Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"

    save_assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Entry_ID                      25229
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_conditions_1
   _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'                    .   .   .   25229   1
      2    '3D sparse-sampled HNCO'            .   .   .   25229   1
      3    '3D sparse-sampled HNCA'            .   .   .   25229   1
      4    '3D sparse-sampled HNCOCA'          .   .   .   25229   1
      5    '3D sparse-sampled HNCACB'          .   .   .   25229   1
      6    '3D sparse-sampled HNCOCACB'        .   .   .   25229   1
      7    '3D sparse-sampled HACANH'          .   .   .   25229   1
      8    '3D sparse-sampled HACACONH'        .   .   .   25229   1
      9    '4D sparse-sampled HCccoNH TOCSY'   .   .   .   25229   1
      10   '3D 1H-15N NOESY'                   .   .   .   25229   1
      11   '4D sparse-sampled HCCH TOCSY'      .   .   .   25229   1
      12   '4D sparse-sampled CHCH NOESY'      .   .   .   25229   1
      13   '4D sparse-sampled CHNH NOESY'      .   .   .   25229   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   2    2    HIS   HA     H   1    4.650     0.020   .   1   .   .   .   A   2    HIS   HA     .   25229   1
      2     .   1   1   2    2    HIS   HB2    H   1    3.117     0.020   .   1   .   .   .   A   2    HIS   HB2    .   25229   1
      3     .   1   1   2    2    HIS   HB3    H   1    3.117     0.020   .   1   .   .   .   A   2    HIS   HB3    .   25229   1
      4     .   1   1   2    2    HIS   HD2    H   1    7.053     0.020   .   1   .   .   .   A   2    HIS   HD2    .   25229   1
      5     .   1   1   2    2    HIS   HE1    H   1    7.880     0.020   .   1   .   .   .   A   2    HIS   HE1    .   25229   1
      6     .   1   1   2    2    HIS   CA     C   13   56.178    0.400   .   1   .   .   .   A   2    HIS   CA     .   25229   1
      7     .   1   1   2    2    HIS   CB     C   13   31.096    0.400   .   1   .   .   .   A   2    HIS   CB     .   25229   1
      8     .   1   1   2    2    HIS   CD2    C   13   119.559   0.400   .   1   .   .   .   A   2    HIS   CD2    .   25229   1
      9     .   1   1   2    2    HIS   CE1    C   13   138.247   0.400   .   1   .   .   .   A   2    HIS   CE1    .   25229   1
      10    .   1   1   3    3    MET   HA     H   1    4.450     0.020   .   1   .   .   .   A   3    MET   HA     .   25229   1
      11    .   1   1   3    3    MET   HB2    H   1    1.946     0.020   .   2   .   .   .   A   3    MET   HB2    .   25229   1
      12    .   1   1   3    3    MET   HB3    H   1    2.077     0.020   .   2   .   .   .   A   3    MET   HB3    .   25229   1
      13    .   1   1   3    3    MET   HG2    H   1    2.449     0.020   .   2   .   .   .   A   3    MET   HG2    .   25229   1
      14    .   1   1   3    3    MET   HG3    H   1    2.539     0.020   .   2   .   .   .   A   3    MET   HG3    .   25229   1
      15    .   1   1   3    3    MET   HE1    H   1    2.074     0.020   .   1   .   .   .   A   3    MET   HE1    .   25229   1
      16    .   1   1   3    3    MET   HE2    H   1    2.074     0.020   .   1   .   .   .   A   3    MET   HE2    .   25229   1
      17    .   1   1   3    3    MET   HE3    H   1    2.074     0.020   .   1   .   .   .   A   3    MET   HE3    .   25229   1
      18    .   1   1   3    3    MET   CA     C   13   55.668    0.400   .   1   .   .   .   A   3    MET   CA     .   25229   1
      19    .   1   1   3    3    MET   CB     C   13   32.804    0.400   .   1   .   .   .   A   3    MET   CB     .   25229   1
      20    .   1   1   3    3    MET   CG     C   13   31.869    0.400   .   1   .   .   .   A   3    MET   CG     .   25229   1
      21    .   1   1   3    3    MET   CE     C   13   16.817    0.400   .   1   .   .   .   A   3    MET   CE     .   25229   1
      22    .   1   1   4    4    GLY   H      H   1    8.423     0.020   .   1   .   .   .   A   4    GLY   H      .   25229   1
      23    .   1   1   4    4    GLY   HA2    H   1    3.947     0.020   .   1   .   .   .   A   4    GLY   HA2    .   25229   1
      24    .   1   1   4    4    GLY   HA3    H   1    3.947     0.020   .   1   .   .   .   A   4    GLY   HA3    .   25229   1
      25    .   1   1   4    4    GLY   CA     C   13   45.269    0.400   .   1   .   .   .   A   4    GLY   CA     .   25229   1
      26    .   1   1   4    4    GLY   N      N   15   110.404   0.400   .   1   .   .   .   A   4    GLY   N      .   25229   1
      27    .   1   1   5    5    ALA   H      H   1    8.191     0.020   .   1   .   .   .   A   5    ALA   H      .   25229   1
      28    .   1   1   5    5    ALA   HA     H   1    4.282     0.020   .   1   .   .   .   A   5    ALA   HA     .   25229   1
      29    .   1   1   5    5    ALA   HB1    H   1    1.378     0.020   .   1   .   .   .   A   5    ALA   HB1    .   25229   1
      30    .   1   1   5    5    ALA   HB2    H   1    1.378     0.020   .   1   .   .   .   A   5    ALA   HB2    .   25229   1
      31    .   1   1   5    5    ALA   HB3    H   1    1.378     0.020   .   1   .   .   .   A   5    ALA   HB3    .   25229   1
      32    .   1   1   5    5    ALA   CA     C   13   52.493    0.400   .   1   .   .   .   A   5    ALA   CA     .   25229   1
      33    .   1   1   5    5    ALA   CB     C   13   19.310    0.400   .   1   .   .   .   A   5    ALA   CB     .   25229   1
      34    .   1   1   5    5    ALA   N      N   15   124.042   0.400   .   1   .   .   .   A   5    ALA   N      .   25229   1
      35    .   1   1   6    6    ALA   H      H   1    8.243     0.020   .   1   .   .   .   A   6    ALA   H      .   25229   1
      36    .   1   1   6    6    ALA   HA     H   1    4.283     0.020   .   1   .   .   .   A   6    ALA   HA     .   25229   1
      37    .   1   1   6    6    ALA   HB1    H   1    1.369     0.020   .   1   .   .   .   A   6    ALA   HB1    .   25229   1
      38    .   1   1   6    6    ALA   HB2    H   1    1.369     0.020   .   1   .   .   .   A   6    ALA   HB2    .   25229   1
      39    .   1   1   6    6    ALA   HB3    H   1    1.369     0.020   .   1   .   .   .   A   6    ALA   HB3    .   25229   1
      40    .   1   1   6    6    ALA   CA     C   13   52.383    0.400   .   1   .   .   .   A   6    ALA   CA     .   25229   1
      41    .   1   1   6    6    ALA   CB     C   13   19.313    0.400   .   1   .   .   .   A   6    ALA   CB     .   25229   1
      42    .   1   1   6    6    ALA   N      N   15   122.851   0.400   .   1   .   .   .   A   6    ALA   N      .   25229   1
      43    .   1   1   7    7    ALA   H      H   1    8.167     0.020   .   1   .   .   .   A   7    ALA   H      .   25229   1
      44    .   1   1   7    7    ALA   HA     H   1    4.299     0.020   .   1   .   .   .   A   7    ALA   HA     .   25229   1
      45    .   1   1   7    7    ALA   HB1    H   1    1.363     0.020   .   1   .   .   .   A   7    ALA   HB1    .   25229   1
      46    .   1   1   7    7    ALA   HB2    H   1    1.363     0.020   .   1   .   .   .   A   7    ALA   HB2    .   25229   1
      47    .   1   1   7    7    ALA   HB3    H   1    1.363     0.020   .   1   .   .   .   A   7    ALA   HB3    .   25229   1
      48    .   1   1   7    7    ALA   CA     C   13   52.266    0.400   .   1   .   .   .   A   7    ALA   CA     .   25229   1
      49    .   1   1   7    7    ALA   CB     C   13   19.285    0.400   .   1   .   .   .   A   7    ALA   CB     .   25229   1
      50    .   1   1   7    7    ALA   N      N   15   123.014   0.400   .   1   .   .   .   A   7    ALA   N      .   25229   1
