK but peak is oblong"                           5282   1   5282   46   parsed_1b4c   1   
        153   "some ovlp in LC of own 2 pks, ie too much to pick w/nmrDraw"            5318   1   5318   61   parsed_1b4c   1   
        154   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 0    and name C   )
( segid="sbm1" and resid 1    and name N   )  1.7500  0.2  0.2
1a 2.13, 1b 1.37, ave = 1.75
;
   5327   1   5333   30   parsed_1b4c   1   
        155   
;
ave of 3 multiples is 1.21 +/- 0.56 ,  5c ovlps 77
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 5    and name C   )
( segid="sbm1" and resid 6    and name N   )  -0.1500  0.2  0.2
ave of -0.42(6a) and 0.12(6b), out 980311
;
   5348   1   5357   43   parsed_1b4c   1   
        156   "back in 980210,  ovlps 79"                                              5365   1   5365   27   parsed_1b4c   1   
        157   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 11   and name C   )
( segid="sbm1" and resid 12   and name N   )  2.7000  0.2  0.2
very wk pk
;
   5373   1   5381   12   parsed_1b4c   1   
        158   "back in 980210"                                                         5389   1   5389   16   parsed_1b4c   1   
        159   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 14   and name C   )
( segid="sbm1" and resid 15   and name N   )  -0.7500  0.2  0.2
very poor pk shape and weak
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 22   and name C   )
( segid="sbm1" and resid 23   and name N   )  -0.2700  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 24   and name C   )
( segid="sbm1" and resid 25   and name N   )  1.7400  0.2  0.2
ovlps 51 in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 26   and name C   )
( segid="sbm1" and resid 27   and name N   )  -1.6400  0.2  0.2
back in 980210, out 980313, ovlps 54 some in LC
;
   5397   1   5429   49   parsed_1b4c   1   
        160   "peaks in LC ovlp slightly"                                              5437   1   5437   27   parsed_1b4c   1   
        161   "back in 980210"                                                         5445   1   5445   16   parsed_1b4c   1   
        162   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 38   and name C   )
( segid="sbm1" and resid 39   and name N   )  -0.2900  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 40   and name C   )
( segid="sbm1" and resid 41   and name N   )  -0.06500  0.2  0.2
back in 980210, ave of 41d and 41e, out 980311 - vios
;
   5461   1   5475   55   parsed_1b4c   1   
        163   
;
back in 980210, ave of 42d (0.03) and 42e(-0.30)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 43   and name C   )
( segid="sbm1" and resid 44   and name N   )  -0.1000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 49   and name C   )
( segid="sbm1" and resid 50   and name N   )  -1.8000  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 50   and name C   )
( segid="sbm1" and resid 51   and name N   )  0.6100  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 58   and name C   )
( segid="sbm1" and resid 59   and name N   )  -1.8200  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 65   and name C   )
( segid="sbm1" and resid 66   and name N   )  -1.4200  0.2  0.2
own peaks ovlp in LC, out 980311
;
   5483   1   5522   34   parsed_1b4c   1   
        164   "back in 980210"                                                         5530   1   5530   16   parsed_1b4c   1   
        165   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 89   and name C   )
( segid="sbm1" and resid 90   and name N   )  0.12000  0.2  0.2
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm1" and resid 90   and name C   )
( segid="sbm1" and resid 91   and name N   )  0.1600  0.2  0.2
SECOND SUBUNIT
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 0    and name C   )
( segid="sbm2" and resid 1    and name N   )  1.7500  0.2  0.2
1a 2.13, 1b 1.37, ave = 1.75
;
   5545   1   5573   30   parsed_1b4c   1   
        166   
;
ave of 3 multiples is 1.21 +/- 0.56 ,  5c ovlps 77
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 5    and name C   )
( segid="sbm2" and resid 6    and name N   )  -0.1500  0.2  0.2
ave of -0.42(6a) and 0.12(6b), out 980311
;
   5588   1   5597   43   parsed_1b4c   1   
        167   "back in 980210,  ovlps 79"                                              5605   1   5605   27   parsed_1b4c   1   
        168   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 11   and name C   )
( segid="sbm2" and resid 12   and name N   )  2.7000  0.2  0.2
very wk pk
;
   5613   1   5621   12   parsed_1b4c   1   
        169   "back in 980210"                                                         5629   1   5629   16   parsed_1b4c   1   
        170   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 14   and name C   )
( segid="sbm2" and resid 15   and name N   )  -0.7500  0.2  0.2
very poor pk shape and weak
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 22   and name C   )
( segid="sbm2" and resid 23   and name N   )  -0.2700  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 24   and name C   )
( segid="sbm2" and resid 25   and name N   )  1.7400  0.2  0.2
ovlps 51 in LC
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 26   and name C   )
( segid="sbm2" and resid 27   and name N   )  -1.6400  0.2  0.2
back in 980210, ovlps 54 some in LC
;
   5637   1   5669   37   parsed_1b4c   1   
        171   "peaks in LC ovlp slightly"                                              5677   1   5677   27   parsed_1b4c   1   
        172   "back in 980210"                                                         5685   1   5685   16   parsed_1b4c   1   
        173   
;
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 38   and name C   )
( segid="sbm2" and resid 39   and name N   )  -0.2900  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 40   and name C   )
( segid="sbm2" and resid 41   and name N   )  -0.06500  0.2  0.2
back in 980210, ave of 41d and 41e, out 980311 - vios
;
   5701   1   5715   55   parsed_1b4c   1   
        174   
;
back in 980210, ave of 42d (0.03) and 42e(-0.30)
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 43   and name C   )
( segid="sbm2" and resid 44   and name N   )  -0.1000  0.2  0.2
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 49   and name C   )
( segid="sbm2" and resid 50   and name N   )  -1.8000  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 50   and name C   )
( segid="sbm2" and resid 51   and name N   )  0.6100  0.2  0.2
back in 980210, out 980311
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 58   and name C   )
( segid="sbm2" and resid 59   and name N   )  -1.8200  0.2  0.2
back in 980210, out 980311 - vios
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 65   and name C   )
( segid="sbm2" and resid 66   and name N   )  -1.4200  0.2  0.2
own peaks ovlp in LC, out 980311 - vios
;
   5723   1   5762   41   parsed_1b4c   1   
        175   "back in 980210"                                                         5770   1   5770   16   parsed_1b4c   1   
        176   
;
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 89   and name C   )
( segid="sbm2" and resid 90   and name N   )  0.12000  0.2  0.2
back in 980210
assign ( resid 500  and name OO  )
( resid 500  and name Z   )
( resid 500  and name X   )
( resid 500  and name Y   )
( segid="sbm2" and resid 90   and name C   )
( segid="sbm2" and resid 91   and name N   )  0.1600  0.2  0.2
this is a test file
;
   5785   1   5802   21   parsed_1b4c   1   
    stop_

save_





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