###################################
     #  Assigned chemical shift lists  #
     ###################################

###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################

save_assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Sf_category                  assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                 assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Entry_ID                     31207
   _Assigned_chem_shift_list.ID                           1
   _Assigned_chem_shift_list.Name                         .
   _Assigned_chem_shift_list.Sample_condition_list_ID     1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID      1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chem_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err            .
   _Assigned_chem_shift_list.Chem_shift_13C_err           .
   _Assigned_chem_shift_list.Chem_shift_15N_err           .
   _Assigned_chem_shift_list.Chem_shift_31P_err           .
   _Assigned_chem_shift_list.Chem_shift_2H_err            .
   _Assigned_chem_shift_list.Chem_shift_19F_err           .
   _Assigned_chem_shift_list.Error_derivation_method      .
   _Assigned_chem_shift_list.Details                      .
   _Assigned_chem_shift_list.Text_data_format             .
   _Assigned_chem_shift_list.Text_data                    .

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

     1   '2D 1H-1H TOCSY'   .   .   .   31207   1    
     2   '2D 1H-1H COSY'    .   .   .   31207   1    
     3   '2D DQF-COSY'      .   .   .   31207   1    
     4   '2D 1H-1H NOESY'   .   .   .   31207   1    

   stop_

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

     1     .   1   .   1   1    1    GLY   HA2    H   1   3.635    0.000   .   2   .   .   .   .   A   1    GLY   HA2    .   31207   1    
     2     .   1   .   1   2    2    PHE   H      H   1   8.610    0.000   .   1   .   .   .   .   A   2    PHE   H      .   31207   1    
     3     .   1   .   1   2    2    PHE   HA     H   1   3.929    0.002   .   1   .   .   .   .   A   2    PHE   HA     .   31207   1    
     4     .   1   .   1   2    2    PHE   HB2    H   1   2.846    0.002   .   2   .   .   .   .   A   2    PHE   HB2    .   31207   1    
     5     .   1   .   1   2    2    PHE   HB3    H   1   2.747    0.001   .   2   .   .   .   .   A   2    PHE   HB3    .   31207   1    
     6     .   1   .   1   2    2    PHE   HD1    H   1   6.832    0.000   .   3   .   .   .   .   A   2    PHE   HD1    .   31207   1    
     7     .   1   .   1   2    2    PHE   HD2    H   1   6.832    0.000   .   3   .   .   .   .   A   2    PHE   HD2    .   31207   1    
     8     .   1   .   1   2    2    PHE   HE1    H   1   7.206    0.001   .   3   .   .   .   .   A   2    PHE   HE1    .   31207   1    
     9     .   1   .   1   2    2    PHE   HE2    H   1   7.206    0.001   .   3   .   .   .   .   A   2    PHE   HE2    .   31207   1    
     10    .   1   .   1   3    3    GLY   H      H   1   8.196    0.000   .   1   .   .   .   .   A   3    GLY   H      .   31207   1    
     11    .   1   .   1   3    3    GLY   HA2    H   1   3.508    0.000   .   2   .   .   .   .   A   3    GLY   HA2    .   31207   1    
     12    .   1   .   1   4    4    CYS   H      H   1   7.809    0.000   .   1   .   .   .   .   A   4    CYS   H      .   31207   1    
     13    .   1   .   1   4    4    CYS   HA     H   1   4.721    0.000   .   1   .   .   .   .   A   4    CYS   HA     .   31207   1    
     14    .   1   .   1   4    4    CYS   HB2    H   1   2.610    0.000   .   2   .   .   .   .   A   4    CYS   HB2    .   31207   1    
     15    .   1   .   1   4    4    CYS   HB3    H   1   2.395    0.000   .   2   .   .   .   .   A   4    CYS   HB3    .   31207   1    
