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                      25913
   _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'   .   .   .   25913   1
      2    '2D 1H-13C HSQC'   .   .   .   25913   1
      3    '2D 1H-1H TOCSY'   .   .   .   25913   1
      4    '2D 1H-1H NOESY'   .   .   .   25913   1
      5    '2D 1H-1H NOESY'   .   .   .   25913   1
      6    '3D CBCA(CO)NH'    .   .   .   25913   1
      7    '3D HNCACB'        .   .   .   25913   1
      8    '3D HNCO'          .   .   .   25913   1
      9    '3D HN(CA)CO'      .   .   .   25913   1
      10   '3D HCCH-TOCSY'    .   .   .   25913   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   1    1    GLY   HA3    H   1    3.901     0.000   .   2   .   .   .   A   -1   GLY   HA3    .   25913   1
      2     .   1   1   1    1    GLY   CA     C   13   43.501    0.000   .   1   .   .   .   A   -1   GLY   CA     .   25913   1
      3     .   1   1   2    2    SER   HA     H   1    4.525     0.000   .   1   .   .   .   A   0    SER   HA     .   25913   1
      4     .   1   1   2    2    SER   HB2    H   1    3.914     0.000   .   2   .   .   .   A   0    SER   HB2    .   25913   1
      5     .   1   1   2    2    SER   HB3    H   1    3.870     0.002   .   2   .   .   .   A   0    SER   HB3    .   25913   1
      6     .   1   1   2    2    SER   C      C   13   174.776   0.001   .   1   .   .   .   A   0    SER   C      .   25913   1
      7     .   1   1   2    2    SER   CA     C   13   58.364    0.038   .   1   .   .   .   A   0    SER   CA     .   25913   1
      8     .   1   1   2    2    SER   CB     C   13   64.049    0.040   .   1   .   .   .   A   0    SER   CB     .   25913   1
      9     .   1   1   3    3    MET   H      H   1    8.592     0.013   .   1   .   .   .   A   1    MET   H      .   25913   1
      10    .   1   1   3    3    MET   HA     H   1    4.486     0.007   .   1   .   .   .   A   1    MET   HA     .   25913   1
      11    .   1   1   3    3    MET   HB2    H   1    2.114     0.000   .   2   .   .   .   A   1    MET   HB2    .   25913   1
      12    .   1   1   3    3    MET   HB3    H   1    2.014     0.000   .   2   .   .   .   A   1    MET   HB3    .   25913   1
      13    .   1   1   3    3    MET   HG2    H   1    2.626     0.000   .   2   .   .   .   A   1    MET   HG2    .   25913   1
      14    .   1   1   3    3    MET   HG3    H   1    2.556     0.000   .   2   .   .   .   A   1    MET   HG3    .   25913   1
      15    .   1   1   3    3    MET   HE1    H   1    2.097     0.000   .   1   .   .   .   A   1    MET   HE1    .   25913   1
      16    .   1   1   3    3    MET   HE2    H   1    2.097     0.000   .   1   .   .   .   A   1    MET   HE2    .   25913   1
      17    .   1   1   3    3    MET   HE3    H   1    2.097     0.000   .   1   .   .   .   A   1    MET   HE3    .   25913   1
      18    .   1   1   3    3    MET   C      C   13   176.177   0.012   .   1   .   .   .   A   1    MET   C      .   25913   1
      19    .   1   1   3    3    MET   CA     C   13   55.804    0.023   .   1   .   .   .   A   1    MET   CA     .   25913   1
      20    .   1   1   3    3    MET   CB     C   13   32.941    0.016   .   1   .   .   .   A   1    MET   CB     .   25913   1
      21    .   1   1   3    3    MET   CG     C   13   32.088    0.004   .   1   .   .   .   A   1    MET   CG     .   25913   1
      22    .   1   1   3    3    MET   CE     C   13   16.973    0.000   .   1   .   .   .   A   1    MET   CE     .   25913   1
      23    .   1   1   3    3    MET   N      N   15   123.174   0.090   .   1   .   .   .   A   1    MET   N      .   25913   1
      24    .   1   1   4    4    ALA   H      H   1    8.337     0.003   .   1   .   .   .   A   2    ALA   H      .   25913   1
      25    .   1   1   4    4    ALA   HA     H   1    4.293     0.007   .   1   .   .   .   A   2    ALA   HA     .   25913   1
      26    .   1   1   4    4    ALA   HB1    H   1    1.380     0.006   .   1   .   .   .   A   2    ALA   HB1    .   25913   1
      27    .   1   1   4    4    ALA   HB2    H   1    1.380     0.006   .   1   .   .   .   A   2    ALA   HB2    .   25913   1
      28    .   1   1   4    4    ALA   HB3    H   1    1.380     0.006   .   1   .   .   .   A   2    ALA   HB3    .   25913   1
      29    .   1   1   4    4    ALA   C      C   13   177.812   0.010   .   1   .   .   .   A   2    ALA   C      .   25913   1
      30    .   1   1   4    4    ALA   CA     C   13   52.809    0.074   .   1   .   .   .   A   2    ALA   CA     .   25913   1
      31    .   1   1   4    4    ALA   CB     C   13   19.224    0.097   .   1   .   .   .   A   2    ALA   CB     .   25913   1
      32    .   1   1   4    4    ALA   N      N   15   125.785   0.028   .   1   .   .   .   A   2    ALA   N      .   25913   1
      33    .   1   1   5    5    GLU   H      H   1    8.274     0.004   .   1   .   .   .   A   3    GLU   H      .   25913   1
      34    .   1   1   5    5    GLU   HA     H   1    4.256     0.006   .   1   .   .   .   A   3    GLU   HA     .   25913   1
      35    .   1   1   5    5    GLU   HB2    H   1    2.047     0.002   .   2   .   .   .   A   3    GLU   HB2    .   25913   1
      36    .   1   1   5    5    GLU   HB3    H   1    1.946     0.007   .   2   .   .   .   A   3    GLU   HB3    .   25913   1
      37    .   1   1   5    5    GLU   HG2    H   1    2.271     0.001   .   2   .   .   .   A   3    GLU   HG2    .   25913   1
      38    .   1   1   5    5    GLU   C      C   13   176.186   0.007   .   1   .   .   .   A   3    GLU   C      .   25913   1
      39    .   1   1   5    5    GLU   CA     C   13   56.377    0.022   .   1   .   .   .   A   3    GLU   CA     .   25913   1
      40    .   1   1   5    5    GLU   CB     C   13   30.549    0.035   .   1   .   .   .   A   3    GLU   CB     .   25913   1
      41    .   1   1   5    5    GLU   CG     C   13   36.311    0.000   .   1   .   .   .   A   3    GLU   CG     .   25913   1
      42    .   1   1   5    5    GLU   N      N   15   120.731   0.025   .   1   .   .   .   A   3    GLU   N      .   25913   1
      43    .   1   1   6    6    ALA   H      H   1    8.271     0.007   .   1   .   .   .   A   4    ALA   H      .   25913   1
      44    .   1   1   6    6    ALA   HA     H   1    4.345     0.009   .   1   .   .   .   A   4    ALA   HA     .   25913   1
      45    .   1   1   6    6    ALA   HB1    H   1    1.392     0.010   .   1   .   .   .   A   4    ALA   HB1    .   25913   1
      46    .   1   1   6    6    ALA   HB2    H   1    1.392     0.010   .   1   .   .   .   A   4    ALA   HB2    .   25913   1
      47    .   1   1   6    6    ALA   HB3    H   1    1.392     0.010   .   1   .   .   .   A   4    ALA   HB3    .   25913   1
      48    .   1   1   6    6    ALA   C      C   13   177.530   0.007   .   1   .   .   .   A   4    ALA   C      .   25913   1
      49    .   1   1   6    6    ALA   CA     C   13   52.413    0.078   .   1   .   .   .   A   4    ALA   CA     .   25913   1
      50    .   1   1   6    6    ALA   CB     C   13   19.466    0.050   .   1   .   .   .   A   4    ALA   CB     .   25913   1
      51    .   1   1   6    6    ALA   N      N   15   125.716   0.033   .   1   .   .   .   A   4    ALA   N      .   25913   1
      52    .   1   1   7    7    SER   H      H   1    8.259     0.004   .   1   .   .   .   A   5    SER   H      .   25913   1
      53    .   1   1   7    7    SER   HA     H   1    4.724     0.013   .   1   .   .   .   A   5    SER   HA     .   25913   1
      54    .   1   1   7    7    SER   HB2    H   1    3.840     0.005   .   2   .   .   .   A   5    SER   HB2    .   25913   1
      55    .   1   1   7    7    SER   HB3    H   1    3.800     0.009   .   2   .   .   .   A   5    SER   HB3    .   25913   1
      56    .   1   1   7    7    SER   C      C   13   172.661   0.000   .   1   .   .   .   A   5    SER   C      .   25913   1
