data_16074_sparta

save_entry_information
   _Entry.Sf_category      entry_information
   _Entry.Sf_framecode     entry_information
   _Entry.ID               16074
   _Entry.PDB_ID           2KCH
   _Entry.NMR_STAR_version 3.0.9.100
save_

save_delta_chem_shifts_single
   _Entity_delta_chem_shifts.Sf_category      delta_chem_shifts
   _Entity_delta_chem_shifts.Sf_framecode     delta_chem_shifts_single
   _Entity_delta_chem_shifts.Conformer_type   "single"
   _Entity_delta_chem_shifts.Conformer_count  20
   _Entity_delta_chem_shifts.Best_conformer   1
   _Entity_delta_chem_shifts.ID               1

   loop_
      _Delta_CS.Assigned_chem_shift_list_ID
      _Delta_CS.Atom_chem_shift_ID
      _Delta_CS.Assembly_atom_ID
      _Delta_CS.Conformer_ID
      _Delta_CS.Entity_assembly_ID
      _Delta_CS.Entity_ID
      _Delta_CS.PDB_asym_ID
      _Delta_CS.Comp_index_ID
      _Delta_CS.Seq_ID
      _Delta_CS.Comp_ID
      _Delta_CS.Atom_ID
      _Delta_CS.Atom_type
      _Delta_CS.Auth_seq_ID
      _Delta_CS.Original_CS_value
      _Delta_CS.Sparta_CS_value
      _Delta_CS.Delta_CS_value
      _Delta_CS.Entity_delta_chem_shifts_ID

        1     5  .     1     1     1     A     2     2   GLY     H      H     2      8.645      8.161      0.484  1
        1     6  .     1     1     1     A     2     2   GLY   HA2      H     2      3.887      3.937     -0.050  1
        1     7  .     1     1     1     A     2     2   GLY   HA3      H     2      3.764      3.940     -0.176  1
        1     8  .     1     1     1     A     3     3   GLU     H      H     3      7.071      8.047     -0.976  1
        1     9  .     1     1     1     A     3     3   GLU    HA      H     3      4.867      4.323      0.544  1
        1    14  .     1     1     1     A     4     4   THR     H      H     4      8.448      8.715     -0.267  1
        1    15  .     1     1     1     A     4     4   THR    HA      H     4      4.451      4.623     -0.172  1
        1    19  .     1     1     1     A     5     5   CYS     H      H     5      8.289      8.795     -0.506  1
        1    20  .     1     1     1     A     5     5   CYS    HA      H     5      5.162      4.662      0.500  1
        1    23  .     1     1     1     A     6     6   PHE     H      H     6      9.659      8.056      1.603  1
        1    24  .     1     1     1     A     6     6   PHE    HA      H     6      4.022      3.876      0.146  1
        1    30  .     1     1     1     A     7     7   GLY     H      H     7      9.220      7.997      1.223  1
        1    31  .     1     1     1     A     7     7   GLY   HA2      H     7      4.462      3.855      0.607  1
        1    32  .     1     1     1     A     7     7   GLY   HA3      H     7      3.881      3.949     -0.068  1
        1    33  .     1     1     1     A     8     8   GLY     H      H     8      8.215      8.639     -0.424  1
        1    34  .     1     1     1     A     8     8   GLY   HA2      H     8      4.577      3.984      0.593  1
        1    35  .     1     1     1     A     8     8   GLY   HA3      H     8      4.139      4.062      0.077  1
        1    36  .     1     1     1     A     9     9   THR     H      H     9      8.012      7.671      0.341  1
        1    37  .     1     1     1     A     9     9   THR    HA      H     9      4.740      4.268      0.472  1
        1    42  .     1     1     1     A    10    10   CYS     H      H    10      8.576      8.656     -0.080  1
        1    43  .     1     1     1     A    10    10   CYS    HA      H    10      4.685      5.099     -0.414  1
        1    46  .     1     1     1     A    11    11   ASN     H      H    11     11.445      9.522      1.923  1
        1    47  .     1     1     1     A    11    11   ASN    HA      H    11      4.827      4.652      0.175  1
        1    52  .     1     1     1     A    12    12   THR     H      H    12      9.679      7.992      1.687  1
        1    53  .     1     1     1     A    12    12   THR    HA      H    12      4.369      4.501     -0.132  1
        1    57  .     1     1     1     A    13    13   PRO    HA      H    13      4.308      4.275      0.033  1
        1    64  .     1     1     1     A    14    14   GLY     H      H    14      8.748      8.862     -0.114  1
        1    65  .     1     1     1     A    14    14   GLY   HA2      H    14      4.229      3.816      0.413  1
        1    66  .     1     1     1     A    14    14   GLY   HA3      H    14      3.747      3.817     -0.070  1
        1    67  .     1     1     1     A    15    15   CYS     H      H    15      7.712      7.597      0.115  1
        1    68  .     1     1     1     A    15    15   CYS    HA      H    15      5.331      4.616      0.715  1
        1    71  .     1     1     1     A    16    16   SER     H      H    16      9.548      9.382      0.166  1
        1    72  .     1     1     1     A    16    16   SER    HA      H    16      4.720      4.919     -0.199  1
        1    75  .     1     1     1     A    17    17   CYS     H      H    17      9.028      8.794      0.234  1
        1    76  .     1     1     1     A    17    17   CYS    HA      H    17      4.684      4.593      0.091  1
        1    79  .     1     1     1     A    18    18   THR     H      H    18      8.737      8.613      0.124  1
        1    80  .     1     1     1     A    18    18   THR    HA      H    18      4.498      4.869     -0.371  1
        1    85  .     1     1     1     A    19    19   TRP     H      H    19      7.677      8.173     -0.496  1
        1    86  .     1     1     1     A    19    19   TRP    HA      H    19      4.007      4.421     -0.414  1
        1    95  .     1     1     1     A    20    20   PRO    HA      H    20      3.323      3.715     -0.392  1
        1   102  .     1     1     1     A    21    21   ILE     H      H    21      8.646      7.634      1.012  1
        1   103  .     1     1     1     A    21    21   ILE    HA      H    21      4.249      4.740     -0.491  1
        1   113  .     1     1     1     A    22    22   CYS     H      H    22      7.444      8.905     -1.461  1
        1   114  .     1     1     1     A    22    22   CYS    HA      H    22      5.082      5.290     -0.208  1
        1   117  .     1     1     1     A    23    23   THR     H      H    23      9.953      9.426      0.527  1
        1   118  .     1     1     1     A    23    23   THR    HA      H    23      5.065      5.375     -0.310  1
        1   123  .     1     1     1     A    24    24   ARG     H      H    24      8.743      8.532      0.211  1
        1   124  .     1     1     1     A    24    24   ARG    HA      H    24      4.793      4.862     -0.069  1
        1   132  .     1     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .     1     1     1     A    25    25   ASP    HA      H    25      4.376      4.405     -0.029  1
        1   136  .     1     1     1     A    26    26   GLY     H      H    26      8.543      8.535      0.008  1
        1   137  .     1     1     1     A    26    26   GLY   HA2      H    26      4.212      3.831      0.381  1
        1   138  .     1     1     1     A    26    26   GLY   HA3      H    26      3.616      3.832     -0.216  1
        1   139  .     1     1     1     A    27    27   LEU     H      H    27      7.799      8.235     -0.436  1
        1   140  .     1     1     1     A    27    27   LEU    HA      H    27      5.103      4.549      0.554  1
        1   150  .     1     1     1     A    28    28   PRO    HA      H    28      5.096      4.567      0.529  1
        1     5  .     2     1     1     A     2     2   GLY     H      H     2      8.645      8.177      0.468  1
        1     6  .     2     1     1     A     2     2   GLY   HA2      H     2      3.887      3.945     -0.058  1
        1     7  .     2     1     1     A     2     2   GLY   HA3      H     2      3.764      3.946     -0.182  1
        1     8  .     2     1     1     A     3     3   GLU     H      H     3      7.071      8.058     -0.987  1
        1     9  .     2     1     1     A     3     3   GLU    HA      H     3      4.867      4.335      0.532  1
        1    14  .     2     1     1     A     4     4   THR     H      H     4      8.448      8.441      0.007  1
        1    15  .     2     1     1     A     4     4   THR    HA      H     4      4.451      4.787     -0.336  1
        1    19  .     2     1     1     A     5     5   CYS     H      H     5      8.289      8.881     -0.592  1
        1    20  .     2     1     1     A     5     5   CYS    HA      H     5      5.162      4.685      0.477  1
        1    23  .     2     1     1     A     6     6   PHE     H      H     6      9.659      8.047      1.612  1
        1    24  .     2     1     1     A     6     6   PHE    HA      H     6      4.022      3.641      0.381  1
        1    30  .     2     1     1     A     7     7   GLY     H      H     7      9.220      8.033      1.187  1
        1    31  .     2     1     1     A     7     7   GLY   HA2      H     7      4.462      4.047      0.415  1
        1    32  .     2     1     1     A     7     7   GLY   HA3      H     7      3.881      4.109     -0.228  1
        1    33  .     2     1     1     A     8     8   GLY     H      H     8      8.215      8.639     -0.424  1
        1    34  .     2     1     1     A     8     8   GLY   HA2      H     8      4.577      4.055      0.522  1
        1    35  .     2     1     1     A     8     8   GLY   HA3      H     8      4.139      4.078      0.061  1
        1    36  .     2     1     1     A     9     9   THR     H      H     9      8.012      7.823      0.189  1
        1    37  .     2     1     1     A     9     9   THR    HA      H     9      4.740      4.907     -0.167  1
        1    42  .     2     1     1     A    10    10   CYS     H      H    10      8.576      8.868     -0.292  1
        1    43  .     2     1     1     A    10    10   CYS    HA      H    10      4.685      5.537     -0.852  1
        1    46  .     2     1     1     A    11    11   ASN     H      H    11     11.445      9.370      2.075  1
        1    47  .     2     1     1     A    11    11   ASN    HA      H    11      4.827      4.714      0.113  1
        1    52  .     2     1     1     A    12    12   THR     H      H    12      9.679      7.615      2.064  1
        1    53  .     2     1     1     A    12    12   THR    HA      H    12      4.369      4.515     -0.146  1
        1    57  .     2     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  1
        1    64  .     2     1     1     A    14    14   GLY     H      H    14      8.748      8.820     -0.072  1
        1    65  .     2     1     1     A    14    14   GLY   HA2      H    14      4.229      3.810      0.419  1
        1    66  .     2     1     1     A    14    14   GLY   HA3      H    14      3.747      3.811     -0.064  1
        1    67  .     2     1     1     A    15    15   CYS     H      H    15      7.712      7.579      0.133  1
        1    68  .     2     1     1     A    15    15   CYS    HA      H    15      5.331      4.663      0.668  1
        1    71  .     2     1     1     A    16    16   SER     H      H    16      9.548      9.449      0.099  1
        1    72  .     2     1     1     A    16    16   SER    HA      H    16      4.720      4.994     -0.274  1
        1    75  .     2     1     1     A    17    17   CYS     H      H    17      9.028      8.923      0.105  1
        1    76  .     2     1     1     A    17    17   CYS    HA      H    17      4.684      4.545      0.139  1
        1    79  .     2     1     1     A    18    18   THR     H      H    18      8.737      8.614      0.123  1
        1    80  .     2     1     1     A    18    18   THR    HA      H    18      4.498      4.806     -0.308  1
        1    85  .     2     1     1     A    19    19   TRP     H      H    19      7.677      8.288     -0.611  1
        1    86  .     2     1     1     A    19    19   TRP    HA      H    19      4.007      4.325     -0.318  1
        1    95  .     2     1     1     A    20    20   PRO    HA      H    20      3.323      3.407     -0.084  1
        1   102  .     2     1     1     A    21    21   ILE     H      H    21      8.646      7.520      1.126  1
        1   103  .     2     1     1     A    21    21   ILE    HA      H    21      4.249      4.758     -0.509  1
        1   113  .     2     1     1     A    22    22   CYS     H      H    22      7.444      9.052     -1.608  1
        1   114  .     2     1     1     A    22    22   CYS    HA      H    22      5.082      5.107     -0.025  1
        1   117  .     2     1     1     A    23    23   THR     H      H    23      9.953      9.275      0.678  1
        1   118  .     2     1     1     A    23    23   THR    HA      H    23      5.065      5.116     -0.051  1
        1   123  .     2     1     1     A    24    24   ARG     H      H    24      8.743      8.514      0.229  1
        1   124  .     2     1     1     A    24    24   ARG    HA      H    24      4.793      4.829     -0.036  1
        1   132  .     2     1     1     A    25    25   ASP     H      H    25      9.403      8.980      0.423  1
        1   133  .     2     1     1     A    25    25   ASP    HA      H    25      4.376      4.407     -0.031  1
        1   136  .     2     1     1     A    26    26   GLY     H      H    26      8.543      8.690     -0.147  1
        1   137  .     2     1     1     A    26    26   GLY   HA2      H    26      4.212      3.862      0.350  1
        1   138  .     2     1     1     A    26    26   GLY   HA3      H    26      3.616      3.863     -0.247  1
        1   139  .     2     1     1     A    27    27   LEU     H      H    27      7.799      8.196     -0.397  1
        1   140  .     2     1     1     A    27    27   LEU    HA      H    27      5.103      4.629      0.474  1
        1   150  .     2     1     1     A    28    28   PRO    HA      H    28      5.096      4.616      0.480  1
        1     5  .     3     1     1     A     2     2   GLY     H      H     2      8.645      8.169      0.476  1
        1     6  .     3     1     1     A     2     2   GLY   HA2      H     2      3.887      3.942     -0.055  1
        1     7  .     3     1     1     A     2     2   GLY   HA3      H     2      3.764      3.944     -0.180  1
        1     8  .     3     1     1     A     3     3   GLU     H      H     3      7.071      8.081     -1.010  1
        1     9  .     3     1     1     A     3     3   GLU    HA      H     3      4.867      4.331      0.536  1
        1    14  .     3     1     1     A     4     4   THR     H      H     4      8.448      8.467     -0.019  1
        1    15  .     3     1     1     A     4     4   THR    HA      H     4      4.451      4.666     -0.215  1
        1    19  .     3     1     1     A     5     5   CYS     H      H     5      8.289      8.838     -0.549  1
        1    20  .     3     1     1     A     5     5   CYS    HA      H     5      5.162      4.654      0.508  1
        1    23  .     3     1     1     A     6     6   PHE     H      H     6      9.659      8.032      1.627  1
        1    24  .     3     1     1     A     6     6   PHE    HA      H     6      4.022      3.722      0.300  1
        1    30  .     3     1     1     A     7     7   GLY     H      H     7      9.220      7.922      1.298  1
        1    31  .     3     1     1     A     7     7   GLY   HA2      H     7      4.462      3.868      0.594  1
        1    32  .     3     1     1     A     7     7   GLY   HA3      H     7      3.881      3.953     -0.072  1
        1    33  .     3     1     1     A     8     8   GLY     H      H     8      8.215      8.530     -0.315  1
        1    34  .     3     1     1     A     8     8   GLY   HA2      H     8      4.577      3.993      0.584  1
        1    35  .     3     1     1     A     8     8   GLY   HA3      H     8      4.139      4.049      0.090  1
        1    36  .     3     1     1     A     9     9   THR     H      H     9      8.012      7.656      0.356  1
        1    37  .     3     1     1     A     9     9   THR    HA      H     9      4.740      4.331      0.409  1
        1    42  .     3     1     1     A    10    10   CYS     H      H    10      8.576      8.721     -0.145  1
        1    43  .     3     1     1     A    10    10   CYS    HA      H    10      4.685      5.297     -0.612  1
        1    46  .     3     1     1     A    11    11   ASN     H      H    11     11.445      9.492      1.953  1
        1    47  .     3     1     1     A    11    11   ASN    HA      H    11      4.827      4.654      0.173  1
        1    52  .     3     1     1     A    12    12   THR     H      H    12      9.679      7.883      1.796  1
        1    53  .     3     1     1     A    12    12   THR    HA      H    12      4.369      4.516     -0.147  1
        1    57  .     3     1     1     A    13    13   PRO    HA      H    13      4.308      4.275      0.033  1
        1    64  .     3     1     1     A    14    14   GLY     H      H    14      8.748      8.829     -0.081  1
        1    65  .     3     1     1     A    14    14   GLY   HA2      H    14      4.229      3.815      0.414  1
        1    66  .     3     1     1     A    14    14   GLY   HA3      H    14      3.747      3.816     -0.069  1
        1    67  .     3     1     1     A    15    15   CYS     H      H    15      7.712      7.526      0.186  1
        1    68  .     3     1     1     A    15    15   CYS    HA      H    15      5.331      4.664      0.667  1
        1    71  .     3     1     1     A    16    16   SER     H      H    16      9.548      9.448      0.100  1
        1    72  .     3     1     1     A    16    16   SER    HA      H    16      4.720      5.055     -0.335  1
        1    75  .     3     1     1     A    17    17   CYS     H      H    17      9.028      8.848      0.180  1
        1    76  .     3     1     1     A    17    17   CYS    HA      H    17      4.684      4.556      0.128  1
        1    79  .     3     1     1     A    18    18   THR     H      H    18      8.737      8.692      0.045  1
        1    80  .     3     1     1     A    18    18   THR    HA      H    18      4.498      4.851     -0.353  1