     16    .   1   .   1   5    5    ASN   H      H   1   8.084    0.001   .   1   .   .   .   .   A   5    ASN   H      .   31207   1    
     17    .   1   .   1   5    5    ASN   HA     H   1   5.169    0.001   .   1   .   .   .   .   A   5    ASN   HA     .   31207   1    
     18    .   1   .   1   5    5    ASN   HB2    H   1   3.069    0.001   .   2   .   .   .   .   A   5    ASN   HB2    .   31207   1    
     19    .   1   .   1   5    5    ASN   HB3    H   1   2.715    0.001   .   2   .   .   .   .   A   5    ASN   HB3    .   31207   1    
     20    .   1   .   1   5    5    ASN   HD21   H   1   6.926    0.000   .   2   .   .   .   .   A   5    ASN   HD21   .   31207   1    
     21    .   1   .   1   5    5    ASN   HD22   H   1   7.363    0.000   .   2   .   .   .   .   A   5    ASN   HD22   .   31207   1    
     22    .   1   .   1   6    6    GLY   H      H   1   7.269    0.001   .   1   .   .   .   .   A   6    GLY   H      .   31207   1    
     23    .   1   .   1   6    6    GLY   HA2    H   1   1.667    0.000   .   2   .   .   .   .   A   6    GLY   HA2    .   31207   1    
     24    .   1   .   1   7    7    PRO   HA     H   1   3.965    0.001   .   1   .   .   .   .   A   7    PRO   HA     .   31207   1    
     25    .   1   .   1   7    7    PRO   HB2    H   1   1.845    0.000   .   2   .   .   .   .   A   7    PRO   HB2    .   31207   1    
     26    .   1   .   1   7    7    PRO   HB3    H   1   1.171    0.000   .   2   .   .   .   .   A   7    PRO   HB3    .   31207   1    
     27    .   1   .   1   7    7    PRO   HG2    H   1   1.768    0.000   .   2   .   .   .   .   A   7    PRO   HG2    .   31207   1    
     28    .   1   .   1   7    7    PRO   HG3    H   1   1.488    0.000   .   2   .   .   .   .   A   7    PRO   HG3    .   31207   1    
     29    .   1   .   1   7    7    PRO   HD2    H   1   3.166    0.001   .   2   .   .   .   .   A   7    PRO   HD2    .   31207   1    
     30    .   1   .   1   7    7    PRO   HD3    H   1   3.083    0.001   .   2   .   .   .   .   A   7    PRO   HD3    .   31207   1    
     31    .   1   .   1   8    8    TRP   H      H   1   7.620    0.001   .   1   .   .   .   .   A   8    TRP   H      .   31207   1    
     32    .   1   .   1   8    8    TRP   HA     H   1   4.754    0.000   .   1   .   .   .   .   A   8    TRP   HA     .   31207   1    
     33    .   1   .   1   8    8    TRP   HB2    H   1   3.469    0.000   .   2   .   .   .   .   A   8    TRP   HB2    .   31207   1    
     34    .   1   .   1   8    8    TRP   HB3    H   1   3.156    0.000   .   2   .   .   .   .   A   8    TRP   HB3    .   31207   1    
     35    .   1   .   1   8    8    TRP   HD1    H   1   7.192    0.000   .   1   .   .   .   .   A   8    TRP   HD1    .   31207   1    
     36    .   1   .   1   8    8    TRP   HE1    H   1   10.148   0.000   .   1   .   .   .   .   A   8    TRP   HE1    .   31207   1    
     37    .   1   .   1   8    8    TRP   HE3    H   1   7.687    0.000   .   1   .   .   .   .   A   8    TRP   HE3    .   31207   1    
     38    .   1   .   1   8    8    TRP   HZ2    H   1   7.560    0.001   .   1   .   .   .   .   A   8    TRP   HZ2    .   31207   1    
     39    .   1   .   1   8    8    TRP   HZ3    H   1   7.226    0.001   .   1   .   .   .   .   A   8    TRP   HZ3    .   31207   1    
     40    .   1   .   1   8    8    TRP   HH2    H   1   7.322    0.000   .   1   .   .   .   .   A   8    TRP   HH2    .   31207   1    
     41    .   1   .   1   9    9    ASN   H      H   1   7.690    0.000   .   1   .   .   .   .   A   9    ASN   H      .   31207   1    
     42    .   1   .   1   9    9    ASN   HA     H   1   4.732    0.000   .   1   .   .   .   .   A   9    ASN   HA     .   31207   1    