      51    .   1   1   8    8    LEU   H      H   1    8.137     0.020   .   1   .   .   .   A   8    LEU   H      .   25229   1
      52    .   1   1   8    8    LEU   HA     H   1    4.428     0.020   .   1   .   .   .   A   8    LEU   HA     .   25229   1
      53    .   1   1   8    8    LEU   HB2    H   1    1.703     0.020   .   1   .   .   .   A   8    LEU   HB2    .   25229   1
      54    .   1   1   8    8    LEU   HB3    H   1    1.703     0.020   .   1   .   .   .   A   8    LEU   HB3    .   25229   1
      55    .   1   1   8    8    LEU   HG     H   1    1.740     0.020   .   1   .   .   .   A   8    LEU   HG     .   25229   1
      56    .   1   1   8    8    LEU   HD11   H   1    0.963     0.020   .   2   .   .   .   A   8    LEU   HD11   .   25229   1
      57    .   1   1   8    8    LEU   HD12   H   1    0.963     0.020   .   2   .   .   .   A   8    LEU   HD12   .   25229   1
      58    .   1   1   8    8    LEU   HD13   H   1    0.963     0.020   .   2   .   .   .   A   8    LEU   HD13   .   25229   1
      59    .   1   1   8    8    LEU   HD21   H   1    0.985     0.020   .   2   .   .   .   A   8    LEU   HD21   .   25229   1
      60    .   1   1   8    8    LEU   HD22   H   1    0.985     0.020   .   2   .   .   .   A   8    LEU   HD22   .   25229   1
      61    .   1   1   8    8    LEU   HD23   H   1    0.985     0.020   .   2   .   .   .   A   8    LEU   HD23   .   25229   1
      62    .   1   1   8    8    LEU   CA     C   13   54.962    0.400   .   1   .   .   .   A   8    LEU   CA     .   25229   1
      63    .   1   1   8    8    LEU   CB     C   13   42.812    0.400   .   1   .   .   .   A   8    LEU   CB     .   25229   1
      64    .   1   1   8    8    LEU   CG     C   13   27.101    0.400   .   1   .   .   .   A   8    LEU   CG     .   25229   1
      65    .   1   1   8    8    LEU   CD1    C   13   23.713    0.400   .   1   .   .   .   A   8    LEU   CD1    .   25229   1
      66    .   1   1   8    8    LEU   CD2    C   13   25.372    0.400   .   1   .   .   .   A   8    LEU   CD2    .   25229   1
      67    .   1   1   8    8    LEU   N      N   15   121.468   0.400   .   1   .   .   .   A   8    LEU   N      .   25229   1
      68    .   1   1   9    9    ARG   H      H   1    8.661     0.020   .   1   .   .   .   A   9    ARG   H      .   25229   1
      69    .   1   1   9    9    ARG   HA     H   1    4.551     0.020   .   1   .   .   .   A   9    ARG   HA     .   25229   1
      70    .   1   1   9    9    ARG   HB2    H   1    1.915     0.020   .   2   .   .   .   A   9    ARG   HB2    .   25229   1
      71    .   1   1   9    9    ARG   HB3    H   1    2.054     0.020   .   2   .   .   .   A   9    ARG   HB3    .   25229   1
      72    .   1   1   9    9    ARG   HG2    H   1    1.796     0.020   .   1   .   .   .   A   9    ARG   HG2    .   25229   1
      73    .   1   1   9    9    ARG   HG3    H   1    1.796     0.020   .   1   .   .   .   A   9    ARG   HG3    .   25229   1
      74    .   1   1   9    9    ARG   HD2    H   1    3.181     0.020   .   2   .   .   .   A   9    ARG   HD2    .   25229   1
      75    .   1   1   9    9    ARG   HD3    H   1    3.303     0.020   .   2   .   .   .   A   9    ARG   HD3    .   25229   1
      76    .   1   1   9    9    ARG   CA     C   13   56.074    0.400   .   1   .   .   .   A   9    ARG   CA     .   25229   1
      77    .   1   1   9    9    ARG   CB     C   13   31.407    0.400   .   1   .   .   .   A   9    ARG   CB     .   25229   1
      78    .   1   1   9    9    ARG   CG     C   13   26.640    0.400   .   1   .   .   .   A   9    ARG   CG     .   25229   1
      79    .   1   1   9    9    ARG   CD     C   13   43.267    0.400   .   1   .   .   .   A   9    ARG   CD     .   25229   1
      80    .   1   1   9    9    ARG   N      N   15   121.900   0.400   .   1   .   .   .   A   9    ARG   N      .   25229   1
      81    .   1   1   10   10   SER   H      H   1    7.916     0.020   .   1   .   .   .   A   10   SER   H      .   25229   1
      82    .   1   1   10   10   SER   HA     H   1    4.699     0.020   .   1   .   .   .   A   10   SER   HA     .   25229   1
      83    .   1   1   10   10   SER   HB2    H   1    3.218     0.020   .   2   .   .   .   A   10   SER   HB2    .   25229   1
      84    .   1   1   10   10   SER   HB3    H   1    3.445     0.020   .   2   .   .   .   A   10   SER   HB3    .   25229   1
      85    .   1   1   10   10   SER   CA     C   13   56.024    0.400   .   1   .   .   .   A   10   SER   CA     .   25229   1
      86    .   1   1   10   10   SER   CB     C   13   65.807    0.400   .   1   .   .   .   A   10   SER   CB     .   25229   1
      87    .   1   1   10   10   SER   N      N   15   113.434   0.400   .   1   .   .   .   A   10   SER   N      .   25229   1
      88    .   1   1   11   11   CYS   H      H   1    8.173     0.020   .   1   .   .   .   A   11   CYS   H      .   25229   1
      89    .   1   1   11   11   CYS   HA     H   1    4.672     0.020   .   1   .   .   .   A   11   CYS   HA     .   25229   1
      90    .   1   1   11   11   CYS   HB2    H   1    2.508     0.020   .   2   .   .   .   A   11   CYS   HB2    .   25229   1
      91    .   1   1   11   11   CYS   HB3    H   1    3.129     0.020   .   2   .   .   .   A   11   CYS   HB3    .   25229   1
      92    .   1   1   11   11   CYS   CA     C   13   56.159    0.400   .   1   .   .   .   A   11   CYS   CA     .   25229   1
      93    .   1   1   11   11   CYS   CB     C   13   31.388    0.400   .   1   .   .   .   A   11   CYS   CB     .   25229   1
      94    .   1   1   11   11   CYS   N      N   15   125.462   0.400   .   1   .   .   .   A   11   CYS   N      .   25229   1
      95    .   1   1   12   12   PRO   HA     H   1    4.476     0.020   .   1   .   .   .   A   12   PRO   HA     .   25229   1
      96    .   1   1   12   12   PRO   HB2    H   1    2.029     0.020   .   2   .   .   .   A   12   PRO   HB2    .   25229   1
      97    .   1   1   12   12   PRO   HB3    H   1    2.380     0.020   .   2   .   .   .   A   12   PRO   HB3    .   25229   1
      98    .   1   1   12   12   PRO   HG2    H   1    2.028     0.020   .   2   .   .   .   A   12   PRO   HG2    .   25229   1
      99    .   1   1   12   12   PRO   HG3    H   1    2.143     0.020   .   2   .   .   .   A   12   PRO   HG3    .   25229   1
      100   .   1   1   12   12   PRO   HD2    H   1    4.118     0.020   .   2   .   .   .   A   12   PRO   HD2    .   25229   1
      101   .   1   1   12   12   PRO   HD3    H   1    4.239     0.020   .   2   .   .   .   A   12   PRO   HD3    .   25229   1
      102   .   1   1   12   12   PRO   CA     C   13   64.257    0.400   .   1   .   .   .   A   12   PRO   CA     .   25229   1
      103   .   1   1   12   12   PRO   CB     C   13   32.185    0.400   .   1   .   .   .   A   12   PRO   CB     .   25229   1
      104   .   1   1   12   12   PRO   CG     C   13   27.050    0.400   .   1   .   .   .   A   12   PRO   CG     .   25229   1
      105   .   1   1   12   12   PRO   CD     C   13   51.264    0.400   .   1   .   .   .   A   12   PRO   CD     .   25229   1
      106   .   1   1   13   13   MET   H      H   1    9.132     0.020   .   1   .   .   .   A   13   MET   H      .   25229   1
      107   .   1   1   13   13   MET   HA     H   1    4.549     0.020   .   1   .   .   .   A   13   MET   HA     .   25229   1
      108   .   1   1   13   13   MET   HB2    H   1    2.185     0.020   .   2   .   .   .   A   13   MET   HB2    .   25229   1
      109   .   1   1   13   13   MET   HB3    H   1    2.310     0.020   .   2   .   .   .   A   13   MET   HB3    .   25229   1
