Content for NMR-STAR saveframe, "chemical_shift_set_1"

    save_chemical_shift_set_1
  _Assigned_chem_shift_list.Sf_category                  assigned_chemical_shifts
  _Assigned_chem_shift_list.Sf_framecode                 chemical_shift_set_1
  _Assigned_chem_shift_list.Entry_ID                     5851
  _Assigned_chem_shift_list.ID                           1
  _Assigned_chem_shift_list.Sample_condition_list_ID     1
  _Assigned_chem_shift_list.Sample_condition_list_label  $sample_cond_1
  _Assigned_chem_shift_list.Chem_shift_reference_ID      1
  _Assigned_chem_shift_list.Chem_shift_reference_label   $chemical_shift_reference
  _Assigned_chem_shift_list.Chem_shift_1H_err            .
  _Assigned_chem_shift_list.Chem_shift_13C_err           .
  _Assigned_chem_shift_list.Chem_shift_15N_err           .
  _Assigned_chem_shift_list.Chem_shift_31P_err           .
  _Assigned_chem_shift_list.Chem_shift_2H_err            .
  _Assigned_chem_shift_list.Chem_shift_19F_err           .
  _Assigned_chem_shift_list.Error_derivation_method      .
  _Assigned_chem_shift_list.Details                      .
  _Assigned_chem_shift_list.Text_data_format             .
  _Assigned_chem_shift_list.Text_data                    .

  loop_
    _Chem_shift_experiment.Experiment_ID
    _Chem_shift_experiment.Experiment_name
    _Chem_shift_experiment.Sample_ID
    _Chem_shift_experiment.Sample_label
    _Chem_shift_experiment.Sample_state
    _Chem_shift_experiment.Entry_ID
    _Chem_shift_experiment.Assigned_chem_shift_list_ID

    .   .   1    $sample_1   .   5851    1    
  stop_

  loop_
    _Atom_chem_shift.ID
    _Atom_chem_shift.Assembly_atom_ID
    _Atom_chem_shift.Entity_assembly_ID
    _Atom_chem_shift.Entity_ID
    _Atom_chem_shift.Comp_index_ID
    _Atom_chem_shift.Seq_ID
    _Atom_chem_shift.Comp_ID
    _Atom_chem_shift.Atom_ID
    _Atom_chem_shift.Atom_type
    _Atom_chem_shift.Atom_isotope_number
    _Atom_chem_shift.Val
    _Atom_chem_shift.Val_err
    _Atom_chem_shift.Assign_fig_of_merit
    _Atom_chem_shift.Ambiguity_code
    _Atom_chem_shift.Occupancy
    _Atom_chem_shift.Resonance_ID
    _Atom_chem_shift.Auth_entity_assembly_ID
    _Atom_chem_shift.Auth_asym_ID
    _Atom_chem_shift.Auth_seq_ID
    _Atom_chem_shift.Auth_comp_ID
    _Atom_chem_shift.Auth_atom_ID
    _Atom_chem_shift.Details
    _Atom_chem_shift.Entry_ID
    _Atom_chem_shift.Assigned_chem_shift_list_ID

    1      .   1    1    3     3     THR    H       H    1     8.521      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    2      .   1    1    3     3     THR    HA      H    1     4.399      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    3      .   1    1    3     3     THR    HB      H    1     4.259      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    4      .   1    1    3     3     THR    HG21    H    1     1.225      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    5      .   1    1    3     3     THR    HG22    H    1     1.225      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    6      .   1    1    3     3     THR    HG23    H    1     1.225      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    7      .   1    1    3     3     THR    N       N    15    116.678    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    8      .   1    1    4     4     ARG    H       H    1     8.618      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    9      .   1    1    4     4     ARG    HA      H    1     4.352      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    10     .   1    1    4     4     ARG    HB2     H    1     1.882      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    11     .   1    1    4     4     ARG    HB3     H    1     1.789      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    12     .   1    1    4     4     ARG    HG2     H    1     1.665      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    13     .   1    1    4     4     ARG    HD2     H    1     3.206      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    14     .   1    1    4     4     ARG    HE      H    1     7.241      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    15     .   1    1    4     4     ARG    N       N    15    124.043    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    16     .   1    1    5     5     GLY    H       H    1     8.610      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    17     .   1    1    5     5     GLY    HA2     H    1     4.001      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    18     .   1    1    5     5     GLY    N       N    15    110.56     .         .   .   .   .   .   .   .   .   .   .   5851    1    
    19     .   1    1    6     6     SER    H       H    1     8.416      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    20     .   1    1    6     6     SER    HA      H    1     4.562      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    21     .   1    1    6     6     SER    HB2     H    1     3.934      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    22     .   1    1    6     6     SER    HB3     H    1     3.880      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    23     .   1    1    6     6     SER    N       N    15    115.604    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    24     .   1    1    7     7     THR    H       H    1     8.375      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    25     .   1    1    7     7     THR    HA      H    1     4.399      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    26     .   1    1    7     7     THR    HB      H    1     4.285      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    27     .   1    1    7     7     THR    HG21    H    1     1.222      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    28     .   1    1    7     7     THR    HG22    H    1     1.222      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    29     .   1    1    7     7     THR    HG23    H    1     1.222      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    30     .   1    1    7     7     THR    N       N    15    115.417    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    31     .   1    1    8     8     GLY    H       H    1     8.481      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    32     .   1    1    8     8     GLY    HA2     H    1     3.954      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    33     .   1    1    8     8     GLY    N       N    15    110.99     .         .   .   .   .   .   .   .   .   .   .   5851    1    