     43    .   1   .   1   9    9    ASN   HB2    H   1   2.778    0.000   .   2   .   .   .   .   A   9    ASN   HB2    .   31207   1    
     44    .   1   .   1   9    9    ASN   HB3    H   1   2.640    0.000   .   2   .   .   .   .   A   9    ASN   HB3    .   31207   1    
     45    .   1   .   1   9    9    ASN   HD21   H   1   6.960    0.000   .   2   .   .   .   .   A   9    ASN   HD21   .   31207   1    
     46    .   1   .   1   9    9    ASN   HD22   H   1   7.583    0.000   .   2   .   .   .   .   A   9    ASN   HD22   .   31207   1    
     47    .   1   .   1   10   10   GLU   H      H   1   8.460    0.000   .   1   .   .   .   .   A   10   GLU   H      .   31207   1    
     48    .   1   .   1   10   10   GLU   HA     H   1   4.790    0.000   .   1   .   .   .   .   A   10   GLU   HA     .   31207   1    
     49    .   1   .   1   10   10   GLU   HB2    H   1   1.924    0.000   .   2   .   .   .   .   A   10   GLU   HB2    .   31207   1    
     50    .   1   .   1   10   10   GLU   HG2    H   1   2.264    0.000   .   2   .   .   .   .   A   10   GLU   HG2    .   31207   1    
     51    .   1   .   1   11   11   ASP   H      H   1   8.497    0.002   .   1   .   .   .   .   A   11   ASP   H      .   31207   1    
     52    .   1   .   1   11   11   ASP   HA     H   1   4.878    0.001   .   1   .   .   .   .   A   11   ASP   HA     .   31207   1    
     53    .   1   .   1   11   11   ASP   HB2    H   1   2.581    0.000   .   2   .   .   .   .   A   11   ASP   HB2    .   31207   1    
     54    .   1   .   1   12   12   ASP   H      H   1   8.394    0.000   .   1   .   .   .   .   A   12   ASP   H      .   31207   1    
     55    .   1   .   1   12   12   ASP   HA     H   1   4.353    0.001   .   1   .   .   .   .   A   12   ASP   HA     .   31207   1    
     56    .   1   .   1   12   12   ASP   HB2    H   1   2.741    0.000   .   2   .   .   .   .   A   12   ASP   HB2    .   31207   1    
     57    .   1   .   1   13   13   LEU   H      H   1   8.247    0.000   .   1   .   .   .   .   A   13   LEU   H      .   31207   1    
     58    .   1   .   1   13   13   LEU   HA     H   1   4.254    0.002   .   1   .   .   .   .   A   13   LEU   HA     .   31207   1    
     59    .   1   .   1   13   13   LEU   HB2    H   1   1.904    0.001   .   2   .   .   .   .   A   13   LEU   HB2    .   31207   1    
     60    .   1   .   1   13   13   LEU   HB3    H   1   1.653    0.000   .   2   .   .   .   .   A   13   LEU   HB3    .   31207   1    
     61    .   1   .   1   13   13   LEU   HG     H   1   1.639    0.001   .   1   .   .   .   .   A   13   LEU   HG     .   31207   1    
     62    .   1   .   1   13   13   LEU   HD11   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD11   .   31207   1    
     63    .   1   .   1   13   13   LEU   HD12   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD12   .   31207   1    
     64    .   1   .   1   13   13   LEU   HD13   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD13   .   31207   1    
     65    .   1   .   1   13   13   LEU   HD21   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD21   .   31207   1    
     66    .   1   .   1   13   13   LEU   HD22   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD22   .   31207   1    
     67    .   1   .   1   13   13   LEU   HD23   H   1   0.920    0.000   .   2   .   .   .   .   A   13   LEU   HD23   .   31207   1    
     68    .   1   .   1   14   14   ARG   H      H   1   7.522    0.001   .   1   .   .   .   .   A   14   ARG   H      .   31207   1    
     69    .   1   .   1   14   14   ARG   HA     H   1   4.064    0.001   .   1   .   .   .   .   A   14   ARG   HA     .   31207   1    
