Content for NMR-STAR saveframe, "assigned_chem_shift_list"

    save_assigned_chem_shift_list
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list
   _Assigned_chem_shift_list.Entry_ID                      18729
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $Standard
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chemical_shift_reference_1
   _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    '2D 1H-15N HSQC/HMQC'                         1   $15N       isotropic   18729   1
      2    '3D HNCACB'                                   2   $13C_15N   isotropic   18729   1
      3    'HNcoCACB (H[N[co[{CA|ca[C]}]]])'             2   $13C_15N   isotropic   18729   1
      4    '3D HNCO'                                     2   $13C_15N   isotropic   18729   1
      5    '3D HBHA(CO)NH'                               2   $13C_15N   isotropic   18729   1
      6    'HNCACO (HNcaCO)'                             2   $13C_15N   isotropic   18729   1
      7    'HCCoNNH (HccoNH)'                            2   $13C_15N   isotropic   18729   1
      8    '3D C(CO)NH'                                  2   $13C_15N   isotropic   18729   1
      9    '2D 1H-1H TOCSY'                              2   $13C_15N   isotropic   18729   1
      10   '2D 1H-1H NOESY'                              2   $13C_15N   isotropic   18729   1
      11   '2D 1H-13C HSQC/HMQC'                         2   $13C_15N   isotropic   18729   1
      12   '2D 1H-13C HSQC/HMQC'                         2   $13C_15N   isotropic   18729   1
      13   '2D 1H-15N HSQC/HMQC'                         2   $13C_15N   isotropic   18729   1
      14   '13C HSQC-NOESY (H[{N|C}]_H.through-space)'   2   $13C_15N   isotropic   18729   1
      15   '15N HSQC-NOESY (H[{N|C}]_H.through-space)'   2   $13C_15N   isotropic   18729   1
      16   '2D 1H-1H NOESY'                              2   $13C_15N   isotropic   18729   1
      17   '2D 1H-1H TOCSY'                              2   $13C_15N   isotropic   18729   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.Ambiguity_set_ID
      _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   1    1    SER   HA     H   1    3.975     .       .   1   .   .   330   .   .   1    SER   HA     .   18729   1
      2     .   1   1   1    1    SER   HB2    H   1    3.972     .       .   2   .   .   334   .   .   1    SER   HB2    .   18729   1
      3     .   1   1   1    1    SER   HB3    H   1    3.949     .       .   2   .   .   332   .   .   1    SER   HB3    .   18729   1
      4     .   1   1   1    1    SER   CA     C   13   57.957    .       .   1   .   .   331   .   .   1    SER   CA     .   18729   1
      5     .   1   1   1    1    SER   CB     C   13   64.309    .       .   1   .   .   333   .   .   1    SER   CB     .   18729   1
      6     .   1   1   2    2    GLU   HA     H   1    4.471     0.012   .   1   .   .   234   .   .   2    GLU   HA     .   18729   1
      7     .   1   1   2    2    GLU   HB2    H   1    1.932     0.008   .   2   .   .   232   .   .   2    GLU   HB2    .   18729   1
      8     .   1   1   2    2    GLU   HB3    H   1    2.142     0.01    .   2   .   .   233   .   .   2    GLU   HB3    .   18729   1
      9     .   1   1   2    2    GLU   HG2    H   1    2.317     0.01    .   1   .   .   245   .   .   2    GLU   HG2    .   18729   1
      10    .   1   1   2    2    GLU   HG3    H   1    2.317     0.01    .   1   .   .   246   .   .   2    GLU   HG3    .   18729   1
      11    .   1   1   2    2    GLU   C      C   13   175.710   0.033   .   1   .   .   154   .   .   2    GLU   C      .   18729   1
      12    .   1   1   2    2    GLU   CA     C   13   56.316    0.041   .   1   .   .   153   .   .   2    GLU   CA     .   18729   1
      13    .   1   1   2    2    GLU   CB     C   13   30.322    0.167   .   1   .   .   152   .   .   2    GLU   CB     .   18729   1
      14    .   1   1   2    2    GLU   CG     C   13   36.389    0.016   .   1   .   .   276   .   .   2    GLU   CG     .   18729   1
      15    .   1   1   3    3    CYS   H      H   1    8.257     0.009   .   1   .   .   54    .   .   3    CYS   H      .   18729   1
      16    .   1   1   3    3    CYS   HA     H   1    4.824     0.015   .   1   .   .   231   .   .   3    CYS   HA     .   18729   1
      17    .   1   1   3    3    CYS   HB2    H   1    3.121     0.012   .   2   .   .   230   .   .   3    CYS   HB2    .   18729   1
      18    .   1   1   3    3    CYS   HB3    H   1    3.051     0.006   .   2   .   .   229   .   .   3    CYS   HB3    .   18729   1
      19    .   1   1   3    3    CYS   C      C   13   173.366   0.034   .   1   .   .   151   .   .   3    CYS   C      .   18729   1
      20    .   1   1   3    3    CYS   CA     C   13   54.123    0.042   .   1   .   .   111   .   .   3    CYS   CA     .   18729   1
      21    .   1   1   3    3    CYS   CB     C   13   41.531    0.047   .   1   .   .   112   .   .   3    CYS   CB     .   18729   1
      22    .   1   1   3    3    CYS   N      N   15   118.068   0.056   .   1   .   .   55    .   .   3    CYS   N      .   18729   1
      23    .   1   1   4    4    VAL   H      H   1    8.809     0.003   .   1   .   .   42    .   .   4    VAL   H      .   18729   1
      24    .   1   1   4    4    VAL   HA     H   1    3.963     0.037   .   1   .   .   228   .   .   4    VAL   HA     .   18729   1
      25    .   1   1   4    4    VAL   HB     H   1    2.143     0.011   .   1   .   .   227   .   .   4    VAL   HB     .   18729   1
      26    .   1   1   4    4    VAL   HG11   H   1    0.975     0.005   .   2   .   .   247   .   .   4    VAL   HG11   .   18729   1
      27    .   1   1   4    4    VAL   HG12   H   1    0.975     0.005   .   2   .   .   247   .   .   4    VAL   HG12   .   18729   1
      28    .   1   1   4    4    VAL   HG13   H   1    0.975     0.005   .   2   .   .   247   .   .   4    VAL   HG13   .   18729   1
      29    .   1   1   4    4    VAL   HG21   H   1    1.197     0.007   .   2   .   .   248   .   .   4    VAL   HG21   .   18729   1
      30    .   1   1   4    4    VAL   HG22   H   1    1.197     0.007   .   2   .   .   248   .   .   4    VAL   HG22   .   18729   1