    34     .   1    1    9     9     ILE    H       H    1     8.071      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    35     .   1    1    9     9     ILE    HA      H    1     4.049      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    36     .   1    1    9     9     ILE    HB      H    1     1.785      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    37     .   1    1    9     9     ILE    HG21    H    1     0.869      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    38     .   1    1    9     9     ILE    HG22    H    1     0.869      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    39     .   1    1    9     9     ILE    HG23    H    1     0.869      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    40     .   1    1    9     9     ILE    HG12    H    1     1.430      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    41     .   1    1    9     9     ILE    HG13    H    1     1.148      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    42     .   1    1    9     9     ILE    HD11    H    1     0.843      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    43     .   1    1    9     9     ILE    HD12    H    1     0.843      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    44     .   1    1    9     9     ILE    HD13    H    1     0.843      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    45     .   1    1    9     9     ILE    N       N    15    120.179    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    46     .   1    1    10    10    LYS    H       H    1     8.499      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    47     .   1    1    10    10    LYS    HA      H    1     4.493      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    48     .   1    1    10    10    LYS    HB2     H    1     1.523      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    49     .   1    1    10    10    LYS    HG2     H    1     1.345      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    50     .   1    1    10    10    LYS    HG3     H    1     1.267      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    51     .   1    1    10    10    LYS    HD2     H    1     1.611      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    52     .   1    1    10    10    LYS    HD3     H    1     1.493      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    53     .   1    1    10    10    LYS    HE2     H    1     2.927      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    54     .   1    1    10    10    LYS    N       N    15    126.898    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    55     .   1    1    11    11    PRO    HA      H    1     4.233      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    56     .   1    1    11    11    PRO    HB2     H    1     2.023      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    57     .   1    1    11    11    PRO    HB3     H    1     1.269      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    58     .   1    1    11    11    PRO    HG2     H    1     1.877      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    59     .   1    1    11    11    PRO    HG3     H    1     1.797      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    60     .   1    1    11    11    PRO    HD2     H    1     3.743      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    61     .   1    1    11    11    PRO    HD3     H    1     3.660      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    62     .   1    1    12    12    PHE    H       H    1     8.231      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    63     .   1    1    12    12    PHE    HA      H    1     4.702      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    64     .   1    1    12    12    PHE    HB2     H    1     3.023      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    65     .   1    1    12    12    PHE    HD1     H    1     7.181      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    66     .   1    1    12    12    PHE    HE1     H    1     7.414      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    67     .   1    1    12    12    PHE    N       N    15    117.099    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    68     .   1    1    13    13    GLN    H       H    1     8.665      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    69     .   1    1    13    13    GLN    HA      H    1     4.329      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    70     .   1    1    13    13    GLN    HB2     H    1     2.051      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    71     .   1    1    13    13    GLN    HG2     H    1     2.302      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    72     .   1    1    13    13    GLN    HG3     H    1     2.178      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    73     .   1    1    13    13    GLN    HE22    H    1     6.237      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    74     .   1    1    13    13    GLN    N       N    15    125.182    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    75     .   1    1    14    14    CYS    H       H    1     8.998      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    76     .   1    1    14    14    CYS    HA      H    1     4.773      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    77     .   1    1    14    14    CYS    HB2     H    1     3.580      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    78     .   1    1    14    14    CYS    HB3     H    1     2.803      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    79     .   1    1    14    14    CYS    N       N    15    131.135    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    80     .   1    1    15    15    PRO    HA      H    1     4.656      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    81     .   1    1    15    15    PRO    HB2     H    1     2.371      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    82     .   1    1    15    15    PRO    HB3     H    1     2.030      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    83     .   1    1    15    15    PRO    HG2     H    1     2.091      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    84     .   1    1    15    15    PRO    HD2     H    1     4.296      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    85     .   1    1    15    15    PRO    HD3     H    1     4.120      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    86     .   1    1    16    16    ASP    H       H    1     9.293      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    87     .   1    1    16    16    ASP    HA      H    1     4.796      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    88     .   1    1    16    16    ASP    HB2     H    1     2.084      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    89     .   