      110   .   1   1   13   13   MET   HG2    H   1    2.415     0.020   .   2   .   .   .   A   13   MET   HG2    .   25229   1
      111   .   1   1   13   13   MET   HG3    H   1    2.628     0.020   .   2   .   .   .   A   13   MET   HG3    .   25229   1
      112   .   1   1   13   13   MET   HE1    H   1    2.190     0.020   .   1   .   .   .   A   13   MET   HE1    .   25229   1
      113   .   1   1   13   13   MET   HE2    H   1    2.190     0.020   .   1   .   .   .   A   13   MET   HE2    .   25229   1
      114   .   1   1   13   13   MET   HE3    H   1    2.190     0.020   .   1   .   .   .   A   13   MET   HE3    .   25229   1
      115   .   1   1   13   13   MET   CA     C   13   57.426    0.400   .   1   .   .   .   A   13   MET   CA     .   25229   1
      116   .   1   1   13   13   MET   CB     C   13   33.451    0.400   .   1   .   .   .   A   13   MET   CB     .   25229   1
      117   .   1   1   13   13   MET   CG     C   13   33.191    0.400   .   1   .   .   .   A   13   MET   CG     .   25229   1
      118   .   1   1   13   13   MET   CE     C   13   17.895    0.400   .   1   .   .   .   A   13   MET   CE     .   25229   1
      119   .   1   1   13   13   MET   N      N   15   120.537   0.400   .   1   .   .   .   A   13   MET   N      .   25229   1
      120   .   1   1   14   14   CYS   H      H   1    8.331     0.020   .   1   .   .   .   A   14   CYS   H      .   25229   1
      121   .   1   1   14   14   CYS   HA     H   1    4.943     0.020   .   1   .   .   .   A   14   CYS   HA     .   25229   1
      122   .   1   1   14   14   CYS   HB2    H   1    2.650     0.020   .   2   .   .   .   A   14   CYS   HB2    .   25229   1
      123   .   1   1   14   14   CYS   HB3    H   1    3.251     0.020   .   2   .   .   .   A   14   CYS   HB3    .   25229   1
      124   .   1   1   14   14   CYS   CA     C   13   58.945    0.400   .   1   .   .   .   A   14   CYS   CA     .   25229   1
      125   .   1   1   14   14   CYS   CB     C   13   31.882    0.400   .   1   .   .   .   A   14   CYS   CB     .   25229   1
      126   .   1   1   14   14   CYS   N      N   15   118.266   0.400   .   1   .   .   .   A   14   CYS   N      .   25229   1
      127   .   1   1   15   15   GLN   H      H   1    7.789     0.020   .   1   .   .   .   A   15   GLN   H      .   25229   1
      128   .   1   1   15   15   GLN   HA     H   1    4.010     0.020   .   1   .   .   .   A   15   GLN   HA     .   25229   1
      129   .   1   1   15   15   GLN   HB2    H   1    2.258     0.020   .   2   .   .   .   A   15   GLN   HB2    .   25229   1
      130   .   1   1   15   15   GLN   HB3    H   1    2.376     0.020   .   2   .   .   .   A   15   GLN   HB3    .   25229   1
      131   .   1   1   15   15   GLN   HG2    H   1    2.182     0.020   .   1   .   .   .   A   15   GLN   HG2    .   25229   1
      132   .   1   1   15   15   GLN   HG3    H   1    2.182     0.020   .   1   .   .   .   A   15   GLN   HG3    .   25229   1
      133   .   1   1   15   15   GLN   CA     C   13   58.046    0.400   .   1   .   .   .   A   15   GLN   CA     .   25229   1
      134   .   1   1   15   15   GLN   CB     C   13   25.591    0.400   .   1   .   .   .   A   15   GLN   CB     .   25229   1
      135   .   1   1   15   15   GLN   CG     C   13   34.231    0.400   .   1   .   .   .   A   15   GLN   CG     .   25229   1
      136   .   1   1   15   15   GLN   N      N   15   115.660   0.400   .   1   .   .   .   A   15   GLN   N      .   25229   1
      137   .   1   1   16   16   LYS   H      H   1    8.222     0.020   .   1   .   .   .   A   16   LYS   H      .   25229   1
      138   .   1   1   16   16   LYS   HA     H   1    3.975     0.020   .   1   .   .   .   A   16   LYS   HA     .   25229   1
      139   .   1   1   16   16   LYS   HB2    H   1    1.146     0.020   .   2   .   .   .   A   16   LYS   HB2    .   25229   1
      140   .   1   1   16   16   LYS   HB3    H   1    1.797     0.020   .   2   .   .   .   A   16   LYS   HB3    .   25229   1
      141   .   1   1   16   16   LYS   HG2    H   1    0.921     0.020   .   2   .   .   .   A   16   LYS   HG2    .   25229   1
      142   .   1   1   16   16   LYS   HG3    H   1    1.118     0.020   .   2   .   .   .   A   16   LYS   HG3    .   25229   1
      143   .   1   1   16   16   LYS   HD2    H   1    1.200     0.020   .   2   .   .   .   A   16   LYS   HD2    .   25229   1
      144   .   1   1   16   16   LYS   HD3    H   1    1.412     0.020   .   2   .   .   .   A   16   LYS   HD3    .   25229   1
      145   .   1   1   16   16   LYS   HE2    H   1    2.853     0.020   .   1   .   .   .   A   16   LYS   HE2    .   25229   1
      146   .   1   1   16   16   LYS   HE3    H   1    2.853     0.020   .   1   .   .   .   A   16   LYS   HE3    .   25229   1
      147   .   1   1   16   16   LYS   CA     C   13   57.336    0.400   .   1   .   .   .   A   16   LYS   CA     .   25229   1
      148   .   1   1   16   16   LYS   CB     C   13   33.252    0.400   .   1   .   .   .   A   16   LYS   CB     .   25229   1
      149   .   1   1   16   16   LYS   CG     C   13   24.692    0.400   .   1   .   .   .   A   16   LYS   CG     .   25229   1
      150   .   1   1   16   16   LYS   CD     C   13   29.084    0.400   .   1   .   .   .   A   16   LYS   CD     .   25229   1
      151   .   1   1   16   16   LYS   CE     C   13   41.790    0.400   .   1   .   .   .   A   16   LYS   CE     .   25229   1
      152   .   1   1   16   16   LYS   N      N   15   122.955   0.400   .   1   .   .   .   A   16   LYS   N      .   25229   1
      153   .   1   1   17   17   GLU   H      H   1    8.367     0.020   .   1   .   .   .   A   17   GLU   H      .   25229   1
      154   .   1   1   17   17   GLU   HA     H   1    4.075     0.020   .   1   .   .   .   A   17   GLU   HA     .   25229   1
      155   .   1   1   17   17   GLU   HB2    H   1    1.856     0.020   .   1   .   .   .   A   17   GLU   HB2    .   25229   1
      156   .   1   1   17   17   GLU   HB3    H   1    1.856     0.020   .   1   .   .   .   A   17   GLU   HB3    .   25229   1
      157   .   1   1   17   17   GLU   HG2    H   1    2.034     0.020   .   2   .   .   .   A   17   GLU   HG2    .   25229   1
      158   .   1   1   17   17   GLU   HG3    H   1    2.267     0.020   .   2   .   .   .   A   17   GLU   HG3    .   25229   1
      159   .   1   1   17   17   GLU   CA     C   13   55.676    0.400   .   1   .   .   .   A   17   GLU   CA     .   25229   1
      160   .   1   1   17   17   GLU   CB     C   13   30.687    0.400   .   1   .   .   .   A   17   GLU   CB     .   25229   1
      161   .   1   1   17   17   GLU   CG     C   13   36.658    0.400   .   1   .   .   .   A   17   GLU   CG     .   25229   1
      162   .   1   1   17   17   GLU   N      N   15   123.884   0.400   .   1   .   .   .   A   17   GLU   N      .   25229   1
      163   .   1   1   18   18   PHE   H      H   1    8.177     0.020   .   1   .   .   .   A   18   PHE   H      .   25229   1
      164   .   1   1   18   18   PHE   HA     H   1    4.714     0.020   .   1   .   .   .   A   18   PHE   HA     .   25229   1
      165   .   1   1   18   18   PHE   HB2    H   1    2.710     0.020   .   2   .   .   .   A   18   PHE   HB2    .   25229   1
      166   .   1   1   18   18   PHE   HB3    H   1    2.912     0.020   .   2   .   .   .   A   18   PHE   HB3    .   25229   1
      167   .   1   1   18   18   PHE   HD1    H   1    6.896     0.020   .   1   .   .   .   A   18   PHE   HD1    .   25229   1
      168   .   1   1   18   18   PHE   HD2    H   1    6.896     0.020   .   1   .   .   .   A   18   PHE   HD2    .   25229   1
      169   .   1   1   18   18   PHE   HE1    H   1    6.800     0.020   .   1   .   .   .   A   18   PHE   HE1    .   25229   1