      31    .   1   1   4    4    VAL   HG23   H   1    1.197     0.007   .   2   .   .   248   .   .   4    VAL   HG23   .   18729   1
      32    .   1   1   4    4    VAL   C      C   13   175.171   0.016   .   1   .   .   150   .   .   4    VAL   C      .   18729   1
      33    .   1   1   4    4    VAL   CA     C   13   64.326    0.167   .   1   .   .   98    .   .   4    VAL   CA     .   18729   1
      34    .   1   1   4    4    VAL   CB     C   13   32.360    0.112   .   1   .   .   99    .   .   4    VAL   CB     .   18729   1
      35    .   1   1   4    4    VAL   CG1    C   13   22.152    0.046   .   2   .   .   278   .   .   4    VAL   CG1    .   18729   1
      36    .   1   1   4    4    VAL   CG2    C   13   22.204    0.009   .   2   .   .   277   .   .   4    VAL   CG2    .   18729   1
      37    .   1   1   4    4    VAL   N      N   15   121.917   0.033   .   1   .   .   43    .   .   4    VAL   N      .   18729   1
      38    .   1   1   5    5    GLU   H      H   1    8.996     0.006   .   1   .   .   5     .   .   5    GLU   H      .   18729   1
      39    .   1   1   5    5    GLU   HA     H   1    4.103     0.008   .   1   .   .   226   .   .   5    GLU   HA     .   18729   1
      40    .   1   1   5    5    GLU   HB2    H   1    2.036     0.013   .   2   .   .   224   .   .   5    GLU   HB2    .   18729   1
      41    .   1   1   5    5    GLU   HB3    H   1    2.218     0.009   .   2   .   .   225   .   .   5    GLU   HB3    .   18729   1
      42    .   1   1   5    5    GLU   HG2    H   1    2.435     0.013   .   2   .   .   250   .   .   5    GLU   HG2    .   18729   1
      43    .   1   1   5    5    GLU   HG3    H   1    2.358     0.008   .   2   .   .   249   .   .   5    GLU   HG3    .   18729   1
      44    .   1   1   5    5    GLU   C      C   13   175.240   0.012   .   1   .   .   148   .   .   5    GLU   C      .   18729   1
      45    .   1   1   5    5    GLU   CA     C   13   56.165    0.058   .   1   .   .   96    .   .   5    GLU   CA     .   18729   1
      46    .   1   1   5    5    GLU   CB     C   13   30.535    0.104   .   1   .   .   97    .   .   5    GLU   CB     .   18729   1
      47    .   1   1   5    5    GLU   CG     C   13   35.965    0.01    .   1   .   .   279   .   .   5    GLU   CG     .   18729   1
      48    .   1   1   5    5    GLU   N      N   15   129.835   0.038   .   1   .   .   6     .   .   5    GLU   N      .   18729   1
      49    .   1   1   6    6    ASN   H      H   1    8.707     0.006   .   1   .   .   63    .   .   6    ASN   H      .   18729   1
      50    .   1   1   6    6    ASN   HA     H   1    4.099     0.013   .   1   .   .   223   .   .   6    ASN   HA     .   18729   1
      51    .   1   1   6    6    ASN   HB2    H   1    2.861     0.008   .   2   .   .   222   .   .   6    ASN   HB2    .   18729   1
      52    .   1   1   6    6    ASN   HB3    H   1    2.764     0.013   .   2   .   .   221   .   .   6    ASN   HB3    .   18729   1
      53    .   1   1   6    6    ASN   HD21   H   1    7.618     0.004   .   1   .   .   7     .   .   6    ASN   HD21   .   18729   1
      54    .   1   1   6    6    ASN   HD22   H   1    7.035     0.003   .   1   .   .   11    .   .   6    ASN   HD22   .   18729   1
      55    .   1   1   6    6    ASN   C      C   13   176.276   0.012   .   1   .   .   147   .   .   6    ASN   C      .   18729   1
      56    .   1   1   6    6    ASN   CA     C   13   54.258    0.088   .   1   .   .   69    .   .   6    ASN   CA     .   18729   1
      57    .   1   1   6    6    ASN   CB     C   13   37.346    0.112   .   1   .   .   70    .   .   6    ASN   CB     .   18729   1
      58    .   1   1   6    6    ASN   CG     C   13   175.809   0.003   .   1   .   .   149   .   .   6    ASN   CG     .   18729   1
      59    .   1   1   6    6    ASN   N      N   15   119.294   0.043   .   1   .   .   64    .   .   6    ASN   N      .   18729   1
      60    .   1   1   6    6    ASN   ND2    N   15   111.427   0.046   .   1   .   .   8     .   .   6    ASN   ND2    .   18729   1
      61    .   1   1   7    7    GLY   H      H   1    9.565     0.004   .   1   .   .   50    .   .   7    GLY   H      .   18729   1
      62    .   1   1   7    7    GLY   HA2    H   1    4.503     0.019   .   2   .   .   220   .   .   7    GLY   HA2    .   18729   1
      63    .   1   1   7    7    GLY   HA3    H   1    3.843     0.019   .   2   .   .   219   .   .   7    GLY   HA3    .   18729   1
      64    .   1   1   7    7    GLY   C      C   13   174.901   0.019   .   1   .   .   146   .   .   7    GLY   C      .   18729   1
      65    .   1   1   7    7    GLY   CA     C   13   44.750    0.059   .   1   .   .   95    .   .   7    GLY   CA     .   18729   1
      66    .   1   1   7    7    GLY   N      N   15   113.151   0.033   .   1   .   .   51    .   .   7    GLY   N      .   18729   1
      67    .   1   1   8    8    GLY   H      H   1    8.327     0.004   .   1   .   .   28    .   .   8    GLY   H      .   18729   1
      68    .   1   1   8    8    GLY   HA2    H   1    4.283     0.019   .   2   .   .   218   .   .   8    GLY   HA2    .   18729   1
      69    .   1   1   8    8    GLY   HA3    H   1    3.572     0.008   .   2   .   .   217   .   .   8    GLY   HA3    .   18729   1
      70    .   1   1   8    8    GLY   C      C   13   171.720   0.053   .   1   .   .   145   .   .   8    GLY   C      .   18729   1
      71    .   1   1   8    8    GLY   CA     C   13   44.675    0.082   .   1   .   .   110   .   .   8    GLY   CA     .   18729   1
      72    .   1   1   8    8    GLY   N      N   15   108.221   0.026   .   1   .   .   29    .   .   8    GLY   N      .   18729   1
      73    .   1   1   9    9    PHE   H      H   1    8.433     0.005   .   1   .   .   36    .   .   9    PHE   H      .   18729   1
      74    .   1   1   9    9    PHE   HA     H   1    4.713     0.017   .   1   .   .   216   .   .   9    PHE   HA     .   18729   1
      75    .   1   1   9    9    PHE   HB2    H   1    3.386     0.011   .   2   .   .   215   .   .   9    PHE   HB2    .   18729   1