1    1    16    16    ASP    HB3     H    1     1.459      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    90     .   1    1    16    16    ASP    N       N    15    119.961    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    91     .   1    1    17    17    CYS    H       H    1     7.847      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    92     .   1    1    17    17    CYS    HA      H    1     4.913      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    93     .   1    1    17    17    CYS    HB2     H    1     3.349      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    94     .   1    1    17    17    CYS    HB3     H    1     3.278      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    95     .   1    1    17    17    CYS    N       N    15    118.635    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    96     .   1    1    18    18    ASP    H       H    1     8.238      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    97     .   1    1    18    18    ASP    HA      H    1     4.607      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    98     .   1    1    18    18    ASP    HB2     H    1     2.845      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    99     .   1    1    18    18    ASP    HB3     H    1     2.761      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    100    .   1    1    18    18    ASP    N       N    15    114.063    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    101    .   1    1    19    19    ARG    H       H    1     8.731      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    102    .   1    1    19    19    ARG    HA      H    1     4.094      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    103    .   1    1    19    19    ARG    HB2     H    1     1.357      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    104    .   1    1    19    19    ARG    HB3     H    1     1.268      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    105    .   1    1    19    19    ARG    HG2     H    1     1.735      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    106    .   1    1    19    19    ARG    HG3     H    1     1.683      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    107    .   1    1    19    19    ARG    HD2     H    1     3.134      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    108    .   1    1    19    19    ARG    HD3     H    1     3.049      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    109    .   1    1    19    19    ARG    HE      H    1     7.205      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    110    .   1    1    19    19    ARG    N       N    15    122.987    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    111    .   1    1    20    20    SER    H       H    1     7.722      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    112    .   1    1    20    20    SER    HA      H    1     5.147      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    113    .   1    1    20    20    SER    HB2     H    1     3.764      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    114    .   1    1    20    20    SER    HB3     H    1     3.579      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    115    .   1    1    20    20    SER    N       N    15    112.426    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    116    .   1    1    21    21    PHE    H       H    1     8.734      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    117    .   1    1    21    21    PHE    HA      H    1     4.938      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    118    .   1    1    21    21    PHE    HB2     H    1     3.674      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    119    .   1    1    21    21    PHE    HB3     H    1     2.784      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    120    .   1    1    21    21    PHE    HD1     H    1     7.412      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    121    .   1    1    21    21    PHE    HE1     H    1     6.895      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    122    .   1    1    21    21    PHE    HZ      H    1     6.320      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    123    .   1    1    21    21    PHE    N       N    15    116.305    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    124    .   1    1    22    22    SER    H       H    1     9.830      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    125    .   1    1    22    22    SER    HA      H    1     4.703      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    126    .   1    1    22    22    SER    HB2     H    1     4.183      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    127    .   1    1    22    22    SER    HB3     H    1     4.088      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    128    .   1    1    22    22    SER    N       N    15    116.168    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    129    .   1    1    23    23    ARG    H       H    1     7.535      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    130    .   1    1    23    23    ARG    HA      H    1     4.655      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    131    .   1    1    23    23    ARG    HB2     H    1     1.440      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    132    .   1    1    23    23    ARG    HB3     H    1     1.164      0.009     .   .   .   .   .   .   .   .   .   .   5851    1    
    133    .   1    1    23    23    ARG    HG2     H    1     2.064      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    134    .   1    1    23    23    ARG    HG3     H    1     1.615      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    135    .   1    1    23    23    ARG    HD2     H    1     3.182      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    136    .   1    1    23    23    ARG    HD3     H    1     2.669      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    137    .   1    1    23    23    ARG    HE      H    1     8.097      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    138    .   1    1    23    23    ARG    N       N    15    117.652    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    139    .   1    1    24    24    SER    H       H    1     8.674      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    140    .   1    1    24    24    SER    HA      H    1     3.109      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    141    .   1    1    24    24    SER    HB2     H    1     3.443      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    142    .   1    1    24    24    SER    HB3     H    1     3.154      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    143    .   1    1    24    24    SER    N       N    15    119.291    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    144    .   1    1    25    25    ASP    H       H    1     8.895      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    145    .   1    1    25    25    ASP    HA      H    1     4.329      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    146    .   1    1    25    25    ASP    HB2     H    1     2.761      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    147    .   1    1    25    25    ASP    HB3     H    1     2.643      0.009     .   .   .   .   .   .   .   .   .   .   5851    1    