      170   .   1   1   18   18   PHE   HE2    H   1    6.800     0.020   .   1   .   .   .   A   18   PHE   HE2    .   25229   1
      171   .   1   1   18   18   PHE   HZ     H   1    6.929     0.020   .   1   .   .   .   A   18   PHE   HZ     .   25229   1
      172   .   1   1   18   18   PHE   CA     C   13   55.622    0.400   .   1   .   .   .   A   18   PHE   CA     .   25229   1
      173   .   1   1   18   18   PHE   CB     C   13   38.844    0.400   .   1   .   .   .   A   18   PHE   CB     .   25229   1
      174   .   1   1   18   18   PHE   CD1    C   13   131.094   0.400   .   1   .   .   .   A   18   PHE   CD1    .   25229   1
      175   .   1   1   18   18   PHE   CD2    C   13   131.094   0.400   .   1   .   .   .   A   18   PHE   CD2    .   25229   1
      176   .   1   1   18   18   PHE   CE1    C   13   130.443   0.400   .   1   .   .   .   A   18   PHE   CE1    .   25229   1
      177   .   1   1   18   18   PHE   CE2    C   13   130.443   0.400   .   1   .   .   .   A   18   PHE   CE2    .   25229   1
      178   .   1   1   18   18   PHE   CZ     C   13   128.174   0.400   .   1   .   .   .   A   18   PHE   CZ     .   25229   1
      179   .   1   1   18   18   PHE   N      N   15   123.877   0.400   .   1   .   .   .   A   18   PHE   N      .   25229   1
      180   .   1   1   19   19   ALA   H      H   1    8.433     0.020   .   1   .   .   .   A   19   ALA   H      .   25229   1
      181   .   1   1   19   19   ALA   HA     H   1    4.554     0.020   .   1   .   .   .   A   19   ALA   HA     .   25229   1
      182   .   1   1   19   19   ALA   HB1    H   1    1.509     0.020   .   1   .   .   .   A   19   ALA   HB1    .   25229   1
      183   .   1   1   19   19   ALA   HB2    H   1    1.509     0.020   .   1   .   .   .   A   19   ALA   HB2    .   25229   1
      184   .   1   1   19   19   ALA   HB3    H   1    1.509     0.020   .   1   .   .   .   A   19   ALA   HB3    .   25229   1
      185   .   1   1   19   19   ALA   CA     C   13   50.993    0.400   .   1   .   .   .   A   19   ALA   CA     .   25229   1
      186   .   1   1   19   19   ALA   CB     C   13   17.558    0.400   .   1   .   .   .   A   19   ALA   CB     .   25229   1
      187   .   1   1   19   19   ALA   N      N   15   128.636   0.400   .   1   .   .   .   A   19   ALA   N      .   25229   1
      188   .   1   1   20   20   PRO   HA     H   1    4.355     0.020   .   1   .   .   .   A   20   PRO   HA     .   25229   1
      189   .   1   1   20   20   PRO   HB2    H   1    1.949     0.020   .   2   .   .   .   A   20   PRO   HB2    .   25229   1
      190   .   1   1   20   20   PRO   HB3    H   1    2.386     0.020   .   2   .   .   .   A   20   PRO   HB3    .   25229   1
      191   .   1   1   20   20   PRO   HG2    H   1    2.063     0.020   .   2   .   .   .   A   20   PRO   HG2    .   25229   1
      192   .   1   1   20   20   PRO   HG3    H   1    2.105     0.020   .   2   .   .   .   A   20   PRO   HG3    .   25229   1
      193   .   1   1   20   20   PRO   HD2    H   1    3.823     0.020   .   2   .   .   .   A   20   PRO   HD2    .   25229   1
      194   .   1   1   20   20   PRO   HD3    H   1    3.885     0.020   .   2   .   .   .   A   20   PRO   HD3    .   25229   1
      195   .   1   1   20   20   PRO   CA     C   13   64.969    0.400   .   1   .   .   .   A   20   PRO   CA     .   25229   1
      196   .   1   1   20   20   PRO   CB     C   13   31.916    0.400   .   1   .   .   .   A   20   PRO   CB     .   25229   1
      197   .   1   1   20   20   PRO   CG     C   13   27.579    0.400   .   1   .   .   .   A   20   PRO   CG     .   25229   1
      198   .   1   1   20   20   PRO   CD     C   13   50.514    0.400   .   1   .   .   .   A   20   PRO   CD     .   25229   1
      199   .   1   1   21   21   ARG   H      H   1    7.660     0.020   .   1   .   .   .   A   21   ARG   H      .   25229   1
      200   .   1   1   21   21   ARG   HA     H   1    4.207     0.020   .   1   .   .   .   A   21   ARG   HA     .   25229   1
      201   .   1   1   21   21   ARG   HB2    H   1    1.880     0.020   .   1   .   .   .   A   21   ARG   HB2    .   25229   1
      202   .   1   1   21   21   ARG   HB3    H   1    1.880     0.020   .   1   .   .   .   A   21   ARG   HB3    .   25229   1
      203   .   1   1   21   21   ARG   HG2    H   1    1.496     0.020   .   2   .   .   .   A   21   ARG   HG2    .   25229   1
      204   .   1   1   21   21   ARG   HG3    H   1    1.552     0.020   .   2   .   .   .   A   21   ARG   HG3    .   25229   1
      205   .   1   1   21   21   ARG   HD2    H   1    3.182     0.020   .   1   .   .   .   A   21   ARG   HD2    .   25229   1
      206   .   1   1   21   21   ARG   HD3    H   1    3.182     0.020   .   1   .   .   .   A   21   ARG   HD3    .   25229   1
      207   .   1   1   21   21   ARG   CA     C   13   56.305    0.400   .   1   .   .   .   A   21   ARG   CA     .   25229   1
      208   .   1   1   21   21   ARG   CB     C   13   29.246    0.400   .   1   .   .   .   A   21   ARG   CB     .   25229   1
      209   .   1   1   21   21   ARG   CG     C   13   27.080    0.400   .   1   .   .   .   A   21   ARG   CG     .   25229   1
      210   .   1   1   21   21   ARG   CD     C   13   43.115    0.400   .   1   .   .   .   A   21   ARG   CD     .   25229   1
      211   .   1   1   21   21   ARG   N      N   15   111.683   0.400   .   1   .   .   .   A   21   ARG   N      .   25229   1
      212   .   1   1   22   22   LEU   H      H   1    7.556     0.020   .   1   .   .   .   A   22   LEU   H      .   25229   1
      213   .   1   1   22   22   LEU   HA     H   1    4.393     0.020   .   1   .   .   .   A   22   LEU   HA     .   25229   1
      214   .   1   1   22   22   LEU   HB2    H   1    1.552     0.020   .   2   .   .   .   A   22   LEU   HB2    .   25229   1
      215   .   1   1   22   22   LEU   HB3    H   1    1.748     0.020   .   2   .   .   .   A   22   LEU   HB3    .   25229   1
      216   .   1   1   22   22   LEU   HG     H   1    1.866     0.020   .   1   .   .   .   A   22   LEU   HG     .   25229   1
      217   .   1   1   22   22   LEU   HD11   H   1    0.853     0.020   .   2   .   .   .   A   22   LEU   HD11   .   25229   1
      218   .   1   1   22   22   LEU   HD12   H   1    0.853     0.020   .   2   .   .   .   A   22   LEU   HD12   .   25229   1
      219   .   1   1   22   22   LEU   HD13   H   1    0.853     0.020   .   2   .   .   .   A   22   LEU   HD13   .   25229   1
      220   .   1   1   22   22   LEU   HD21   H   1    1.024     0.020   .   2   .   .   .   A   22   LEU   HD21   .   25229   1
      221   .   1   1   22   22   LEU   HD22   H   1    1.024     0.020   .   2   .   .   .   A   22   LEU   HD22   .   25229   1
      222   .   1   1   22   22   LEU   HD23   H   1    1.024     0.020   .   2   .   .   .   A   22   LEU   HD23   .   25229   1
      223   .   1   1   22   22   LEU   CA     C   13   55.717    0.400   .   1   .   .   .   A   22   LEU   CA     .   25229   1
      224   .   1   1   22   22   LEU   CB     C   13   41.483    0.400   .   1   .   .   .   A   22   LEU   CB     .   25229   1
      225   .   1   1   22   22   LEU   CG     C   13   27.659    0.400   .   1   .   .   .   A   22   LEU   CG     .   25229   1
      226   .   1   1   22   22   LEU   CD1    C   13   23.153    0.400   .   1   .   .   .   A   22   LEU   CD1    .   25229   1
      227   .   1   1   22   22   LEU   CD2    C   13   25.686    0.400   .   1   .   .   .   A   22   LEU   CD2    .   25229   1
      228   .   1   1   22   22   LEU   N      N   15   121.417   0.400   .   1   .   .   .   A   22   LEU   N      .   25229   1