        1    85  .     3     1     1     A    19    19   TRP     H      H    19      7.677      8.176     -0.499  1
        1    86  .     3     1     1     A    19    19   TRP    HA      H    19      4.007      4.428     -0.421  1
        1    95  .     3     1     1     A    20    20   PRO    HA      H    20      3.323      3.676     -0.353  1
        1   102  .     3     1     1     A    21    21   ILE     H      H    21      8.646      7.510      1.136  1
        1   103  .     3     1     1     A    21    21   ILE    HA      H    21      4.249      4.727     -0.478  1
        1   113  .     3     1     1     A    22    22   CYS     H      H    22      7.444      9.155     -1.711  1
        1   114  .     3     1     1     A    22    22   CYS    HA      H    22      5.082      5.097     -0.015  1
        1   117  .     3     1     1     A    23    23   THR     H      H    23      9.953      9.237      0.716  1
        1   118  .     3     1     1     A    23    23   THR    HA      H    23      5.065      5.091     -0.026  1
        1   123  .     3     1     1     A    24    24   ARG     H      H    24      8.743      8.509      0.234  1
        1   124  .     3     1     1     A    24    24   ARG    HA      H    24      4.793      4.715      0.078  1
        1   132  .     3     1     1     A    25    25   ASP     H      H    25      9.403      9.494     -0.091  1
        1   133  .     3     1     1     A    25    25   ASP    HA      H    25      4.376      4.423     -0.047  1
        1   136  .     3     1     1     A    26    26   GLY     H      H    26      8.543      8.705     -0.162  1
        1   137  .     3     1     1     A    26    26   GLY   HA2      H    26      4.212      3.869      0.343  1
        1   138  .     3     1     1     A    26    26   GLY   HA3      H    26      3.616      3.871     -0.255  1
        1   139  .     3     1     1     A    27    27   LEU     H      H    27      7.799      8.135     -0.336  1
        1   140  .     3     1     1     A    27    27   LEU    HA      H    27      5.103      4.569      0.534  1
        1   150  .     3     1     1     A    28    28   PRO    HA      H    28      5.096      4.600      0.496  1
        1     5  .     4     1     1     A     2     2   GLY     H      H     2      8.645      8.173      0.472  1
        1     6  .     4     1     1     A     2     2   GLY   HA2      H     2      3.887      3.942     -0.055  1
        1     7  .     4     1     1     A     2     2   GLY   HA3      H     2      3.764      3.943     -0.179  1
        1     8  .     4     1     1     A     3     3   GLU     H      H     3      7.071      8.049     -0.978  1
        1     9  .     4     1     1     A     3     3   GLU    HA      H     3      4.867      4.336      0.531  1
        1    14  .     4     1     1     A     4     4   THR     H      H     4      8.448      8.488     -0.040  1
        1    15  .     4     1     1     A     4     4   THR    HA      H     4      4.451      4.785     -0.334  1
        1    19  .     4     1     1     A     5     5   CYS     H      H     5      8.289      8.866     -0.577  1
        1    20  .     4     1     1     A     5     5   CYS    HA      H     5      5.162      4.690      0.472  1
        1    23  .     4     1     1     A     6     6   PHE     H      H     6      9.659      8.047      1.612  1
        1    24  .     4     1     1     A     6     6   PHE    HA      H     6      4.022      3.686      0.336  1
        1    30  .     4     1     1     A     7     7   GLY     H      H     7      9.220      8.016      1.204  1
        1    31  .     4     1     1     A     7     7   GLY   HA2      H     7      4.462      4.050      0.412  1
        1    32  .     4     1     1     A     7     7   GLY   HA3      H     7      3.881      4.111     -0.230  1
        1    33  .     4     1     1     A     8     8   GLY     H      H     8      8.215      8.671     -0.456  1
        1    34  .     4     1     1     A     8     8   GLY   HA2      H     8      4.577      4.053      0.524  1
        1    35  .     4     1     1     A     8     8   GLY   HA3      H     8      4.139      4.076      0.063  1
        1    36  .     4     1     1     A     9     9   THR     H      H     9      8.012      7.844      0.168  1
        1    37  .     4     1     1     A     9     9   THR    HA      H     9      4.740      4.904     -0.164  1
        1    42  .     4     1     1     A    10    10   CYS     H      H    10      8.576      8.856     -0.280  1
        1    43  .     4     1     1     A    10    10   CYS    HA      H    10      4.685      5.523     -0.838  1
        1    46  .     4     1     1     A    11    11   ASN     H      H    11     11.445      9.351      2.094  1
        1    47  .     4     1     1     A    11    11   ASN    HA      H    11      4.827      4.729      0.098  1
        1    52  .     4     1     1     A    12    12   THR     H      H    12      9.679      7.742      1.937  1
        1    53  .     4     1     1     A    12    12   THR    HA      H    12      4.369      4.517     -0.148  1
        1    57  .     4     1     1     A    13    13   PRO    HA      H    13      4.308      4.278      0.030  1
        1    64  .     4     1     1     A    14    14   GLY     H      H    14      8.748      8.822     -0.074  1
        1    65  .     4     1     1     A    14    14   GLY   HA2      H    14      4.229      3.812      0.417  1
        1    66  .     4     1     1     A    14    14   GLY   HA3      H    14      3.747      3.813     -0.066  1
        1    67  .     4     1     1     A    15    15   CYS     H      H    15      7.712      7.529      0.183  1
        1    68  .     4     1     1     A    15    15   CYS    HA      H    15      5.331      4.679      0.652  1
        1    71  .     4     1     1     A    16    16   SER     H      H    16      9.548      9.465      0.083  1
        1    72  .     4     1     1     A    16    16   SER    HA      H    16      4.720      5.065     -0.345  1
        1    75  .     4     1     1     A    17    17   CYS     H      H    17      9.028      8.930      0.098  1
        1    76  .     4     1     1     A    17    17   CYS    HA      H    17      4.684      4.567      0.117  1
        1    79  .     4     1     1     A    18    18   THR     H      H    18      8.737      8.489      0.248  1
        1    80  .     4     1     1     A    18    18   THR    HA      H    18      4.498      4.925     -0.427  1
        1    85  .     4     1     1     A    19    19   TRP     H      H    19      7.677      8.723     -1.046  1
        1    86  .     4     1     1     A    19    19   TRP    HA      H    19      4.007      4.317     -0.310  1
        1    95  .     4     1     1     A    20    20   PRO    HA      H    20      3.323      3.338     -0.015  1
        1   102  .     4     1     1     A    21    21   ILE     H      H    21      8.646      7.398      1.248  1
        1   103  .     4     1     1     A    21    21   ILE    HA      H    21      4.249      4.713     -0.464  1
        1   113  .     4     1     1     A    22    22   CYS     H      H    22      7.444      9.154     -1.710  1
        1   114  .     4     1     1     A    22    22   CYS    HA      H    22      5.082      5.115     -0.033  1
        1   117  .     4     1     1     A    23    23   THR     H      H    23      9.953      9.255      0.698  1
        1   118  .     4     1     1     A    23    23   THR    HA      H    23      5.065      5.132     -0.067  1
        1   123  .     4     1     1     A    24    24   ARG     H      H    24      8.743      8.466      0.277  1
        1   124  .     4     1     1     A    24    24   ARG    HA      H    24      4.793      4.695      0.098  1
        1   132  .     4     1     1     A    25    25   ASP     H      H    25      9.403      9.493     -0.090  1
        1   133  .     4     1     1     A    25    25   ASP    HA      H    25      4.376      4.407     -0.031  1
        1   136  .     4     1     1     A    26    26   GLY     H      H    26      8.543      8.752     -0.209  1
        1   137  .     4     1     1     A    26    26   GLY   HA2      H    26      4.212      3.897      0.315  1
        1   138  .     4     1     1     A    26    26   GLY   HA3      H    26      3.616      3.898     -0.282  1
        1   139  .     4     1     1     A    27    27   LEU     H      H    27      7.799      8.184     -0.385  1
        1   140  .     4     1     1     A    27    27   LEU    HA      H    27      5.103      4.633      0.470  1
        1   150  .     4     1     1     A    28    28   PRO    HA      H    28      5.096      4.618      0.478  1
        1     5  .     5     1     1     A     2     2   GLY     H      H     2      8.645      8.488      0.157  1
        1     6  .     5     1     1     A     2     2   GLY   HA2      H     2      3.887      3.895     -0.008  1
        1     7  .     5     1     1     A     2     2   GLY   HA3      H     2      3.764      3.895     -0.131  1
        1     8  .     5     1     1     A     3     3   GLU     H      H     3      7.071      7.765     -0.694  1
        1     9  .     5     1     1     A     3     3   GLU    HA      H     3      4.867      4.907     -0.040  1
        1    14  .     5     1     1     A     4     4   THR     H      H     4      8.448      8.652     -0.204  1
        1    15  .     5     1     1     A     4     4   THR    HA      H     4      4.451      5.017     -0.566  1
        1    19  .     5     1     1     A     5     5   CYS     H      H     5      8.289      8.730     -0.441  1
        1    20  .     5     1     1     A     5     5   CYS    HA      H     5      5.162      4.683      0.479  1
        1    23  .     5     1     1     A     6     6   PHE     H      H     6      9.659      8.040      1.619  1
        1    24  .     5     1     1     A     6     6   PHE    HA      H     6      4.022      3.668      0.354  1
        1    30  .     5     1     1     A     7     7   GLY     H      H     7      9.220      7.999      1.221  1
        1    31  .     5     1     1     A     7     7   GLY   HA2      H     7      4.462      4.039      0.423  1
        1    32  .     5     1     1     A     7     7   GLY   HA3      H     7      3.881      4.101     -0.220  1
        1    33  .     5     1     1     A     8     8   GLY     H      H     8      8.215      8.672     -0.457  1
        1    34  .     5     1     1     A     8     8   GLY   HA2      H     8      4.577      4.042      0.535  1
        1    35  .     5     1     1     A     8     8   GLY   HA3      H     8      4.139      4.094      0.045  1
        1    36  .     5     1     1     A     9     9   THR     H      H     9      8.012      7.689      0.323  1
        1    37  .     5     1     1     A     9     9   THR    HA      H     9      4.740      4.343      0.397  1
        1    42  .     5     1     1     A    10    10   CYS     H      H    10      8.576      8.690     -0.114  1
        1    43  .     5     1     1     A    10    10   CYS    HA      H    10      4.685      5.124     -0.439  1
        1    46  .     5     1     1     A    11    11   ASN     H      H    11     11.445      8.885      2.560  1
        1    47  .     5     1     1     A    11    11   ASN    HA      H    11      4.827      4.742      0.085  1
        1    52  .     5     1     1     A    12    12   THR     H      H    12      9.679      7.780      1.899  1
        1    53  .     5     1     1     A    12    12   THR    HA      H    12      4.369      4.519     -0.150  1
        1    57  .     5     1     1     A    13    13   PRO    HA      H    13      4.308      4.277      0.031  1
        1    64  .     5     1     1     A    14    14   GLY     H      H    14      8.748      8.805     -0.057  1
        1    65  .     5     1     1     A    14    14   GLY   HA2      H    14      4.229      3.812      0.417  1
        1    66  .     5     1     1     A    14    14   GLY   HA3      H    14      3.747      3.813     -0.066  1
        1    67  .     5     1     1     A    15    15   CYS     H      H    15      7.712      7.527      0.185  1
        1    68  .     5     1     1     A    15    15   CYS    HA      H    15      5.331      4.696      0.635  1
        1    71  .     5     1     1     A    16    16   SER     H      H    16      9.548      9.436      0.112  1
        1    72  .     5     1     1     A    16    16   SER    HA      H    16      4.720      5.099     -0.379  1
        1    75  .     5     1     1     A    17    17   CYS     H      H    17      9.028      9.034     -0.006  1
        1    76  .     5     1     1     A    17    17   CYS    HA      H    17      4.684      4.634      0.050  1
        1    79  .     5     1     1     A    18    18   THR     H      H    18      8.737      8.860     -0.123  1
        1    80  .     5     1     1     A    18    18   THR    HA      H    18      4.498      4.827     -0.329  1
        1    85  .     5     1     1     A    19    19   TRP     H      H    19      7.677      8.198     -0.521  1
        1    86  .     5     1     1     A    19    19   TRP    HA      H    19      4.007      4.341     -0.334  1
        1    95  .     5     1     1     A    20    20   PRO    HA      H    20      3.323      3.427     -0.104  1
        1   102  .     5     1     1     A    21    21   ILE     H      H    21      8.646      7.517      1.129  1
        1   103  .     5     1     1     A    21    21   ILE    HA      H    21      4.249      4.755     -0.506  1
        1   113  .     5     1     1     A    22    22   CYS     H      H    22      7.444      9.409     -1.965  1
        1   114  .     5     1     1     A    22    22   CYS    HA      H    22      5.082      5.128     -0.046  1
        1   117  .     5     1     1     A    23    23   THR     H      H    23      9.953      9.224      0.729  1
        1   118  .     5     1     1     A    23    23   THR    HA      H    23      5.065      5.106     -0.041  1
        1   123  .     5     1     1     A    24    24   ARG     H      H    24      8.743      8.420      0.323  1
        1   124  .     5     1     1     A    24    24   ARG    HA      H    24      4.793      4.715      0.078  1
        1   132  .     5     1     1     A    25    25   ASP     H      H    25      9.403      9.493     -0.090  1
        1   133  .     5     1     1     A    25    25   ASP    HA      H    25      4.376      4.409     -0.033  1
        1   136  .     5     1     1     A    26    26   GLY     H      H    26      8.543      8.797     -0.254  1
        1   137  .     5     1     1     A    26    26   GLY   HA2      H    26      4.212      3.920      0.292  1
        1   138  .     5     1     1     A    26    26   GLY   HA3      H    26      3.616      3.921     -0.305  1
        1   139  .     5     1     1     A    27    27   LEU     H      H    27      7.799      8.247     -0.448  1
        1   140  .     5     1     1     A    27    27   LEU    HA      H    27      5.103      4.636      0.467  1
        1   150  .     5     1     1     A    28    28   PRO    HA      H    28      5.096      4.625      0.471  1
        1     5  .     6     1     1     A     2     2   GLY     H      H     2      8.645      8.168      0.477  1
        1     6  .     6     1     1     A     2     2   GLY   HA2      H     2      3.887      3.942     -0.055  1
        1     7  .     6     1     1     A     2     2   GLY   HA3      H     2      3.764      3.944     -0.180  1
        1     8  .     6     1     1     A     3     3   GLU     H      H     3      7.071      8.074     -1.003  1
        1     9  .     6     1     1     A     3     3   GLU    HA      H     3      4.867      4.331      0.536  1
        1    14  .     6     1     1     A     4     4   THR     H      H     4      8.448      8.467     -0.019  1
        1    15  .     6     1     1     A     4     4   THR    HA      H     4      4.451      4.664     -0.213  1
        1    19  .     6     1     1     A     5     5   CYS     H      H     5      8.289      8.815     -0.526  1
        1    20  .     6     1     1     A     5     5   CYS    HA      H     5      5.162      4.660      0.502  1
        1    23  .     6     1     1     A     6     6   PHE     H      H     6      9.659      8.037      1.622  1
        1    24  .     6     1     1     A     6     6   PHE    HA      H     6      4.022      3.764      0.258  1
        1    30  .     6     1     1     A     7     7   GLY     H      H     7      9.220      7.973      1.247  1
        1    31  .     6     1     1     A     7     7   GLY   HA2      H     7      4.462      3.868      0.594  1
        1    32  .     6     1     1     A     7     7   GLY   HA3      H     7      3.881      3.957     -0.076  1
        1    33  .     6     1     1     A     8     8   GLY     H      H     8      8.215      8.551     -0.336  1
        1    34  .     6     1     1     A     8     8   GLY   HA2      H     8      4.577      3.999      0.578  1
        1    35  .     6     1     1     A     8     8   GLY   HA3      H     8      4.139      4.060      0.079  1
        1    36  .     6     1     1     A     9     9   THR     H      H     9      8.012      7.926      0.086  1
        1    37  .     6     1     1     A     9     9   THR    HA      H     9      4.740      4.399      0.341  1
        1    42  .     6     1     1     A    10    10   CYS     H      H    10      8.576      8.638     -0.062  1
        1    43  .     6     1     1     A    10    10   CYS    HA      H    10      4.685      5.098     -0.413  1
        1    46  .     6     1     1     A    11    11   ASN     H      H    11     11.445      9.450      1.995  1
        1    47  .     6     1     1     A    11    11   ASN    HA      H    11      4.827      4.648      0.179  1
        1    52  .     6     1     1     A    12    12   THR     H      H    12      9.679      7.783      1.896  1
        1    53  .     6     1     1     A    12    12   THR    HA      H    12      4.369      4.519     -0.150  1
        1    57  .     6     1     1     A    13    13   PRO    HA      H    13      4.308      4.277      0.031  1
        1    64  .     6     1     1     A    14    14   GLY     H      H    14      8.748      8.841     -0.093  1