      76    .   1   1   9    9    PHE   HB3    H   1    2.849     0.013   .   2   .   .   214   .   .   9    PHE   HB3    .   18729   1
      77    .   1   1   9    9    PHE   HD1    H   1    7.283     0.027   .   3   .   .   303   .   .   9    PHE   HD1    .   18729   1
      78    .   1   1   9    9    PHE   HD2    H   1    7.283     0.027   .   3   .   .   303   .   .   9    PHE   HD2    .   18729   1
      79    .   1   1   9    9    PHE   HE1    H   1    7.347     0.004   .   3   .   .   304   .   .   9    PHE   HE1    .   18729   1
      80    .   1   1   9    9    PHE   HE2    H   1    7.347     0.004   .   3   .   .   304   .   .   9    PHE   HE2    .   18729   1
      81    .   1   1   9    9    PHE   HZ     H   1    7.288     0.002   .   1   .   .   305   .   .   9    PHE   HZ     .   18729   1
      82    .   1   1   9    9    PHE   C      C   13   174.200   0.029   .   1   .   .   144   .   .   9    PHE   C      .   18729   1
      83    .   1   1   9    9    PHE   CA     C   13   58.589    0.056   .   1   .   .   106   .   .   9    PHE   CA     .   18729   1
      84    .   1   1   9    9    PHE   CB     C   13   39.721    0.079   .   1   .   .   107   .   .   9    PHE   CB     .   18729   1
      85    .   1   1   9    9    PHE   CD1    C   13   131.684   .       .   3   .   .   316   .   .   9    PHE   CD1    .   18729   1
      86    .   1   1   9    9    PHE   CD2    C   13   131.684   .       .   3   .   .   316   .   .   9    PHE   CD2    .   18729   1
      87    .   1   1   9    9    PHE   CE1    C   13   131.692   .       .   3   .   .   317   .   .   9    PHE   CE1    .   18729   1
      88    .   1   1   9    9    PHE   CE2    C   13   131.692   .       .   3   .   .   317   .   .   9    PHE   CE2    .   18729   1
      89    .   1   1   9    9    PHE   CZ     C   13   127.337   .       .   1   .   .   315   .   .   9    PHE   CZ     .   18729   1
      90    .   1   1   9    9    PHE   N      N   15   120.621   0.034   .   1   .   .   37    .   .   9    PHE   N      .   18729   1
      91    .   1   1   10   10   CYS   H      H   1    6.938     0.006   .   1   .   .   9     .   .   10   CYS   H      .   18729   1
      92    .   1   1   10   10   CYS   HA     H   1    4.506     0.008   .   1   .   .   237   .   .   10   CYS   HA     .   18729   1
      93    .   1   1   10   10   CYS   HB2    H   1    3.030     0.01    .   2   .   .   238   .   .   10   CYS   HB2    .   18729   1
      94    .   1   1   10   10   CYS   HB3    H   1    2.935     0.008   .   2   .   .   239   .   .   10   CYS   HB3    .   18729   1
      95    .   1   1   10   10   CYS   CA     C   13   50.180    0.005   .   1   .   .   109   .   .   10   CYS   CA     .   18729   1
      96    .   1   1   10   10   CYS   CB     C   13   46.707    0.011   .   1   .   .   108   .   .   10   CYS   CB     .   18729   1
      97    .   1   1   10   10   CYS   N      N   15   122.563   0.038   .   1   .   .   10    .   .   10   CYS   N      .   18729   1
      98    .   1   1   11   11   PRO   HA     H   1    4.081     0.007   .   1   .   .   213   .   .   11   PRO   HA     .   18729   1
      99    .   1   1   11   11   PRO   HB2    H   1    1.676     0.009   .   2   .   .   211   .   .   11   PRO   HB2    .   18729   1
      100   .   1   1   11   11   PRO   HB3    H   1    1.949     0.005   .   2   .   .   212   .   .   11   PRO   HB3    .   18729   1
      101   .   1   1   11   11   PRO   HG2    H   1    0.817     0.017   .   2   .   .   285   .   .   11   PRO   HG2    .   18729   1
      102   .   1   1   11   11   PRO   HG3    H   1    0.711     0.012   .   2   .   .   284   .   .   11   PRO   HG3    .   18729   1
      103   .   1   1   11   11   PRO   HD2    H   1    2.419     0.013   .   2   .   .   281   .   .   11   PRO   HD2    .   18729   1
      104   .   1   1   11   11   PRO   HD3    H   1    2.669     0.008   .   2   .   .   282   .   .   11   PRO   HD3    .   18729   1
      105   .   1   1   11   11   PRO   C      C   13   173.972   0.024   .   1   .   .   143   .   .   11   PRO   C      .   18729   1
      106   .   1   1   11   11   PRO   CA     C   13   60.876    0.082   .   1   .   .   120   .   .   11   PRO   CA     .   18729   1
      107   .   1   1   11   11   PRO   CB     C   13   32.566    0.091   .   1   .   .   121   .   .   11   PRO   CB     .   18729   1
      108   .   1   1   11   11   PRO   CG     C   13   25.897    0.007   .   1   .   .   283   .   .   11   PRO   CG     .   18729   1
      109   .   1   1   11   11   PRO   CD     C   13   49.722    0.052   .   1   .   .   280   .   .   11   PRO   CD     .   18729   1
      110   .   1   1   12   12   ASP   H      H   1    8.120     0.007   .   1   .   .   14    .   .   12   ASP   H      .   18729   1
      111   .   1   1   12   12   ASP   HA     H   1    4.404     0.007   .   1   .   .   240   .   .   12   ASP   HA     .   18729   1
      112   .   1   1   12   12   ASP   HB2    H   1    2.569     0.008   .   2   .   .   302   .   .   12   ASP   HB2    .   18729   1
      113   .   1   1   12   12   ASP   HB3    H   1    2.775     0.004   .   2   .   .   301   .   .   12   ASP   HB3    .   18729   1
      114   .   1   1   12   12   ASP   C      C   13   176.518   .       .   1   .   .   235   .   .   12   ASP   C      .   18729   1
      115   .   1   1   12   12   ASP   CA     C   13   52.537    0.014   .   1   .   .   119   .   .   12   ASP   CA     .   18729   1
      116   .   1   1   12   12   ASP   CB     C   13   40.957    0.026   .   1   .   .   118   .   .   12   ASP   CB     .   18729   1
      117   .   1   1   12   12   ASP   N      N   15   117.109   0.04    .   1   .   .   15    .   .   12   ASP   N      .   18729   1
      118   .   1   1   13   13   PRO   HA     H   1    4.193     0.008   .   1   .   .   208   .   .   13   PRO   HA     .   18729   1
      119   .   1   1   13   13   PRO   HB2    H   1    2.033     0.02    .   1   .   .   210   .   .   13   PRO   HB2    .   18729   1
      120   .   1   1   13   13   PRO   HB3    H   1    2.033     0.02    .   1   .   .   209   .   .   13   PRO   HB3    .   18729   1