      229   .   1   1   23   23   THR   H      H   1    9.120     0.020   .   1   .   .   .   A   23   THR   H      .   25229   1
      230   .   1   1   23   23   THR   HA     H   1    4.455     0.020   .   1   .   .   .   A   23   THR   HA     .   25229   1
      231   .   1   1   23   23   THR   HB     H   1    4.652     0.020   .   1   .   .   .   A   23   THR   HB     .   25229   1
      232   .   1   1   23   23   THR   HG21   H   1    1.382     0.020   .   1   .   .   .   A   23   THR   HG21   .   25229   1
      233   .   1   1   23   23   THR   HG22   H   1    1.382     0.020   .   1   .   .   .   A   23   THR   HG22   .   25229   1
      234   .   1   1   23   23   THR   HG23   H   1    1.382     0.020   .   1   .   .   .   A   23   THR   HG23   .   25229   1
      235   .   1   1   23   23   THR   CA     C   13   60.644    0.400   .   1   .   .   .   A   23   THR   CA     .   25229   1
      236   .   1   1   23   23   THR   CB     C   13   71.479    0.400   .   1   .   .   .   A   23   THR   CB     .   25229   1
      237   .   1   1   23   23   THR   CG2    C   13   21.635    0.400   .   1   .   .   .   A   23   THR   CG2    .   25229   1
      238   .   1   1   23   23   THR   N      N   15   114.867   0.400   .   1   .   .   .   A   23   THR   N      .   25229   1
      239   .   1   1   24   24   GLN   H      H   1    8.869     0.020   .   1   .   .   .   A   24   GLN   H      .   25229   1
      240   .   1   1   24   24   GLN   HA     H   1    3.726     0.020   .   1   .   .   .   A   24   GLN   HA     .   25229   1
      241   .   1   1   24   24   GLN   HB2    H   1    1.961     0.020   .   2   .   .   .   A   24   GLN   HB2    .   25229   1
      242   .   1   1   24   24   GLN   HB3    H   1    2.180     0.020   .   2   .   .   .   A   24   GLN   HB3    .   25229   1
      243   .   1   1   24   24   GLN   HG2    H   1    2.409     0.020   .   1   .   .   .   A   24   GLN   HG2    .   25229   1
      244   .   1   1   24   24   GLN   HG3    H   1    2.409     0.020   .   1   .   .   .   A   24   GLN   HG3    .   25229   1
      245   .   1   1   24   24   GLN   CA     C   13   58.336    0.400   .   1   .   .   .   A   24   GLN   CA     .   25229   1
      246   .   1   1   24   24   GLN   CB     C   13   28.002    0.400   .   1   .   .   .   A   24   GLN   CB     .   25229   1
      247   .   1   1   24   24   GLN   CG     C   13   33.174    0.400   .   1   .   .   .   A   24   GLN   CG     .   25229   1
      248   .   1   1   24   24   GLN   N      N   15   120.923   0.400   .   1   .   .   .   A   24   GLN   N      .   25229   1
      249   .   1   1   25   25   LEU   H      H   1    7.761     0.020   .   1   .   .   .   A   25   LEU   H      .   25229   1
      250   .   1   1   25   25   LEU   HA     H   1    4.189     0.020   .   1   .   .   .   A   25   LEU   HA     .   25229   1
      251   .   1   1   25   25   LEU   HB2    H   1    1.592     0.020   .   1   .   .   .   A   25   LEU   HB2    .   25229   1
      252   .   1   1   25   25   LEU   HB3    H   1    1.592     0.020   .   1   .   .   .   A   25   LEU   HB3    .   25229   1
      253   .   1   1   25   25   LEU   HG     H   1    1.640     0.020   .   1   .   .   .   A   25   LEU   HG     .   25229   1
      254   .   1   1   25   25   LEU   HD11   H   1    0.895     0.020   .   2   .   .   .   A   25   LEU   HD11   .   25229   1
      255   .   1   1   25   25   LEU   HD12   H   1    0.895     0.020   .   2   .   .   .   A   25   LEU   HD12   .   25229   1
      256   .   1   1   25   25   LEU   HD13   H   1    0.895     0.020   .   2   .   .   .   A   25   LEU   HD13   .   25229   1
      257   .   1   1   25   25   LEU   HD21   H   1    0.900     0.020   .   2   .   .   .   A   25   LEU   HD21   .   25229   1
      258   .   1   1   25   25   LEU   HD22   H   1    0.900     0.020   .   2   .   .   .   A   25   LEU   HD22   .   25229   1
      259   .   1   1   25   25   LEU   HD23   H   1    0.900     0.020   .   2   .   .   .   A   25   LEU   HD23   .   25229   1
      260   .   1   1   25   25   LEU   CA     C   13   57.972    0.400   .   1   .   .   .   A   25   LEU   CA     .   25229   1
      261   .   1   1   25   25   LEU   CB     C   13   41.647    0.400   .   1   .   .   .   A   25   LEU   CB     .   25229   1
      262   .   1   1   25   25   LEU   CG     C   13   27.125    0.400   .   1   .   .   .   A   25   LEU   CG     .   25229   1
      263   .   1   1   25   25   LEU   CD1    C   13   24.298    0.400   .   1   .   .   .   A   25   LEU   CD1    .   25229   1
      264   .   1   1   25   25   LEU   CD2    C   13   24.318    0.400   .   1   .   .   .   A   25   LEU   CD2    .   25229   1
      265   .   1   1   25   25   LEU   N      N   15   118.215   0.400   .   1   .   .   .   A   25   LEU   N      .   25229   1
      266   .   1   1   26   26   ASP   H      H   1    7.539     0.020   .   1   .   .   .   A   26   ASP   H      .   25229   1
      267   .   1   1   26   26   ASP   HA     H   1    4.347     0.020   .   1   .   .   .   A   26   ASP   HA     .   25229   1
      268   .   1   1   26   26   ASP   HB2    H   1    2.613     0.020   .   2   .   .   .   A   26   ASP   HB2    .   25229   1
      269   .   1   1   26   26   ASP   HB3    H   1    2.980     0.020   .   2   .   .   .   A   26   ASP   HB3    .   25229   1
      270   .   1   1   26   26   ASP   CA     C   13   57.532    0.400   .   1   .   .   .   A   26   ASP   CA     .   25229   1
      271   .   1   1   26   26   ASP   CB     C   13   41.641    0.400   .   1   .   .   .   A   26   ASP   CB     .   25229   1
      272   .   1   1   26   26   ASP   N      N   15   120.786   0.400   .   1   .   .   .   A   26   ASP   N      .   25229   1
      273   .   1   1   27   27   VAL   H      H   1    7.805     0.020   .   1   .   .   .   A   27   VAL   H      .   25229   1
      274   .   1   1   27   27   VAL   HA     H   1    2.900     0.020   .   1   .   .   .   A   27   VAL   HA     .   25229   1
      275   .   1   1   27   27   VAL   HB     H   1    1.900     0.020   .   1   .   .   .   A   27   VAL   HB     .   25229   1
      276   .   1   1   27   27   VAL   HG11   H   1    0.240     0.020   .   2   .   .   .   A   27   VAL   HG11   .   25229   1
      277   .   1   1   27   27   VAL   HG12   H   1    0.240     0.020   .   2   .   .   .   A   27   VAL   HG12   .   25229   1
      278   .   1   1   27   27   VAL   HG13   H   1    0.240     0.020   .   2   .   .   .   A   27   VAL   HG13   .   25229   1
      279   .   1   1   27   27   VAL   HG21   H   1    0.449     0.020   .   2   .   .   .   A   27   VAL   HG21   .   25229   1
      280   .   1   1   27   27   VAL   HG22   H   1    0.449     0.020   .   2   .   .   .   A   27   VAL   HG22   .   25229   1
      281   .   1   1   27   27   VAL   HG23   H   1    0.449     0.020   .   2   .   .   .   A   27   VAL   HG23   .   25229   1
      282   .   1   1   27   27   VAL   CA     C   13   66.764    0.400   .   1   .   .   .   A   27   VAL   CA     .   25229   1
      283   .   1   1   27   27   VAL   CB     C   13   31.342    0.400   .   1   .   .   .   A   27   VAL   CB     .   25229   1
      284   .   1   1   27   27   VAL   CG1    C   13   21.822    0.400   .   1   .   .   .   A   27   VAL   CG1    .   25229   1
      285   .   1   1   27   27   VAL   CG2    C   13   20.585    0.400   .   1   .   .   .   A   27   VAL   CG2    .   25229   1
      286   .   1   1   27   27   VAL   N      N   15   123.699   0.400   .   1   .   .   .   A   27   VAL   N      .   25229   1
      287   .   1   1   28   28   ASP   H      H   1    8.895     0.020   .   1   .   .   .   A   28   ASP   H      .   25229   1