      57    .   1   1   7    7    SER   CA     C   13   56.354    0.019   .   1   .   .   .   A   5    SER   CA     .   25913   1
      58    .   1   1   7    7    SER   CB     C   13   63.442    0.071   .   1   .   .   .   A   5    SER   CB     .   25913   1
      59    .   1   1   7    7    SER   N      N   15   117.161   0.043   .   1   .   .   .   A   5    SER   N      .   25913   1
      60    .   1   1   8    8    PRO   HA     H   1    4.414     0.003   .   1   .   .   .   A   6    PRO   HA     .   25913   1
      61    .   1   1   8    8    PRO   HB2    H   1    2.232     0.007   .   2   .   .   .   A   6    PRO   HB2    .   25913   1
      62    .   1   1   8    8    PRO   HB3    H   1    1.810     0.012   .   2   .   .   .   A   6    PRO   HB3    .   25913   1
      63    .   1   1   8    8    PRO   HG2    H   1    1.969     0.008   .   2   .   .   .   A   6    PRO   HG2    .   25913   1
      64    .   1   1   8    8    PRO   HD2    H   1    3.783     0.005   .   2   .   .   .   A   6    PRO   HD2    .   25913   1
      65    .   1   1   8    8    PRO   HD3    H   1    3.687     0.006   .   2   .   .   .   A   6    PRO   HD3    .   25913   1
      66    .   1   1   8    8    PRO   C      C   13   176.523   0.000   .   1   .   .   .   A   6    PRO   C      .   25913   1
      67    .   1   1   8    8    PRO   CA     C   13   63.385    0.064   .   1   .   .   .   A   6    PRO   CA     .   25913   1
      68    .   1   1   8    8    PRO   CB     C   13   32.187    0.092   .   1   .   .   .   A   6    PRO   CB     .   25913   1
      69    .   1   1   8    8    PRO   CG     C   13   26.988    0.179   .   1   .   .   .   A   6    PRO   CG     .   25913   1
      70    .   1   1   8    8    PRO   CD     C   13   50.754    0.028   .   1   .   .   .   A   6    PRO   CD     .   25913   1
      71    .   1   1   9    9    HIS   H      H   1    8.489     0.004   .   1   .   .   .   A   7    HIS   H      .   25913   1
      72    .   1   1   9    9    HIS   HA     H   1    4.980     0.009   .   1   .   .   .   A   7    HIS   HA     .   25913   1
      73    .   1   1   9    9    HIS   HB2    H   1    3.220     0.003   .   2   .   .   .   A   7    HIS   HB2    .   25913   1
      74    .   1   1   9    9    HIS   HB3    H   1    3.150     0.006   .   2   .   .   .   A   7    HIS   HB3    .   25913   1
      75    .   1   1   9    9    HIS   HD2    H   1    7.268     0.007   .   1   .   .   .   A   7    HIS   HD2    .   25913   1
      76    .   1   1   9    9    HIS   C      C   13   172.577   0.000   .   1   .   .   .   A   7    HIS   C      .   25913   1
      77    .   1   1   9    9    HIS   CA     C   13   53.492    0.010   .   1   .   .   .   A   7    HIS   CA     .   25913   1
      78    .   1   1   9    9    HIS   CB     C   13   29.133    0.059   .   1   .   .   .   A   7    HIS   CB     .   25913   1
      79    .   1   1   9    9    HIS   CD2    C   13   120.387   0.068   .   1   .   .   .   A   7    HIS   CD2    .   25913   1
      80    .   1   1   9    9    HIS   N      N   15   120.170   0.045   .   1   .   .   .   A   7    HIS   N      .   25913   1
      81    .   1   1   10   10   PRO   HA     H   1    4.546     0.009   .   1   .   .   .   A   8    PRO   HA     .   25913   1
      82    .   1   1   10   10   PRO   HB2    H   1    2.338     0.021   .   2   .   .   .   A   8    PRO   HB2    .   25913   1
      83    .   1   1   10   10   PRO   HB3    H   1    2.032     0.003   .   2   .   .   .   A   8    PRO   HB3    .   25913   1
      84    .   1   1   10   10   PRO   HG2    H   1    2.024     0.009   .   2   .   .   .   A   8    PRO   HG2    .   25913   1
      85    .   1   1   10   10   PRO   HD2    H   1    3.710     0.004   .   2   .   .   .   A   8    PRO   HD2    .   25913   1
      86    .   1   1   10   10   PRO   HD3    H   1    3.596     0.017   .   2   .   .   .   A   8    PRO   HD3    .   25913   1
      87    .   1   1   10   10   PRO   C      C   13   177.382   0.000   .   1   .   .   .   A   8    PRO   C      .   25913   1
      88    .   1   1   10   10   PRO   CA     C   13   63.443    0.186   .   1   .   .   .   A   8    PRO   CA     .   25913   1
      89    .   1   1   10   10   PRO   CB     C   13   32.377    0.036   .   1   .   .   .   A   8    PRO   CB     .   25913   1
      90    .   1   1   10   10   PRO   CG     C   13   27.340    0.000   .   1   .   .   .   A   8    PRO   CG     .   25913   1
      91    .   1   1   10   10   PRO   CD     C   13   50.627    0.022   .   1   .   .   .   A   8    PRO   CD     .   25913   1
      92    .   1   1   11   11   GLY   H      H   1    8.635     0.009   .   1   .   .   .   A   9    GLY   H      .   25913   1
      93    .   1   1   11   11   GLY   HA2    H   1    4.049     0.006   .   2   .   .   .   A   9    GLY   HA2    .   25913   1
      94    .   1   1   11   11   GLY   HA3    H   1    3.955     0.007   .   2   .   .   .   A   9    GLY   HA3    .   25913   1
      95    .   1   1   11   11   GLY   C      C   13   172.859   0.006   .   1   .   .   .   A   9    GLY   C      .   25913   1
      96    .   1   1   11   11   GLY   CA     C   13   45.211    0.065   .   1   .   .   .   A   9    GLY   CA     .   25913   1
      97    .   1   1   11   11   GLY   N      N   15   110.263   0.174   .   1   .   .   .   A   9    GLY   N      .   25913   1
      98    .   1   1   12   12   ARG   H      H   1    8.229     0.005   .   1   .   .   .   A   10   ARG   H      .   25913   1
      99    .   1   1   12   12   ARG   HA     H   1    4.782     0.027   .   1   .   .   .   A   10   ARG   HA     .   25913   1
      100   .   1   1   12   12   ARG   HB2    H   1    1.822     0.005   .   2   .   .   .   A   10   ARG   HB2    .   25913   1
      101   .   1   1   12   12   ARG   HB3    H   1    1.641     0.005   .   2   .   .   .   A   10   ARG   HB3    .   25913   1
      102   .   1   1   12   12   ARG   HG2    H   1    1.680     0.009   .   2   .   .   .   A   10   ARG   HG2    .   25913   1
      103   .   1   1   12   12   ARG   HG3    H   1    1.618     0.011   .   2   .   .   .   A   10   ARG   HG3    .   25913   1
      104   .   1   1   12   12   ARG   HD2    H   1    3.226     0.004   .   2   .   .   .   A   10   ARG   HD2    .   25913   1
      105   .   1   1   12   12   ARG   HD3    H   1    3.150     0.006   .   2   .   .   .   A   10   ARG   HD3    .   25913   1
      106   .   1   1   12   12   ARG   HE     H   1    7.550     0.003   .   1   .   .   .   A   10   ARG   HE     .   25913   1
      107   .   1   1   12   12   ARG   C      C   13   175.125   0.002   .   1   .   .   .   A   10   ARG   C      .   25913   1
      108   .   1   1   12   12   ARG   CA     C   13   55.356    0.086   .   1   .   .   .   A   10   ARG   CA     .   25913   1
      109   .   1   1   12   12   ARG   CB     C   13   32.982    0.008   .   1   .   .   .   A   10   ARG   CB     .   25913   1
      110   .   1   1   12   12   ARG   CG     C   13   27.183    0.032   .   1   .   .   .   A   10   ARG   CG     .   25913   1
      111   .   1   1   12   12   ARG   CD     C   13   43.757    0.075   .   1   .   .   .   A   10   ARG   CD     .   25913   1
      112   .   1   1   12   12   ARG   N      N   15   121.025   0.056   .   1   .   .   .   A   10   ARG   N      .   25913   1
      113   .   1   1   12   12   ARG   NE     N   15   85.379    0.026   .   1   .   .   .   A   10   ARG   NE     .   25913   1
      114   .   1   1   13   13   TYR   H      H   1    8.692     0.004   .   1   .   .   .   A   11   TYR   H      .   25913   1
      115   .   1   1   13   13   TYR   HA     H   1    5.328     0.006   .   1   .   .   .   A   11   TYR   HA     .   25913   1
      116   .   1   1   13   13   TYR   HB2    H   1    2.937     0.006   .   2   .   .   .   A   11   TYR   HB2    .   25913   1
      117   .   1   1   13   13   TYR   HB3    H   1    2.569     0.008   .   2   .   .   .   A   11   TYR   HB3    .   25913   1