      121   .   1   1   13   13   PRO   HG2    H   1    2.082     0.001   .   2   .   .   253   .   .   13   PRO   HG2    .   18729   1
      122   .   1   1   13   13   PRO   HG3    H   1    1.979     0.004   .   2   .   .   254   .   .   13   PRO   HG3    .   18729   1
      123   .   1   1   13   13   PRO   HD2    H   1    3.855     0.012   .   1   .   .   252   .   .   13   PRO   HD2    .   18729   1
      124   .   1   1   13   13   PRO   HD3    H   1    3.855     0.012   .   1   .   .   251   .   .   13   PRO   HD3    .   18729   1
      125   .   1   1   13   13   PRO   C      C   13   179.079   0.054   .   1   .   .   142   .   .   13   PRO   C      .   18729   1
      126   .   1   1   13   13   PRO   CA     C   13   63.810    0.115   .   1   .   .   116   .   .   13   PRO   CA     .   18729   1
      127   .   1   1   13   13   PRO   CB     C   13   31.935    0.122   .   1   .   .   117   .   .   13   PRO   CB     .   18729   1
      128   .   1   1   13   13   PRO   CG     C   13   27.808    0.034   .   1   .   .   286   .   .   13   PRO   CG     .   18729   1
      129   .   1   1   13   13   PRO   CD     C   13   51.720    0.057   .   1   .   .   287   .   .   13   PRO   CD     .   18729   1
      130   .   1   1   14   14   GLU   H      H   1    8.741     0.004   .   1   .   .   48    .   .   14   GLU   H      .   18729   1
      131   .   1   1   14   14   GLU   HA     H   1    4.104     0.011   .   1   .   .   205   .   .   14   GLU   HA     .   18729   1
      132   .   1   1   14   14   GLU   HB2    H   1    2.087     0.009   .   1   .   .   207   .   .   14   GLU   HB2    .   18729   1
      133   .   1   1   14   14   GLU   HB3    H   1    2.087     0.009   .   1   .   .   206   .   .   14   GLU   HB3    .   18729   1
      134   .   1   1   14   14   GLU   HG2    H   1    2.365     0.009   .   2   .   .   256   .   .   14   GLU   HG2    .   18729   1
      135   .   1   1   14   14   GLU   HG3    H   1    2.268     0.008   .   2   .   .   255   .   .   14   GLU   HG3    .   18729   1
      136   .   1   1   14   14   GLU   C      C   13   177.349   0.026   .   1   .   .   141   .   .   14   GLU   C      .   18729   1
      137   .   1   1   14   14   GLU   CA     C   13   58.721    0.082   .   1   .   .   115   .   .   14   GLU   CA     .   18729   1
      138   .   1   1   14   14   GLU   CB     C   13   28.923    0.128   .   1   .   .   114   .   .   14   GLU   CB     .   18729   1
      139   .   1   1   14   14   GLU   CG     C   13   36.709    0.015   .   1   .   .   288   .   .   14   GLU   CG     .   18729   1
      140   .   1   1   14   14   GLU   N      N   15   119.901   0.033   .   1   .   .   49    .   .   14   GLU   N      .   18729   1
      141   .   1   1   15   15   LYS   H      H   1    7.455     0.006   .   1   .   .   18    .   .   15   LYS   H      .   18729   1
      142   .   1   1   15   15   LYS   HA     H   1    4.418     0.008   .   1   .   .   204   .   .   15   LYS   HA     .   18729   1
      143   .   1   1   15   15   LYS   HB2    H   1    1.824     0.024   .   2   .   .   202   .   .   15   LYS   HB2    .   18729   1
      144   .   1   1   15   15   LYS   HB3    H   1    1.908     0.009   .   2   .   .   203   .   .   15   LYS   HB3    .   18729   1
      145   .   1   1   15   15   LYS   HG2    H   1    1.417     0.009   .   2   .   .   259   .   .   15   LYS   HG2    .   18729   1
      146   .   1   1   15   15   LYS   HG3    H   1    1.512     0.009   .   2   .   .   260   .   .   15   LYS   HG3    .   18729   1
      147   .   1   1   15   15   LYS   HD2    H   1    1.726     0.014   .   1   .   .   262   .   .   15   LYS   HD2    .   18729   1
      148   .   1   1   15   15   LYS   HD3    H   1    1.726     0.014   .   1   .   .   261   .   .   15   LYS   HD3    .   18729   1
      149   .   1   1   15   15   LYS   HE2    H   1    3.036     0.007   .   1   .   .   257   .   .   15   LYS   HE2    .   18729   1
      150   .   1   1   15   15   LYS   HE3    H   1    3.036     0.007   .   1   .   .   258   .   .   15   LYS   HE3    .   18729   1
      151   .   1   1   15   15   LYS   C      C   13   177.850   0.037   .   1   .   .   139   .   .   15   LYS   C      .   18729   1
      152   .   1   1   15   15   LYS   CA     C   13   57.313    0.085   .   1   .   .   113   .   .   15   LYS   CA     .   18729   1
      153   .   1   1   15   15   LYS   CB     C   13   34.082    0.11    .   1   .   .   140   .   .   15   LYS   CB     .   18729   1
      154   .   1   1   15   15   LYS   CG     C   13   25.391    0.033   .   1   .   .   291   .   .   15   LYS   CG     .   18729   1
      155   .   1   1   15   15   LYS   CD     C   13   29.042    0.01    .   1   .   .   290   .   .   15   LYS   CD     .   18729   1
      156   .   1   1   15   15   LYS   CE     C   13   42.245    0.051   .   1   .   .   289   .   .   15   LYS   CE     .   18729   1
      157   .   1   1   15   15   LYS   N      N   15   116.302   0.037   .   1   .   .   19    .   .   15   LYS   N      .   18729   1
      158   .   1   1   16   16   MET   H      H   1    7.930     0.005   .   1   .   .   38    .   .   16   MET   H      .   18729   1
      159   .   1   1   16   16   MET   HA     H   1    4.802     0.011   .   1   .   .   201   .   .   16   MET   HA     .   18729   1
      160   .   1   1   16   16   MET   HB2    H   1    1.734     0.013   .   2   .   .   199   .   .   16   MET   HB2    .   18729   1
      161   .   1   1   16   16   MET   HB3    H   1    2.294     0.009   .   2   .   .   200   .   .   16   MET   HB3    .   18729   1
      162   .   1   1   16   16   MET   HG2    H   1    2.492     0.007   .   2   .   .   263   .   .   16   MET   HG2    .   18729   1
      163   .   1   1   16   16   MET   HG3    H   1    2.544     0.009   .   2   .   .   264   .   .   16   MET   HG3    .   18729   1
      164   .   1   1   16   16   MET   HE1    H   1    2.198     0.0     .   1   .   .   244   .   .   16   MET   HE1    .   18729   1
      165   .   1   1   16   16   MET   HE2    H   1    2.198     0.0     .   1   .   .   244   .   .   16   MET   HE2    .   18729   1