        1    65  .     6     1     1     A    14    14   GLY   HA2      H    14      4.229      3.819      0.410  1
        1    66  .     6     1     1     A    14    14   GLY   HA3      H    14      3.747      3.820     -0.073  1
        1    67  .     6     1     1     A    15    15   CYS     H      H    15      7.712      7.506      0.206  1
        1    68  .     6     1     1     A    15    15   CYS    HA      H    15      5.331      4.690      0.641  1
        1    71  .     6     1     1     A    16    16   SER     H      H    16      9.548      9.442      0.106  1
        1    72  .     6     1     1     A    16    16   SER    HA      H    16      4.720      5.081     -0.361  1
        1    75  .     6     1     1     A    17    17   CYS     H      H    17      9.028      8.958      0.070  1
        1    76  .     6     1     1     A    17    17   CYS    HA      H    17      4.684      4.631      0.053  1
        1    79  .     6     1     1     A    18    18   THR     H      H    18      8.737      8.730      0.007  1
        1    80  .     6     1     1     A    18    18   THR    HA      H    18      4.498      4.813     -0.315  1
        1    85  .     6     1     1     A    19    19   TRP     H      H    19      7.677      8.403     -0.726  1
        1    86  .     6     1     1     A    19    19   TRP    HA      H    19      4.007      4.425     -0.418  1
        1    95  .     6     1     1     A    20    20   PRO    HA      H    20      3.323      3.635     -0.312  1
        1   102  .     6     1     1     A    21    21   ILE     H      H    21      8.646      7.524      1.122  1
        1   103  .     6     1     1     A    21    21   ILE    HA      H    21      4.249      4.723     -0.474  1
        1   113  .     6     1     1     A    22    22   CYS     H      H    22      7.444      9.126     -1.682  1
        1   114  .     6     1     1     A    22    22   CYS    HA      H    22      5.082      5.052      0.030  1
        1   117  .     6     1     1     A    23    23   THR     H      H    23      9.953      9.239      0.714  1
        1   118  .     6     1     1     A    23    23   THR    HA      H    23      5.065      5.118     -0.053  1
        1   123  .     6     1     1     A    24    24   ARG     H      H    24      8.743      8.433      0.310  1
        1   124  .     6     1     1     A    24    24   ARG    HA      H    24      4.793      4.717      0.076  1
        1   132  .     6     1     1     A    25    25   ASP     H      H    25      9.403      9.491     -0.088  1
        1   133  .     6     1     1     A    25    25   ASP    HA      H    25      4.376      4.410     -0.034  1
        1   136  .     6     1     1     A    26    26   GLY     H      H    26      8.543      8.760     -0.217  1
        1   137  .     6     1     1     A    26    26   GLY   HA2      H    26      4.212      3.883      0.329  1
        1   138  .     6     1     1     A    26    26   GLY   HA3      H    26      3.616      3.885     -0.269  1
        1   139  .     6     1     1     A    27    27   LEU     H      H    27      7.799      8.250     -0.451  1
        1   140  .     6     1     1     A    27    27   LEU    HA      H    27      5.103      4.643      0.460  1
        1   150  .     6     1     1     A    28    28   PRO    HA      H    28      5.096      4.616      0.480  1
        1     5  .     7     1     1     A     2     2   GLY     H      H     2      8.645      8.176      0.469  1
        1     6  .     7     1     1     A     2     2   GLY   HA2      H     2      3.887      3.949     -0.062  1
        1     7  .     7     1     1     A     2     2   GLY   HA3      H     2      3.764      3.951     -0.187  1
        1     8  .     7     1     1     A     3     3   GLU     H      H     3      7.071      8.001     -0.930  1
        1     9  .     7     1     1     A     3     3   GLU    HA      H     3      4.867      4.331      0.536  1
        1    14  .     7     1     1     A     4     4   THR     H      H     4      8.448      8.431      0.017  1
        1    15  .     7     1     1     A     4     4   THR    HA      H     4      4.451      4.783     -0.332  1
        1    19  .     7     1     1     A     5     5   CYS     H      H     5      8.289      8.898     -0.609  1
        1    20  .     7     1     1     A     5     5   CYS    HA      H     5      5.162      4.683      0.479  1
        1    23  .     7     1     1     A     6     6   PHE     H      H     6      9.659      8.044      1.615  1
        1    24  .     7     1     1     A     6     6   PHE    HA      H     6      4.022      3.642      0.380  1
        1    30  .     7     1     1     A     7     7   GLY     H      H     7      9.220      7.996      1.224  1
        1    31  .     7     1     1     A     7     7   GLY   HA2      H     7      4.462      4.050      0.412  1
        1    32  .     7     1     1     A     7     7   GLY   HA3      H     7      3.881      4.112     -0.231  1
        1    33  .     7     1     1     A     8     8   GLY     H      H     8      8.215      8.656     -0.441  1
        1    34  .     7     1     1     A     8     8   GLY   HA2      H     8      4.577      4.041      0.536  1
        1    35  .     7     1     1     A     8     8   GLY   HA3      H     8      4.139      4.090      0.049  1
        1    36  .     7     1     1     A     9     9   THR     H      H     9      8.012      7.709      0.303  1
        1    37  .     7     1     1     A     9     9   THR    HA      H     9      4.740      4.344      0.396  1
        1    42  .     7     1     1     A    10    10   CYS     H      H    10      8.576      8.655     -0.079  1
        1    43  .     7     1     1     A    10    10   CYS    HA      H    10      4.685      5.127     -0.442  1
        1    46  .     7     1     1     A    11    11   ASN     H      H    11     11.445      8.915      2.530  1
        1    47  .     7     1     1     A    11    11   ASN    HA      H    11      4.827      4.747      0.080  1
        1    52  .     7     1     1     A    12    12   THR     H      H    12      9.679      7.798      1.881  1
        1    53  .     7     1     1     A    12    12   THR    HA      H    12      4.369      4.718     -0.349  1
        1    57  .     7     1     1     A    13    13   PRO    HA      H    13      4.308      4.282      0.026  1
        1    64  .     7     1     1     A    14    14   GLY     H      H    14      8.748      8.842     -0.094  1
        1    65  .     7     1     1     A    14    14   GLY   HA2      H    14      4.229      3.820      0.409  1
        1    66  .     7     1     1     A    14    14   GLY   HA3      H    14      3.747      3.821     -0.074  1
        1    67  .     7     1     1     A    15    15   CYS     H      H    15      7.712      7.458      0.254  1
        1    68  .     7     1     1     A    15    15   CYS    HA      H    15      5.331      4.690      0.641  1
        1    71  .     7     1     1     A    16    16   SER     H      H    16      9.548      9.422      0.126  1
        1    72  .     7     1     1     A    16    16   SER    HA      H    16      4.720      5.047     -0.327  1
        1    75  .     7     1     1     A    17    17   CYS     H      H    17      9.028      8.842      0.186  1
        1    76  .     7     1     1     A    17    17   CYS    HA      H    17      4.684      4.548      0.136  1
        1    79  .     7     1     1     A    18    18   THR     H      H    18      8.737      8.577      0.160  1
        1    80  .     7     1     1     A    18    18   THR    HA      H    18      4.498      4.817     -0.319  1
        1    85  .     7     1     1     A    19    19   TRP     H      H    19      7.677      8.279     -0.602  1
        1    86  .     7     1     1     A    19    19   TRP    HA      H    19      4.007      4.334     -0.327  1
        1    95  .     7     1     1     A    20    20   PRO    HA      H    20      3.323      3.412     -0.089  1
        1   102  .     7     1     1     A    21    21   ILE     H      H    21      8.646      7.518      1.128  1
        1   103  .     7     1     1     A    21    21   ILE    HA      H    21      4.249      4.764     -0.515  1
        1   113  .     7     1     1     A    22    22   CYS     H      H    22      7.444      9.026     -1.582  1
        1   114  .     7     1     1     A    22    22   CYS    HA      H    22      5.082      5.058      0.024  1
        1   117  .     7     1     1     A    23    23   THR     H      H    23      9.953      9.258      0.695  1
        1   118  .     7     1     1     A    23    23   THR    HA      H    23      5.065      5.109     -0.044  1
        1   123  .     7     1     1     A    24    24   ARG     H      H    24      8.743      8.495      0.248  1
        1   124  .     7     1     1     A    24    24   ARG    HA      H    24      4.793      4.680      0.113  1
        1   132  .     7     1     1     A    25    25   ASP     H      H    25      9.403      9.493     -0.090  1
        1   133  .     7     1     1     A    25    25   ASP    HA      H    25      4.376      4.416     -0.040  1
        1   136  .     7     1     1     A    26    26   GLY     H      H    26      8.543      8.713     -0.170  1
        1   137  .     7     1     1     A    26    26   GLY   HA2      H    26      4.212      3.874      0.338  1
        1   138  .     7     1     1     A    26    26   GLY   HA3      H    26      3.616      3.875     -0.259  1
        1   139  .     7     1     1     A    27    27   LEU     H      H    27      7.799      8.118     -0.319  1
        1   140  .     7     1     1     A    27    27   LEU    HA      H    27      5.103      4.631      0.472  1
        1   150  .     7     1     1     A    28    28   PRO    HA      H    28      5.096      4.617      0.479  1
        1     5  .     8     1     1     A     2     2   GLY     H      H     2      8.645      8.617      0.028  1
        1     6  .     8     1     1     A     2     2   GLY   HA2      H     2      3.887      3.909     -0.022  1
        1     7  .     8     1     1     A     2     2   GLY   HA3      H     2      3.764      3.910     -0.146  1
        1     8  .     8     1     1     A     3     3   GLU     H      H     3      7.071      7.599     -0.528  1
        1     9  .     8     1     1     A     3     3   GLU    HA      H     3      4.867      4.860      0.007  1
        1    14  .     8     1     1     A     4     4   THR     H      H     4      8.448      8.490     -0.042  1
        1    15  .     8     1     1     A     4     4   THR    HA      H     4      4.451      4.979     -0.528  1
        1    19  .     8     1     1     A     5     5   CYS     H      H     5      8.289      8.825     -0.536  1
        1    20  .     8     1     1     A     5     5   CYS    HA      H     5      5.162      4.682      0.480  1
        1    23  .     8     1     1     A     6     6   PHE     H      H     6      9.659      8.049      1.610  1
        1    24  .     8     1     1     A     6     6   PHE    HA      H     6      4.022      3.652      0.370  1
        1    30  .     8     1     1     A     7     7   GLY     H      H     7      9.220      7.998      1.222  1
        1    31  .     8     1     1     A     7     7   GLY   HA2      H     7      4.462      4.051      0.411  1
        1    32  .     8     1     1     A     7     7   GLY   HA3      H     7      3.881      4.113     -0.232  1
        1    33  .     8     1     1     A     8     8   GLY     H      H     8      8.215      8.656     -0.441  1
        1    34  .     8     1     1     A     8     8   GLY   HA2      H     8      4.577      4.041      0.536  1
        1    35  .     8     1     1     A     8     8   GLY   HA3      H     8      4.139      4.091      0.048  1
        1    36  .     8     1     1     A     9     9   THR     H      H     9      8.012      7.706      0.306  1
        1    37  .     8     1     1     A     9     9   THR    HA      H     9      4.740      4.342      0.398  1
        1    42  .     8     1     1     A    10    10   CYS     H      H    10      8.576      8.652     -0.076  1
        1    43  .     8     1     1     A    10    10   CYS    HA      H    10      4.685      5.290     -0.605  1
        1    46  .     8     1     1     A    11    11   ASN     H      H    11     11.445      9.420      2.025  1
        1    47  .     8     1     1     A    11    11   ASN    HA      H    11      4.827      4.651      0.176  1
        1    52  .     8     1     1     A    12    12   THR     H      H    12      9.679      7.868      1.811  1
        1    53  .     8     1     1     A    12    12   THR    HA      H    12      4.369      4.541     -0.172  1
        1    57  .     8     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  1
        1    64  .     8     1     1     A    14    14   GLY     H      H    14      8.748      8.830     -0.082  1
        1    65  .     8     1     1     A    14    14   GLY   HA2      H    14      4.229      3.811      0.418  1
        1    66  .     8     1     1     A    14    14   GLY   HA3      H    14      3.747      3.812     -0.065  1
        1    67  .     8     1     1     A    15    15   CYS     H      H    15      7.712      7.554      0.158  1
        1    68  .     8     1     1     A    15    15   CYS    HA      H    15      5.331      4.690      0.641  1
        1    71  .     8     1     1     A    16    16   SER     H      H    16      9.548      9.321      0.227  1
        1    72  .     8     1     1     A    16    16   SER    HA      H    16      4.720      5.083     -0.363  1
        1    75  .     8     1     1     A    17    17   CYS     H      H    17      9.028      9.021      0.007  1
        1    76  .     8     1     1     A    17    17   CYS    HA      H    17      4.684      4.625      0.059  1
        1    79  .     8     1     1     A    18    18   THR     H      H    18      8.737      8.725      0.012  1
        1    80  .     8     1     1     A    18    18   THR    HA      H    18      4.498      4.807     -0.309  1
        1    85  .     8     1     1     A    19    19   TRP     H      H    19      7.677      8.211     -0.534  1
        1    86  .     8     1     1     A    19    19   TRP    HA      H    19      4.007      4.339     -0.332  1
        1    95  .     8     1     1     A    20    20   PRO    HA      H    20      3.323      3.424     -0.101  1
        1   102  .     8     1     1     A    21    21   ILE     H      H    21      8.646      7.512      1.134  1
        1   103  .     8     1     1     A    21    21   ILE    HA      H    21      4.249      4.758     -0.509  1
        1   113  .     8     1     1     A    22    22   CYS     H      H    22      7.444      9.161     -1.717  1
        1   114  .     8     1     1     A    22    22   CYS    HA      H    22      5.082      5.075      0.007  1
        1   117  .     8     1     1     A    23    23   THR     H      H    23      9.953      9.256      0.697  1
        1   118  .     8     1     1     A    23    23   THR    HA      H    23      5.065      5.182     -0.117  1
        1   123  .     8     1     1     A    24    24   ARG     H      H    24      8.743      8.438      0.305  1
        1   124  .     8     1     1     A    24    24   ARG    HA      H    24      4.793      4.711      0.082  1
        1   132  .     8     1     1     A    25    25   ASP     H      H    25      9.403      9.491     -0.088  1
        1   133  .     8     1     1     A    25    25   ASP    HA      H    25      4.376      4.423     -0.047  1
        1   136  .     8     1     1     A    26    26   GLY     H      H    26      8.543      8.690     -0.147  1
        1   137  .     8     1     1     A    26    26   GLY   HA2      H    26      4.212      3.864      0.348  1
        1   138  .     8     1     1     A    26    26   GLY   HA3      H    26      3.616      3.865     -0.249  1
        1   139  .     8     1     1     A    27    27   LEU     H      H    27      7.799      8.285     -0.486  1
        1   140  .     8     1     1     A    27    27   LEU    HA      H    27      5.103      4.561      0.542  1
        1   150  .     8     1     1     A    28    28   PRO    HA      H    28      5.096      4.598      0.498  1
        1     5  .     9     1     1     A     2     2   GLY     H      H     2      8.645      8.161      0.484  1
        1     6  .     9     1     1     A     2     2   GLY   HA2      H     2      3.887      3.934     -0.047  1
        1     7  .     9     1     1     A     2     2   GLY   HA3      H     2      3.764      3.937     -0.173  1
        1     8  .     9     1     1     A     3     3   GLU     H      H     3      7.071      8.055     -0.984  1
        1     9  .     9     1     1     A     3     3   GLU    HA      H     3      4.867      4.330      0.537  1
        1    14  .     9     1     1     A     4     4   THR     H      H     4      8.448      8.785     -0.337  1
        1    15  .     9     1     1     A     4     4   THR    HA      H     4      4.451      4.435      0.016  1
        1    19  .     9     1     1     A     5     5   CYS     H      H     5      8.289      8.622     -0.333  1
        1    20  .     9     1     1     A     5     5   CYS    HA      H     5      5.162      4.289      0.873  1
        1    23  .     9     1     1     A     6     6   PHE     H      H     6      9.659      7.319      2.340  1
        1    24  .     9     1     1     A     6     6   PHE    HA      H     6      4.022      3.671      0.351  1
        1    30  .     9     1     1     A     7     7   GLY     H      H     7      9.220      7.371      1.849  1
        1    31  .     9     1     1     A     7     7   GLY   HA2      H     7      4.462      3.982      0.480  1
        1    32  .     9     1     1     A     7     7   GLY   HA3      H     7      3.881      4.158     -0.277  1
        1    33  .     9     1     1     A     8     8   GLY     H      H     8      8.215      8.663     -0.448  1
        1    34  .     9     1     1     A     8     8   GLY   HA2      H     8      4.577      4.040      0.537  1
        1    35  .     9     1     1     A     8     8   GLY   HA3      H     8      4.139      4.052      0.087  1