     70    .   1   .   1   14   14   ARG   HB2    H   1   1.835    0.000   .   2   .   .   .   .   A   14   ARG   HB2    .   31207   1    
     71    .   1   .   1   14   14   ARG   HB3    H   1   1.835    0.000   .   2   .   .   .   .   A   14   ARG   HB3    .   31207   1    
     72    .   1   .   1   14   14   ARG   HG2    H   1   1.743    0.000   .   2   .   .   .   .   A   14   ARG   HG2    .   31207   1    
     73    .   1   .   1   14   14   ARG   HG3    H   1   1.509    0.001   .   2   .   .   .   .   A   14   ARG   HG3    .   31207   1    
     74    .   1   .   1   14   14   ARG   HD2    H   1   3.161    0.001   .   2   .   .   .   .   A   14   ARG   HD2    .   31207   1    
     75    .   1   .   1   14   14   ARG   HD3    H   1   3.161    0.001   .   2   .   .   .   .   A   14   ARG   HD3    .   31207   1    
     76    .   1   .   1   14   14   ARG   HE     H   1   7.382    0.001   .   1   .   .   .   .   A   14   ARG   HE     .   31207   1    
     77    .   1   .   1   15   15   CYS   H      H   1   7.442    0.001   .   1   .   .   .   .   A   15   CYS   H      .   31207   1    
     78    .   1   .   1   15   15   CYS   HA     H   1   4.866    0.000   .   1   .   .   .   .   A   15   CYS   HA     .   31207   1    
     79    .   1   .   1   15   15   CYS   HB2    H   1   3.775    0.000   .   2   .   .   .   .   A   15   CYS   HB2    .   31207   1    
     80    .   1   .   1   15   15   CYS   HB3    H   1   2.612    0.000   .   2   .   .   .   .   A   15   CYS   HB3    .   31207   1    
     81    .   1   .   1   16   16   HIS   H      H   1   9.121    0.000   .   1   .   .   .   .   A   16   HIS   H      .   31207   1    
     82    .   1   .   1   16   16   HIS   HA     H   1   3.832    0.001   .   1   .   .   .   .   A   16   HIS   HA     .   31207   1    
     83    .   1   .   1   16   16   HIS   HB2    H   1   3.625    0.001   .   2   .   .   .   .   A   16   HIS   HB2    .   31207   1    
     84    .   1   .   1   16   16   HIS   HB3    H   1   3.583    0.003   .   2   .   .   .   .   A   16   HIS   HB3    .   31207   1    
     85    .   1   .   1   16   16   HIS   HD2    H   1   7.388    0.000   .   1   .   .   .   .   A   16   HIS   HD2    .   31207   1    
     86    .   1   .   1   16   16   HIS   HE1    H   1   8.531    0.000   .   1   .   .   .   .   A   16   HIS   HE1    .   31207   1    
     87    .   1   .   1   17   17   ASN   H      H   1   8.843    0.000   .   1   .   .   .   .   A   17   ASN   H      .   31207   1    
     88    .   1   .   1   17   17   ASN   HA     H   1   4.345    0.001   .   1   .   .   .   .   A   17   ASN   HA     .   31207   1    
     89    .   1   .   1   17   17   ASN   HB2    H   1   2.941    0.000   .   2   .   .   .   .   A   17   ASN   HB2    .   31207   1    
     90    .   1   .   1   17   17   ASN   HB3    H   1   2.836    0.001   .   2   .   .   .   .   A   17   ASN   HB3    .   31207   1    
     91    .   1   .   1   17   17   ASN   HD21   H   1   6.922    0.000   .   2   .   .   .   .   A   17   ASN   HD21   .   31207   1    
     92    .   1   .   1   17   17   ASN   HD22   H   1   7.642    0.000   .   2   .   .   .   .   A   17   ASN   HD22   .   31207   1    
     93    .   1   .   1   18   18   HIS   H      H   1   8.214    0.001   .   1   .   .   .   .   A   18   HIS   H      .   31207   1    
     94    .   1   .   1   18   18   HIS   HA     H   1   4.315    0.000   .   1   .   .   .   .   A   18   HIS   HA     .   31207   1    
     95    .   1   .   1   18   18   HIS   HB2    H   1   3.632    0.002   .   2   .   .   .   .   A   18   HIS   HB2    .   31207   1    
     96    .   1   .   1   18   18   HIS   HB3    H   1   3.234    0.004   .   2   .   .   .   .   A   18   HIS   HB3    .   31207   1    