      166   .   1   1   16   16   MET   HE3    H   1    2.198     0.0     .   1   .   .   244   .   .   16   MET   HE3    .   18729   1
      167   .   1   1   16   16   MET   C      C   13   177.323   0.028   .   1   .   .   138   .   .   16   MET   C      .   18729   1
      168   .   1   1   16   16   MET   CA     C   13   55.059    0.087   .   1   .   .   83    .   .   16   MET   CA     .   18729   1
      169   .   1   1   16   16   MET   CB     C   13   33.928    0.089   .   1   .   .   82    .   .   16   MET   CB     .   18729   1
      170   .   1   1   16   16   MET   CG     C   13   32.906    0.005   .   1   .   .   292   .   .   16   MET   CG     .   18729   1
      171   .   1   1   16   16   MET   CE     C   13   17.352    0.004   .   1   .   .   243   .   .   16   MET   CE     .   18729   1
      172   .   1   1   16   16   MET   N      N   15   114.912   0.042   .   1   .   .   39    .   .   16   MET   N      .   18729   1
      173   .   1   1   17   17   GLY   H      H   1    7.661     0.005   .   1   .   .   20    .   .   17   GLY   H      .   18729   1
      174   .   1   1   17   17   GLY   HA2    H   1    3.819     0.014   .   2   .   .   156   .   .   17   GLY   HA2    .   18729   1
      175   .   1   1   17   17   GLY   HA3    H   1    4.404     0.02    .   2   .   .   157   .   .   17   GLY   HA3    .   18729   1
      176   .   1   1   17   17   GLY   C      C   13   171.801   0.093   .   1   .   .   137   .   .   17   GLY   C      .   18729   1
      177   .   1   1   17   17   GLY   CA     C   13   44.435    0.054   .   1   .   .   81    .   .   17   GLY   CA     .   18729   1
      178   .   1   1   17   17   GLY   N      N   15   109.260   0.038   .   1   .   .   21    .   .   17   GLY   N      .   18729   1
      179   .   1   1   18   18   ASP   H      H   1    8.608     0.005   .   1   .   .   56    .   .   18   ASP   H      .   18729   1
      180   .   1   1   18   18   ASP   HA     H   1    4.882     0.016   .   1   .   .   198   .   .   18   ASP   HA     .   18729   1
      181   .   1   1   18   18   ASP   HB2    H   1    2.350     0.007   .   2   .   .   196   .   .   18   ASP   HB2    .   18729   1
      182   .   1   1   18   18   ASP   HB3    H   1    3.141     0.01    .   2   .   .   197   .   .   18   ASP   HB3    .   18729   1
      183   .   1   1   18   18   ASP   C      C   13   177.621   0.037   .   1   .   .   136   .   .   18   ASP   C      .   18729   1
      184   .   1   1   18   18   ASP   CA     C   13   53.636    0.039   .   1   .   .   80    .   .   18   ASP   CA     .   18729   1
      185   .   1   1   18   18   ASP   CB     C   13   41.929    0.078   .   1   .   .   79    .   .   18   ASP   CB     .   18729   1
      186   .   1   1   18   18   ASP   N      N   15   119.882   0.04    .   1   .   .   57    .   .   18   ASP   N      .   18729   1
      187   .   1   1   19   19   TRP   H      H   1    8.223     0.003   .   1   .   .   46    .   .   19   TRP   H      .   18729   1
      188   .   1   1   19   19   TRP   HA     H   1    4.878     0.013   .   1   .   .   195   .   .   19   TRP   HA     .   18729   1
      189   .   1   1   19   19   TRP   HB2    H   1    3.045     0.008   .   2   .   .   193   .   .   19   TRP   HB2    .   18729   1
      190   .   1   1   19   19   TRP   HB3    H   1    3.619     0.014   .   2   .   .   194   .   .   19   TRP   HB3    .   18729   1
      191   .   1   1   19   19   TRP   HD1    H   1    6.885     0.003   .   1   .   .   300   .   .   19   TRP   HD1    .   18729   1
      192   .   1   1   19   19   TRP   HE1    H   1    9.816     0.002   .   1   .   .   32    .   .   19   TRP   HE1    .   18729   1
      193   .   1   1   19   19   TRP   HE3    H   1    7.624     0.005   .   1   .   .   309   .   .   19   TRP   HE3    .   18729   1
      194   .   1   1   19   19   TRP   HZ2    H   1    7.548     0.013   .   1   .   .   306   .   .   19   TRP   HZ2    .   18729   1
      195   .   1   1   19   19   TRP   HZ3    H   1    7.228     0.006   .   1   .   .   312   .   .   19   TRP   HZ3    .   18729   1
      196   .   1   1   19   19   TRP   HH2    H   1    7.343     0.009   .   1   .   .   311   .   .   19   TRP   HH2    .   18729   1
      197   .   1   1   19   19   TRP   C      C   13   177.238   0.063   .   1   .   .   135   .   .   19   TRP   C      .   18729   1
      198   .   1   1   19   19   TRP   CA     C   13   55.732    0.111   .   1   .   .   77    .   .   19   TRP   CA     .   18729   1
      199   .   1   1   19   19   TRP   CB     C   13   30.153    0.125   .   1   .   .   78    .   .   19   TRP   CB     .   18729   1
      200   .   1   1   19   19   TRP   CD1    C   13   124.644   .       .   1   .   .   308   .   .   19   TRP   CD1    .   18729   1
      201   .   1   1   19   19   TRP   CE3    C   13   121.011   .       .   1   .   .   310   .   .   19   TRP   CE3    .   18729   1
      202   .   1   1   19   19   TRP   CZ2    C   13   114.542   .       .   1   .   .   307   .   .   19   TRP   CZ2    .   18729   1
      203   .   1   1   19   19   TRP   CZ3    C   13   122.221   .       .   1   .   .   314   .   .   19   TRP   CZ3    .   18729   1
      204   .   1   1   19   19   TRP   CH2    C   13   125.008   .       .   1   .   .   313   .   .   19   TRP   CH2    .   18729   1
      205   .   1   1   19   19   TRP   N      N   15   126.897   0.042   .   1   .   .   47    .   .   19   TRP   N      .   18729   1
      206   .   1   1   19   19   TRP   NE1    N   15   127.222   0.05    .   1   .   .   33    .   .   19   TRP   NE1    .   18729   1
      207   .   1   1   20   20   CYS   H      H   1    9.447     0.004   .   1   .   .   30    .   .   20   CYS   H      .   18729   1
      208   .   1   1   20   20   CYS   HA     H   1    4.850     0.015   .   1   .   .   192   .   .   20   CYS   HA     .   18729   1
      209   .   1   1   20   20   CYS   HB2    H   1    3.035     0.009   .   2   .   .   191   .   .   20   CYS   HB2    .   18729   1
      210   .   1   1   20   20   CYS   HB3    H   1    2.696     0.009   .   2   .   .   190   .   .   20   CYS   HB3    .   18729   1