      118   .   1   1   13   13   TYR   HD1    H   1    6.946     0.007   .   3   .   .   .   A   11   TYR   HD1    .   25913   1
      119   .   1   1   13   13   TYR   HD2    H   1    6.946     0.007   .   3   .   .   .   A   11   TYR   HD2    .   25913   1
      120   .   1   1   13   13   TYR   HE1    H   1    6.845     0.004   .   3   .   .   .   A   11   TYR   HE1    .   25913   1
      121   .   1   1   13   13   TYR   HE2    H   1    6.845     0.004   .   3   .   .   .   A   11   TYR   HE2    .   25913   1
      122   .   1   1   13   13   TYR   C      C   13   174.229   0.004   .   1   .   .   .   A   11   TYR   C      .   25913   1
      123   .   1   1   13   13   TYR   CA     C   13   57.049    0.145   .   1   .   .   .   A   11   TYR   CA     .   25913   1
      124   .   1   1   13   13   TYR   CB     C   13   43.051    0.055   .   1   .   .   .   A   11   TYR   CB     .   25913   1
      125   .   1   1   13   13   TYR   CD1    C   13   133.503   0.000   .   3   .   .   .   A   11   TYR   CD1    .   25913   1
      126   .   1   1   13   13   TYR   CD2    C   13   133.503   0.000   .   3   .   .   .   A   11   TYR   CD2    .   25913   1
      127   .   1   1   13   13   TYR   CE1    C   13   117.984   0.064   .   3   .   .   .   A   11   TYR   CE1    .   25913   1
      128   .   1   1   13   13   TYR   CE2    C   13   117.984   0.064   .   3   .   .   .   A   11   TYR   CE2    .   25913   1
      129   .   1   1   13   13   TYR   N      N   15   121.353   0.029   .   1   .   .   .   A   11   TYR   N      .   25913   1
      130   .   1   1   14   14   PHE   H      H   1    9.415     0.011   .   1   .   .   .   A   12   PHE   H      .   25913   1
      131   .   1   1   14   14   PHE   HA     H   1    4.884     0.010   .   1   .   .   .   A   12   PHE   HA     .   25913   1
      132   .   1   1   14   14   PHE   HB2    H   1    2.766     0.017   .   2   .   .   .   A   12   PHE   HB2    .   25913   1
      133   .   1   1   14   14   PHE   HD1    H   1    6.513     0.016   .   3   .   .   .   A   12   PHE   HD1    .   25913   1
      134   .   1   1   14   14   PHE   HD2    H   1    6.513     0.016   .   3   .   .   .   A   12   PHE   HD2    .   25913   1
      135   .   1   1   14   14   PHE   HE1    H   1    7.042     0.006   .   3   .   .   .   A   12   PHE   HE1    .   25913   1
      136   .   1   1   14   14   PHE   HE2    H   1    7.042     0.006   .   3   .   .   .   A   12   PHE   HE2    .   25913   1
      137   .   1   1   14   14   PHE   HZ     H   1    7.042     0.001   .   1   .   .   .   A   12   PHE   HZ     .   25913   1
      138   .   1   1   14   14   PHE   C      C   13   174.224   0.000   .   1   .   .   .   A   12   PHE   C      .   25913   1
      139   .   1   1   14   14   PHE   CA     C   13   57.019    0.046   .   1   .   .   .   A   12   PHE   CA     .   25913   1
      140   .   1   1   14   14   PHE   CB     C   13   44.078    0.026   .   1   .   .   .   A   12   PHE   CB     .   25913   1
      141   .   1   1   14   14   PHE   CD1    C   13   131.648   0.012   .   3   .   .   .   A   12   PHE   CD1    .   25913   1
      142   .   1   1   14   14   PHE   CD2    C   13   131.648   0.012   .   3   .   .   .   A   12   PHE   CD2    .   25913   1
      143   .   1   1   14   14   PHE   CE1    C   13   131.381   0.257   .   3   .   .   .   A   12   PHE   CE1    .   25913   1
      144   .   1   1   14   14   PHE   CE2    C   13   131.381   0.257   .   3   .   .   .   A   12   PHE   CE2    .   25913   1
      145   .   1   1   14   14   PHE   CZ     C   13   129.742   0.000   .   1   .   .   .   A   12   PHE   CZ     .   25913   1
      146   .   1   1   14   14   PHE   N      N   15   122.456   0.054   .   1   .   .   .   A   12   PHE   N      .   25913   1
      147   .   1   1   15   15   CYS   H      H   1    7.942     0.004   .   1   .   .   .   A   13   CYS   H      .   25913   1
      148   .   1   1   15   15   CYS   HA     H   1    4.653     0.008   .   1   .   .   .   A   13   CYS   HA     .   25913   1
      149   .   1   1   15   15   CYS   HB2    H   1    2.803     0.007   .   2   .   .   .   A   13   CYS   HB2    .   25913   1
      150   .   1   1   15   15   CYS   HB3    H   1    2.728     0.009   .   2   .   .   .   A   13   CYS   HB3    .   25913   1
      151   .   1   1   15   15   CYS   C      C   13   176.686   0.004   .   1   .   .   .   A   13   CYS   C      .   25913   1
      152   .   1   1   15   15   CYS   CA     C   13   58.328    0.039   .   1   .   .   .   A   13   CYS   CA     .   25913   1
      153   .   1   1   15   15   CYS   CB     C   13   31.220    0.003   .   1   .   .   .   A   13   CYS   CB     .   25913   1
      154   .   1   1   15   15   CYS   N      N   15   128.438   0.043   .   1   .   .   .   A   13   CYS   N      .   25913   1
      155   .   1   1   16   16   HIS   H      H   1    8.971     0.004   .   1   .   .   .   A   14   HIS   H      .   25913   1
      156   .   1   1   16   16   HIS   HA     H   1    4.323     0.014   .   1   .   .   .   A   14   HIS   HA     .   25913   1
      157   .   1   1   16   16   HIS   HB2    H   1    3.050     0.012   .   2   .   .   .   A   14   HIS   HB2    .   25913   1
      158   .   1   1   16   16   HIS   HB3    H   1    2.757     0.007   .   2   .   .   .   A   14   HIS   HB3    .   25913   1
      159   .   1   1   16   16   HIS   HD2    H   1    6.925     0.025   .   1   .   .   .   A   14   HIS   HD2    .   25913   1
      160   .   1   1   16   16   HIS   C      C   13   175.452   0.003   .   1   .   .   .   A   14   HIS   C      .   25913   1
      161   .   1   1   16   16   HIS   CA     C   13   58.736    0.035   .   1   .   .   .   A   14   HIS   CA     .   25913   1
      162   .   1   1   16   16   HIS   CB     C   13   29.191    0.076   .   1   .   .   .   A   14   HIS   CB     .   25913   1
      163   .   1   1   16   16   HIS   CD2    C   13   118.927   0.031   .   1   .   .   .   A   14   HIS   CD2    .   25913   1
      164   .   1   1   16   16   HIS   N      N   15   126.467   0.052   .   1   .   .   .   A   14   HIS   N      .   25913   1
      165   .   1   1   17   17   CYS   H      H   1    9.195     0.005   .   1   .   .   .   A   15   CYS   H      .   25913   1
      166   .   1   1   17   17   CYS   HA     H   1    4.442     0.009   .   1   .   .   .   A   15   CYS   HA     .   25913   1
      167   .   1   1   17   17   CYS   HB2    H   1    3.282     0.004   .   2   .   .   .   A   15   CYS   HB2    .   25913   1
      168   .   1   1   17   17   CYS   HB3    H   1    3.218     0.008   .   2   .   .   .   A   15   CYS   HB3    .   25913   1
      169   .   1   1   17   17   CYS   C      C   13   176.939   0.001   .   1   .   .   .   A   15   CYS   C      .   25913   1
      170   .   1   1   17   17   CYS   CA     C   13   61.704    0.029   .   1   .   .   .   A   15   CYS   CA     .   25913   1
      171   .   1   1   17   17   CYS   CB     C   13   28.341    0.032   .   1   .   .   .   A   15   CYS   CB     .   25913   1
      172   .   1   1   17   17   CYS   N      N   15   123.882   0.026   .   1   .   .   .   A   15   CYS   N      .   25913   1
      173   .   1   1   18   18   CYS   H      H   1    9.794     0.006   .   1   .   .   .   A   16   CYS   H      .   25913   1
      174   .   1   1   18   18   CYS   HA     H   1    3.998     0.008   .   1   .   .   .   A   16   CYS   HA     .   25913   1
      175   .   1   1   18   18   CYS   HB2    H   1    2.877     0.011   .   2   .   .   .   A   16   CYS   HB2    .   25913   1
      176   .   1   1   18   18   CYS   HB3    H   1    2.625     0.007   .   2   .   .   .   A   16   CYS   HB3    .   25913   1
      177   .   1   1   18   18   CYS   C      C   13   175.557   0.023   .   1   .   .   .   A   16   CYS   C      .   25913   1
      178   .   1   1   18   18   CYS   CB     C   13   30.961    0.006   .   1   .   .   .   A   16   CYS   CB     .   25913   1