     97    .   1   .   1   18   18   HIS   HD2    H   1   6.687    0.000   .   1   .   .   .   .   A   18   HIS   HD2    .   31207   1    
     98    .   1   .   1   18   18   HIS   HE1    H   1   8.063    0.000   .   1   .   .   .   .   A   18   HIS   HE1    .   31207   1    
     99    .   1   .   1   19   19   CYS   H      H   1   8.562    0.000   .   1   .   .   .   .   A   19   CYS   H      .   31207   1    
     100   .   1   .   1   19   19   CYS   HA     H   1   3.713    0.000   .   1   .   .   .   .   A   19   CYS   HA     .   31207   1    
     101   .   1   .   1   19   19   CYS   HB2    H   1   2.248    0.000   .   2   .   .   .   .   A   19   CYS   HB2    .   31207   1    
     102   .   1   .   1   19   19   CYS   HB3    H   1   2.186    0.000   .   2   .   .   .   .   A   19   CYS   HB3    .   31207   1    
     103   .   1   .   1   20   20   LYS   H      H   1   7.794    0.001   .   1   .   .   .   .   A   20   LYS   H      .   31207   1    
     104   .   1   .   1   20   20   LYS   HA     H   1   3.771    0.001   .   1   .   .   .   .   A   20   LYS   HA     .   31207   1    
     105   .   1   .   1   20   20   LYS   HB2    H   1   1.568    0.000   .   2   .   .   .   .   A   20   LYS   HB2    .   31207   1    
     106   .   1   .   1   20   20   LYS   HB3    H   1   1.568    0.000   .   2   .   .   .   .   A   20   LYS   HB3    .   31207   1    
     107   .   1   .   1   20   20   LYS   HG2    H   1   1.223    0.001   .   2   .   .   .   .   A   20   LYS   HG2    .   31207   1    
     108   .   1   .   1   20   20   LYS   HG3    H   1   1.223    0.001   .   2   .   .   .   .   A   20   LYS   HG3    .   31207   1    
     109   .   1   .   1   20   20   LYS   HD2    H   1   1.490    0.000   .   2   .   .   .   .   A   20   LYS   HD2    .   31207   1    
     110   .   1   .   1   20   20   LYS   HD3    H   1   1.490    0.000   .   2   .   .   .   .   A   20   LYS   HD3    .   31207   1    
     111   .   1   .   1   20   20   LYS   HE2    H   1   2.993    0.000   .   2   .   .   .   .   A   20   LYS   HE2    .   31207   1    
     112   .   1   .   1   20   20   LYS   HE3    H   1   2.993    0.000   .   2   .   .   .   .   A   20   LYS   HE3    .   31207   1    
     113   .   1   .   1   21   21   SER   H      H   1   7.213    0.001   .   1   .   .   .   .   A   21   SER   H      .   31207   1    
     114   .   1   .   1   21   21   SER   HA     H   1   4.341    0.000   .   1   .   .   .   .   A   21   SER   HA     .   31207   1    
     115   .   1   .   1   21   21   SER   HB2    H   1   4.017    0.000   .   2   .   .   .   .   A   21   SER   HB2    .   31207   1    
     116   .   1   .   1   21   21   SER   HB3    H   1   3.890    0.000   .   2   .   .   .   .   A   21   SER   HB3    .   31207   1    
     117   .   1   .   1   22   22   ILE   H      H   1   7.545    0.001   .   1   .   .   .   .   A   22   ILE   H      .   31207   1    
     118   .   1   .   1   22   22   ILE   HA     H   1   4.004    0.000   .   1   .   .   .   .   A   22   ILE   HA     .   31207   1    
     119   .   1   .   1   22   22   ILE   HB     H   1   1.982    0.000   .   1   .   .   .   .   A   22   ILE   HB     .   31207   1    
     120   .   1   .   1   22   22   ILE   HG12   H   1   1.338    0.000   .   2   .   .   .   .   A   22   ILE   HG12   .   31207   1    
     121   .   1   .   1   22   22   ILE   HG13   H   1   0.737    0.000   .   2   .   .   .   .   A   22   ILE   HG13   .   31207   1    
     122   .   1   .   1   22   22   ILE   HG21   H   1   0.784    0.000   .   1   .   .   .   .   A   22   ILE   HG21   .   31207   1    
     123   .   1   .   1   22   22   ILE   HG22   H   1   0.784    0.000   .   1   .   .   .   .   A   22   ILE   HG22   .   31207   1    