    148    .   1    1    25    25    ASP    N       N    15    122.123    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    149    .   1    1    26    26    HIS    H       H    1     7.424      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    150    .   1    1    26    26    HIS    HA      H    1     4.403      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    151    .   1    1    26    26    HIS    HB2     H    1     3.392      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    152    .   1    1    26    26    HIS    HB3     H    1     3.262      0.009     .   .   .   .   .   .   .   .   .   .   5851    1    
    153    .   1    1    26    26    HIS    HD2     H    1     7.047      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    154    .   1    1    26    26    HIS    N       N    15    121.389    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    155    .   1    1    27    27    LEU    H       H    1     7.199      0.008     .   .   .   .   .   .   .   .   .   .   5851    1    
    156    .   1    1    27    27    LEU    HA      H    1     3.323      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    157    .   1    1    27    27    LEU    HB2     H    1     1.944      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    158    .   1    1    27    27    LEU    HB3     H    1     1.383      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    159    .   1    1    27    27    LEU    HG      H    1     1.613      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    160    .   1    1    27    27    LEU    HD11    H    1     1.150      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    161    .   1    1    27    27    LEU    HD12    H    1     1.150      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    162    .   1    1    27    27    LEU    HD13    H    1     1.150      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    163    .   1    1    27    27    LEU    HD21    H    1     1.075      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    164    .   1    1    27    27    LEU    HD22    H    1     1.075      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    165    .   1    1    27    27    LEU    HD23    H    1     1.075      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    166    .   1    1    27    27    LEU    N       N    15    120.406    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    167    .   1    1    28    28    ALA    H       H    1     7.994      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    168    .   1    1    28    28    ALA    HA      H    1     3.955      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    169    .   1    1    28    28    ALA    HB1     H    1     1.433      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    170    .   1    1    28    28    ALA    HB2     H    1     1.433      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    171    .   1    1    28    28    ALA    HB3     H    1     1.433      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    172    .   1    1    28    28    ALA    N       N    15    121.2      .         .   .   .   .   .   .   .   .   .   .   5851    1    
    173    .   1    1    29    29    LEU    H       H    1     7.493      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    174    .   1    1    29    29    LEU    HA      H    1     4.048      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    175    .   1    1    29    29    LEU    HB2     H    1     1.687      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    176    .   1    1    29    29    LEU    HG      H    1     1.603      0.010     .   .   .   .   .   .   .   .   .   .   5851    1    
    177    .   1    1    29    29    LEU    HD11    H    1     0.868      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    178    .   1    1    29    29    LEU    HD12    H    1     0.868      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    179    .   1    1    29    29    LEU    HD13    H    1     0.868      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    180    .   1    1    29    29    LEU    N       N    15    117.328    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    181    .   1    1    30    30    HIS    H       H    1     7.503      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    182    .   1    1    30    30    HIS    HA      H    1     4.190      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    183    .   1    1    30    30    HIS    HB2     H    1     3.139      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    184    .   1    1    30    30    HIS    HB3     H    1     2.923      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    185    .   1    1    30    30    HIS    N       N    15    119.121    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    186    .   1    1    31    31    ARG    H       H    1     8.585      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    187    .   1    1    31    31    ARG    HA      H    1     3.767      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    188    .   1    1    31    31    ARG    HB2     H    1     2.153      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    189    .   1    1    31    31    ARG    HB3     H    1     1.873      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    190    .   1    1    31    31    ARG    HG2     H    1     2.319      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    191    .   1    1    31    31    ARG    HG3     H    1     2.250      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    192    .   1    1    31    31    ARG    HD2     H    1     3.302      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    193    .   1    1    31    31    ARG    HE      H    1     8.033      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    194    .   1    1    31    31    ARG    N       N    15    116.211    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    195    .   1    1    32    32    LYS    H       H    1     7.295      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    196    .   1    1    32    32    LYS    HA      H    1     4.055      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    197    .   1    1    32    32    LYS    HB2     H    1     1.897      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    198    .   1    1    32    32    LYS    HG2     H    1     1.513      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    199    .   1    1    32    32    LYS    HD2     H    1     1.708      0.010     .   .   .   .   .   .   .   .   .   .   5851    1    