      211   .   1   1   20   20   CYS   C      C   13   175.440   0.019   .   1   .   .   134   .   .   20   CYS   C      .   18729   1
      212   .   1   1   20   20   CYS   CA     C   13   55.355    0.037   .   1   .   .   75    .   .   20   CYS   CA     .   18729   1
      213   .   1   1   20   20   CYS   CB     C   13   36.644    0.057   .   1   .   .   76    .   .   20   CYS   CB     .   18729   1
      214   .   1   1   20   20   CYS   N      N   15   120.752   0.037   .   1   .   .   31    .   .   20   CYS   N      .   18729   1
      215   .   1   1   21   21   CYS   H      H   1    9.261     0.003   .   1   .   .   3     .   .   21   CYS   H      .   18729   1
      216   .   1   1   21   21   CYS   HA     H   1    4.557     0.013   .   1   .   .   189   .   .   21   CYS   HA     .   18729   1
      217   .   1   1   21   21   CYS   HB2    H   1    2.735     0.009   .   2   .   .   187   .   .   21   CYS   HB2    .   18729   1
      218   .   1   1   21   21   CYS   HB3    H   1    3.266     0.015   .   2   .   .   188   .   .   21   CYS   HB3    .   18729   1
      219   .   1   1   21   21   CYS   C      C   13   176.823   0.043   .   1   .   .   133   .   .   21   CYS   C      .   18729   1
      220   .   1   1   21   21   CYS   CA     C   13   57.093    0.055   .   1   .   .   74    .   .   21   CYS   CA     .   18729   1
      221   .   1   1   21   21   CYS   CB     C   13   38.789    0.093   .   1   .   .   73    .   .   21   CYS   CB     .   18729   1
      222   .   1   1   21   21   CYS   N      N   15   122.649   0.036   .   1   .   .   4     .   .   21   CYS   N      .   18729   1
      223   .   1   1   22   22   GLY   H      H   1    8.881     0.005   .   1   .   .   16    .   .   22   GLY   H      .   18729   1
      224   .   1   1   22   22   GLY   HA2    H   1    3.811     0.014   .   2   .   .   185   .   .   22   GLY   HA2    .   18729   1
      225   .   1   1   22   22   GLY   HA3    H   1    4.255     0.016   .   2   .   .   186   .   .   22   GLY   HA3    .   18729   1
      226   .   1   1   22   22   GLY   C      C   13   172.049   0.054   .   1   .   .   132   .   .   22   GLY   C      .   18729   1
      227   .   1   1   22   22   GLY   CA     C   13   44.725    0.032   .   1   .   .   72    .   .   22   GLY   CA     .   18729   1
      228   .   1   1   22   22   GLY   N      N   15   109.391   0.044   .   1   .   .   17    .   .   22   GLY   N      .   18729   1
      229   .   1   1   23   23   ARG   H      H   1    9.152     0.006   .   1   .   .   52    .   .   23   ARG   H      .   18729   1
      230   .   1   1   23   23   ARG   HA     H   1    4.850     0.014   .   1   .   .   182   .   .   23   ARG   HA     .   18729   1
      231   .   1   1   23   23   ARG   HB2    H   1    1.653     0.007   .   1   .   .   183   .   .   23   ARG   HB2    .   18729   1
      232   .   1   1   23   23   ARG   HB3    H   1    1.653     0.007   .   1   .   .   184   .   .   23   ARG   HB3    .   18729   1
      233   .   1   1   23   23   ARG   HG2    H   1    1.558     0.002   .   2   .   .   323   .   .   23   ARG   HG2    .   18729   1
      234   .   1   1   23   23   ARG   HG3    H   1    1.535     0.016   .   2   .   .   321   .   .   23   ARG   HG3    .   18729   1
      235   .   1   1   23   23   ARG   HD2    H   1    3.215     0.009   .   1   .   .   265   .   .   23   ARG   HD2    .   18729   1
      236   .   1   1   23   23   ARG   HD3    H   1    3.215     0.009   .   1   .   .   266   .   .   23   ARG   HD3    .   18729   1
      237   .   1   1   23   23   ARG   C      C   13   174.040   0.015   .   1   .   .   130   .   .   23   ARG   C      .   18729   1
      238   .   1   1   23   23   ARG   CA     C   13   54.281    0.062   .   1   .   .   102   .   .   23   ARG   CA     .   18729   1
      239   .   1   1   23   23   ARG   CB     C   13   34.533    0.135   .   1   .   .   101   .   .   23   ARG   CB     .   18729   1
      240   .   1   1   23   23   ARG   CG     C   13   26.680    0.007   .   1   .   .   322   .   .   23   ARG   CG     .   18729   1
      241   .   1   1   23   23   ARG   CD     C   13   43.745    0.051   .   1   .   .   297   .   .   23   ARG   CD     .   18729   1
      242   .   1   1   23   23   ARG   N      N   15   125.358   0.029   .   1   .   .   53    .   .   23   ARG   N      .   18729   1
      243   .   1   1   24   24   CYS   H      H   1    10.614    0.005   .   1   .   .   40    .   .   24   CYS   H      .   18729   1
      244   .   1   1   24   24   CYS   HA     H   1    4.700     0.015   .   1   .   .   179   .   .   24   CYS   HA     .   18729   1
      245   .   1   1   24   24   CYS   HB2    H   1    3.447     0.012   .   2   .   .   181   .   .   24   CYS   HB2    .   18729   1
      246   .   1   1   24   24   CYS   HB3    H   1    2.698     0.016   .   2   .   .   180   .   .   24   CYS   HB3    .   18729   1
      247   .   1   1   24   24   CYS   C      C   13   174.769   0.037   .   1   .   .   129   .   .   24   CYS   C      .   18729   1
      248   .   1   1   24   24   CYS   CA     C   13   56.775    0.061   .   1   .   .   100   .   .   24   CYS   CA     .   18729   1
      249   .   1   1   24   24   CYS   CB     C   13   39.197    0.075   .   1   .   .   103   .   .   24   CYS   CB     .   18729   1
      250   .   1   1   24   24   CYS   N      N   15   127.205   0.047   .   1   .   .   41    .   .   24   CYS   N      .   18729   1
      251   .   1   1   25   25   ILE   H      H   1    8.765     0.005   .   1   .   .   12    .   .   25   ILE   H      .   18729   1
      252   .   1   1   25   25   ILE   HA     H   1    4.296     0.011   .   1   .   .   177   .   .   25   ILE   HA     .   18729   1
      253   .   1   1   25   25   ILE   HB     H   1    1.778     0.009   .   1   .   .   178   .   .   25   ILE   HB     .   18729   1
      254   .   1   1   25   25   ILE   HG12   H   1    1.420     0.01    .   2   .   .   327   .   .   25   ILE   HG12   .   18729   1
      255   .   1   1   25   25   ILE   HG13   H   1    1.116     0.009   .   2   .   .   328   .   .   25   ILE   HG13   .   18729   1