      179   .   1   1   18   18   CYS   N      N   15   124.898   0.050   .   1   .   .   .   A   16   CYS   N      .   25913   1
      180   .   1   1   19   19   SER   H      H   1    7.950     0.005   .   1   .   .   .   A   17   SER   H      .   25913   1
      181   .   1   1   19   19   SER   HA     H   1    3.755     0.004   .   1   .   .   .   A   17   SER   HA     .   25913   1
      182   .   1   1   19   19   SER   HB2    H   1    4.208     0.013   .   2   .   .   .   A   17   SER   HB2    .   25913   1
      183   .   1   1   19   19   SER   HB3    H   1    3.890     0.005   .   2   .   .   .   A   17   SER   HB3    .   25913   1
      184   .   1   1   19   19   SER   C      C   13   173.790   0.000   .   1   .   .   .   A   17   SER   C      .   25913   1
      185   .   1   1   19   19   SER   CA     C   13   58.868    0.058   .   1   .   .   .   A   17   SER   CA     .   25913   1
      186   .   1   1   19   19   SER   CB     C   13   61.703    0.025   .   1   .   .   .   A   17   SER   CB     .   25913   1
      187   .   1   1   19   19   SER   N      N   15   114.055   0.051   .   1   .   .   .   A   17   SER   N      .   25913   1
      188   .   1   1   20   20   VAL   H      H   1    6.438     0.015   .   1   .   .   .   A   18   VAL   H      .   25913   1
      189   .   1   1   20   20   VAL   HA     H   1    4.458     0.004   .   1   .   .   .   A   18   VAL   HA     .   25913   1
      190   .   1   1   20   20   VAL   HB     H   1    2.047     0.006   .   1   .   .   .   A   18   VAL   HB     .   25913   1
      191   .   1   1   20   20   VAL   HG11   H   1    0.783     0.012   .   2   .   .   .   A   18   VAL   HG11   .   25913   1
      192   .   1   1   20   20   VAL   HG12   H   1    0.783     0.012   .   2   .   .   .   A   18   VAL   HG12   .   25913   1
      193   .   1   1   20   20   VAL   HG13   H   1    0.783     0.012   .   2   .   .   .   A   18   VAL   HG13   .   25913   1
      194   .   1   1   20   20   VAL   HG21   H   1    0.691     0.016   .   2   .   .   .   A   18   VAL   HG21   .   25913   1
      195   .   1   1   20   20   VAL   HG22   H   1    0.691     0.016   .   2   .   .   .   A   18   VAL   HG22   .   25913   1
      196   .   1   1   20   20   VAL   HG23   H   1    0.691     0.016   .   2   .   .   .   A   18   VAL   HG23   .   25913   1
      197   .   1   1   20   20   VAL   C      C   13   173.765   0.004   .   1   .   .   .   A   18   VAL   C      .   25913   1
      198   .   1   1   20   20   VAL   CA     C   13   59.032    0.064   .   1   .   .   .   A   18   VAL   CA     .   25913   1
      199   .   1   1   20   20   VAL   CB     C   13   36.667    0.059   .   1   .   .   .   A   18   VAL   CB     .   25913   1
      200   .   1   1   20   20   VAL   CG1    C   13   21.607    0.021   .   2   .   .   .   A   18   VAL   CG1    .   25913   1
      201   .   1   1   20   20   VAL   CG2    C   13   19.358    0.021   .   2   .   .   .   A   18   VAL   CG2    .   25913   1
      202   .   1   1   20   20   VAL   N      N   15   111.916   0.040   .   1   .   .   .   A   18   VAL   N      .   25913   1
      203   .   1   1   21   21   GLU   H      H   1    8.346     0.004   .   1   .   .   .   A   19   GLU   H      .   25913   1
      204   .   1   1   21   21   GLU   HA     H   1    5.023     0.007   .   1   .   .   .   A   19   GLU   HA     .   25913   1
      205   .   1   1   21   21   GLU   HB2    H   1    2.062     0.018   .   2   .   .   .   A   19   GLU   HB2    .   25913   1
      206   .   1   1   21   21   GLU   HG2    H   1    2.669     0.006   .   2   .   .   .   A   19   GLU   HG2    .   25913   1
      207   .   1   1   21   21   GLU   HG3    H   1    2.309     0.006   .   2   .   .   .   A   19   GLU   HG3    .   25913   1
      208   .   1   1   21   21   GLU   C      C   13   176.506   0.006   .   1   .   .   .   A   19   GLU   C      .   25913   1
      209   .   1   1   21   21   GLU   CA     C   13   56.818    0.102   .   1   .   .   .   A   19   GLU   CA     .   25913   1
      210   .   1   1   21   21   GLU   CB     C   13   30.165    0.097   .   1   .   .   .   A   19   GLU   CB     .   25913   1
      211   .   1   1   21   21   GLU   CG     C   13   36.922    0.003   .   1   .   .   .   A   19   GLU   CG     .   25913   1
      212   .   1   1   21   21   GLU   N      N   15   123.431   0.035   .   1   .   .   .   A   19   GLU   N      .   25913   1
      213   .   1   1   22   22   ILE   H      H   1    8.537     0.005   .   1   .   .   .   A   20   ILE   H      .   25913   1
      214   .   1   1   22   22   ILE   HA     H   1    4.741     0.007   .   1   .   .   .   A   20   ILE   HA     .   25913   1
      215   .   1   1   22   22   ILE   HB     H   1    1.683     0.020   .   1   .   .   .   A   20   ILE   HB     .   25913   1
      216   .   1   1   22   22   ILE   HG12   H   1    1.255     0.008   .   2   .   .   .   A   20   ILE   HG12   .   25913   1
      217   .   1   1   22   22   ILE   HG21   H   1    1.072     0.005   .   1   .   .   .   A   20   ILE   HG21   .   25913   1
      218   .   1   1   22   22   ILE   HG22   H   1    1.072     0.005   .   1   .   .   .   A   20   ILE   HG22   .   25913   1
      219   .   1   1   22   22   ILE   HG23   H   1    1.072     0.005   .   1   .   .   .   A   20   ILE   HG23   .   25913   1
      220   .   1   1   22   22   ILE   HD11   H   1    0.741     0.007   .   1   .   .   .   A   20   ILE   HD11   .   25913   1
      221   .   1   1   22   22   ILE   HD12   H   1    0.741     0.007   .   1   .   .   .   A   20   ILE   HD12   .   25913   1
      222   .   1   1   22   22   ILE   HD13   H   1    0.741     0.007   .   1   .   .   .   A   20   ILE   HD13   .   25913   1
      223   .   1   1   22   22   ILE   C      C   13   175.511   0.004   .   1   .   .   .   A   20   ILE   C      .   25913   1
      224   .   1   1   22   22   ILE   CA     C   13   58.945    0.094   .   1   .   .   .   A   20   ILE   CA     .   25913   1
      225   .   1   1   22   22   ILE   CB     C   13   44.667    0.023   .   1   .   .   .   A   20   ILE   CB     .   25913   1
      226   .   1   1   22   22   ILE   CG1    C   13   26.526    0.027   .   1   .   .   .   A   20   ILE   CG1    .   25913   1
      227   .   1   1   22   22   ILE   CG2    C   13   21.253    0.009   .   1   .   .   .   A   20   ILE   CG2    .   25913   1
      228   .   1   1   22   22   ILE   CD1    C   13   15.356    0.033   .   1   .   .   .   A   20   ILE   CD1    .   25913   1
      229   .   1   1   22   22   ILE   N      N   15   117.751   0.036   .   1   .   .   .   A   20   ILE   N      .   25913   1
      230   .   1   1   23   23   VAL   H      H   1    8.203     0.005   .   1   .   .   .   A   21   VAL   H      .   25913   1
      231   .   1   1   23   23   VAL   HA     H   1    4.586     0.006   .   1   .   .   .   A   21   VAL   HA     .   25913   1
      232   .   1   1   23   23   VAL   HB     H   1    1.990     0.008   .   1   .   .   .   A   21   VAL   HB     .   25913   1
      233   .   1   1   23   23   VAL   HG11   H   1    1.028     0.004   .   2   .   .   .   A   21   VAL   HG11   .   25913   1
      234   .   1   1   23   23   VAL   HG12   H   1    1.028     0.004   .   2   .   .   .   A   21   VAL   HG12   .   25913   1
      235   .   1   1   23   23   VAL   HG13   H   1    1.028     0.004   .   2   .   .   .   A   21   VAL   HG13   .   25913   1
      236   .   1   1   23   23   VAL   HG21   H   1    0.969     0.005   .   2   .   .   .   A   21   VAL   HG21   .   25913   1
      237   .   1   1   23   23   VAL   HG22   H   1    0.969     0.005   .   2   .   .   .   A   21   VAL   HG22   .   25913   1
      238   .   1   1   23   23   VAL   HG23   H   1    0.969     0.005   .   2   .   .   .   A   21   VAL   HG23   .   25913   1
      239   .   1   1   23   23   VAL   C      C   13   174.640   0.000   .   1   .   .   .   A   21   VAL   C      .   25913   1