      288   .   1   1   28   28   ASP   HA     H   1    4.357     0.020   .   1   .   .   .   A   28   ASP   HA     .   25229   1
      289   .   1   1   28   28   ASP   HB2    H   1    2.621     0.020   .   2   .   .   .   A   28   ASP   HB2    .   25229   1
      290   .   1   1   28   28   ASP   HB3    H   1    2.785     0.020   .   2   .   .   .   A   28   ASP   HB3    .   25229   1
      291   .   1   1   28   28   ASP   CA     C   13   57.678    0.400   .   1   .   .   .   A   28   ASP   CA     .   25229   1
      292   .   1   1   28   28   ASP   CB     C   13   39.900    0.400   .   1   .   .   .   A   28   ASP   CB     .   25229   1
      293   .   1   1   28   28   ASP   N      N   15   120.628   0.400   .   1   .   .   .   A   28   ASP   N      .   25229   1
      294   .   1   1   29   29   SER   H      H   1    8.284     0.020   .   1   .   .   .   A   29   SER   H      .   25229   1
      295   .   1   1   29   29   SER   HA     H   1    4.287     0.020   .   1   .   .   .   A   29   SER   HA     .   25229   1
      296   .   1   1   29   29   SER   HB2    H   1    4.003     0.020   .   2   .   .   .   A   29   SER   HB2    .   25229   1
      297   .   1   1   29   29   SER   HB3    H   1    4.066     0.020   .   2   .   .   .   A   29   SER   HB3    .   25229   1
      298   .   1   1   29   29   SER   CA     C   13   61.454    0.400   .   1   .   .   .   A   29   SER   CA     .   25229   1
      299   .   1   1   29   29   SER   CB     C   13   62.751    0.400   .   1   .   .   .   A   29   SER   CB     .   25229   1
      300   .   1   1   29   29   SER   N      N   15   115.786   0.400   .   1   .   .   .   A   29   SER   N      .   25229   1
      301   .   1   1   30   30   HIS   H      H   1    7.831     0.020   .   1   .   .   .   A   30   HIS   H      .   25229   1
      302   .   1   1   30   30   HIS   HA     H   1    4.252     0.020   .   1   .   .   .   A   30   HIS   HA     .   25229   1
      303   .   1   1   30   30   HIS   HB2    H   1    3.383     0.020   .   2   .   .   .   A   30   HIS   HB2    .   25229   1
      304   .   1   1   30   30   HIS   HB3    H   1    3.637     0.020   .   2   .   .   .   A   30   HIS   HB3    .   25229   1
      305   .   1   1   30   30   HIS   HD2    H   1    7.248     0.020   .   1   .   .   .   A   30   HIS   HD2    .   25229   1
      306   .   1   1   30   30   HIS   HE1    H   1    7.943     0.020   .   1   .   .   .   A   30   HIS   HE1    .   25229   1
      307   .   1   1   30   30   HIS   CA     C   13   60.442    0.400   .   1   .   .   .   A   30   HIS   CA     .   25229   1
      308   .   1   1   30   30   HIS   CB     C   13   27.757    0.400   .   1   .   .   .   A   30   HIS   CB     .   25229   1
      309   .   1   1   30   30   HIS   CD2    C   13   127.932   0.400   .   1   .   .   .   A   30   HIS   CD2    .   25229   1
      310   .   1   1   30   30   HIS   CE1    C   13   139.448   0.400   .   1   .   .   .   A   30   HIS   CE1    .   25229   1
      311   .   1   1   30   30   HIS   N      N   15   121.227   0.400   .   1   .   .   .   A   30   HIS   N      .   25229   1
      312   .   1   1   31   31   LEU   H      H   1    8.845     0.020   .   1   .   .   .   A   31   LEU   H      .   25229   1
      313   .   1   1   31   31   LEU   HA     H   1    3.996     0.020   .   1   .   .   .   A   31   LEU   HA     .   25229   1
      314   .   1   1   31   31   LEU   HB2    H   1    1.621     0.020   .   2   .   .   .   A   31   LEU   HB2    .   25229   1
      315   .   1   1   31   31   LEU   HB3    H   1    1.997     0.020   .   2   .   .   .   A   31   LEU   HB3    .   25229   1
      316   .   1   1   31   31   LEU   HG     H   1    2.127     0.020   .   1   .   .   .   A   31   LEU   HG     .   25229   1
      317   .   1   1   31   31   LEU   HD11   H   1    1.038     0.020   .   2   .   .   .   A   31   LEU   HD11   .   25229   1
      318   .   1   1   31   31   LEU   HD12   H   1    1.038     0.020   .   2   .   .   .   A   31   LEU   HD12   .   25229   1
      319   .   1   1   31   31   LEU   HD13   H   1    1.038     0.020   .   2   .   .   .   A   31   LEU   HD13   .   25229   1
      320   .   1   1   31   31   LEU   HD21   H   1    1.273     0.020   .   2   .   .   .   A   31   LEU   HD21   .   25229   1
      321   .   1   1   31   31   LEU   HD22   H   1    1.273     0.020   .   2   .   .   .   A   31   LEU   HD22   .   25229   1
      322   .   1   1   31   31   LEU   HD23   H   1    1.273     0.020   .   2   .   .   .   A   31   LEU   HD23   .   25229   1
      323   .   1   1   31   31   LEU   CA     C   13   58.555    0.400   .   1   .   .   .   A   31   LEU   CA     .   25229   1
      324   .   1   1   31   31   LEU   CB     C   13   41.548    0.400   .   1   .   .   .   A   31   LEU   CB     .   25229   1
      325   .   1   1   31   31   LEU   CG     C   13   27.462    0.400   .   1   .   .   .   A   31   LEU   CG     .   25229   1
      326   .   1   1   31   31   LEU   CD1    C   13   26.082    0.400   .   1   .   .   .   A   31   LEU   CD1    .   25229   1
      327   .   1   1   31   31   LEU   CD2    C   13   24.325    0.400   .   1   .   .   .   A   31   LEU   CD2    .   25229   1
      328   .   1   1   31   31   LEU   N      N   15   119.378   0.400   .   1   .   .   .   A   31   LEU   N      .   25229   1
      329   .   1   1   32   32   ALA   H      H   1    7.889     0.020   .   1   .   .   .   A   32   ALA   H      .   25229   1
      330   .   1   1   32   32   ALA   HA     H   1    4.104     0.020   .   1   .   .   .   A   32   ALA   HA     .   25229   1
      331   .   1   1   32   32   ALA   HB1    H   1    1.505     0.020   .   1   .   .   .   A   32   ALA   HB1    .   25229   1
      332   .   1   1   32   32   ALA   HB2    H   1    1.505     0.020   .   1   .   .   .   A   32   ALA   HB2    .   25229   1
      333   .   1   1   32   32   ALA   HB3    H   1    1.505     0.020   .   1   .   .   .   A   32   ALA   HB3    .   25229   1
      334   .   1   1   32   32   ALA   CA     C   13   54.722    0.400   .   1   .   .   .   A   32   ALA   CA     .   25229   1
      335   .   1   1   32   32   ALA   CB     C   13   18.258    0.400   .   1   .   .   .   A   32   ALA   CB     .   25229   1
      336   .   1   1   32   32   ALA   N      N   15   118.429   0.400   .   1   .   .   .   A   32   ALA   N      .   25229   1
      337   .   1   1   33   33   GLN   H      H   1    7.391     0.020   .   1   .   .   .   A   33   GLN   H      .   25229   1
      338   .   1   1   33   33   GLN   HA     H   1    4.204     0.020   .   1   .   .   .   A   33   GLN   HA     .   25229   1
      339   .   1   1   33   33   GLN   HB2    H   1    2.102     0.020   .   1   .   .   .   A   33   GLN   HB2    .   25229   1
      340   .   1   1   33   33   GLN   HB3    H   1    2.102     0.020   .   1   .   .   .   A   33   GLN   HB3    .   25229   1
      341   .   1   1   33   33   GLN   HG2    H   1    2.337     0.020   .   2   .   .   .   A   33   GLN   HG2    .   25229   1
      342   .   1   1   33   33   GLN   HG3    H   1    2.452     0.020   .   2   .   .   .   A   33   GLN   HG3    .   25229   1
      343   .   1   1   33   33   GLN   CA     C   13   57.351    0.400   .   1   .   .   .   A   33   GLN   CA     .   25229   1
      344   .   1   1   33   33   GLN   CB     C   13   29.017    0.400   .   1   .   .   .   A   33   GLN   CB     .   25229   1
      345   .   1   1   33   33   GLN   CG     C   13   33.753    0.400   .   1   .   .   .   A   33   GLN   CG     .   25229   1
      346   .   1   1   33   33   GLN   N      N   15   117.277   0.400   .   1   .   .   .   A   33   GLN   N      .   25229   1
      347   .   1   1   34   34   CYS   H      H   1    8.167     0.020   .   1   .   .   .   A   34   CYS   H      .   25229   1