      256   .   1   1   25   25   ILE   HG21   H   1    0.889     0.01    .   1   .   .   268   .   .   25   ILE   HG21   .   18729   1
      257   .   1   1   25   25   ILE   HG22   H   1    0.889     0.01    .   1   .   .   268   .   .   25   ILE   HG22   .   18729   1
      258   .   1   1   25   25   ILE   HG23   H   1    0.889     0.01    .   1   .   .   268   .   .   25   ILE   HG23   .   18729   1
      259   .   1   1   25   25   ILE   HD11   H   1    0.794     0.01    .   1   .   .   267   .   .   25   ILE   HD11   .   18729   1
      260   .   1   1   25   25   ILE   HD12   H   1    0.794     0.01    .   1   .   .   267   .   .   25   ILE   HD12   .   18729   1
      261   .   1   1   25   25   ILE   HD13   H   1    0.794     0.01    .   1   .   .   267   .   .   25   ILE   HD13   .   18729   1
      262   .   1   1   25   25   ILE   C      C   13   175.188   0.012   .   1   .   .   155   .   .   25   ILE   C      .   18729   1
      263   .   1   1   25   25   ILE   CA     C   13   60.278    0.106   .   1   .   .   105   .   .   25   ILE   CA     .   18729   1
      264   .   1   1   25   25   ILE   CB     C   13   39.611    0.075   .   1   .   .   104   .   .   25   ILE   CB     .   18729   1
      265   .   1   1   25   25   ILE   CG1    C   13   26.563    0.004   .   1   .   .   329   .   .   25   ILE   CG1    .   18729   1
      266   .   1   1   25   25   ILE   CG2    C   13   17.079    0.133   .   1   .   .   294   .   .   25   ILE   CG2    .   18729   1
      267   .   1   1   25   25   ILE   CD1    C   13   12.165    0.089   .   1   .   .   293   .   .   25   ILE   CD1    .   18729   1
      268   .   1   1   25   25   ILE   N      N   15   132.507   0.026   .   1   .   .   13    .   .   25   ILE   N      .   18729   1
      269   .   1   1   26   26   ARG   H      H   1    9.276     0.008   .   1   .   .   26    .   .   26   ARG   H      .   18729   1
      270   .   1   1   26   26   ARG   HA     H   1    3.784     0.006   .   1   .   .   173   .   .   26   ARG   HA     .   18729   1
      271   .   1   1   26   26   ARG   HB2    H   1    1.838     0.009   .   2   .   .   174   .   .   26   ARG   HB2    .   18729   1
      272   .   1   1   26   26   ARG   HB3    H   1    2.000     0.009   .   2   .   .   176   .   .   26   ARG   HB3    .   18729   1
      273   .   1   1   26   26   ARG   HG2    H   1    1.640     0.009   .   2   .   .   175   .   .   26   ARG   HG2    .   18729   1
      274   .   1   1   26   26   ARG   HG3    H   1    1.680     0.014   .   2   .   .   271   .   .   26   ARG   HG3    .   18729   1
      275   .   1   1   26   26   ARG   HD2    H   1    3.223     0.005   .   2   .   .   270   .   .   26   ARG   HD2    .   18729   1
      276   .   1   1   26   26   ARG   HD3    H   1    3.290     0.009   .   2   .   .   269   .   .   26   ARG   HD3    .   18729   1
      277   .   1   1   26   26   ARG   C      C   13   175.535   0.021   .   1   .   .   127   .   .   26   ARG   C      .   18729   1
      278   .   1   1   26   26   ARG   CA     C   13   57.597    0.063   .   1   .   .   93    .   .   26   ARG   CA     .   18729   1
      279   .   1   1   26   26   ARG   CB     C   13   27.667    0.112   .   1   .   .   94    .   .   26   ARG   CB     .   18729   1
      280   .   1   1   26   26   ARG   CG     C   13   28.053    0.014   .   1   .   .   296   .   .   26   ARG   CG     .   18729   1
      281   .   1   1   26   26   ARG   CD     C   13   43.469    0.018   .   1   .   .   295   .   .   26   ARG   CD     .   18729   1
      282   .   1   1   26   26   ARG   N      N   15   128.844   0.042   .   1   .   .   27    .   .   26   ARG   N      .   18729   1
      283   .   1   1   27   27   ASN   H      H   1    8.370     0.008   .   1   .   .   1     .   .   27   ASN   H      .   18729   1
      284   .   1   1   27   27   ASN   HA     H   1    4.337     0.01    .   1   .   .   170   .   .   27   ASN   HA     .   18729   1
      285   .   1   1   27   27   ASN   HB2    H   1    3.284     0.006   .   2   .   .   171   .   .   27   ASN   HB2    .   18729   1
      286   .   1   1   27   27   ASN   HB3    H   1    2.916     0.017   .   2   .   .   172   .   .   27   ASN   HB3    .   18729   1
      287   .   1   1   27   27   ASN   HD21   H   1    6.853     0.002   .   1   .   .   65    .   .   27   ASN   HD21   .   18729   1
      288   .   1   1   27   27   ASN   HD22   H   1    7.995     0.003   .   1   .   .   34    .   .   27   ASN   HD22   .   18729   1
      289   .   1   1   27   27   ASN   C      C   13   174.065   0.032   .   1   .   .   126   .   .   27   ASN   C      .   18729   1
      290   .   1   1   27   27   ASN   CA     C   13   57.373    0.091   .   1   .   .   91    .   .   27   ASN   CA     .   18729   1
      291   .   1   1   27   27   ASN   CB     C   13   37.954    0.135   .   1   .   .   92    .   .   27   ASN   CB     .   18729   1
      292   .   1   1   27   27   ASN   CG     C   13   180.770   0.002   .   1   .   .   128   .   .   27   ASN   CG     .   18729   1
      293   .   1   1   27   27   ASN   N      N   15   106.094   0.029   .   1   .   .   2     .   .   27   ASN   N      .   18729   1
      294   .   1   1   27   27   ASN   ND2    N   15   108.095   0.065   .   1   .   .   35    .   .   27   ASN   ND2    .   18729   1
      295   .   1   1   28   28   GLU   H      H   1    7.874     0.005   .   1   .   .   22    .   .   28   GLU   H      .   18729   1
      296   .   1   1   28   28   GLU   HA     H   1    5.048     0.007   .   1   .   .   167   .   .   28   GLU   HA     .   18729   1
      297   .   1   1   28   28   GLU   HB2    H   1    1.910     0.015   .   1   .   .   169   .   .   28   GLU   HB2    .   18729   1
      298   .   1   1   28   28   GLU   HB3    H   1    1.910     0.015   .   1   .   .   168   .   .   28   GLU   HB3    .   18729   1
      299   .   1   1   28   28   GLU   HG2    H   1    2.172     0.009   .   1   .   .   273   .   .   28   GLU   HG2    .   18729   1
      300   .   1   1   28   28   GLU   HG3    H   1    2.172     0.009   .   1   .   .   272   .   .   28   GLU   HG3    .   18729   1