        1    36  .     9     1     1     A     9     9   THR     H      H     9      8.012      7.686      0.326  1
        1    37  .     9     1     1     A     9     9   THR    HA      H     9      4.740      4.845     -0.105  1
        1    42  .     9     1     1     A    10    10   CYS     H      H    10      8.576      8.831     -0.255  1
        1    43  .     9     1     1     A    10    10   CYS    HA      H    10      4.685      5.482     -0.797  1
        1    46  .     9     1     1     A    11    11   ASN     H      H    11     11.445      9.320      2.125  1
        1    47  .     9     1     1     A    11    11   ASN    HA      H    11      4.827      4.684      0.143  1
        1    52  .     9     1     1     A    12    12   THR     H      H    12      9.679      7.615      2.064  1
        1    53  .     9     1     1     A    12    12   THR    HA      H    12      4.369      4.487     -0.118  1
        1    57  .     9     1     1     A    13    13   PRO    HA      H    13      4.308      4.261      0.047  1
        1    64  .     9     1     1     A    14    14   GLY     H      H    14      8.748      8.809     -0.061  1
        1    65  .     9     1     1     A    14    14   GLY   HA2      H    14      4.229      3.800      0.429  1
        1    66  .     9     1     1     A    14    14   GLY   HA3      H    14      3.747      3.801     -0.054  1
        1    67  .     9     1     1     A    15    15   CYS     H      H    15      7.712      7.578      0.134  1
        1    68  .     9     1     1     A    15    15   CYS    HA      H    15      5.331      4.641      0.690  1
        1    71  .     9     1     1     A    16    16   SER     H      H    16      9.548      9.467      0.081  1
        1    72  .     9     1     1     A    16    16   SER    HA      H    16      4.720      5.067     -0.347  1
        1    75  .     9     1     1     A    17    17   CYS     H      H    17      9.028      8.941      0.087  1
        1    76  .     9     1     1     A    17    17   CYS    HA      H    17      4.684      4.550      0.134  1
        1    79  .     9     1     1     A    18    18   THR     H      H    18      8.737      8.639      0.098  1
        1    80  .     9     1     1     A    18    18   THR    HA      H    18      4.498      4.813     -0.315  1
        1    85  .     9     1     1     A    19    19   TRP     H      H    19      7.677      8.299     -0.622  1
        1    86  .     9     1     1     A    19    19   TRP    HA      H    19      4.007      4.412     -0.405  1
        1    95  .     9     1     1     A    20    20   PRO    HA      H    20      3.323      3.662     -0.339  1
        1   102  .     9     1     1     A    21    21   ILE     H      H    21      8.646      7.623      1.023  1
        1   103  .     9     1     1     A    21    21   ILE    HA      H    21      4.249      4.707     -0.458  1
        1   113  .     9     1     1     A    22    22   CYS     H      H    22      7.444      9.030     -1.586  1
        1   114  .     9     1     1     A    22    22   CYS    HA      H    22      5.082      5.018      0.064  1
        1   117  .     9     1     1     A    23    23   THR     H      H    23      9.953      9.192      0.761  1
        1   118  .     9     1     1     A    23    23   THR    HA      H    23      5.065      5.104     -0.039  1
        1   123  .     9     1     1     A    24    24   ARG     H      H    24      8.743      8.482      0.261  1
        1   124  .     9     1     1     A    24    24   ARG    HA      H    24      4.793      4.749      0.044  1
        1   132  .     9     1     1     A    25    25   ASP     H      H    25      9.403      9.487     -0.084  1
        1   133  .     9     1     1     A    25    25   ASP    HA      H    25      4.376      4.409     -0.033  1
        1   136  .     9     1     1     A    26    26   GLY     H      H    26      8.543      8.676     -0.133  1
        1   137  .     9     1     1     A    26    26   GLY   HA2      H    26      4.212      3.859      0.353  1
        1   138  .     9     1     1     A    26    26   GLY   HA3      H    26      3.616      3.860     -0.244  1
        1   139  .     9     1     1     A    27    27   LEU     H      H    27      7.799      8.139     -0.340  1
        1   140  .     9     1     1     A    27    27   LEU    HA      H    27      5.103      4.566      0.537  1
        1   150  .     9     1     1     A    28    28   PRO    HA      H    28      5.096      4.594      0.502  1
        1     5  .    10     1     1     A     2     2   GLY     H      H     2      8.645      8.169      0.476  1
        1     6  .    10     1     1     A     2     2   GLY   HA2      H     2      3.887      3.934     -0.047  1
        1     7  .    10     1     1     A     2     2   GLY   HA3      H     2      3.764      3.936     -0.172  1
        1     8  .    10     1     1     A     3     3   GLU     H      H     3      7.071      8.099     -1.028  1
        1     9  .    10     1     1     A     3     3   GLU    HA      H     3      4.867      4.331      0.536  1
        1    14  .    10     1     1     A     4     4   THR     H      H     4      8.448      8.687     -0.239  1
        1    15  .    10     1     1     A     4     4   THR    HA      H     4      4.451      4.351      0.100  1
        1    19  .    10     1     1     A     5     5   CYS     H      H     5      8.289      8.742     -0.453  1
        1    20  .    10     1     1     A     5     5   CYS    HA      H     5      5.162      4.745      0.417  1
        1    23  .    10     1     1     A     6     6   PHE     H      H     6      9.659      7.958      1.701  1
        1    24  .    10     1     1     A     6     6   PHE    HA      H     6      4.022      3.794      0.228  1
        1    30  .    10     1     1     A     7     7   GLY     H      H     7      9.220      7.977      1.243  1
        1    31  .    10     1     1     A     7     7   GLY   HA2      H     7      4.462      3.850      0.612  1
        1    32  .    10     1     1     A     7     7   GLY   HA3      H     7      3.881      3.947     -0.066  1
        1    33  .    10     1     1     A     8     8   GLY     H      H     8      8.215      8.356     -0.141  1
        1    34  .    10     1     1     A     8     8   GLY   HA2      H     8      4.577      4.015      0.562  1
        1    35  .    10     1     1     A     8     8   GLY   HA3      H     8      4.139      4.056      0.083  1
        1    36  .    10     1     1     A     9     9   THR     H      H     9      8.012      7.830      0.182  1
        1    37  .    10     1     1     A     9     9   THR    HA      H     9      4.740      4.872     -0.132  1
        1    42  .    10     1     1     A    10    10   CYS     H      H    10      8.576      8.923     -0.347  1
        1    43  .    10     1     1     A    10    10   CYS    HA      H    10      4.685      5.177     -0.492  1
        1    46  .    10     1     1     A    11    11   ASN     H      H    11     11.445      8.952      2.493  1
        1    47  .    10     1     1     A    11    11   ASN    HA      H    11      4.827      4.787      0.040  1
        1    52  .    10     1     1     A    12    12   THR     H      H    12      9.679      7.567      2.112  1
        1    53  .    10     1     1     A    12    12   THR    HA      H    12      4.369      4.500     -0.131  1
        1    57  .    10     1     1     A    13    13   PRO    HA      H    13      4.308      4.273      0.035  1
        1    64  .    10     1     1     A    14    14   GLY     H      H    14      8.748      8.796     -0.048  1
        1    65  .    10     1     1     A    14    14   GLY   HA2      H    14      4.229      3.816      0.413  1
        1    66  .    10     1     1     A    14    14   GLY   HA3      H    14      3.747      3.817     -0.070  1
        1    67  .    10     1     1     A    15    15   CYS     H      H    15      7.712      7.556      0.156  1
        1    68  .    10     1     1     A    15    15   CYS    HA      H    15      5.331      4.659      0.672  1
        1    71  .    10     1     1     A    16    16   SER     H      H    16      9.548      9.457      0.091  1
        1    72  .    10     1     1     A    16    16   SER    HA      H    16      4.720      4.977     -0.257  1
        1    75  .    10     1     1     A    17    17   CYS     H      H    17      9.028      8.917      0.111  1
        1    76  .    10     1     1     A    17    17   CYS    HA      H    17      4.684      4.591      0.093  1
        1    79  .    10     1     1     A    18    18   THR     H      H    18      8.737      8.637      0.100  1
        1    80  .    10     1     1     A    18    18   THR    HA      H    18      4.498      4.819     -0.321  1
        1    85  .    10     1     1     A    19    19   TRP     H      H    19      7.677      8.176     -0.499  1
        1    86  .    10     1     1     A    19    19   TRP    HA      H    19      4.007      4.422     -0.415  1
        1    95  .    10     1     1     A    20    20   PRO    HA      H    20      3.323      3.684     -0.361  1
        1   102  .    10     1     1     A    21    21   ILE     H      H    21      8.646      7.606      1.040  1
        1   103  .    10     1     1     A    21    21   ILE    HA      H    21      4.249      4.730     -0.481  1
        1   113  .    10     1     1     A    22    22   CYS     H      H    22      7.444      9.027     -1.583  1
        1   114  .    10     1     1     A    22    22   CYS    HA      H    22      5.082      5.067      0.015  1
        1   117  .    10     1     1     A    23    23   THR     H      H    23      9.953      9.235      0.718  1
        1   118  .    10     1     1     A    23    23   THR    HA      H    23      5.065      5.103     -0.038  1
        1   123  .    10     1     1     A    24    24   ARG     H      H    24      8.743      8.511      0.232  1
        1   124  .    10     1     1     A    24    24   ARG    HA      H    24      4.793      4.861     -0.068  1
        1   132  .    10     1     1     A    25    25   ASP     H      H    25      9.403      8.995      0.408  1
        1   133  .    10     1     1     A    25    25   ASP    HA      H    25      4.376      4.420     -0.044  1
        1   136  .    10     1     1     A    26    26   GLY     H      H    26      8.543      8.662     -0.119  1
        1   137  .    10     1     1     A    26    26   GLY   HA2      H    26      4.212      3.853      0.359  1
        1   138  .    10     1     1     A    26    26   GLY   HA3      H    26      3.616      3.855     -0.239  1
        1   139  .    10     1     1     A    27    27   LEU     H      H    27      7.799      8.221     -0.422  1
        1   140  .    10     1     1     A    27    27   LEU    HA      H    27      5.103      4.591      0.512  1
        1   150  .    10     1     1     A    28    28   PRO    HA      H    28      5.096      4.600      0.496  1
        1     5  .    11     1     1     A     2     2   GLY     H      H     2      8.645      8.629      0.016  1
        1     6  .    11     1     1     A     2     2   GLY   HA2      H     2      3.887      3.933     -0.046  1
        1     7  .    11     1     1     A     2     2   GLY   HA3      H     2      3.764      3.933     -0.169  1
        1     8  .    11     1     1     A     3     3   GLU     H      H     3      7.071      7.606     -0.535  1
        1     9  .    11     1     1     A     3     3   GLU    HA      H     3      4.867      4.876     -0.009  1
        1    14  .    11     1     1     A     4     4   THR     H      H     4      8.448      8.520     -0.072  1
        1    15  .    11     1     1     A     4     4   THR    HA      H     4      4.451      5.043     -0.592  1
        1    19  .    11     1     1     A     5     5   CYS     H      H     5      8.289      8.826     -0.537  1
        1    20  .    11     1     1     A     5     5   CYS    HA      H     5      5.162      4.681      0.481  1
        1    23  .    11     1     1     A     6     6   PHE     H      H     6      9.659      8.034      1.625  1
        1    24  .    11     1     1     A     6     6   PHE    HA      H     6      4.022      3.625      0.397  1
        1    30  .    11     1     1     A     7     7   GLY     H      H     7      9.220      7.993      1.227  1
        1    31  .    11     1     1     A     7     7   GLY   HA2      H     7      4.462      4.038      0.424  1
        1    32  .    11     1     1     A     7     7   GLY   HA3      H     7      3.881      4.100     -0.219  1
        1    33  .    11     1     1     A     8     8   GLY     H      H     8      8.215      8.649     -0.434  1
        1    34  .    11     1     1     A     8     8   GLY   HA2      H     8      4.577      4.041      0.536  1
        1    35  .    11     1     1     A     8     8   GLY   HA3      H     8      4.139      4.091      0.048  1
        1    36  .    11     1     1     A     9     9   THR     H      H     9      8.012      7.699      0.313  1
        1    37  .    11     1     1     A     9     9   THR    HA      H     9      4.740      4.297      0.443  1
        1    42  .    11     1     1     A    10    10   CYS     H      H    10      8.576      8.661     -0.085  1
        1    43  .    11     1     1     A    10    10   CYS    HA      H    10      4.685      5.062     -0.377  1
        1    46  .    11     1     1     A    11    11   ASN     H      H    11     11.445      8.881      2.564  1
        1    47  .    11     1     1     A    11    11   ASN    HA      H    11      4.827      4.757      0.070  1
        1    52  .    11     1     1     A    12    12   THR     H      H    12      9.679      7.867      1.812  1
        1    53  .    11     1     1     A    12    12   THR    HA      H    12      4.369      4.718     -0.349  1
        1    57  .    11     1     1     A    13    13   PRO    HA      H    13      4.308      4.282      0.026  1
        1    64  .    11     1     1     A    14    14   GLY     H      H    14      8.748      8.846     -0.098  1
        1    65  .    11     1     1     A    14    14   GLY   HA2      H    14      4.229      3.819      0.410  1
        1    66  .    11     1     1     A    14    14   GLY   HA3      H    14      3.747      3.821     -0.074  1
        1    67  .    11     1     1     A    15    15   CYS     H      H    15      7.712      7.438      0.274  1
        1    68  .    11     1     1     A    15    15   CYS    HA      H    15      5.331      4.718      0.613  1
        1    71  .    11     1     1     A    16    16   SER     H      H    16      9.548      9.416      0.132  1
        1    72  .    11     1     1     A    16    16   SER    HA      H    16      4.720      5.030     -0.310  1
        1    75  .    11     1     1     A    17    17   CYS     H      H    17      9.028      8.844      0.184  1
        1    76  .    11     1     1     A    17    17   CYS    HA      H    17      4.684      4.542      0.142  1
        1    79  .    11     1     1     A    18    18   THR     H      H    18      8.737      8.684      0.053  1
        1    80  .    11     1     1     A    18    18   THR    HA      H    18      4.498      4.790     -0.292  1
        1    85  .    11     1     1     A    19    19   TRP     H      H    19      7.677      8.278     -0.601  1
        1    86  .    11     1     1     A    19    19   TRP    HA      H    19      4.007      4.330     -0.323  1
        1    95  .    11     1     1     A    20    20   PRO    HA      H    20      3.323      3.412     -0.089  1
        1   102  .    11     1     1     A    21    21   ILE     H      H    21      8.646      7.546      1.100  1
        1   103  .    11     1     1     A    21    21   ILE    HA      H    21      4.249      4.759     -0.510  1
        1   113  .    11     1     1     A    22    22   CYS     H      H    22      7.444      9.100     -1.656  1
        1   114  .    11     1     1     A    22    22   CYS    HA      H    22      5.082      5.053      0.029  1
        1   117  .    11     1     1     A    23    23   THR     H      H    23      9.953      9.243      0.710  1
        1   118  .    11     1     1     A    23    23   THR    HA      H    23      5.065      5.136     -0.071  1
        1   123  .    11     1     1     A    24    24   ARG     H      H    24      8.743      8.505      0.238  1
        1   124  .    11     1     1     A    24    24   ARG    HA      H    24      4.793      4.630      0.163  1
        1   132  .    11     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .    11     1     1     A    25    25   ASP    HA      H    25      4.376      4.420     -0.044  1
        1   136  .    11     1     1     A    26    26   GLY     H      H    26      8.543      8.713     -0.170  1
        1   137  .    11     1     1     A    26    26   GLY   HA2      H    26      4.212      3.870      0.342  1
        1   138  .    11     1     1     A    26    26   GLY   HA3      H    26      3.616      3.871     -0.255  1
        1   139  .    11     1     1     A    27    27   LEU     H      H    27      7.799      8.119     -0.320  1
        1   140  .    11     1     1     A    27    27   LEU    HA      H    27      5.103      4.625      0.478  1
        1   150  .    11     1     1     A    28    28   PRO    HA      H    28      5.096      4.616      0.480  1
        1     5  .    12     1     1     A     2     2   GLY     H      H     2      8.645      8.254      0.391  1
        1     6  .    12     1     1     A     2     2   GLY   HA2      H     2      3.887      3.895     -0.008  1
        1     7  .    12     1     1     A     2     2   GLY   HA3      H     2      3.764      3.897     -0.133  1
        1     8  .    12     1     1     A     3     3   GLU     H      H     3      7.071      7.843     -0.772  1
        1     9  .    12     1     1     A     3     3   GLU    HA      H     3      4.867      4.900     -0.033  1
        1    14  .    12     1     1     A     4     4   THR     H      H     4      8.448      8.514     -0.066  1
        1    15  .    12     1     1     A     4     4   THR    HA      H     4      4.451      5.066     -0.615  1
        1    19  .    12     1     1     A     5     5   CYS     H      H     5      8.289      8.748     -0.459  1