      348   .   1   1   34   34   CYS   HA     H   1    3.901     0.020   .   1   .   .   .   A   34   CYS   HA     .   25229   1
      349   .   1   1   34   34   CYS   HB2    H   1    2.431     0.020   .   2   .   .   .   A   34   CYS   HB2    .   25229   1
      350   .   1   1   34   34   CYS   HB3    H   1    2.826     0.020   .   2   .   .   .   A   34   CYS   HB3    .   25229   1
      351   .   1   1   34   34   CYS   CA     C   13   64.265    0.400   .   1   .   .   .   A   34   CYS   CA     .   25229   1
      352   .   1   1   34   34   CYS   CB     C   13   28.501    0.400   .   1   .   .   .   A   34   CYS   CB     .   25229   1
      353   .   1   1   34   34   CYS   N      N   15   122.933   0.400   .   1   .   .   .   A   34   CYS   N      .   25229   1
      354   .   1   1   35   35   LEU   H      H   1    8.225     0.020   .   1   .   .   .   A   35   LEU   H      .   25229   1
      355   .   1   1   35   35   LEU   HA     H   1    4.207     0.020   .   1   .   .   .   A   35   LEU   HA     .   25229   1
      356   .   1   1   35   35   LEU   HB2    H   1    1.694     0.020   .   1   .   .   .   A   35   LEU   HB2    .   25229   1
      357   .   1   1   35   35   LEU   HB3    H   1    1.694     0.020   .   1   .   .   .   A   35   LEU   HB3    .   25229   1
      358   .   1   1   35   35   LEU   HG     H   1    1.661     0.020   .   1   .   .   .   A   35   LEU   HG     .   25229   1
      359   .   1   1   35   35   LEU   HD11   H   1    0.920     0.020   .   2   .   .   .   A   35   LEU   HD11   .   25229   1
      360   .   1   1   35   35   LEU   HD12   H   1    0.920     0.020   .   2   .   .   .   A   35   LEU   HD12   .   25229   1
      361   .   1   1   35   35   LEU   HD13   H   1    0.920     0.020   .   2   .   .   .   A   35   LEU   HD13   .   25229   1
      362   .   1   1   35   35   LEU   HD21   H   1    0.923     0.020   .   2   .   .   .   A   35   LEU   HD21   .   25229   1
      363   .   1   1   35   35   LEU   HD22   H   1    0.923     0.020   .   2   .   .   .   A   35   LEU   HD22   .   25229   1
      364   .   1   1   35   35   LEU   HD23   H   1    0.923     0.020   .   2   .   .   .   A   35   LEU   HD23   .   25229   1
      365   .   1   1   35   35   LEU   CA     C   13   56.760    0.400   .   1   .   .   .   A   35   LEU   CA     .   25229   1
      366   .   1   1   35   35   LEU   CB     C   13   42.071    0.400   .   1   .   .   .   A   35   LEU   CB     .   25229   1
      367   .   1   1   35   35   LEU   CG     C   13   27.152    0.400   .   1   .   .   .   A   35   LEU   CG     .   25229   1
      368   .   1   1   35   35   LEU   CD1    C   13   24.457    0.400   .   1   .   .   .   A   35   LEU   CD1    .   25229   1
      369   .   1   1   35   35   LEU   CD2    C   13   24.424    0.400   .   1   .   .   .   A   35   LEU   CD2    .   25229   1
      370   .   1   1   35   35   LEU   N      N   15   120.457   0.400   .   1   .   .   .   A   35   LEU   N      .   25229   1
      371   .   1   1   36   36   ALA   H      H   1    7.641     0.020   .   1   .   .   .   A   36   ALA   H      .   25229   1
      372   .   1   1   36   36   ALA   HA     H   1    4.200     0.020   .   1   .   .   .   A   36   ALA   HA     .   25229   1
      373   .   1   1   36   36   ALA   HB1    H   1    1.467     0.020   .   1   .   .   .   A   36   ALA   HB1    .   25229   1
      374   .   1   1   36   36   ALA   HB2    H   1    1.467     0.020   .   1   .   .   .   A   36   ALA   HB2    .   25229   1
      375   .   1   1   36   36   ALA   HB3    H   1    1.467     0.020   .   1   .   .   .   A   36   ALA   HB3    .   25229   1
      376   .   1   1   36   36   ALA   CA     C   13   53.767    0.400   .   1   .   .   .   A   36   ALA   CA     .   25229   1
      377   .   1   1   36   36   ALA   CB     C   13   18.605    0.400   .   1   .   .   .   A   36   ALA   CB     .   25229   1
      378   .   1   1   36   36   ALA   N      N   15   122.336   0.400   .   1   .   .   .   A   36   ALA   N      .   25229   1
      379   .   1   1   37   37   GLU   H      H   1    8.057     0.020   .   1   .   .   .   A   37   GLU   H      .   25229   1
      380   .   1   1   37   37   GLU   HA     H   1    4.272     0.020   .   1   .   .   .   A   37   GLU   HA     .   25229   1
      381   .   1   1   37   37   GLU   HB2    H   1    2.033     0.020   .   2   .   .   .   A   37   GLU   HB2    .   25229   1
      382   .   1   1   37   37   GLU   HB3    H   1    2.139     0.020   .   2   .   .   .   A   37   GLU   HB3    .   25229   1
      383   .   1   1   37   37   GLU   HG2    H   1    2.288     0.020   .   2   .   .   .   A   37   GLU   HG2    .   25229   1
      384   .   1   1   37   37   GLU   HG3    H   1    2.412     0.020   .   2   .   .   .   A   37   GLU   HG3    .   25229   1
      385   .   1   1   37   37   GLU   CA     C   13   56.975    0.400   .   1   .   .   .   A   37   GLU   CA     .   25229   1
      386   .   1   1   37   37   GLU   CB     C   13   30.326    0.400   .   1   .   .   .   A   37   GLU   CB     .   25229   1
      387   .   1   1   37   37   GLU   CG     C   13   36.396    0.400   .   1   .   .   .   A   37   GLU   CG     .   25229   1
      388   .   1   1   37   37   GLU   N      N   15   117.925   0.400   .   1   .   .   .   A   37   GLU   N      .   25229   1
      389   .   1   1   38   38   SER   H      H   1    8.077     0.020   .   1   .   .   .   A   38   SER   H      .   25229   1
      390   .   1   1   38   38   SER   HA     H   1    4.538     0.020   .   1   .   .   .   A   38   SER   HA     .   25229   1
      391   .   1   1   38   38   SER   HB2    H   1    3.974     0.020   .   1   .   .   .   A   38   SER   HB2    .   25229   1
      392   .   1   1   38   38   SER   HB3    H   1    3.974     0.020   .   1   .   .   .   A   38   SER   HB3    .   25229   1
      393   .   1   1   38   38   SER   CA     C   13   58.600    0.400   .   1   .   .   .   A   38   SER   CA     .   25229   1
      394   .   1   1   38   38   SER   CB     C   13   63.892    0.400   .   1   .   .   .   A   38   SER   CB     .   25229   1
      395   .   1   1   38   38   SER   N      N   15   115.753   0.400   .   1   .   .   .   A   38   SER   N      .   25229   1
      396   .   1   1   39   39   THR   H      H   1    8.136     0.020   .   1   .   .   .   A   39   THR   H      .   25229   1
      397   .   1   1   39   39   THR   HA     H   1    4.428     0.020   .   1   .   .   .   A   39   THR   HA     .   25229   1
      398   .   1   1   39   39   THR   HB     H   1    4.320     0.020   .   1   .   .   .   A   39   THR   HB     .   25229   1
      399   .   1   1   39   39   THR   HG21   H   1    1.232     0.020   .   1   .   .   .   A   39   THR   HG21   .   25229   1
      400   .   1   1   39   39   THR   HG22   H   1    1.232     0.020   .   1   .   .   .   A   39   THR   HG22   .   25229   1
      401   .   1   1   39   39   THR   HG23   H   1    1.232     0.020   .   1   .   .   .   A   39   THR   HG23   .   25229   1
      402   .   1   1   39   39   THR   CA     C   13   61.816    0.400   .   1   .   .   .   A   39   THR   CA     .   25229   1
      403   .   1   1   39   39   THR   CB     C   13   69.710    0.400   .   1   .   .   .   A   39   THR   CB     .   25229   1
      404   .   1   1   39   39   THR   CG2    C   13   21.469    0.400   .   1   .   .   .   A   39   THR   CG2    .   25229   1
      405   .   1   1   39   39   THR   N      N   15   115.550   0.400   .   1   .   .   .   A   39   THR   N      .   25229   1
      406   .   1   1   40   40   GLU   H      H   1    8.265     0.020   .   1   .   .   .   A   40   GLU   H      .   25229   1