      240   .   1   1   23   23   VAL   CA     C   13   59.718    0.045   .   1   .   .   .   A   21   VAL   CA     .   25913   1
      241   .   1   1   23   23   VAL   CB     C   13   32.503    0.060   .   1   .   .   .   A   21   VAL   CB     .   25913   1
      242   .   1   1   23   23   VAL   CG1    C   13   20.942    0.003   .   2   .   .   .   A   21   VAL   CG1    .   25913   1
      243   .   1   1   23   23   VAL   CG2    C   13   20.969    0.028   .   2   .   .   .   A   21   VAL   CG2    .   25913   1
      244   .   1   1   23   23   VAL   N      N   15   124.220   0.048   .   1   .   .   .   A   21   VAL   N      .   25913   1
      245   .   1   1   24   24   PRO   HA     H   1    4.059     0.006   .   1   .   .   .   A   22   PRO   HA     .   25913   1
      246   .   1   1   24   24   PRO   HB2    H   1    1.299     0.020   .   2   .   .   .   A   22   PRO   HB2    .   25913   1
      247   .   1   1   24   24   PRO   HB3    H   1    1.161     0.013   .   2   .   .   .   A   22   PRO   HB3    .   25913   1
      248   .   1   1   24   24   PRO   HG2    H   1    0.816     0.009   .   2   .   .   .   A   22   PRO   HG2    .   25913   1
      249   .   1   1   24   24   PRO   HG3    H   1    1.116     0.007   .   2   .   .   .   A   22   PRO   HG3    .   25913   1
      250   .   1   1   24   24   PRO   HD2    H   1    3.542     0.004   .   2   .   .   .   A   22   PRO   HD2    .   25913   1
      251   .   1   1   24   24   PRO   HD3    H   1    3.465     0.011   .   2   .   .   .   A   22   PRO   HD3    .   25913   1
      252   .   1   1   24   24   PRO   C      C   13   175.352   0.000   .   1   .   .   .   A   22   PRO   C      .   25913   1
      253   .   1   1   24   24   PRO   CA     C   13   62.661    0.080   .   1   .   .   .   A   22   PRO   CA     .   25913   1
      254   .   1   1   24   24   PRO   CB     C   13   32.014    0.057   .   1   .   .   .   A   22   PRO   CB     .   25913   1
      255   .   1   1   24   24   PRO   CG     C   13   26.619    0.008   .   1   .   .   .   A   22   PRO   CG     .   25913   1
      256   .   1   1   24   24   PRO   CD     C   13   51.050    0.031   .   1   .   .   .   A   22   PRO   CD     .   25913   1
      257   .   1   1   25   25   ARG   H      H   1    8.635     0.005   .   1   .   .   .   A   23   ARG   H      .   25913   1
      258   .   1   1   25   25   ARG   HA     H   1    4.255     0.005   .   1   .   .   .   A   23   ARG   HA     .   25913   1
      259   .   1   1   25   25   ARG   HB2    H   1    1.698     0.006   .   2   .   .   .   A   23   ARG   HB2    .   25913   1
      260   .   1   1   25   25   ARG   HB3    H   1    1.533     0.015   .   2   .   .   .   A   23   ARG   HB3    .   25913   1
      261   .   1   1   25   25   ARG   HG2    H   1    1.610     0.008   .   2   .   .   .   A   23   ARG   HG2    .   25913   1
      262   .   1   1   25   25   ARG   HD2    H   1    3.136     0.002   .   2   .   .   .   A   23   ARG   HD2    .   25913   1
      263   .   1   1   25   25   ARG   HD3    H   1    3.086     0.007   .   2   .   .   .   A   23   ARG   HD3    .   25913   1
      264   .   1   1   25   25   ARG   HE     H   1    7.309     0.002   .   1   .   .   .   A   23   ARG   HE     .   25913   1
      265   .   1   1   25   25   ARG   C      C   13   175.759   0.035   .   1   .   .   .   A   23   ARG   C      .   25913   1
      266   .   1   1   25   25   ARG   CA     C   13   56.052    0.080   .   1   .   .   .   A   23   ARG   CA     .   25913   1
      267   .   1   1   25   25   ARG   CB     C   13   30.886    0.023   .   1   .   .   .   A   23   ARG   CB     .   25913   1
      268   .   1   1   25   25   ARG   CG     C   13   27.070    0.000   .   1   .   .   .   A   23   ARG   CG     .   25913   1
      269   .   1   1   25   25   ARG   CD     C   13   43.954    0.023   .   1   .   .   .   A   23   ARG   CD     .   25913   1
      270   .   1   1   25   25   ARG   N      N   15   121.370   0.080   .   1   .   .   .   A   23   ARG   N      .   25913   1
      271   .   1   1   25   25   ARG   NE     N   15   84.203    0.129   .   1   .   .   .   A   23   ARG   NE     .   25913   1
      272   .   1   1   26   26   LEU   H      H   1    8.521     0.005   .   1   .   .   .   A   24   LEU   H      .   25913   1
      273   .   1   1   26   26   LEU   HA     H   1    4.173     0.008   .   1   .   .   .   A   24   LEU   HA     .   25913   1
      274   .   1   1   26   26   LEU   HB2    H   1    1.538     0.003   .   2   .   .   .   A   24   LEU   HB2    .   25913   1
      275   .   1   1   26   26   LEU   HB3    H   1    1.366     0.005   .   2   .   .   .   A   24   LEU   HB3    .   25913   1
      276   .   1   1   26   26   LEU   HG     H   1    1.406     0.009   .   1   .   .   .   A   24   LEU   HG     .   25913   1
      277   .   1   1   26   26   LEU   HD11   H   1    0.730     0.047   .   2   .   .   .   A   24   LEU   HD11   .   25913   1
      278   .   1   1   26   26   LEU   HD12   H   1    0.730     0.047   .   2   .   .   .   A   24   LEU   HD12   .   25913   1
      279   .   1   1   26   26   LEU   HD13   H   1    0.730     0.047   .   2   .   .   .   A   24   LEU   HD13   .   25913   1
      280   .   1   1   26   26   LEU   HD21   H   1    0.397     0.010   .   2   .   .   .   A   24   LEU   HD21   .   25913   1
      281   .   1   1   26   26   LEU   HD22   H   1    0.397     0.010   .   2   .   .   .   A   24   LEU   HD22   .   25913   1
      282   .   1   1   26   26   LEU   HD23   H   1    0.397     0.010   .   2   .   .   .   A   24   LEU   HD23   .   25913   1
      283   .   1   1   26   26   LEU   C      C   13   175.774   0.000   .   1   .   .   .   A   24   LEU   C      .   25913   1
      284   .   1   1   26   26   LEU   CA     C   13   52.938    0.055   .   1   .   .   .   A   24   LEU   CA     .   25913   1
      285   .   1   1   26   26   LEU   CB     C   13   41.420    0.037   .   1   .   .   .   A   24   LEU   CB     .   25913   1
      286   .   1   1   26   26   LEU   CG     C   13   27.299    0.000   .   1   .   .   .   A   24   LEU   CG     .   25913   1
      287   .   1   1   26   26   LEU   CD1    C   13   24.750    0.004   .   2   .   .   .   A   24   LEU   CD1    .   25913   1
      288   .   1   1   26   26   LEU   CD2    C   13   22.518    0.014   .   2   .   .   .   A   24   LEU   CD2    .   25913   1
      289   .   1   1   26   26   LEU   N      N   15   127.914   0.024   .   1   .   .   .   A   24   LEU   N      .   25913   1
      290   .   1   1   27   27   PRO   HA     H   1    4.340     0.002   .   1   .   .   .   A   25   PRO   HA     .   25913   1
      291   .   1   1   27   27   PRO   HB2    H   1    2.280     0.004   .   2   .   .   .   A   25   PRO   HB2    .   25913   1
      292   .   1   1   27   27   PRO   HG2    H   1    1.950     0.004   .   2   .   .   .   A   25   PRO   HG2    .   25913   1
      293   .   1   1   27   27   PRO   HG3    H   1    1.714     0.006   .   2   .   .   .   A   25   PRO   HG3    .   25913   1
      294   .   1   1   27   27   PRO   HD2    H   1    3.569     0.014   .   2   .   .   .   A   25   PRO   HD2    .   25913   1
      295   .   1   1   27   27   PRO   HD3    H   1    3.445     0.018   .   2   .   .   .   A   25   PRO   HD3    .   25913   1
      296   .   1   1   27   27   PRO   C      C   13   176.386   0.011   .   1   .   .   .   A   25   PRO   C      .   25913   1
      297   .   1   1   27   27   PRO   CA     C   13   63.667    0.084   .   1   .   .   .   A   25   PRO   CA     .   25913   1
      298   .   1   1   27   27   PRO   CB     C   13   34.676    0.042   .   1   .   .   .   A   25   PRO   CB     .   25913   1
      299   .   1   1   27   27   PRO   CG     C   13   24.257    0.031   .   1   .   .   .   A   25   PRO   CG     .   25913   1