        1    20  .    12     1     1     A     5     5   CYS    HA      H     5      5.162      4.662      0.500  1
        1    23  .    12     1     1     A     6     6   PHE     H      H     6      9.659      7.977      1.682  1
        1    24  .    12     1     1     A     6     6   PHE    HA      H     6      4.022      3.736      0.286  1
        1    30  .    12     1     1     A     7     7   GLY     H      H     7      9.220      7.954      1.266  1
        1    31  .    12     1     1     A     7     7   GLY   HA2      H     7      4.462      3.859      0.603  1
        1    32  .    12     1     1     A     7     7   GLY   HA3      H     7      3.881      3.946     -0.065  1
        1    33  .    12     1     1     A     8     8   GLY     H      H     8      8.215      8.564     -0.349  1
        1    34  .    12     1     1     A     8     8   GLY   HA2      H     8      4.577      4.003      0.574  1
        1    35  .    12     1     1     A     8     8   GLY   HA3      H     8      4.139      4.074      0.065  1
        1    36  .    12     1     1     A     9     9   THR     H      H     9      8.012      7.671      0.341  1
        1    37  .    12     1     1     A     9     9   THR    HA      H     9      4.740      4.264      0.476  1
        1    42  .    12     1     1     A    10    10   CYS     H      H    10      8.576      8.657     -0.081  1
        1    43  .    12     1     1     A    10    10   CYS    HA      H    10      4.685      4.929     -0.244  1
        1    46  .    12     1     1     A    11    11   ASN     H      H    11     11.445      9.562      1.883  1
        1    47  .    12     1     1     A    11    11   ASN    HA      H    11      4.827      4.643      0.184  1
        1    52  .    12     1     1     A    12    12   THR     H      H    12      9.679      8.016      1.663  1
        1    53  .    12     1     1     A    12    12   THR    HA      H    12      4.369      4.550     -0.181  1
        1    57  .    12     1     1     A    13    13   PRO    HA      H    13      4.308      4.275      0.033  1
        1    64  .    12     1     1     A    14    14   GLY     H      H    14      8.748      8.939     -0.191  1
        1    65  .    12     1     1     A    14    14   GLY   HA2      H    14      4.229      3.853      0.376  1
        1    66  .    12     1     1     A    14    14   GLY   HA3      H    14      3.747      3.854     -0.107  1
        1    67  .    12     1     1     A    15    15   CYS     H      H    15      7.712      7.382      0.330  1
        1    68  .    12     1     1     A    15    15   CYS    HA      H    15      5.331      4.644      0.687  1
        1    71  .    12     1     1     A    16    16   SER     H      H    16      9.548      8.818      0.730  1
        1    72  .    12     1     1     A    16    16   SER    HA      H    16      4.720      4.718      0.002  1
        1    75  .    12     1     1     A    17    17   CYS     H      H    17      9.028      8.787      0.241  1
        1    76  .    12     1     1     A    17    17   CYS    HA      H    17      4.684      4.513      0.171  1
        1    79  .    12     1     1     A    18    18   THR     H      H    18      8.737      8.880     -0.143  1
        1    80  .    12     1     1     A    18    18   THR    HA      H    18      4.498      4.854     -0.356  1
        1    85  .    12     1     1     A    19    19   TRP     H      H    19      7.677      8.309     -0.632  1
        1    86  .    12     1     1     A    19    19   TRP    HA      H    19      4.007      4.426     -0.419  1
        1    95  .    12     1     1     A    20    20   PRO    HA      H    20      3.323      3.721     -0.398  1
        1   102  .    12     1     1     A    21    21   ILE     H      H    21      8.646      7.695      0.951  1
        1   103  .    12     1     1     A    21    21   ILE    HA      H    21      4.249      4.849     -0.600  1
        1   113  .    12     1     1     A    22    22   CYS     H      H    22      7.444      9.015     -1.571  1
        1   114  .    12     1     1     A    22    22   CYS    HA      H    22      5.082      5.332     -0.250  1
        1   117  .    12     1     1     A    23    23   THR     H      H    23      9.953      9.134      0.819  1
        1   118  .    12     1     1     A    23    23   THR    HA      H    23      5.065      5.055      0.010  1
        1   123  .    12     1     1     A    24    24   ARG     H      H    24      8.743      8.491      0.252  1
        1   124  .    12     1     1     A    24    24   ARG    HA      H    24      4.793      4.660      0.133  1
        1   132  .    12     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .    12     1     1     A    25    25   ASP    HA      H    25      4.376      4.418     -0.042  1
        1   136  .    12     1     1     A    26    26   GLY     H      H    26      8.543      8.482      0.061  1
        1   137  .    12     1     1     A    26    26   GLY   HA2      H    26      4.212      3.838      0.374  1
        1   138  .    12     1     1     A    26    26   GLY   HA3      H    26      3.616      3.840     -0.224  1
        1   139  .    12     1     1     A    27    27   LEU     H      H    27      7.799      8.215     -0.416  1
        1   140  .    12     1     1     A    27    27   LEU    HA      H    27      5.103      4.565      0.538  1
        1   150  .    12     1     1     A    28    28   PRO    HA      H    28      5.096      4.624      0.472  1
        1     5  .    13     1     1     A     2     2   GLY     H      H     2      8.645      8.163      0.482  1
        1     6  .    13     1     1     A     2     2   GLY   HA2      H     2      3.887      3.936     -0.049  1
        1     7  .    13     1     1     A     2     2   GLY   HA3      H     2      3.764      3.937     -0.173  1
        1     8  .    13     1     1     A     3     3   GLU     H      H     3      7.071      8.024     -0.953  1
        1     9  .    13     1     1     A     3     3   GLU    HA      H     3      4.867      4.329      0.538  1
        1    14  .    13     1     1     A     4     4   THR     H      H     4      8.448      8.464     -0.016  1
        1    15  .    13     1     1     A     4     4   THR    HA      H     4      4.451      4.947     -0.496  1
        1    19  .    13     1     1     A     5     5   CYS     H      H     5      8.289      8.730     -0.441  1
        1    20  .    13     1     1     A     5     5   CYS    HA      H     5      5.162      4.692      0.470  1
        1    23  .    13     1     1     A     6     6   PHE     H      H     6      9.659      7.970      1.689  1
        1    24  .    13     1     1     A     6     6   PHE    HA      H     6      4.022      3.693      0.329  1
        1    30  .    13     1     1     A     7     7   GLY     H      H     7      9.220      7.942      1.278  1
        1    31  .    13     1     1     A     7     7   GLY   HA2      H     7      4.462      3.867      0.595  1
        1    32  .    13     1     1     A     7     7   GLY   HA3      H     7      3.881      3.960     -0.079  1
        1    33  .    13     1     1     A     8     8   GLY     H      H     8      8.215      8.491     -0.276  1
        1    34  .    13     1     1     A     8     8   GLY   HA2      H     8      4.577      4.019      0.558  1
        1    35  .    13     1     1     A     8     8   GLY   HA3      H     8      4.139      4.056      0.083  1
        1    36  .    13     1     1     A     9     9   THR     H      H     9      8.012      7.779      0.233  1
        1    37  .    13     1     1     A     9     9   THR    HA      H     9      4.740      4.884     -0.144  1
        1    42  .    13     1     1     A    10    10   CYS     H      H    10      8.576      8.886     -0.310  1
        1    43  .    13     1     1     A    10    10   CYS    HA      H    10      4.685      5.204     -0.519  1
        1    46  .    13     1     1     A    11    11   ASN     H      H    11     11.445      8.850      2.595  1
        1    47  .    13     1     1     A    11    11   ASN    HA      H    11      4.827      4.752      0.075  1
        1    52  .    13     1     1     A    12    12   THR     H      H    12      9.679      7.828      1.851  1
        1    53  .    13     1     1     A    12    12   THR    HA      H    12      4.369      4.536     -0.167  1
        1    57  .    13     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  1
        1    64  .    13     1     1     A    14    14   GLY     H      H    14      8.748      8.910     -0.162  1
        1    65  .    13     1     1     A    14    14   GLY   HA2      H    14      4.229      3.820      0.409  1
        1    66  .    13     1     1     A    14    14   GLY   HA3      H    14      3.747      3.821     -0.074  1
        1    67  .    13     1     1     A    15    15   CYS     H      H    15      7.712      7.433      0.279  1
        1    68  .    13     1     1     A    15    15   CYS    HA      H    15      5.331      4.639      0.692  1
        1    71  .    13     1     1     A    16    16   SER     H      H    16      9.548      9.225      0.323  1
        1    72  .    13     1     1     A    16    16   SER    HA      H    16      4.720      4.853     -0.133  1
        1    75  .    13     1     1     A    17    17   CYS     H      H    17      9.028      8.788      0.240  1
        1    76  .    13     1     1     A    17    17   CYS    HA      H    17      4.684      4.513      0.171  1
        1    79  .    13     1     1     A    18    18   THR     H      H    18      8.737      8.864     -0.127  1
        1    80  .    13     1     1     A    18    18   THR    HA      H    18      4.498      4.839     -0.341  1
        1    85  .    13     1     1     A    19    19   TRP     H      H    19      7.677      8.401     -0.724  1
        1    86  .    13     1     1     A    19    19   TRP    HA      H    19      4.007      4.433     -0.426  1
        1    95  .    13     1     1     A    20    20   PRO    HA      H    20      3.323      3.707     -0.384  1
        1   102  .    13     1     1     A    21    21   ILE     H      H    21      8.646      7.640      1.006  1
        1   103  .    13     1     1     A    21    21   ILE    HA      H    21      4.249      4.726     -0.477  1
        1   113  .    13     1     1     A    22    22   CYS     H      H    22      7.444      8.766     -1.322  1
        1   114  .    13     1     1     A    22    22   CYS    HA      H    22      5.082      5.271     -0.189  1
        1   117  .    13     1     1     A    23    23   THR     H      H    23      9.953      9.100      0.853  1
        1   118  .    13     1     1     A    23    23   THR    HA      H    23      5.065      5.107     -0.042  1
        1   123  .    13     1     1     A    24    24   ARG     H      H    24      8.743      8.695      0.048  1
        1   124  .    13     1     1     A    24    24   ARG    HA      H    24      4.793      4.694      0.099  1
        1   132  .    13     1     1     A    25    25   ASP     H      H    25      9.403      9.494     -0.091  1
        1   133  .    13     1     1     A    25    25   ASP    HA      H    25      4.376      4.412     -0.036  1
        1   136  .    13     1     1     A    26    26   GLY     H      H    26      8.543      8.461      0.082  1
        1   137  .    13     1     1     A    26    26   GLY   HA2      H    26      4.212      3.828      0.384  1
        1   138  .    13     1     1     A    26    26   GLY   HA3      H    26      3.616      3.830     -0.214  1
        1   139  .    13     1     1     A    27    27   LEU     H      H    27      7.799      8.178     -0.379  1
        1   140  .    13     1     1     A    27    27   LEU    HA      H    27      5.103      4.564      0.539  1
        1   150  .    13     1     1     A    28    28   PRO    HA      H    28      5.096      4.623      0.473  1
        1     5  .    14     1     1     A     2     2   GLY     H      H     2      8.645      8.168      0.477  1
        1     6  .    14     1     1     A     2     2   GLY   HA2      H     2      3.887      3.942     -0.055  1
        1     7  .    14     1     1     A     2     2   GLY   HA3      H     2      3.764      3.944     -0.180  1
        1     8  .    14     1     1     A     3     3   GLU     H      H     3      7.071      8.047     -0.976  1
        1     9  .    14     1     1     A     3     3   GLU    HA      H     3      4.867      4.341      0.526  1
        1    14  .    14     1     1     A     4     4   THR     H      H     4      8.448      8.382      0.066  1
        1    15  .    14     1     1     A     4     4   THR    HA      H     4      4.451      4.748     -0.297  1
        1    19  .    14     1     1     A     5     5   CYS     H      H     5      8.289      8.803     -0.514  1
        1    20  .    14     1     1     A     5     5   CYS    HA      H     5      5.162      4.653      0.509  1
        1    23  .    14     1     1     A     6     6   PHE     H      H     6      9.659      7.972      1.687  1
        1    24  .    14     1     1     A     6     6   PHE    HA      H     6      4.022      3.751      0.271  1
        1    30  .    14     1     1     A     7     7   GLY     H      H     7      9.220      7.944      1.276  1
        1    31  .    14     1     1     A     7     7   GLY   HA2      H     7      4.462      3.860      0.602  1
        1    32  .    14     1     1     A     7     7   GLY   HA3      H     7      3.881      3.950     -0.069  1
        1    33  .    14     1     1     A     8     8   GLY     H      H     8      8.215      8.572     -0.357  1
        1    34  .    14     1     1     A     8     8   GLY   HA2      H     8      4.577      4.000      0.577  1
        1    35  .    14     1     1     A     8     8   GLY   HA3      H     8      4.139      4.081      0.058  1
        1    36  .    14     1     1     A     9     9   THR     H      H     9      8.012      7.911      0.101  1
        1    37  .    14     1     1     A     9     9   THR    HA      H     9      4.740      4.526      0.214  1
        1    42  .    14     1     1     A    10    10   CYS     H      H    10      8.576      8.737     -0.161  1
        1    43  .    14     1     1     A    10    10   CYS    HA      H    10      4.685      5.259     -0.574  1
        1    46  .    14     1     1     A    11    11   ASN     H      H    11     11.445      9.481      1.964  1
        1    47  .    14     1     1     A    11    11   ASN    HA      H    11      4.827      4.654      0.173  1
        1    52  .    14     1     1     A    12    12   THR     H      H    12      9.679      7.861      1.818  1
        1    53  .    14     1     1     A    12    12   THR    HA      H    12      4.369      4.518     -0.149  1
        1    57  .    14     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  1
        1    64  .    14     1     1     A    14    14   GLY     H      H    14      8.748      8.840     -0.092  1
        1    65  .    14     1     1     A    14    14   GLY   HA2      H    14      4.229      3.815      0.414  1
        1    66  .    14     1     1     A    14    14   GLY   HA3      H    14      3.747      3.816     -0.069  1
        1    67  .    14     1     1     A    15    15   CYS     H      H    15      7.712      7.579      0.133  1
        1    68  .    14     1     1     A    15    15   CYS    HA      H    15      5.331      4.661      0.670  1
        1    71  .    14     1     1     A    16    16   SER     H      H    16      9.548      9.502      0.046  1
        1    72  .    14     1     1     A    16    16   SER    HA      H    16      4.720      5.046     -0.326  1
        1    75  .    14     1     1     A    17    17   CYS     H      H    17      9.028      8.887      0.141  1
        1    76  .    14     1     1     A    17    17   CYS    HA      H    17      4.684      4.576      0.108  1
        1    79  .    14     1     1     A    18    18   THR     H      H    18      8.737      8.655      0.082  1
        1    80  .    14     1     1     A    18    18   THR    HA      H    18      4.498      4.867     -0.369  1
        1    85  .    14     1     1     A    19    19   TRP     H      H    19      7.677      8.087     -0.410  1
        1    86  .    14     1     1     A    19    19   TRP    HA      H    19      4.007      4.426     -0.419  1
        1    95  .    14     1     1     A    20    20   PRO    HA      H    20      3.323      3.665     -0.342  1
        1   102  .    14     1     1     A    21    21   ILE     H      H    21      8.646      7.514      1.132  1
        1   103  .    14     1     1     A    21    21   ILE    HA      H    21      4.249      4.728     -0.479  1
        1   113  .    14     1     1     A    22    22   CYS     H      H    22      7.444      9.046     -1.602  1
        1   114  .    14     1     1     A    22    22   CYS    HA      H    22      5.082      5.143     -0.061  1
        1   117  .    14     1     1     A    23    23   THR     H      H    23      9.953      9.240      0.713  1
        1   118  .    14     1     1     A    23    23   THR    HA      H    23      5.065      5.123     -0.058  1
        1   123  .    14     1     1     A    24    24   ARG     H      H    24      8.743      8.490      0.253  1
        1   124  .    14     1     1     A    24    24   ARG    HA      H    24      4.793      4.746      0.047  1
        1   132  .    14     1     1     A    25    25   ASP     H      H    25      9.403      9.494     -0.091  1
        1   133  .    14     1     1     A    25    25   ASP    HA      H    25      4.376      4.417     -0.041  1
        1   136  .    14     1     1     A    26    26   GLY     H      H    26      8.543      8.718     -0.175  1
        1   137  .    14     1     1     A    26    26   GLY   HA2      H    26      4.212      3.883      0.329  1
        1   138  .    14     1     1     A    26    26   GLY   HA3      H    26      3.616      3.885     -0.269  1
        1   139  .    14     1     1     A    27    27   LEU     H      H    27      7.799      8.152     -0.353  1
        1   140  .    14     1     1     A    27    27   LEU    HA      H    27      5.103      4.630      0.473  1