      407   .   1   1   40   40   GLU   HA     H   1    4.317     0.020   .   1   .   .   .   A   40   GLU   HA     .   25229   1
      408   .   1   1   40   40   GLU   HB2    H   1    1.929     0.020   .   2   .   .   .   A   40   GLU   HB2    .   25229   1
      409   .   1   1   40   40   GLU   HB3    H   1    2.061     0.020   .   2   .   .   .   A   40   GLU   HB3    .   25229   1
      410   .   1   1   40   40   GLU   HG2    H   1    2.272     0.020   .   1   .   .   .   A   40   GLU   HG2    .   25229   1
      411   .   1   1   40   40   GLU   HG3    H   1    2.272     0.020   .   1   .   .   .   A   40   GLU   HG3    .   25229   1
      412   .   1   1   40   40   GLU   CA     C   13   56.435    0.400   .   1   .   .   .   A   40   GLU   CA     .   25229   1
      413   .   1   1   40   40   GLU   CB     C   13   30.509    0.400   .   1   .   .   .   A   40   GLU   CB     .   25229   1
      414   .   1   1   40   40   GLU   CG     C   13   36.129    0.400   .   1   .   .   .   A   40   GLU   CG     .   25229   1
      415   .   1   1   40   40   GLU   N      N   15   122.776   0.400   .   1   .   .   .   A   40   GLU   N      .   25229   1
      416   .   1   1   41   41   ASP   H      H   1    8.390     0.020   .   1   .   .   .   A   41   ASP   H      .   25229   1
      417   .   1   1   41   41   ASP   HA     H   1    4.587     0.020   .   1   .   .   .   A   41   ASP   HA     .   25229   1
      418   .   1   1   41   41   ASP   HB2    H   1    2.551     0.020   .   2   .   .   .   A   41   ASP   HB2    .   25229   1
      419   .   1   1   41   41   ASP   HB3    H   1    2.664     0.020   .   2   .   .   .   A   41   ASP   HB3    .   25229   1
      420   .   1   1   41   41   ASP   CA     C   13   54.232    0.400   .   1   .   .   .   A   41   ASP   CA     .   25229   1
      421   .   1   1   41   41   ASP   CB     C   13   41.015    0.400   .   1   .   .   .   A   41   ASP   CB     .   25229   1
      422   .   1   1   41   41   ASP   N      N   15   121.819   0.400   .   1   .   .   .   A   41   ASP   N      .   25229   1
      423   .   1   1   42   42   VAL   H      H   1    7.996     0.020   .   1   .   .   .   A   42   VAL   H      .   25229   1
      424   .   1   1   42   42   VAL   HA     H   1    3.991     0.020   .   1   .   .   .   A   42   VAL   HA     .   25229   1
      425   .   1   1   42   42   VAL   HB     H   1    1.876     0.020   .   1   .   .   .   A   42   VAL   HB     .   25229   1
      426   .   1   1   42   42   VAL   HG11   H   1    0.651     0.020   .   2   .   .   .   A   42   VAL   HG11   .   25229   1
      427   .   1   1   42   42   VAL   HG12   H   1    0.651     0.020   .   2   .   .   .   A   42   VAL   HG12   .   25229   1
      428   .   1   1   42   42   VAL   HG13   H   1    0.651     0.020   .   2   .   .   .   A   42   VAL   HG13   .   25229   1
      429   .   1   1   42   42   VAL   HG21   H   1    0.795     0.020   .   2   .   .   .   A   42   VAL   HG21   .   25229   1
      430   .   1   1   42   42   VAL   HG22   H   1    0.795     0.020   .   2   .   .   .   A   42   VAL   HG22   .   25229   1
      431   .   1   1   42   42   VAL   HG23   H   1    0.795     0.020   .   2   .   .   .   A   42   VAL   HG23   .   25229   1
      432   .   1   1   42   42   VAL   CA     C   13   62.013    0.400   .   1   .   .   .   A   42   VAL   CA     .   25229   1
      433   .   1   1   42   42   VAL   CB     C   13   32.773    0.400   .   1   .   .   .   A   42   VAL   CB     .   25229   1
      434   .   1   1   42   42   VAL   CG1    C   13   20.914    0.400   .   1   .   .   .   A   42   VAL   CG1    .   25229   1
      435   .   1   1   42   42   VAL   CG2    C   13   20.159    0.400   .   1   .   .   .   A   42   VAL   CG2    .   25229   1
      436   .   1   1   42   42   VAL   N      N   15   120.623   0.400   .   1   .   .   .   A   42   VAL   N      .   25229   1
      437   .   1   1   43   43   THR   H      H   1    7.915     0.020   .   1   .   .   .   A   43   THR   H      .   25229   1
      438   .   1   1   43   43   THR   HA     H   1    4.307     0.020   .   1   .   .   .   A   43   THR   HA     .   25229   1
      439   .   1   1   43   43   THR   HB     H   1    4.164     0.020   .   1   .   .   .   A   43   THR   HB     .   25229   1
      440   .   1   1   43   43   THR   HG21   H   1    1.121     0.020   .   1   .   .   .   A   43   THR   HG21   .   25229   1
      441   .   1   1   43   43   THR   HG22   H   1    1.121     0.020   .   1   .   .   .   A   43   THR   HG22   .   25229   1
      442   .   1   1   43   43   THR   HG23   H   1    1.121     0.020   .   1   .   .   .   A   43   THR   HG23   .   25229   1
      443   .   1   1   43   43   THR   CA     C   13   61.280    0.400   .   1   .   .   .   A   43   THR   CA     .   25229   1
      444   .   1   1   43   43   THR   CB     C   13   69.858    0.400   .   1   .   .   .   A   43   THR   CB     .   25229   1
      445   .   1   1   43   43   THR   CG2    C   13   21.293    0.400   .   1   .   .   .   A   43   THR   CG2    .   25229   1
      446   .   1   1   43   43   THR   N      N   15   117.870   0.400   .   1   .   .   .   A   43   THR   N      .   25229   1
      447   .   1   1   44   44   TRP   H      H   1    7.620     0.020   .   1   .   .   .   A   44   TRP   H      .   25229   1
      448   .   1   1   44   44   TRP   HA     H   1    4.543     0.020   .   1   .   .   .   A   44   TRP   HA     .   25229   1
      449   .   1   1   44   44   TRP   HB2    H   1    3.171     0.020   .   2   .   .   .   A   44   TRP   HB2    .   25229   1
      450   .   1   1   44   44   TRP   HB3    H   1    3.327     0.020   .   2   .   .   .   A   44   TRP   HB3    .   25229   1
      451   .   1   1   44   44   TRP   HD1    H   1    7.202     0.020   .   1   .   .   .   A   44   TRP   HD1    .   25229   1
      452   .   1   1   44   44   TRP   HE1    H   1    10.080    0.020   .   1   .   .   .   A   44   TRP   HE1    .   25229   1
      453   .   1   1   44   44   TRP   HE3    H   1    7.670     0.020   .   1   .   .   .   A   44   TRP   HE3    .   25229   1
      454   .   1   1   44   44   TRP   HZ2    H   1    7.489     0.020   .   1   .   .   .   A   44   TRP   HZ2    .   25229   1
      455   .   1   1   44   44   TRP   HZ3    H   1    7.153     0.020   .   1   .   .   .   A   44   TRP   HZ3    .   25229   1
      456   .   1   1   44   44   TRP   HH2    H   1    7.215     0.020   .   1   .   .   .   A   44   TRP   HH2    .   25229   1
      457   .   1   1   44   44   TRP   CA     C   13   58.413    0.400   .   1   .   .   .   A   44   TRP   CA     .   25229   1
      458   .   1   1   44   44   TRP   CB     C   13   30.215    0.400   .   1   .   .   .   A   44   TRP   CB     .   25229   1
      459   .   1   1   44   44   TRP   CD1    C   13   126.822   0.400   .   1   .   .   .   A   44   TRP   CD1    .   25229   1
      460   .   1   1   44   44   TRP   CE3    C   13   121.226   0.400   .   1   .   .   .   A   44   TRP   CE3    .   25229   1
      461   .   1   1   44   44   TRP   CZ2    C   13   114.771   0.400   .   1   .   .   .   A   44   TRP   CZ2    .   25229   1
      462   .   1   1   44   44   TRP   CZ3    C   13   121.767   0.400   .   1   .   .   .   A   44   TRP   CZ3    .   25229   1
      463   .   1   1   44   44   TRP   CH2    C   13   124.389   0.400   .   1   .   .   .   A   44   TRP   CH2    .   25229   1
      464   .   1   1   44   44   TRP   N      N   15   128.689   0.400   .   1   .   .   .   A   44   TRP   N      .   25229   1
      465   .   1   1   44   44   TRP   NE1    N   15   129.000   0.400   .   1   .   .   .   A   44   TRP   NE1    .   25229   1
   stop_
save_