      300   .   1   1   27   27   PRO   CD     C   13   50.292    0.028   .   1   .   .   .   A   25   PRO   CD     .   25913   1
      301   .   1   1   28   28   ASP   H      H   1    8.752     0.005   .   1   .   .   .   A   26   ASP   H      .   25913   1
      302   .   1   1   28   28   ASP   HA     H   1    4.387     0.004   .   1   .   .   .   A   26   ASP   HA     .   25913   1
      303   .   1   1   28   28   ASP   HB2    H   1    2.603     0.013   .   2   .   .   .   A   26   ASP   HB2    .   25913   1
      304   .   1   1   28   28   ASP   HB3    H   1    2.352     0.009   .   2   .   .   .   A   26   ASP   HB3    .   25913   1
      305   .   1   1   28   28   ASP   C      C   13   175.321   0.006   .   1   .   .   .   A   26   ASP   C      .   25913   1
      306   .   1   1   28   28   ASP   CA     C   13   56.355    0.022   .   1   .   .   .   A   26   ASP   CA     .   25913   1
      307   .   1   1   28   28   ASP   CB     C   13   41.066    0.056   .   1   .   .   .   A   26   ASP   CB     .   25913   1
      308   .   1   1   28   28   ASP   N      N   15   122.078   0.024   .   1   .   .   .   A   26   ASP   N      .   25913   1
      309   .   1   1   29   29   TYR   H      H   1    8.666     0.004   .   1   .   .   .   A   27   TYR   H      .   25913   1
      310   .   1   1   29   29   TYR   HA     H   1    3.449     0.009   .   1   .   .   .   A   27   TYR   HA     .   25913   1
      311   .   1   1   29   29   TYR   HB2    H   1    3.029     0.018   .   2   .   .   .   A   27   TYR   HB2    .   25913   1
      312   .   1   1   29   29   TYR   HD1    H   1    6.772     0.009   .   3   .   .   .   A   27   TYR   HD1    .   25913   1
      313   .   1   1   29   29   TYR   HD2    H   1    6.772     0.009   .   3   .   .   .   A   27   TYR   HD2    .   25913   1
      314   .   1   1   29   29   TYR   HE1    H   1    6.697     0.004   .   3   .   .   .   A   27   TYR   HE1    .   25913   1
      315   .   1   1   29   29   TYR   HE2    H   1    6.697     0.004   .   3   .   .   .   A   27   TYR   HE2    .   25913   1
      316   .   1   1   29   29   TYR   C      C   13   173.074   0.005   .   1   .   .   .   A   27   TYR   C      .   25913   1
      317   .   1   1   29   29   TYR   CA     C   13   60.437    0.054   .   1   .   .   .   A   27   TYR   CA     .   25913   1
      318   .   1   1   29   29   TYR   CB     C   13   35.060    0.052   .   1   .   .   .   A   27   TYR   CB     .   25913   1
      319   .   1   1   29   29   TYR   CD1    C   13   132.752   0.104   .   3   .   .   .   A   27   TYR   CD1    .   25913   1
      320   .   1   1   29   29   TYR   CD2    C   13   132.752   0.104   .   3   .   .   .   A   27   TYR   CD2    .   25913   1
      321   .   1   1   29   29   TYR   CE1    C   13   118.263   0.078   .   3   .   .   .   A   27   TYR   CE1    .   25913   1
      322   .   1   1   29   29   TYR   CE2    C   13   118.263   0.078   .   3   .   .   .   A   27   TYR   CE2    .   25913   1
      323   .   1   1   29   29   TYR   N      N   15   117.607   0.020   .   1   .   .   .   A   27   TYR   N      .   25913   1
      324   .   1   1   30   30   ILE   H      H   1    6.761     0.005   .   1   .   .   .   A   28   ILE   H      .   25913   1
      325   .   1   1   30   30   ILE   HA     H   1    4.775     0.011   .   1   .   .   .   A   28   ILE   HA     .   25913   1
      326   .   1   1   30   30   ILE   HB     H   1    1.412     0.020   .   1   .   .   .   A   28   ILE   HB     .   25913   1
      327   .   1   1   30   30   ILE   HG12   H   1    1.039     0.019   .   2   .   .   .   A   28   ILE   HG12   .   25913   1
      328   .   1   1   30   30   ILE   HG13   H   1    0.805     0.007   .   2   .   .   .   A   28   ILE   HG13   .   25913   1
      329   .   1   1   30   30   ILE   HG21   H   1    0.625     0.003   .   1   .   .   .   A   28   ILE   HG21   .   25913   1
      330   .   1   1   30   30   ILE   HG22   H   1    0.625     0.003   .   1   .   .   .   A   28   ILE   HG22   .   25913   1
      331   .   1   1   30   30   ILE   HG23   H   1    0.625     0.003   .   1   .   .   .   A   28   ILE   HG23   .   25913   1
      332   .   1   1   30   30   ILE   HD11   H   1    0.697     0.009   .   1   .   .   .   A   28   ILE   HD11   .   25913   1
      333   .   1   1   30   30   ILE   HD12   H   1    0.697     0.009   .   1   .   .   .   A   28   ILE   HD12   .   25913   1
      334   .   1   1   30   30   ILE   HD13   H   1    0.697     0.009   .   1   .   .   .   A   28   ILE   HD13   .   25913   1
      335   .   1   1   30   30   ILE   C      C   13   175.083   0.027   .   1   .   .   .   A   28   ILE   C      .   25913   1
      336   .   1   1   30   30   ILE   CA     C   13   57.569    0.012   .   1   .   .   .   A   28   ILE   CA     .   25913   1
      337   .   1   1   30   30   ILE   CB     C   13   42.107    0.052   .   1   .   .   .   A   28   ILE   CB     .   25913   1
      338   .   1   1   30   30   ILE   CG1    C   13   25.600    0.062   .   1   .   .   .   A   28   ILE   CG1    .   25913   1
      339   .   1   1   30   30   ILE   CG2    C   13   17.264    0.016   .   1   .   .   .   A   28   ILE   CG2    .   25913   1
      340   .   1   1   30   30   ILE   CD1    C   13   12.595    0.014   .   1   .   .   .   A   28   ILE   CD1    .   25913   1
      341   .   1   1   30   30   ILE   N      N   15   111.804   0.087   .   1   .   .   .   A   28   ILE   N      .   25913   1
      342   .   1   1   31   31   CYS   H      H   1    8.783     0.006   .   1   .   .   .   A   29   CYS   H      .   25913   1
      343   .   1   1   31   31   CYS   HA     H   1    4.408     0.016   .   1   .   .   .   A   29   CYS   HA     .   25913   1
      344   .   1   1   31   31   CYS   HB2    H   1    3.241     0.003   .   2   .   .   .   A   29   CYS   HB2    .   25913   1
      345   .   1   1   31   31   CYS   HB3    H   1    2.813     0.011   .   2   .   .   .   A   29   CYS   HB3    .   25913   1
      346   .   1   1   31   31   CYS   C      C   13   175.932   0.000   .   1   .   .   .   A   29   CYS   C      .   25913   1
      347   .   1   1   31   31   CYS   CA     C   13   56.402    0.014   .   1   .   .   .   A   29   CYS   CA     .   25913   1
      348   .   1   1   31   31   CYS   CB     C   13   32.214    0.052   .   1   .   .   .   A   29   CYS   CB     .   25913   1
      349   .   1   1   31   31   CYS   N      N   15   126.875   0.101   .   1   .   .   .   A   29   CYS   N      .   25913   1
      350   .   1   1   32   32   PRO   HA     H   1    4.382     0.009   .   1   .   .   .   A   30   PRO   HA     .   25913   1
      351   .   1   1   32   32   PRO   HB3    H   1    2.124     0.011   .   2   .   .   .   A   30   PRO   HB3    .   25913   1
      352   .   1   1   32   32   PRO   HG2    H   1    2.379     0.005   .   2   .   .   .   A   30   PRO   HG2    .   25913   1
      353   .   1   1   32   32   PRO   HG3    H   1    1.978     0.010   .   2   .   .   .   A   30   PRO   HG3    .   25913   1
      354   .   1   1   32   32   PRO   HD2    H   1    4.174     0.006   .   2   .   .   .   A   30   PRO   HD2    .   25913   1
      355   .   1   1   32   32   PRO   HD3    H   1    3.873     0.012   .   2   .   .   .   A   30   PRO   HD3    .   25913   1
      356   .   1   1   32   32   PRO   C      C   13   176.824   0.003   .   1   .   .   .   A   30   PRO   C      .   25913   1
      357   .   1   1   32   32   PRO   CA     C   13   64.040    0.032   .   1   .   .   .   A   30   PRO   CA     .   25913   1
      358   .   1   1   32   32   PRO   CB     C   13   32.344    0.021   .   1   .   .   .   A   30   PRO   CB     .   25913   1
      359   .   1   1   32   32   PRO   CG     C   13   26.814    0.038   .   1   .   .   .   A   30   PRO   CG     .   25913   1
      360   .   1   1   32   32   PRO   CD     C   13   51.411    0.041   .   1   .   .   .   A   30   PRO   CD     .   25913   1