        1   150  .    14     1     1     A    28    28   PRO    HA      H    28      5.096      4.599      0.497  1
        1     5  .    15     1     1     A     2     2   GLY     H      H     2      8.645      8.165      0.480  1
        1     6  .    15     1     1     A     2     2   GLY   HA2      H     2      3.887      3.935     -0.048  1
        1     7  .    15     1     1     A     2     2   GLY   HA3      H     2      3.764      3.937     -0.173  1
        1     8  .    15     1     1     A     3     3   GLU     H      H     3      7.071      8.045     -0.974  1
        1     9  .    15     1     1     A     3     3   GLU    HA      H     3      4.867      4.332      0.535  1
        1    14  .    15     1     1     A     4     4   THR     H      H     4      8.448      8.469     -0.021  1
        1    15  .    15     1     1     A     4     4   THR    HA      H     4      4.451      4.673     -0.222  1
        1    19  .    15     1     1     A     5     5   CYS     H      H     5      8.289      8.841     -0.552  1
        1    20  .    15     1     1     A     5     5   CYS    HA      H     5      5.162      4.655      0.507  1
        1    23  .    15     1     1     A     6     6   PHE     H      H     6      9.659      8.027      1.632  1
        1    24  .    15     1     1     A     6     6   PHE    HA      H     6      4.022      3.720      0.302  1
        1    30  .    15     1     1     A     7     7   GLY     H      H     7      9.220      7.958      1.262  1
        1    31  .    15     1     1     A     7     7   GLY   HA2      H     7      4.462      3.868      0.594  1
        1    32  .    15     1     1     A     7     7   GLY   HA3      H     7      3.881      3.956     -0.075  1
        1    33  .    15     1     1     A     8     8   GLY     H      H     8      8.215      8.588     -0.373  1
        1    34  .    15     1     1     A     8     8   GLY   HA2      H     8      4.577      4.002      0.575  1
        1    35  .    15     1     1     A     8     8   GLY   HA3      H     8      4.139      4.071      0.068  1
        1    36  .    15     1     1     A     9     9   THR     H      H     9      8.012      7.649      0.363  1
        1    37  .    15     1     1     A     9     9   THR    HA      H     9      4.740      4.285      0.455  1
        1    42  .    15     1     1     A    10    10   CYS     H      H    10      8.576      8.655     -0.079  1
        1    43  .    15     1     1     A    10    10   CYS    HA      H    10      4.685      5.167     -0.482  1
        1    46  .    15     1     1     A    11    11   ASN     H      H    11     11.445      9.511      1.934  1
        1    47  .    15     1     1     A    11    11   ASN    HA      H    11      4.827      4.646      0.181  1
        1    52  .    15     1     1     A    12    12   THR     H      H    12      9.679      7.833      1.846  1
        1    53  .    15     1     1     A    12    12   THR    HA      H    12      4.369      4.537     -0.168  1
        1    57  .    15     1     1     A    13    13   PRO    HA      H    13      4.308      4.281      0.027  1
        1    64  .    15     1     1     A    14    14   GLY     H      H    14      8.748      8.908     -0.160  1
        1    65  .    15     1     1     A    14    14   GLY   HA2      H    14      4.229      3.827      0.402  1
        1    66  .    15     1     1     A    14    14   GLY   HA3      H    14      3.747      3.828     -0.081  1
        1    67  .    15     1     1     A    15    15   CYS     H      H    15      7.712      7.407      0.305  1
        1    68  .    15     1     1     A    15    15   CYS    HA      H    15      5.331      4.714      0.617  1
        1    71  .    15     1     1     A    16    16   SER     H      H    16      9.548      9.255      0.293  1
        1    72  .    15     1     1     A    16    16   SER    HA      H    16      4.720      5.028     -0.308  1
        1    75  .    15     1     1     A    17    17   CYS     H      H    17      9.028      8.913      0.115  1
        1    76  .    15     1     1     A    17    17   CYS    HA      H    17      4.684      4.551      0.133  1
        1    79  .    15     1     1     A    18    18   THR     H      H    18      8.737      8.850     -0.113  1
        1    80  .    15     1     1     A    18    18   THR    HA      H    18      4.498      4.835     -0.337  1
        1    85  .    15     1     1     A    19    19   TRP     H      H    19      7.677      8.307     -0.630  1
        1    86  .    15     1     1     A    19    19   TRP    HA      H    19      4.007      4.434     -0.427  1
        1    95  .    15     1     1     A    20    20   PRO    HA      H    20      3.323      3.653     -0.330  1
        1   102  .    15     1     1     A    21    21   ILE     H      H    21      8.646      7.595      1.051  1
        1   103  .    15     1     1     A    21    21   ILE    HA      H    21      4.249      4.727     -0.478  1
        1   113  .    15     1     1     A    22    22   CYS     H      H    22      7.444      9.123     -1.679  1
        1   114  .    15     1     1     A    22    22   CYS    HA      H    22      5.082      5.130     -0.048  1
        1   117  .    15     1     1     A    23    23   THR     H      H    23      9.953      9.167      0.786  1
        1   118  .    15     1     1     A    23    23   THR    HA      H    23      5.065      5.110     -0.045  1
        1   123  .    15     1     1     A    24    24   ARG     H      H    24      8.743      8.446      0.297  1
        1   124  .    15     1     1     A    24    24   ARG    HA      H    24      4.793      4.610      0.183  1
        1   132  .    15     1     1     A    25    25   ASP     H      H    25      9.403      9.493     -0.090  1
        1   133  .    15     1     1     A    25    25   ASP    HA      H    25      4.376      4.427     -0.051  1
        1   136  .    15     1     1     A    26    26   GLY     H      H    26      8.543      8.701     -0.158  1
        1   137  .    15     1     1     A    26    26   GLY   HA2      H    26      4.212      3.871      0.341  1
        1   138  .    15     1     1     A    26    26   GLY   HA3      H    26      3.616      3.872     -0.256  1
        1   139  .    15     1     1     A    27    27   LEU     H      H    27      7.799      8.259     -0.460  1
        1   140  .    15     1     1     A    27    27   LEU    HA      H    27      5.103      4.589      0.514  1
        1   150  .    15     1     1     A    28    28   PRO    HA      H    28      5.096      4.627      0.469  1
        1     5  .    16     1     1     A     2     2   GLY     H      H     2      8.645      8.173      0.472  1
        1     6  .    16     1     1     A     2     2   GLY   HA2      H     2      3.887      3.947     -0.060  1
        1     7  .    16     1     1     A     2     2   GLY   HA3      H     2      3.764      3.949     -0.185  1
        1     8  .    16     1     1     A     3     3   GLU     H      H     3      7.071      8.088     -1.017  1
        1     9  .    16     1     1     A     3     3   GLU    HA      H     3      4.867      4.328      0.539  1
        1    14  .    16     1     1     A     4     4   THR     H      H     4      8.448      8.468     -0.020  1
        1    15  .    16     1     1     A     4     4   THR    HA      H     4      4.451      4.881     -0.430  1
        1    19  .    16     1     1     A     5     5   CYS     H      H     5      8.289      8.847     -0.558  1
        1    20  .    16     1     1     A     5     5   CYS    HA      H     5      5.162      4.678      0.484  1
        1    23  .    16     1     1     A     6     6   PHE     H      H     6      9.659      8.041      1.618  1
        1    24  .    16     1     1     A     6     6   PHE    HA      H     6      4.022      3.675      0.347  1
        1    30  .    16     1     1     A     7     7   GLY     H      H     7      9.220      8.000      1.220  1
        1    31  .    16     1     1     A     7     7   GLY   HA2      H     7      4.462      4.032      0.430  1
        1    32  .    16     1     1     A     7     7   GLY   HA3      H     7      3.881      4.092     -0.211  1
        1    33  .    16     1     1     A     8     8   GLY     H      H     8      8.215      8.656     -0.441  1
        1    34  .    16     1     1     A     8     8   GLY   HA2      H     8      4.577      4.041      0.536  1
        1    35  .    16     1     1     A     8     8   GLY   HA3      H     8      4.139      4.102      0.037  1
        1    36  .    16     1     1     A     9     9   THR     H      H     9      8.012      7.929      0.083  1
        1    37  .    16     1     1     A     9     9   THR    HA      H     9      4.740      4.531      0.209  1
        1    42  .    16     1     1     A    10    10   CYS     H      H    10      8.576      8.824     -0.248  1
        1    43  .    16     1     1     A    10    10   CYS    HA      H    10      4.685      5.113     -0.428  1
        1    46  .    16     1     1     A    11    11   ASN     H      H    11     11.445      8.906      2.539  1
        1    47  .    16     1     1     A    11    11   ASN    HA      H    11      4.827      4.759      0.068  1
        1    52  .    16     1     1     A    12    12   THR     H      H    12      9.679      7.753      1.926  1
        1    53  .    16     1     1     A    12    12   THR    HA      H    12      4.369      4.502     -0.133  1
        1    57  .    16     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  1
        1    64  .    16     1     1     A    14    14   GLY     H      H    14      8.748      8.830     -0.082  1
        1    65  .    16     1     1     A    14    14   GLY   HA2      H    14      4.229      3.816      0.413  1
        1    66  .    16     1     1     A    14    14   GLY   HA3      H    14      3.747      3.817     -0.070  1
        1    67  .    16     1     1     A    15    15   CYS     H      H    15      7.712      7.605      0.107  1
        1    68  .    16     1     1     A    15    15   CYS    HA      H    15      5.331      4.672      0.659  1
        1    71  .    16     1     1     A    16    16   SER     H      H    16      9.548      9.439      0.109  1
        1    72  .    16     1     1     A    16    16   SER    HA      H    16      4.720      5.012     -0.292  1
        1    75  .    16     1     1     A    17    17   CYS     H      H    17      9.028      8.844      0.184  1
        1    76  .    16     1     1     A    17    17   CYS    HA      H    17      4.684      4.558      0.126  1
        1    79  .    16     1     1     A    18    18   THR     H      H    18      8.737      8.572      0.165  1
        1    80  .    16     1     1     A    18    18   THR    HA      H    18      4.498      4.855     -0.357  1
        1    85  .    16     1     1     A    19    19   TRP     H      H    19      7.677      8.142     -0.465  1
        1    86  .    16     1     1     A    19    19   TRP    HA      H    19      4.007      4.353     -0.346  1
        1    95  .    16     1     1     A    20    20   PRO    HA      H    20      3.323      3.449     -0.126  1
        1   102  .    16     1     1     A    21    21   ILE     H      H    21      8.646      7.479      1.167  1
        1   103  .    16     1     1     A    21    21   ILE    HA      H    21      4.249      4.762     -0.513  1
        1   113  .    16     1     1     A    22    22   CYS     H      H    22      7.444      9.051     -1.607  1
        1   114  .    16     1     1     A    22    22   CYS    HA      H    22      5.082      5.122     -0.040  1
        1   117  .    16     1     1     A    23    23   THR     H      H    23      9.953      9.251      0.702  1
        1   118  .    16     1     1     A    23    23   THR    HA      H    23      5.065      5.166     -0.101  1
        1   123  .    16     1     1     A    24    24   ARG     H      H    24      8.743      8.459      0.284  1
        1   124  .    16     1     1     A    24    24   ARG    HA      H    24      4.793      4.845     -0.052  1
        1   132  .    16     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .    16     1     1     A    25    25   ASP    HA      H    25      4.376      4.414     -0.038  1
        1   136  .    16     1     1     A    26    26   GLY     H      H    26      8.543      8.520      0.023  1
        1   137  .    16     1     1     A    26    26   GLY   HA2      H    26      4.212      3.838      0.374  1
        1   138  .    16     1     1     A    26    26   GLY   HA3      H    26      3.616      3.840     -0.224  1
        1   139  .    16     1     1     A    27    27   LEU     H      H    27      7.799      8.230     -0.431  1
        1   140  .    16     1     1     A    27    27   LEU    HA      H    27      5.103      4.526      0.577  1
        1   150  .    16     1     1     A    28    28   PRO    HA      H    28      5.096      4.572      0.524  1
        1     5  .    17     1     1     A     2     2   GLY     H      H     2      8.645      8.170      0.475  1
        1     6  .    17     1     1     A     2     2   GLY   HA2      H     2      3.887      3.934     -0.047  1
        1     7  .    17     1     1     A     2     2   GLY   HA3      H     2      3.764      3.937     -0.173  1
        1     8  .    17     1     1     A     3     3   GLU     H      H     3      7.071      8.109     -1.038  1
        1     9  .    17     1     1     A     3     3   GLU    HA      H     3      4.867      4.336      0.531  1
        1    14  .    17     1     1     A     4     4   THR     H      H     4      8.448      8.711     -0.263  1
        1    15  .    17     1     1     A     4     4   THR    HA      H     4      4.451      4.391      0.060  1
        1    19  .    17     1     1     A     5     5   CYS     H      H     5      8.289      8.767     -0.478  1
        1    20  .    17     1     1     A     5     5   CYS    HA      H     5      5.162      4.720      0.442  1
        1    23  .    17     1     1     A     6     6   PHE     H      H     6      9.659      7.968      1.691  1
        1    24  .    17     1     1     A     6     6   PHE    HA      H     6      4.022      3.792      0.230  1
        1    30  .    17     1     1     A     7     7   GLY     H      H     7      9.220      7.981      1.239  1
        1    31  .    17     1     1     A     7     7   GLY   HA2      H     7      4.462      3.871      0.591  1
        1    32  .    17     1     1     A     7     7   GLY   HA3      H     7      3.881      3.968     -0.087  1
        1    33  .    17     1     1     A     8     8   GLY     H      H     8      8.215      8.333     -0.118  1
        1    34  .    17     1     1     A     8     8   GLY   HA2      H     8      4.577      4.008      0.569  1
        1    35  .    17     1     1     A     8     8   GLY   HA3      H     8      4.139      4.047      0.092  1
        1    36  .    17     1     1     A     9     9   THR     H      H     9      8.012      7.816      0.196  1
        1    37  .    17     1     1     A     9     9   THR    HA      H     9      4.740      4.873     -0.133  1
        1    42  .    17     1     1     A    10    10   CYS     H      H    10      8.576      8.950     -0.374  1
        1    43  .    17     1     1     A    10    10   CYS    HA      H    10      4.685      5.542     -0.857  1
        1    46  .    17     1     1     A    11    11   ASN     H      H    11     11.445      9.385      2.060  1
        1    47  .    17     1     1     A    11    11   ASN    HA      H    11      4.827      4.735      0.092  1
        1    52  .    17     1     1     A    12    12   THR     H      H    12      9.679      7.551      2.128  1
        1    53  .    17     1     1     A    12    12   THR    HA      H    12      4.369      4.499     -0.130  1
        1    57  .    17     1     1     A    13    13   PRO    HA      H    13      4.308      4.274      0.034  1
        1    64  .    17     1     1     A    14    14   GLY     H      H    14      8.748      8.819     -0.071  1
        1    65  .    17     1     1     A    14    14   GLY   HA2      H    14      4.229      3.811      0.418  1
        1    66  .    17     1     1     A    14    14   GLY   HA3      H    14      3.747      3.812     -0.065  1
        1    67  .    17     1     1     A    15    15   CYS     H      H    15      7.712      7.559      0.153  1
        1    68  .    17     1     1     A    15    15   CYS    HA      H    15      5.331      4.655      0.676  1
        1    71  .    17     1     1     A    16    16   SER     H      H    16      9.548      9.423      0.125  1
        1    72  .    17     1     1     A    16    16   SER    HA      H    16      4.720      5.079     -0.359  1
        1    75  .    17     1     1     A    17    17   CYS     H      H    17      9.028      9.028      0.000  1
        1    76  .    17     1     1     A    17    17   CYS    HA      H    17      4.684      4.628      0.056  1
        1    79  .    17     1     1     A    18    18   THR     H      H    18      8.737      8.697      0.040  1
        1    80  .    17     1     1     A    18    18   THR    HA      H    18      4.498      4.805     -0.307  1
        1    85  .    17     1     1     A    19    19   TRP     H      H    19      7.677      8.348     -0.671  1
        1    86  .    17     1     1     A    19    19   TRP    HA      H    19      4.007      4.425     -0.418  1
        1    95  .    17     1     1     A    20    20   PRO    HA      H    20      3.323      3.655     -0.332  1
        1   102  .    17     1     1     A    21    21   ILE     H      H    21      8.646      7.595      1.051  1
        1   103  .    17     1     1     A    21    21   ILE    HA      H    21      4.249      4.726     -0.477  1
        1   113  .    17     1     1     A    22    22   CYS     H      H    22      7.444      9.023     -1.579  1
        1   114  .    17     1     1     A    22    22   CYS    HA      H    22      5.082      5.051      0.031  1
        1   117  .    17     1     1     A    23    23   THR     H      H    23      9.953      9.248      0.705  1
        1   118  .    17     1     1     A    23    23   THR    HA      H    23      5.065      5.134     -0.069  1