    200    .   1    1    32    32    LYS    HE2     H    1     2.975      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    201    .   1    1    32    32    LYS    HZ1     H    1     7.648      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    202    .   1    1    32    32    LYS    HZ2     H    1     7.648      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    203    .   1    1    32    32    LYS    HZ3     H    1     7.648      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    204    .   1    1    32    32    LYS    N       N    15    118.08     .         .   .   .   .   .   .   .   .   .   .   5851    1    
    205    .   1    1    33    33    ARG    H       H    1     7.753      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    206    .   1    1    33    33    ARG    HA      H    1     4.069      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    207    .   1    1    33    33    ARG    HB2     H    1     1.501      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    208    .   1    1    33    33    ARG    HB3     H    1     1.431      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    209    .   1    1    33    33    ARG    HG2     H    1     1.570      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    210    .   1    1    33    33    ARG    HD2     H    1     3.089      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    211    .   1    1    33    33    ARG    HE      H    1     7.281      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    212    .   1    1    33    33    ARG    N       N    15    116.17     .         .   .   .   .   .   .   .   .   .   .   5851    1    
    213    .   1    1    34    34    HIS    H       H    1     7.399      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    214    .   1    1    34    34    HIS    HA      H    1     4.702      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    215    .   1    1    34    34    HIS    HB2     H    1     3.279      0.005     .   .   .   .   .   .   .   .   .   .   5851    1    
    216    .   1    1    34    34    HIS    HB3     H    1     3.184      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    217    .   1    1    34    34    HIS    HD2     H    1     6.761      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    218    .   1    1    34    34    HIS    N       N    15    115.916    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    219    .   1    1    35    35    MET    H       H    1     7.650      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    220    .   1    1    35    35    MET    HA      H    1     4.492      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    221    .   1    1    35    35    MET    HB2     H    1     2.181      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    222    .   1    1    35    35    MET    HB3     H    1     2.056      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    223    .   1    1    35    35    MET    HG2     H    1     2.656      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    224    .   1    1    35    35    MET    HG3     H    1     2.577      0.003     .   .   .   .   .   .   .   .   .   .   5851    1    
    225    .   1    1    35    35    MET    N       N    15    118.751    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    226    .   1    1    36    36    LEU    H       H    1     8.241      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    227    .   1    1    36    36    LEU    HA      H    1     4.426      0.007     .   .   .   .   .   .   .   .   .   .   5851    1    
    228    .   1    1    36    36    LEU    HB2     H    1     1.687      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    229    .   1    1    36    36    LEU    HG      H    1     1.653      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    230    .   1    1    36    36    LEU    HD11    H    1     0.943      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    231    .   1    1    36    36    LEU    HD12    H    1     0.943      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    232    .   1    1    36    36    LEU    HD13    H    1     0.943      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    233    .   1    1    36    36    LEU    HD21    H    1     0.887      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    234    .   1    1    36    36    LEU    HD22    H    1     0.887      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    235    .   1    1    36    36    LEU    HD23    H    1     0.887      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    236    .   1    1    36    36    LEU    N       N    15    123.515    .         .   .   .   .   .   .   .   .   .   .   5851    1    
    237    .   1    1    37    37    VAL    H       H    1     7.761      0.002     .   .   .   .   .   .   .   .   .   .   5851    1    
    238    .   1    1    37    37    VAL    HA      H    1     4.071      0.0005    .   .   .   .   .   .   .   .   .   .   5851    1    
    239    .   1    1    37    37    VAL    HB      H    1     2.102      0.006     .   .   .   .   .   .   .   .   .   .   5851    1    
    240    .   1    1    37    37    VAL    HG11    H    1     0.920      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    241    .   1    1    37    37    VAL    HG12    H    1     0.920      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    242    .   1    1    37    37    VAL    HG13    H    1     0.920      0.004     .   .   .   .   .   .   .   .   .   .   5851    1    
    243    .   1    1    37    37    VAL    HG21    H    1     0.893      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    244    .   1    1    37    37    VAL    HG22    H    1     0.893      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    245    .   1    1    37    37    VAL    HG23    H    1     0.893      0.001     .   .   .   .   .   .   .   .   .   .   5851    1    
    246    .   1    1    37    37    VAL    N       N    15    124.515    .         .   .   .   .   .   .   .   .   .   .   5851    1    
  stop_

save_