      301   .   1   1   28   28   GLU   C      C   13   175.907   0.011   .   1   .   .   125   .   .   28   GLU   C      .   18729   1
      302   .   1   1   28   28   GLU   CA     C   13   54.730    0.046   .   1   .   .   89    .   .   28   GLU   CA     .   18729   1
      303   .   1   1   28   28   GLU   CB     C   13   33.800    0.117   .   1   .   .   90    .   .   28   GLU   CB     .   18729   1
      304   .   1   1   28   28   GLU   CG     C   13   37.036    0.01    .   1   .   .   298   .   .   28   GLU   CG     .   18729   1
      305   .   1   1   28   28   GLU   N      N   15   121.256   0.04    .   1   .   .   23    .   .   28   GLU   N      .   18729   1
      306   .   1   1   29   29   CYS   H      H   1    8.993     0.005   .   1   .   .   61    .   .   29   CYS   H      .   18729   1
      307   .   1   1   29   29   CYS   HA     H   1    5.261     0.007   .   1   .   .   164   .   .   29   CYS   HA     .   18729   1
      308   .   1   1   29   29   CYS   HB2    H   1    3.670     0.008   .   2   .   .   165   .   .   29   CYS   HB2    .   18729   1
      309   .   1   1   29   29   CYS   HB3    H   1    2.760     0.006   .   2   .   .   166   .   .   29   CYS   HB3    .   18729   1
      310   .   1   1   29   29   CYS   C      C   13   176.269   0.025   .   1   .   .   124   .   .   29   CYS   C      .   18729   1
      311   .   1   1   29   29   CYS   CA     C   13   53.541    0.057   .   1   .   .   88    .   .   29   CYS   CA     .   18729   1
      312   .   1   1   29   29   CYS   CB     C   13   36.016    0.077   .   1   .   .   87    .   .   29   CYS   CB     .   18729   1
      313   .   1   1   29   29   CYS   N      N   15   125.101   0.026   .   1   .   .   62    .   .   29   CYS   N      .   18729   1
      314   .   1   1   30   30   ARG   H      H   1    9.617     0.005   .   1   .   .   59    .   .   30   ARG   H      .   18729   1
      315   .   1   1   30   30   ARG   HA     H   1    4.760     0.015   .   1   .   .   161   .   .   30   ARG   HA     .   18729   1
      316   .   1   1   30   30   ARG   HB2    H   1    1.772     0.009   .   2   .   .   162   .   .   30   ARG   HB2    .   18729   1
      317   .   1   1   30   30   ARG   HB3    H   1    2.080     0.005   .   2   .   .   163   .   .   30   ARG   HB3    .   18729   1
      318   .   1   1   30   30   ARG   HG2    H   1    1.763     0.0     .   1   .   .   324   .   .   30   ARG   HG2    .   18729   1
      319   .   1   1   30   30   ARG   HG3    H   1    1.763     0.0     .   1   .   .   326   .   .   30   ARG   HG3    .   18729   1
      320   .   1   1   30   30   ARG   HD2    H   1    3.264     0.009   .   2   .   .   274   .   .   30   ARG   HD2    .   18729   1
      321   .   1   1   30   30   ARG   HD3    H   1    3.189     0.008   .   2   .   .   275   .   .   30   ARG   HD3    .   18729   1
      322   .   1   1   30   30   ARG   C      C   13   175.247   0.006   .   1   .   .   123   .   .   30   ARG   C      .   18729   1
      323   .   1   1   30   30   ARG   CA     C   13   53.908    0.019   .   1   .   .   86    .   .   30   ARG   CA     .   18729   1
      324   .   1   1   30   30   ARG   CB     C   13   34.280    0.124   .   1   .   .   85    .   .   30   ARG   CB     .   18729   1
      325   .   1   1   30   30   ARG   CG     C   13   26.827    0.014   .   1   .   .   325   .   .   30   ARG   CG     .   18729   1
      326   .   1   1   30   30   ARG   CD     C   13   43.360    0.012   .   1   .   .   299   .   .   30   ARG   CD     .   18729   1
      327   .   1   1   30   30   ARG   N      N   15   125.154   0.038   .   1   .   .   60    .   .   30   ARG   N      .   18729   1
      328   .   1   1   31   31   ASN   H      H   1    8.697     0.007   .   1   .   .   24    .   .   31   ASN   H      .   18729   1
      329   .   1   1   31   31   ASN   HA     H   1    4.563     0.01    .   1   .   .   158   .   .   31   ASN   HA     .   18729   1
      330   .   1   1   31   31   ASN   HB2    H   1    2.841     0.011   .   2   .   .   159   .   .   31   ASN   HB2    .   18729   1
      331   .   1   1   31   31   ASN   HB3    H   1    2.950     0.01    .   2   .   .   160   .   .   31   ASN   HB3    .   18729   1
      332   .   1   1   31   31   ASN   HD21   H   1    7.641     0.007   .   1   .   .   58    .   .   31   ASN   HD21   .   18729   1
      333   .   1   1   31   31   ASN   HD22   H   1    7.022     0.004   .   1   .   .   67    .   .   31   ASN   HD22   .   18729   1
      334   .   1   1   31   31   ASN   C      C   13   175.072   0.024   .   1   .   .   122   .   .   31   ASN   C      .   18729   1
      335   .   1   1   31   31   ASN   CA     C   13   54.820    0.058   .   1   .   .   68    .   .   31   ASN   CA     .   18729   1
      336   .   1   1   31   31   ASN   CB     C   13   38.255    0.074   .   1   .   .   71    .   .   31   ASN   CB     .   18729   1
      337   .   1   1   31   31   ASN   CG     C   13   177.318   0.001   .   1   .   .   131   .   .   31   ASN   CG     .   18729   1
      338   .   1   1   31   31   ASN   N      N   15   115.776   0.057   .   1   .   .   25    .   .   31   ASN   N      .   18729   1
      339   .   1   1   31   31   ASN   ND2    N   15   112.800   0.018   .   1   .   .   66    .   .   31   ASN   ND2    .   18729   1
      340   .   1   1   32   32   GLY   H      H   1    8.421     0.009   .   1   .   .   44    .   .   32   GLY   H      .   18729   1
      341   .   1   1   32   32   GLY   HA2    H   1    3.761     0.008   .   2   .   .   241   .   .   32   GLY   HA2    .   18729   1
      342   .   1   1   32   32   GLY   HA3    H   1    3.531     0.012   .   2   .   .   242   .   .   32   GLY   HA3    .   18729   1
      343   .   1   1   32   32   GLY   C      C   13   178.493   .       .   1   .   .   236   .   .   32   GLY   C      .   18729   1
      344   .   1   1   32   32   GLY   CA     C   13   46.102    0.036   .   1   .   .   84    .   .   32   GLY   CA     .   18729   1
      345   .   1   1   32   32   GLY   N      N   15   114.585   0.026   .   1   .   .   45    .   .   32   GLY   N      .   18729   1
   stop_
save_