        1   123  .    17     1     1     A    24    24   ARG     H      H    24      8.743      8.514      0.229  1
        1   124  .    17     1     1     A    24    24   ARG    HA      H    24      4.793      4.889     -0.096  1
        1   132  .    17     1     1     A    25    25   ASP     H      H    25      9.403      9.038      0.365  1
        1   133  .    17     1     1     A    25    25   ASP    HA      H    25      4.376      4.399     -0.023  1
        1   136  .    17     1     1     A    26    26   GLY     H      H    26      8.543      8.721     -0.178  1
        1   137  .    17     1     1     A    26    26   GLY   HA2      H    26      4.212      3.906      0.306  1
        1   138  .    17     1     1     A    26    26   GLY   HA3      H    26      3.616      3.908     -0.292  1
        1   139  .    17     1     1     A    27    27   LEU     H      H    27      7.799      8.270     -0.471  1
        1   140  .    17     1     1     A    27    27   LEU    HA      H    27      5.103      4.639      0.464  1
        1   150  .    17     1     1     A    28    28   PRO    HA      H    28      5.096      4.616      0.480  1
        1     5  .    18     1     1     A     2     2   GLY     H      H     2      8.645      8.357      0.288  1
        1     6  .    18     1     1     A     2     2   GLY   HA2      H     2      3.887      3.883      0.004  1
        1     7  .    18     1     1     A     2     2   GLY   HA3      H     2      3.764      3.886     -0.122  1
        1     8  .    18     1     1     A     3     3   GLU     H      H     3      7.071      7.782     -0.711  1
        1     9  .    18     1     1     A     3     3   GLU    HA      H     3      4.867      4.864      0.003  1
        1    14  .    18     1     1     A     4     4   THR     H      H     4      8.448      8.650     -0.202  1
        1    15  .    18     1     1     A     4     4   THR    HA      H     4      4.451      4.790     -0.339  1
        1    19  .    18     1     1     A     5     5   CYS     H      H     5      8.289      8.841     -0.552  1
        1    20  .    18     1     1     A     5     5   CYS    HA      H     5      5.162      4.659      0.503  1
        1    23  .    18     1     1     A     6     6   PHE     H      H     6      9.659      8.038      1.621  1
        1    24  .    18     1     1     A     6     6   PHE    HA      H     6      4.022      3.899      0.123  1
        1    30  .    18     1     1     A     7     7   GLY     H      H     7      9.220      8.008      1.212  1
        1    31  .    18     1     1     A     7     7   GLY   HA2      H     7      4.462      3.956      0.506  1
        1    32  .    18     1     1     A     7     7   GLY   HA3      H     7      3.881      4.002     -0.121  1
        1    33  .    18     1     1     A     8     8   GLY     H      H     8      8.215      8.643     -0.428  1
        1    34  .    18     1     1     A     8     8   GLY   HA2      H     8      4.577      4.021      0.556  1
        1    35  .    18     1     1     A     8     8   GLY   HA3      H     8      4.139      4.106      0.033  1
        1    36  .    18     1     1     A     9     9   THR     H      H     9      8.012      7.610      0.402  1
        1    37  .    18     1     1     A     9     9   THR    HA      H     9      4.740      4.271      0.469  1
        1    42  .    18     1     1     A    10    10   CYS     H      H    10      8.576      8.704     -0.128  1
        1    43  .    18     1     1     A    10    10   CYS    HA      H    10      4.685      4.920     -0.235  1
        1    46  .    18     1     1     A    11    11   ASN     H      H    11     11.445      9.531      1.914  1
        1    47  .    18     1     1     A    11    11   ASN    HA      H    11      4.827      4.638      0.189  1
        1    52  .    18     1     1     A    12    12   THR     H      H    12      9.679      7.927      1.752  1
        1    53  .    18     1     1     A    12    12   THR    HA      H    12      4.369      4.539     -0.170  1
        1    57  .    18     1     1     A    13    13   PRO    HA      H    13      4.308      4.278      0.030  1
        1    64  .    18     1     1     A    14    14   GLY     H      H    14      8.748      8.913     -0.165  1
        1    65  .    18     1     1     A    14    14   GLY   HA2      H    14      4.229      3.820      0.409  1
        1    66  .    18     1     1     A    14    14   GLY   HA3      H    14      3.747      3.821     -0.074  1
        1    67  .    18     1     1     A    15    15   CYS     H      H    15      7.712      7.444      0.268  1
        1    68  .    18     1     1     A    15    15   CYS    HA      H    15      5.331      4.643      0.688  1
        1    71  .    18     1     1     A    16    16   SER     H      H    16      9.548      9.124      0.424  1
        1    72  .    18     1     1     A    16    16   SER    HA      H    16      4.720      4.804     -0.084  1
        1    75  .    18     1     1     A    17    17   CYS     H      H    17      9.028      8.896      0.132  1
        1    76  .    18     1     1     A    17    17   CYS    HA      H    17      4.684      4.637      0.047  1
        1    79  .    18     1     1     A    18    18   THR     H      H    18      8.737      8.892     -0.155  1
        1    80  .    18     1     1     A    18    18   THR    HA      H    18      4.498      4.796     -0.298  1
        1    85  .    18     1     1     A    19    19   TRP     H      H    19      7.677      8.199     -0.522  1
        1    86  .    18     1     1     A    19    19   TRP    HA      H    19      4.007      4.428     -0.421  1
        1    95  .    18     1     1     A    20    20   PRO    HA      H    20      3.323      3.707     -0.384  1
        1   102  .    18     1     1     A    21    21   ILE     H      H    21      8.646      7.697      0.949  1
        1   103  .    18     1     1     A    21    21   ILE    HA      H    21      4.249      4.860     -0.611  1
        1   113  .    18     1     1     A    22    22   CYS     H      H    22      7.444      9.097     -1.653  1
        1   114  .    18     1     1     A    22    22   CYS    HA      H    22      5.082      5.405     -0.323  1
        1   117  .    18     1     1     A    23    23   THR     H      H    23      9.953      9.255      0.698  1
        1   118  .    18     1     1     A    23    23   THR    HA      H    23      5.065      5.011      0.054  1
        1   123  .    18     1     1     A    24    24   ARG     H      H    24      8.743      8.511      0.232  1
        1   124  .    18     1     1     A    24    24   ARG    HA      H    24      4.793      4.691      0.102  1
        1   132  .    18     1     1     A    25    25   ASP     H      H    25      9.403      9.488     -0.085  1
        1   133  .    18     1     1     A    25    25   ASP    HA      H    25      4.376      4.418     -0.042  1
        1   136  .    18     1     1     A    26    26   GLY     H      H    26      8.543      8.738     -0.195  1
        1   137  .    18     1     1     A    26    26   GLY   HA2      H    26      4.212      3.867      0.345  1
        1   138  .    18     1     1     A    26    26   GLY   HA3      H    26      3.616      3.868     -0.252  1
        1   139  .    18     1     1     A    27    27   LEU     H      H    27      7.799      8.291     -0.492  1
        1   140  .    18     1     1     A    27    27   LEU    HA      H    27      5.103      4.610      0.493  1
        1   150  .    18     1     1     A    28    28   PRO    HA      H    28      5.096      4.636      0.460  1
        1     5  .    19     1     1     A     2     2   GLY     H      H     2      8.645      8.347      0.298  1
        1     6  .    19     1     1     A     2     2   GLY   HA2      H     2      3.887      3.883      0.004  1
        1     7  .    19     1     1     A     2     2   GLY   HA3      H     2      3.764      3.886     -0.122  1
        1     8  .    19     1     1     A     3     3   GLU     H      H     3      7.071      7.765     -0.694  1
        1     9  .    19     1     1     A     3     3   GLU    HA      H     3      4.867      4.909     -0.042  1
        1    14  .    19     1     1     A     4     4   THR     H      H     4      8.448      8.841     -0.393  1
        1    15  .    19     1     1     A     4     4   THR    HA      H     4      4.451      4.491     -0.040  1
        1    19  .    19     1     1     A     5     5   CYS     H      H     5      8.289      8.675     -0.386  1
        1    20  .    19     1     1     A     5     5   CYS    HA      H     5      5.162      4.709      0.453  1
        1    23  .    19     1     1     A     6     6   PHE     H      H     6      9.659      7.939      1.720  1
        1    24  .    19     1     1     A     6     6   PHE    HA      H     6      4.022      3.715      0.307  1
        1    30  .    19     1     1     A     7     7   GLY     H      H     7      9.220      7.961      1.259  1
        1    31  .    19     1     1     A     7     7   GLY   HA2      H     7      4.462      3.870      0.592  1
        1    32  .    19     1     1     A     7     7   GLY   HA3      H     7      3.881      3.965     -0.084  1
        1    33  .    19     1     1     A     8     8   GLY     H      H     8      8.215      8.214      0.001  1
        1    34  .    19     1     1     A     8     8   GLY   HA2      H     8      4.577      4.019      0.558  1
        1    35  .    19     1     1     A     8     8   GLY   HA3      H     8      4.139      4.056      0.083  1
        1    36  .    19     1     1     A     9     9   THR     H      H     9      8.012      7.816      0.196  1
        1    37  .    19     1     1     A     9     9   THR    HA      H     9      4.740      4.861     -0.121  1
        1    42  .    19     1     1     A    10    10   CYS     H      H    10      8.576      8.904     -0.328  1
        1    43  .    19     1     1     A    10    10   CYS    HA      H    10      4.685      5.517     -0.832  1
        1    46  .    19     1     1     A    11    11   ASN     H      H    11     11.445      9.394      2.051  1
        1    47  .    19     1     1     A    11    11   ASN    HA      H    11      4.827      4.730      0.097  1
        1    52  .    19     1     1     A    12    12   THR     H      H    12      9.679      7.597      2.082  1
        1    53  .    19     1     1     A    12    12   THR    HA      H    12      4.369      4.503     -0.134  1
        1    57  .    19     1     1     A    13    13   PRO    HA      H    13      4.308      4.273      0.035  1
        1    64  .    19     1     1     A    14    14   GLY     H      H    14      8.748      8.807     -0.059  1
        1    65  .    19     1     1     A    14    14   GLY   HA2      H    14      4.229      3.811      0.418  1
        1    66  .    19     1     1     A    14    14   GLY   HA3      H    14      3.747      3.812     -0.065  1
        1    67  .    19     1     1     A    15    15   CYS     H      H    15      7.712      7.554      0.158  1
        1    68  .    19     1     1     A    15    15   CYS    HA      H    15      5.331      4.677      0.654  1
        1    71  .    19     1     1     A    16    16   SER     H      H    16      9.548      9.356      0.192  1
        1    72  .    19     1     1     A    16    16   SER    HA      H    16      4.720      5.109     -0.389  1
        1    75  .    19     1     1     A    17    17   CYS     H      H    17      9.028      9.018      0.010  1
        1    76  .    19     1     1     A    17    17   CYS    HA      H    17      4.684      4.575      0.109  1
        1    79  .    19     1     1     A    18    18   THR     H      H    18      8.737      8.824     -0.087  1
        1    80  .    19     1     1     A    18    18   THR    HA      H    18      4.498      4.833     -0.335  1
        1    85  .    19     1     1     A    19    19   TRP     H      H    19      7.677      8.254     -0.577  1
        1    86  .    19     1     1     A    19    19   TRP    HA      H    19      4.007      4.433     -0.426  1
        1    95  .    19     1     1     A    20    20   PRO    HA      H    20      3.323      3.650     -0.327  1
        1   102  .    19     1     1     A    21    21   ILE     H      H    21      8.646      7.647      0.999  1
        1   103  .    19     1     1     A    21    21   ILE    HA      H    21      4.249      4.724     -0.475  1
        1   113  .    19     1     1     A    22    22   CYS     H      H    22      7.444      9.391     -1.947  1
        1   114  .    19     1     1     A    22    22   CYS    HA      H    22      5.082      5.082      0.000  1
        1   117  .    19     1     1     A    23    23   THR     H      H    23      9.953      9.206      0.747  1
        1   118  .    19     1     1     A    23    23   THR    HA      H    23      5.065      5.032      0.033  1
        1   123  .    19     1     1     A    24    24   ARG     H      H    24      8.743      8.415      0.328  1
        1   124  .    19     1     1     A    24    24   ARG    HA      H    24      4.793      4.717      0.076  1
        1   132  .    19     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .    19     1     1     A    25    25   ASP    HA      H    25      4.376      4.408     -0.032  1
        1   136  .    19     1     1     A    26    26   GLY     H      H    26      8.543      8.755     -0.212  1
        1   137  .    19     1     1     A    26    26   GLY   HA2      H    26      4.212      3.905      0.307  1
        1   138  .    19     1     1     A    26    26   GLY   HA3      H    26      3.616      3.907     -0.291  1
        1   139  .    19     1     1     A    27    27   LEU     H      H    27      7.799      8.299     -0.500  1
        1   140  .    19     1     1     A    27    27   LEU    HA      H    27      5.103      4.644      0.459  1
        1   150  .    19     1     1     A    28    28   PRO    HA      H    28      5.096      4.618      0.478  1
        1     5  .    20     1     1     A     2     2   GLY     H      H     2      8.645      8.194      0.451  1
        1     6  .    20     1     1     A     2     2   GLY   HA2      H     2      3.887      3.899     -0.012  1
        1     7  .    20     1     1     A     2     2   GLY   HA3      H     2      3.764      3.901     -0.137  1
        1     8  .    20     1     1     A     3     3   GLU     H      H     3      7.071      8.000     -0.929  1
        1     9  .    20     1     1     A     3     3   GLU    HA      H     3      4.867      4.722      0.145  1
        1    14  .    20     1     1     A     4     4   THR     H      H     4      8.448      8.606     -0.158  1
        1    15  .    20     1     1     A     4     4   THR    HA      H     4      4.451      4.496     -0.045  1
        1    19  .    20     1     1     A     5     5   CYS     H      H     5      8.289      8.675     -0.386  1
        1    20  .    20     1     1     A     5     5   CYS    HA      H     5      5.162      4.680      0.482  1
        1    23  .    20     1     1     A     6     6   PHE     H      H     6      9.659      8.004      1.655  1
        1    24  .    20     1     1     A     6     6   PHE    HA      H     6      4.022      3.753      0.269  1
        1    30  .    20     1     1     A     7     7   GLY     H      H     7      9.220      7.991      1.229  1
        1    31  .    20     1     1     A     7     7   GLY   HA2      H     7      4.462      3.842      0.620  1
        1    32  .    20     1     1     A     7     7   GLY   HA3      H     7      3.881      3.944     -0.063  1
        1    33  .    20     1     1     A     8     8   GLY     H      H     8      8.215      8.683     -0.468  1
        1    34  .    20     1     1     A     8     8   GLY   HA2      H     8      4.577      4.036      0.541  1
        1    35  .    20     1     1     A     8     8   GLY   HA3      H     8      4.139      4.090      0.049  1
        1    36  .    20     1     1     A     9     9   THR     H      H     9      8.012      7.797      0.215  1
        1    37  .    20     1     1     A     9     9   THR    HA      H     9      4.740      4.886     -0.146  1
        1    42  .    20     1     1     A    10    10   CYS     H      H    10      8.576      8.929     -0.353  1
        1    43  .    20     1     1     A    10    10   CYS    HA      H    10      4.685      5.412     -0.727  1
        1    46  .    20     1     1     A    11    11   ASN     H      H    11     11.445      9.511      1.934  1
        1    47  .    20     1     1     A    11    11   ASN    HA      H    11      4.827      4.655      0.172  1
        1    52  .    20     1     1     A    12    12   THR     H      H    12      9.679      7.736      1.943  1
        1    53  .    20     1     1     A    12    12   THR    HA      H    12      4.369      4.537     -0.168  1
        1    57  .    20     1     1     A    13    13   PRO    HA      H    13      4.308      4.277      0.031  1
        1    64  .    20     1     1     A    14    14   GLY     H      H    14      8.748      8.891     -0.143  1
        1    65  .    20     1     1     A    14    14   GLY   HA2      H    14      4.229      3.817      0.412  1
        1    66  .    20     1     1     A    14    14   GLY   HA3      H    14      3.747      3.818     -0.071  1
        1    67  .    20     1     1     A    15    15   CYS     H      H    15      7.712      7.504      0.208  1
        1    68  .    20     1     1     A    15    15   CYS    HA      H    15      5.331      4.710      0.621  1
        1    71  .    20     1     1     A    16    16   SER     H      H    16      9.548      9.307      0.241  1
        1    72  .    20     1     1     A    16    16   SER    HA      H    16      4.720      5.098     -0.378  1
        1    75  .    20     1     1     A    17    17   CYS     H      H    17      9.028      8.904      0.124  1
        1    76  .    20     1     1     A    17    17   CYS    HA      H    17      4.684      4.529      0.155  1
        1    79  .    20     1     1     A    18    18   THR     H      H    18      8.737      8.831     -0.094  1
        1    80  .    20     1     1     A    18    18   THR    HA      H    18      4.498      4.796     -0.298  1