      361   .   1   1   33   33   ARG   H      H   1    9.604     0.005   .   1   .   .   .   A   31   ARG   H      .   25913   1
      362   .   1   1   33   33   ARG   HA     H   1    4.301     0.012   .   1   .   .   .   A   31   ARG   HA     .   25913   1
      363   .   1   1   33   33   ARG   HB2    H   1    2.124     0.014   .   2   .   .   .   A   31   ARG   HB2    .   25913   1
      364   .   1   1   33   33   ARG   HB3    H   1    1.895     0.009   .   2   .   .   .   A   31   ARG   HB3    .   25913   1
      365   .   1   1   33   33   ARG   HG2    H   1    1.564     0.009   .   2   .   .   .   A   31   ARG   HG2    .   25913   1
      366   .   1   1   33   33   ARG   HD2    H   1    3.235     0.003   .   2   .   .   .   A   31   ARG   HD2    .   25913   1
      367   .   1   1   33   33   ARG   HD3    H   1    3.067     0.005   .   2   .   .   .   A   31   ARG   HD3    .   25913   1
      368   .   1   1   33   33   ARG   HE     H   1    7.314     0.002   .   1   .   .   .   A   31   ARG   HE     .   25913   1
      369   .   1   1   33   33   ARG   C      C   13   177.721   0.018   .   1   .   .   .   A   31   ARG   C      .   25913   1
      370   .   1   1   33   33   ARG   CA     C   13   58.190    0.018   .   1   .   .   .   A   31   ARG   CA     .   25913   1
      371   .   1   1   33   33   ARG   CB     C   13   31.682    0.091   .   1   .   .   .   A   31   ARG   CB     .   25913   1
      372   .   1   1   33   33   ARG   CG     C   13   27.540    0.035   .   1   .   .   .   A   31   ARG   CG     .   25913   1
      373   .   1   1   33   33   ARG   CD     C   13   43.717    0.000   .   1   .   .   .   A   31   ARG   CD     .   25913   1
      374   .   1   1   33   33   ARG   N      N   15   124.131   0.048   .   1   .   .   .   A   31   ARG   N      .   25913   1
      375   .   1   1   33   33   ARG   NE     N   15   85.495    0.000   .   1   .   .   .   A   31   ARG   NE     .   25913   1
      376   .   1   1   34   34   CYS   H      H   1    8.549     0.005   .   1   .   .   .   A   32   CYS   H      .   25913   1
      377   .   1   1   34   34   CYS   HA     H   1    4.839     0.008   .   1   .   .   .   A   32   CYS   HA     .   25913   1
      378   .   1   1   34   34   CYS   HB2    H   1    3.223     0.012   .   2   .   .   .   A   32   CYS   HB2    .   25913   1
      379   .   1   1   34   34   CYS   HB3    H   1    2.450     0.012   .   2   .   .   .   A   32   CYS   HB3    .   25913   1
      380   .   1   1   34   34   CYS   C      C   13   176.450   0.008   .   1   .   .   .   A   32   CYS   C      .   25913   1
      381   .   1   1   34   34   CYS   CA     C   13   58.710    0.107   .   1   .   .   .   A   32   CYS   CA     .   25913   1
      382   .   1   1   34   34   CYS   CB     C   13   33.230    0.047   .   1   .   .   .   A   32   CYS   CB     .   25913   1
      383   .   1   1   34   34   CYS   N      N   15   119.758   0.066   .   1   .   .   .   A   32   CYS   N      .   25913   1
      384   .   1   1   35   35   GLU   H      H   1    7.868     0.006   .   1   .   .   .   A   33   GLU   H      .   25913   1
      385   .   1   1   35   35   GLU   HA     H   1    4.078     0.007   .   1   .   .   .   A   33   GLU   HA     .   25913   1
      386   .   1   1   35   35   GLU   HB2    H   1    2.297     0.009   .   2   .   .   .   A   33   GLU   HB2    .   25913   1
      387   .   1   1   35   35   GLU   HB3    H   1    2.231     0.005   .   2   .   .   .   A   33   GLU   HB3    .   25913   1
      388   .   1   1   35   35   GLU   HG2    H   1    2.088     0.006   .   2   .   .   .   A   33   GLU   HG2    .   25913   1
      389   .   1   1   35   35   GLU   HG3    H   1    1.989     0.008   .   2   .   .   .   A   33   GLU   HG3    .   25913   1
      390   .   1   1   35   35   GLU   C      C   13   174.739   0.034   .   1   .   .   .   A   33   GLU   C      .   25913   1
      391   .   1   1   35   35   GLU   CA     C   13   58.518    0.145   .   1   .   .   .   A   33   GLU   CA     .   25913   1
      392   .   1   1   35   35   GLU   CB     C   13   26.692    0.061   .   1   .   .   .   A   33   GLU   CB     .   25913   1
      393   .   1   1   35   35   GLU   CG     C   13   36.852    0.013   .   1   .   .   .   A   33   GLU   CG     .   25913   1
      394   .   1   1   35   35   GLU   N      N   15   118.109   0.046   .   1   .   .   .   A   33   GLU   N      .   25913   1
      395   .   1   1   36   36   SER   H      H   1    8.786     0.007   .   1   .   .   .   A   34   SER   H      .   25913   1
      396   .   1   1   36   36   SER   HA     H   1    4.437     0.006   .   1   .   .   .   A   34   SER   HA     .   25913   1
      397   .   1   1   36   36   SER   HB2    H   1    4.308     0.007   .   2   .   .   .   A   34   SER   HB2    .   25913   1
      398   .   1   1   36   36   SER   HB3    H   1    3.865     0.006   .   2   .   .   .   A   34   SER   HB3    .   25913   1
      399   .   1   1   36   36   SER   C      C   13   175.392   0.008   .   1   .   .   .   A   34   SER   C      .   25913   1
      400   .   1   1   36   36   SER   CA     C   13   59.277    0.027   .   1   .   .   .   A   34   SER   CA     .   25913   1
      401   .   1   1   36   36   SER   CB     C   13   65.429    0.138   .   1   .   .   .   A   34   SER   CB     .   25913   1
      402   .   1   1   36   36   SER   N      N   15   117.224   0.015   .   1   .   .   .   A   34   SER   N      .   25913   1
      403   .   1   1   37   37   GLY   H      H   1    8.511     0.005   .   1   .   .   .   A   35   GLY   H      .   25913   1
      404   .   1   1   37   37   GLY   HA2    H   1    4.740     0.007   .   2   .   .   .   A   35   GLY   HA2    .   25913   1
      405   .   1   1   37   37   GLY   HA3    H   1    3.787     0.010   .   2   .   .   .   A   35   GLY   HA3    .   25913   1
      406   .   1   1   37   37   GLY   C      C   13   175.730   0.008   .   1   .   .   .   A   35   GLY   C      .   25913   1
      407   .   1   1   37   37   GLY   CA     C   13   45.241    0.038   .   1   .   .   .   A   35   GLY   CA     .   25913   1
      408   .   1   1   37   37   GLY   N      N   15   111.095   0.088   .   1   .   .   .   A   35   GLY   N      .   25913   1
      409   .   1   1   38   38   PHE   H      H   1    8.850     0.007   .   1   .   .   .   A   36   PHE   H      .   25913   1
      410   .   1   1   38   38   PHE   HA     H   1    5.151     0.003   .   1   .   .   .   A   36   PHE   HA     .   25913   1
      411   .   1   1   38   38   PHE   HB2    H   1    3.460     0.007   .   2   .   .   .   A   36   PHE   HB2    .   25913   1
      412   .   1   1   38   38   PHE   HB3    H   1    3.085     0.010   .   2   .   .   .   A   36   PHE   HB3    .   25913   1
      413   .   1   1   38   38   PHE   HD1    H   1    7.282     0.009   .   3   .   .   .   A   36   PHE   HD1    .   25913   1
      414   .   1   1   38   38   PHE   HD2    H   1    7.282     0.009   .   3   .   .   .   A   36   PHE   HD2    .   25913   1
      415   .   1   1   38   38   PHE   HE1    H   1    7.314     0.009   .   3   .   .   .   A   36   PHE   HE1    .   25913   1
      416   .   1   1   38   38   PHE   HE2    H   1    7.314     0.009   .   3   .   .   .   A   36   PHE   HE2    .   25913   1
      417   .   1   1   38   38   PHE   HZ     H   1    7.228     0.048   .   1   .   .   .   A   36   PHE   HZ     .   25913   1
      418   .   1   1   38   38   PHE   C      C   13   174.098   0.002   .   1   .   .   .   A   36   PHE   C      .   25913   1
      419   .   1   1   38   38   PHE   CA     C   13   55.269    0.094   .   1   .   .   .   A   36   PHE   CA     .   25913   1
      420   .   1   1   38   38   PHE   CB     C   13   36.027    0.045   .   1   .   .   .   A   36   PHE   CB     .   25913   1
      421   .   1   1   38   38   PHE   CD1    C   13   131.299   0.000   .   3   .   .   .   A   36   PHE   CD1    .   25913   1