     124   .   1   .   1   22   22   ILE   HG23   H   1   0.784    0.000   .   1   .   .   .   .   A   22   ILE   HG23   .   31207   1    
     125   .   1   .   1   22   22   ILE   HD11   H   1   0.501    0.000   .   1   .   .   .   .   A   22   ILE   HD11   .   31207   1    
     126   .   1   .   1   22   22   ILE   HD12   H   1   0.501    0.000   .   1   .   .   .   .   A   22   ILE   HD12   .   31207   1    
     127   .   1   .   1   22   22   ILE   HD13   H   1   0.501    0.000   .   1   .   .   .   .   A   22   ILE   HD13   .   31207   1    
     128   .   1   .   1   23   23   LYS   H      H   1   8.197    0.000   .   1   .   .   .   .   A   23   LYS   H      .   31207   1    
     129   .   1   .   1   23   23   LYS   HA     H   1   3.899    0.002   .   1   .   .   .   .   A   23   LYS   HA     .   31207   1    
     130   .   1   .   1   23   23   LYS   HB2    H   1   1.733    0.000   .   2   .   .   .   .   A   23   LYS   HB2    .   31207   1    
     131   .   1   .   1   23   23   LYS   HB3    H   1   1.655    0.000   .   2   .   .   .   .   A   23   LYS   HB3    .   31207   1    
     132   .   1   .   1   23   23   LYS   HG2    H   1   1.329    0.004   .   2   .   .   .   .   A   23   LYS   HG2    .   31207   1    
     133   .   1   .   1   23   23   LYS   HG3    H   1   1.329    0.004   .   2   .   .   .   .   A   23   LYS   HG3    .   31207   1    
     134   .   1   .   1   23   23   LYS   HD2    H   1   1.439    0.001   .   2   .   .   .   .   A   23   LYS   HD2    .   31207   1    
     135   .   1   .   1   23   23   LYS   HD3    H   1   1.439    0.001   .   2   .   .   .   .   A   23   LYS   HD3    .   31207   1    
     136   .   1   .   1   23   23   LYS   HE2    H   1   2.962    0.000   .   2   .   .   .   .   A   23   LYS   HE2    .   31207   1    
     137   .   1   .   1   23   23   LYS   HE3    H   1   2.962    0.000   .   2   .   .   .   .   A   23   LYS   HE3    .   31207   1    
     138   .   1   .   1   24   24   GLY   H      H   1   8.562    0.000   .   1   .   .   .   .   A   24   GLY   H      .   31207   1    
     139   .   1   .   1   24   24   GLY   HA2    H   1   3.500    0.006   .   2   .   .   .   .   A   24   GLY   HA2    .   31207   1    
     140   .   1   .   1   25   25   TYR   H      H   1   7.763    0.000   .   1   .   .   .   .   A   25   TYR   H      .   31207   1    
     141   .   1   .   1   25   25   TYR   HA     H   1   4.843    0.003   .   1   .   .   .   .   A   25   TYR   HA     .   31207   1    
     142   .   1   .   1   25   25   TYR   HB2    H   1   3.220    0.000   .   2   .   .   .   .   A   25   TYR   HB2    .   31207   1    
     143   .   1   .   1   25   25   TYR   HB3    H   1   2.670    0.000   .   2   .   .   .   .   A   25   TYR   HB3    .   31207   1    
     144   .   1   .   1   25   25   TYR   HD1    H   1   6.988    0.001   .   3   .   .   .   .   A   25   TYR   HD1    .   31207   1    
     145   .   1   .   1   25   25   TYR   HD2    H   1   6.988    0.001   .   3   .   .   .   .   A   25   TYR   HD2    .   31207   1    
     146   .   1   .   1   25   25   TYR   HE1    H   1   6.684    0.000   .   3   .   .   .   .   A   25   TYR   HE1    .   31207   1    
     147   .   1   .   1   25   25   TYR   HE2    H   1   6.684    0.000   .   3   .   .   .   .   A   25   TYR   HE2    .   31207   1    
     148   .   1   .   1   26   26   LYS   H      H   1   9.302    0.001   .   1   .   .   .   .   A   26   LYS   H      .   31207   1    
     149   .   1   .   1   26   26   LYS   HA     H   1   4.455    0.000   .   1   .   .   .   .   A   26   LYS   HA     .   31207   1    
     150   .   1   .   1   26   26   LYS   HB2    H   1   1.858    0.000   .   2   .   .   .   .   A   26   LYS   HB2    .   31207   1    