        1    85  .    20     1     1     A    19    19   TRP     H      H    19      7.677      8.254     -0.577  1
        1    86  .    20     1     1     A    19    19   TRP    HA      H    19      4.007      4.433     -0.426  1
        1    95  .    20     1     1     A    20    20   PRO    HA      H    20      3.323      3.642     -0.319  1
        1   102  .    20     1     1     A    21    21   ILE     H      H    21      8.646      7.636      1.010  1
        1   103  .    20     1     1     A    21    21   ILE    HA      H    21      4.249      4.721     -0.472  1
        1   113  .    20     1     1     A    22    22   CYS     H      H    22      7.444      9.459     -2.015  1
        1   114  .    20     1     1     A    22    22   CYS    HA      H    22      5.082      5.119     -0.037  1
        1   117  .    20     1     1     A    23    23   THR     H      H    23      9.953      9.174      0.779  1
        1   118  .    20     1     1     A    23    23   THR    HA      H    23      5.065      5.048      0.017  1
        1   123  .    20     1     1     A    24    24   ARG     H      H    24      8.743      8.436      0.307  1
        1   124  .    20     1     1     A    24    24   ARG    HA      H    24      4.793      4.683      0.110  1
        1   132  .    20     1     1     A    25    25   ASP     H      H    25      9.403      9.492     -0.089  1
        1   133  .    20     1     1     A    25    25   ASP    HA      H    25      4.376      4.415     -0.039  1
        1   136  .    20     1     1     A    26    26   GLY     H      H    26      8.543      8.744     -0.201  1
        1   137  .    20     1     1     A    26    26   GLY   HA2      H    26      4.212      3.875      0.337  1
        1   138  .    20     1     1     A    26    26   GLY   HA3      H    26      3.616      3.876     -0.260  1
        1   139  .    20     1     1     A    27    27   LEU     H      H    27      7.799      8.311     -0.512  1
        1   140  .    20     1     1     A    27    27   LEU    HA      H    27      5.103      4.609      0.494  1
        1   150  .    20     1     1     A    28    28   PRO    HA      H    28      5.096      4.631      0.465  1
   stop_

   loop_
      _SPARTA_output.Data_ID
      _SPARTA_output.Assigned_chem_shift_list_ID
      _SPARTA_output.Conformer_ID
      _SPARTA_output.Entity_ID
      _SPARTA_output.Data_type
      _SPARTA_output.Data_atom
      _SPARTA_output.Data_num_shifts
      _SPARTA_output.Data_value
      _SPARTA_output.Entity_delta_chem_shifts_ID
        1    1     1     1  "RMS(OBS, PRED)"     C     0      0.000  1
        2    1     1     1  "RMS(OBS, PRED)"    CA     0      0.000  1
        3    1     1     1  "RMS(OBS, PRED)"    CB     0      0.000  1
        4    1     1     1  "RMS(OBS, PRED)"     H    24      0.846  1
        5    1     1     1  "RMS(OBS, PRED)"    HA    32      0.359  1
        6    1     1     1  "RMS(OBS, PRED)"     N     0      0.000  1
        7    1     2     1  "RMS(OBS, PRED)"     C     0      0.000  1
        8    1     2     1  "RMS(OBS, PRED)"    CA     0      0.000  1
        9    1     2     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       10    1     2     1  "RMS(OBS, PRED)"     H    24      0.922  1
       11    1     2     1  "RMS(OBS, PRED)"    HA    32      0.351  1
       12    1     2     1  "RMS(OBS, PRED)"     N     0      0.000  1
       13    1     3     1  "RMS(OBS, PRED)"     C     0      0.000  1
       14    1     3     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       15    1     3     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       16    1     3     1  "RMS(OBS, PRED)"     H    24      0.895  1
       17    1     3     1  "RMS(OBS, PRED)"    HA    32      0.359  1
       18    1     3     1  "RMS(OBS, PRED)"     N     0      0.000  1
       19    1     4     1  "RMS(OBS, PRED)"     C     0      0.000  1
       20    1     4     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       21    1     4     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       22    1     4     1  "RMS(OBS, PRED)"     H    24      0.943  1
       23    1     4     1  "RMS(OBS, PRED)"    HA    32      0.350  1
       24    1     4     1  "RMS(OBS, PRED)"     N     0      0.000  1
       25    1     5     1  "RMS(OBS, PRED)"     C     0      0.000  1
       26    1     5     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       27    1     5     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       28    1     5     1  "RMS(OBS, PRED)"     H    24      0.972  1
       29    1     5     1  "RMS(OBS, PRED)"    HA    32      0.327  1
       30    1     5     1  "RMS(OBS, PRED)"     N     0      0.000  1
       31    1     6     1  "RMS(OBS, PRED)"     C     0      0.000  1
       32    1     6     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       33    1     6     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       34    1     6     1  "RMS(OBS, PRED)"     H    24      0.908  1
       35    1     6     1  "RMS(OBS, PRED)"    HA    32      0.337  1
       36    1     6     1  "RMS(OBS, PRED)"     N     0      0.000  1
       37    1     7     1  "RMS(OBS, PRED)"     C     0      0.000  1
       38    1     7     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       39    1     7     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       40    1     7     1  "RMS(OBS, PRED)"     H    24      0.950  1
       41    1     7     1  "RMS(OBS, PRED)"    HA    32      0.337  1
       42    1     7     1  "RMS(OBS, PRED)"     N     0      0.000  1
       43    1     8     1  "RMS(OBS, PRED)"     C     0      0.000  1
       44    1     8     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       45    1     8     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       46    1     8     1  "RMS(OBS, PRED)"     H    24      0.879  1
       47    1     8     1  "RMS(OBS, PRED)"    HA    32      0.341  1
       48    1     8     1  "RMS(OBS, PRED)"     N     0      0.000  1
       49    1     9     1  "RMS(OBS, PRED)"     C     0      0.000  1
       50    1     9     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       51    1     9     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       52    1     9     1  "RMS(OBS, PRED)"     H    24      1.027  1
       53    1     9     1  "RMS(OBS, PRED)"    HA    32      0.377  1
       54    1     9     1  "RMS(OBS, PRED)"     N     0      0.000  1
       55    1    10     1  "RMS(OBS, PRED)"     C     0      0.000  1
       56    1    10     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       57    1    10     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       58    1    10     1  "RMS(OBS, PRED)"     H    24      0.970  1
       59    1    10     1  "RMS(OBS, PRED)"    HA    32      0.332  1
       60    1    10     1  "RMS(OBS, PRED)"     N     0      0.000  1
       61    1    11     1  "RMS(OBS, PRED)"     C     0      0.000  1
       62    1    11     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       63    1    11     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       64    1    11     1  "RMS(OBS, PRED)"     H    24      0.933  1
       65    1    11     1  "RMS(OBS, PRED)"    HA    32      0.333  1
       66    1    11     1  "RMS(OBS, PRED)"     N     0      0.000  1
       67    1    12     1  "RMS(OBS, PRED)"     C     0      0.000  1
       68    1    12     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       69    1    12     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       70    1    12     1  "RMS(OBS, PRED)"     H    24      0.870  1
       71    1    12     1  "RMS(OBS, PRED)"    HA    32      0.354  1
       72    1    12     1  "RMS(OBS, PRED)"     N     0      0.000  1
       73    1    13     1  "RMS(OBS, PRED)"     C     0      0.000  1
       74    1    13     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       75    1    13     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       76    1    13     1  "RMS(OBS, PRED)"     H    24      0.948  1
       77    1    13     1  "RMS(OBS, PRED)"    HA    32      0.354  1
       78    1    13     1  "RMS(OBS, PRED)"     N     0      0.000  1
       79    1    14     1  "RMS(OBS, PRED)"     C     0      0.000  1
       80    1    14     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       81    1    14     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       82    1    14     1  "RMS(OBS, PRED)"     H    24      0.886  1
       83    1    14     1  "RMS(OBS, PRED)"    HA    32      0.348  1
       84    1    14     1  "RMS(OBS, PRED)"     N     0      0.000  1
       85    1    15     1  "RMS(OBS, PRED)"     C     0      0.000  1
       86    1    15     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       87    1    15     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       88    1    15     1  "RMS(OBS, PRED)"     H    24      0.901  1
       89    1    15     1  "RMS(OBS, PRED)"    HA    32      0.348  1
       90    1    15     1  "RMS(OBS, PRED)"     N     0      0.000  1
       91    1    16     1  "RMS(OBS, PRED)"     C     0      0.000  1
       92    1    16     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       93    1    16     1  "RMS(OBS, PRED)"    CB     0      0.000  1
       94    1    16     1  "RMS(OBS, PRED)"     H    24      0.958  1
       95    1    16     1  "RMS(OBS, PRED)"    HA    32      0.339  1
       96    1    16     1  "RMS(OBS, PRED)"     N     0      0.000  1
       97    1    17     1  "RMS(OBS, PRED)"     C     0      0.000  1
       98    1    17     1  "RMS(OBS, PRED)"    CA     0      0.000  1
       99    1    17     1  "RMS(OBS, PRED)"    CB     0      0.000  1
      100    1    17     1  "RMS(OBS, PRED)"     H    24      0.932  1
      101    1    17     1  "RMS(OBS, PRED)"    HA    32      0.355  1
      102    1    17     1  "RMS(OBS, PRED)"     N     0      0.000  1
      103    1    18     1  "RMS(OBS, PRED)"     C     0      0.000  1
      104    1    18     1  "RMS(OBS, PRED)"    CA     0      0.000  1
      105    1    18     1  "RMS(OBS, PRED)"    CB     0      0.000  1
      106    1    18     1  "RMS(OBS, PRED)"     H    24      0.864  1
      107    1    18     1  "RMS(OBS, PRED)"    HA    32      0.330  1
      108    1    18     1  "RMS(OBS, PRED)"     N     0      0.000  1
      109    1    19     1  "RMS(OBS, PRED)"     C     0      0.000  1
      110    1    19     1  "RMS(OBS, PRED)"    CA     0      0.000  1
      111    1    19     1  "RMS(OBS, PRED)"    CB     0      0.000  1
      112    1    19     1  "RMS(OBS, PRED)"     H    24      0.939  1
      113    1    19     1  "RMS(OBS, PRED)"    HA    32      0.341  1
      114    1    19     1  "RMS(OBS, PRED)"     N     0      0.000  1
      115    1    20     1  "RMS(OBS, PRED)"     C     0      0.000  1
      116    1    20     1  "RMS(OBS, PRED)"    CA     0      0.000  1
      117    1    20     1  "RMS(OBS, PRED)"    CB     0      0.000  1
      118    1    20     1  "RMS(OBS, PRED)"     H    24      0.932  1
      119    1    20     1  "RMS(OBS, PRED)"    HA    32      0.334  1
      120    1    20     1  "RMS(OBS, PRED)"     N     0      0.000  1
   stop_
save_

save_delta_chem_shifts_average
   _Entity_delta_chem_shifts.Sf_category      delta_chem_shifts
   _Entity_delta_chem_shifts.Sf_framecode     delta_chem_shifts_average
   _Entity_delta_chem_shifts.Conformer_type   "average"
   _Entity_delta_chem_shifts.ID               2
   _Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;

   loop_
      _Delta_CS.Assigned_chem_shift_list_ID
      _Delta_CS.Atom_chem_shift_ID
      _Delta_CS.Assembly_atom_ID
      _Delta_CS.Entity_assembly_ID
      _Delta_CS.Entity_ID
      _Delta_CS.PDB_asym_ID
      _Delta_CS.Comp_index_ID
      _Delta_CS.Seq_ID
      _Delta_CS.Comp_ID
      _Delta_CS.Atom_ID
      _Delta_CS.Atom_type
      _Delta_CS.Auth_seq_ID
      _Delta_CS.Original_CS_value
      _Delta_CS.Sparta_CS_value
      _Delta_CS.Delta_CS_value
      _Delta_CS.Entity_delta_chem_shifts_ID

        1     5  .     1     1     A     2     2   GLY     H      H     2      8.645      8.254      0.391  2
        1     6  .     1     1     A     2     2   GLY   HA2      H     2      3.887      3.926     -0.039  2
        1     7  .     1     1     A     2     2   GLY   HA3      H     2      3.764      3.928     -0.164  2
        1     8  .     1     1     A     3     3   GLU     H      H     3      7.071      7.957     -0.886  2
        1     9  .     1     1     A     3     3   GLU    HA      H     3      4.867      4.518      0.349  2
        1    14  .     1     1     A     4     4   THR     H      H     4      8.448      8.562     -0.114  2
        1    15  .     1     1     A     4     4   THR    HA      H     4      4.451      4.731     -0.280  2
        1    19  .     1     1     A     5     5   CYS     H      H     5      8.289      8.788     -0.499  2
        1    20  .     1     1     A     5     5   CYS    HA      H     5      5.162      4.661      0.501  2
        1    23  .     1     1     A     6     6   PHE     H      H     6      9.659      7.980      1.679  2
        1    24  .     1     1     A     6     6   PHE    HA      H     6      4.022      3.724      0.298  2
        1    30  .     1     1     A     7     7   GLY     H      H     7      9.220      7.951      1.269  2
        1    31  .     1     1     A     7     7   GLY   HA2      H     7      4.462      3.936      0.526  2
        1    32  .     1     1     A     7     7   GLY   HA3      H     7      3.881      4.020     -0.139  2
        1    33  .     1     1     A     8     8   GLY     H      H     8      8.215      8.571     -0.356  2
        1    34  .     1     1     A     8     8   GLY   HA2      H     8      4.577      4.023      0.554  2
        1    35  .     1     1     A     8     8   GLY   HA3      H     8      4.139      4.074      0.065  2
        1    36  .     1     1     A     9     9   THR     H      H     9      8.012      7.761      0.251  2
        1    37  .     1     1     A     9     9   THR    HA      H     9      4.740      4.562      0.178  2
        1    42  .     1     1     A    10    10   CYS     H      H    10      8.576      8.770     -0.194  2
        1    43  .     1     1     A    10    10   CYS    HA      H    10      4.685      5.244     -0.559  2
        1    46  .     1     1     A    11    11   ASN     H      H    11     11.445      9.284      2.161  2
        1    47  .     1     1     A    11    11   ASN    HA      H    11      4.827      4.699      0.128  2
        1    52  .     1     1     A    12    12   THR     H      H    12      9.679      7.781      1.898  2
        1    53  .     1     1     A    12    12   THR    HA      H    12      4.369      4.539     -0.170  2
        1    57  .     1     1     A    13    13   PRO    HA      H    13      4.308      4.276      0.032  2
        1    64  .     1     1     A    14    14   GLY     H      H    14      8.748      8.848     -0.100  2
        1    65  .     1     1     A    14    14   GLY   HA2      H    14      4.229      3.817      0.412  2
        1    66  .     1     1     A    14    14   GLY   HA3      H    14      3.747      3.818     -0.071  2
        1    67  .     1     1     A    15    15   CYS     H      H    15      7.712      7.516      0.196  2
        1    68  .     1     1     A    15    15   CYS    HA      H    15      5.331      4.671      0.660  2
        1    71  .     1     1     A    16    16   SER     H      H    16      9.548      9.358      0.190  2
        1    72  .     1     1     A    16    16   SER    HA      H    16      4.720      5.008     -0.288  2
        1    75  .     1     1     A    17    17   CYS     H      H    17      9.028      8.906      0.122  2
        1    76  .     1     1     A    17    17   CYS    HA      H    17      4.684      4.573      0.111  2
        1    79  .     1     1     A    18    18   THR     H      H    18      8.737      8.716      0.021  2
        1    80  .     1     1     A    18    18   THR    HA      H    18      4.498      4.831     -0.333  2
        1    85  .     1     1     A    19    19   TRP     H      H    19      7.677      8.275     -0.598  2
        1    86  .     1     1     A    19    19   TRP    HA      H    19      4.007      4.394     -0.387  2
        1    95  .     1     1     A    20    20   PRO    HA      H    20      3.323      3.582     -0.259  2
        1   102  .     1     1     A    21    21   ILE     H      H    21      8.646      7.570      1.076  2
        1   103  .     1     1     A    21    21   ILE    HA      H    21      4.249      4.748     -0.499  2
        1   113  .     1     1     A    22    22   CYS     H      H    22      7.444      9.106     -1.662  2
        1   114  .     1     1     A    22    22   CYS    HA      H    22      5.082      5.136     -0.054  2
        1   117  .     1     1     A    23    23   THR     H      H    23      9.953      9.231      0.722  2
        1   118  .     1     1     A    23    23   THR    HA      H    23      5.065      5.118     -0.053  2
        1   123  .     1     1     A    24    24   ARG     H      H    24      8.743      8.488      0.255  2
        1   124  .     1     1     A    24    24   ARG    HA      H    24      4.793      4.735      0.058  2
        1   132  .     1     1     A    25    25   ASP     H      H    25      9.403      9.419     -0.016  2
        1   133  .     1     1     A    25    25   ASP    HA      H    25      4.376      4.414     -0.038  2
        1   136  .     1     1     A    26    26   GLY     H      H    26      8.543      8.677     -0.134  2
        1   137  .     1     1     A    26    26   GLY   HA2      H    26      4.212      3.870      0.342  2
        1   138  .     1     1     A    26    26   GLY   HA3      H    26      3.616      3.871     -0.255  2
        1   139  .     1     1     A    27    27   LEU     H      H    27      7.799      8.217     -0.418  2
        1   140  .     1     1     A    27    27   LEU    HA      H    27      5.103      4.600      0.503  2
        1   150  .     1     1     A    28    28   PRO    HA      H    28      5.096      4.611      0.485  2
   stop_
save_