      422   .   1   1   38   38   PHE   CD2    C   13   131.299   0.000   .   3   .   .   .   A   36   PHE   CD2    .   25913   1
      423   .   1   1   38   38   PHE   CE1    C   13   131.880   0.000   .   3   .   .   .   A   36   PHE   CE1    .   25913   1
      424   .   1   1   38   38   PHE   CE2    C   13   131.880   0.000   .   3   .   .   .   A   36   PHE   CE2    .   25913   1
      425   .   1   1   38   38   PHE   CZ     C   13   129.498   0.000   .   1   .   .   .   A   36   PHE   CZ     .   25913   1
      426   .   1   1   38   38   PHE   N      N   15   126.409   0.064   .   1   .   .   .   A   36   PHE   N      .   25913   1
      427   .   1   1   39   39   ILE   H      H   1    7.972     0.004   .   1   .   .   .   A   37   ILE   H      .   25913   1
      428   .   1   1   39   39   ILE   HA     H   1    5.356     0.017   .   1   .   .   .   A   37   ILE   HA     .   25913   1
      429   .   1   1   39   39   ILE   HB     H   1    1.675     0.017   .   1   .   .   .   A   37   ILE   HB     .   25913   1
      430   .   1   1   39   39   ILE   HG12   H   1    1.365     0.019   .   2   .   .   .   A   37   ILE   HG12   .   25913   1
      431   .   1   1   39   39   ILE   HG13   H   1    0.993     0.014   .   2   .   .   .   A   37   ILE   HG13   .   25913   1
      432   .   1   1   39   39   ILE   HG21   H   1    0.825     0.004   .   1   .   .   .   A   37   ILE   HG21   .   25913   1
      433   .   1   1   39   39   ILE   HG22   H   1    0.825     0.004   .   1   .   .   .   A   37   ILE   HG22   .   25913   1
      434   .   1   1   39   39   ILE   HG23   H   1    0.825     0.004   .   1   .   .   .   A   37   ILE   HG23   .   25913   1
      435   .   1   1   39   39   ILE   HD11   H   1    0.325     0.010   .   1   .   .   .   A   37   ILE   HD11   .   25913   1
      436   .   1   1   39   39   ILE   HD12   H   1    0.325     0.010   .   1   .   .   .   A   37   ILE   HD12   .   25913   1
      437   .   1   1   39   39   ILE   HD13   H   1    0.325     0.010   .   1   .   .   .   A   37   ILE   HD13   .   25913   1
      438   .   1   1   39   39   ILE   C      C   13   175.508   0.004   .   1   .   .   .   A   37   ILE   C      .   25913   1
      439   .   1   1   39   39   ILE   CA     C   13   58.687    0.049   .   1   .   .   .   A   37   ILE   CA     .   25913   1
      440   .   1   1   39   39   ILE   CB     C   13   41.148    0.023   .   1   .   .   .   A   37   ILE   CB     .   25913   1
      441   .   1   1   39   39   ILE   CG1    C   13   26.074    0.017   .   1   .   .   .   A   37   ILE   CG1    .   25913   1
      442   .   1   1   39   39   ILE   CG2    C   13   18.078    0.043   .   1   .   .   .   A   37   ILE   CG2    .   25913   1
      443   .   1   1   39   39   ILE   CD1    C   13   14.266    0.023   .   1   .   .   .   A   37   ILE   CD1    .   25913   1
      444   .   1   1   39   39   ILE   N      N   15   117.377   0.047   .   1   .   .   .   A   37   ILE   N      .   25913   1
      445   .   1   1   40   40   GLU   H      H   1    9.131     0.010   .   1   .   .   .   A   38   GLU   H      .   25913   1
      446   .   1   1   40   40   GLU   HA     H   1    4.885     0.011   .   1   .   .   .   A   38   GLU   HA     .   25913   1
      447   .   1   1   40   40   GLU   HB2    H   1    2.140     0.012   .   2   .   .   .   A   38   GLU   HB2    .   25913   1
      448   .   1   1   40   40   GLU   HG2    H   1    2.362     0.006   .   2   .   .   .   A   38   GLU   HG2    .   25913   1
      449   .   1   1   40   40   GLU   HG3    H   1    2.305     0.006   .   2   .   .   .   A   38   GLU   HG3    .   25913   1
      450   .   1   1   40   40   GLU   C      C   13   174.300   0.006   .   1   .   .   .   A   38   GLU   C      .   25913   1
      451   .   1   1   40   40   GLU   CA     C   13   54.656    0.050   .   1   .   .   .   A   38   GLU   CA     .   25913   1
      452   .   1   1   40   40   GLU   CB     C   13   34.589    0.056   .   1   .   .   .   A   38   GLU   CB     .   25913   1
      453   .   1   1   40   40   GLU   CG     C   13   35.926    0.004   .   1   .   .   .   A   38   GLU   CG     .   25913   1
      454   .   1   1   40   40   GLU   N      N   15   124.869   0.047   .   1   .   .   .   A   38   GLU   N      .   25913   1
      455   .   1   1   41   41   GLU   H      H   1    8.844     0.004   .   1   .   .   .   A   39   GLU   H      .   25913   1
      456   .   1   1   41   41   GLU   HA     H   1    3.848     0.028   .   1   .   .   .   A   39   GLU   HA     .   25913   1
      457   .   1   1   41   41   GLU   HB2    H   1    1.908     0.005   .   2   .   .   .   A   39   GLU   HB2    .   25913   1
      458   .   1   1   41   41   GLU   HB3    H   1    1.701     0.009   .   2   .   .   .   A   39   GLU   HB3    .   25913   1
      459   .   1   1   41   41   GLU   HG2    H   1    2.188     0.008   .   2   .   .   .   A   39   GLU   HG2    .   25913   1
      460   .   1   1   41   41   GLU   HG3    H   1    1.912     0.006   .   2   .   .   .   A   39   GLU   HG3    .   25913   1
      461   .   1   1   41   41   GLU   C      C   13   175.507   0.003   .   1   .   .   .   A   39   GLU   C      .   25913   1
      462   .   1   1   41   41   GLU   CA     C   13   56.505    0.076   .   1   .   .   .   A   39   GLU   CA     .   25913   1
      463   .   1   1   41   41   GLU   CB     C   13   30.249    0.109   .   1   .   .   .   A   39   GLU   CB     .   25913   1
      464   .   1   1   41   41   GLU   CG     C   13   36.222    0.009   .   1   .   .   .   A   39   GLU   CG     .   25913   1
      465   .   1   1   41   41   GLU   N      N   15   127.840   0.040   .   1   .   .   .   A   39   GLU   N      .   25913   1
      466   .   1   1   42   42   LEU   H      H   1    8.188     0.006   .   1   .   .   .   A   40   LEU   H      .   25913   1
      467   .   1   1   42   42   LEU   HA     H   1    4.147     0.018   .   1   .   .   .   A   40   LEU   HA     .   25913   1
      468   .   1   1   42   42   LEU   HB2    H   1    1.416     0.005   .   2   .   .   .   A   40   LEU   HB2    .   25913   1
      469   .   1   1   42   42   LEU   HG     H   1    1.408     0.014   .   1   .   .   .   A   40   LEU   HG     .   25913   1
      470   .   1   1   42   42   LEU   HD11   H   1    0.714     0.013   .   2   .   .   .   A   40   LEU   HD11   .   25913   1
      471   .   1   1   42   42   LEU   HD12   H   1    0.714     0.013   .   2   .   .   .   A   40   LEU   HD12   .   25913   1
      472   .   1   1   42   42   LEU   HD13   H   1    0.714     0.013   .   2   .   .   .   A   40   LEU   HD13   .   25913   1
      473   .   1   1   42   42   LEU   HD21   H   1    0.663     0.005   .   2   .   .   .   A   40   LEU   HD21   .   25913   1
      474   .   1   1   42   42   LEU   HD22   H   1    0.663     0.005   .   2   .   .   .   A   40   LEU   HD22   .   25913   1
      475   .   1   1   42   42   LEU   HD23   H   1    0.663     0.005   .   2   .   .   .   A   40   LEU   HD23   .   25913   1
      476   .   1   1   42   42   LEU   C      C   13   182.199   0.000   .   1   .   .   .   A   40   LEU   C      .   25913   1
      477   .   1   1   42   42   LEU   CA     C   13   56.363    0.088   .   1   .   .   .   A   40   LEU   CA     .   25913   1
      478   .   1   1   42   42   LEU   CB     C   13   43.383    0.073   .   1   .   .   .   A   40   LEU   CB     .   25913   1
      479   .   1   1   42   42   LEU   CG     C   13   27.318    0.040   .   1   .   .   .   A   40   LEU   CG     .   25913   1
      480   .   1   1   42   42   LEU   CD1    C   13   25.732    0.062   .   2   .   .   .   A   40   LEU   CD1    .   25913   1
      481   .   1   1   42   42   LEU   CD2    C   13   23.041    0.021   .   2   .   .   .   A   40   LEU   CD2    .   25913   1
      482   .   1   1   42   42   LEU   N      N   15   133.545   0.050   .   1   .   .   .   A   40   LEU   N      .   25913   1
   stop_
save_