     151   .   1   .   1   26   26   LYS   HB3    H   1   1.725    0.000   .   2   .   .   .   .   A   26   LYS   HB3    .   31207   1    
     152   .   1   .   1   26   26   LYS   HG2    H   1   1.464    0.000   .   2   .   .   .   .   A   26   LYS   HG2    .   31207   1    
     153   .   1   .   1   26   26   LYS   HG3    H   1   1.464    0.000   .   2   .   .   .   .   A   26   LYS   HG3    .   31207   1    
     154   .   1   .   1   26   26   LYS   HD2    H   1   1.772    0.000   .   2   .   .   .   .   A   26   LYS   HD2    .   31207   1    
     155   .   1   .   1   26   26   LYS   HD3    H   1   1.772    0.000   .   2   .   .   .   .   A   26   LYS   HD3    .   31207   1    
     156   .   1   .   1   26   26   LYS   HE2    H   1   3.069    0.001   .   2   .   .   .   .   A   26   LYS   HE2    .   31207   1    
     157   .   1   .   1   26   26   LYS   HE3    H   1   3.069    0.001   .   2   .   .   .   .   A   26   LYS   HE3    .   31207   1    
     158   .   1   .   1   27   27   GLY   H      H   1   7.155    0.000   .   1   .   .   .   .   A   27   GLY   H      .   31207   1    
     159   .   1   .   1   27   27   GLY   HA2    H   1   3.275    0.001   .   2   .   .   .   .   A   27   GLY   HA2    .   31207   1    
     160   .   1   .   1   28   28   GLY   H      H   1   8.130    0.001   .   1   .   .   .   .   A   28   GLY   H      .   31207   1    
     161   .   1   .   1   28   28   GLY   HA2    H   1   4.307    0.001   .   2   .   .   .   .   A   28   GLY   HA2    .   31207   1    
     162   .   1   .   1   29   29   TYR   H      H   1   8.470    0.001   .   1   .   .   .   .   A   29   TYR   H      .   31207   1    
     163   .   1   .   1   29   29   TYR   HA     H   1   4.821    0.000   .   1   .   .   .   .   A   29   TYR   HA     .   31207   1    
     164   .   1   .   1   29   29   TYR   HB2    H   1   3.256    0.001   .   2   .   .   .   .   A   29   TYR   HB2    .   31207   1    
     165   .   1   .   1   29   29   TYR   HB3    H   1   3.100    0.001   .   2   .   .   .   .   A   29   TYR   HB3    .   31207   1    
     166   .   1   .   1   29   29   TYR   HD1    H   1   7.028    0.000   .   3   .   .   .   .   A   29   TYR   HD1    .   31207   1    
     167   .   1   .   1   29   29   TYR   HD2    H   1   7.028    0.000   .   3   .   .   .   .   A   29   TYR   HD2    .   31207   1    
     168   .   1   .   1   29   29   TYR   HE1    H   1   6.682    0.000   .   3   .   .   .   .   A   29   TYR   HE1    .   31207   1    
     169   .   1   .   1   29   29   TYR   HE2    H   1   6.682    0.000   .   3   .   .   .   .   A   29   TYR   HE2    .   31207   1    
     170   .   1   .   1   30   30   CYS   H      H   1   8.789    0.000   .   1   .   .   .   .   A   30   CYS   H      .   31207   1    
     171   .   1   .   1   30   30   CYS   HA     H   1   5.530    0.001   .   1   .   .   .   .   A   30   CYS   HA     .   31207   1    
     172   .   1   .   1   30   30   CYS   HB2    H   1   2.855    0.002   .   2   .   .   .   .   A   30   CYS   HB2    .   31207   1    
     173   .   1   .   1   30   30   CYS   HB3    H   1   2.615    0.003   .   2   .   .   .   .   A   30   CYS   HB3    .   31207   1    
     174   .   1   .   1   31   31   ALA   H      H   1   9.480    0.000   .   1   .   .   .   .   A   31   ALA   H      .   31207   1    
     175   .   1   .   1   31   31   ALA   HA     H   1   4.720    0.001   .   1   .   .   .   .   A   31   ALA   HA     .   31207   1    
     176   .   1   .   1   31   31   ALA   HB1    H   1   1.471    0.000   .   1   .   .   .   .   A   31   ALA   HB1    .   31207   1    
     177   .   1   .   1   31   31   ALA   HB2    H   1   1.471    0.000   .   1   .   .   .   .   A   31   ALA   HB2    .   31207   1    
     178   .   1   .   1   31   31   ALA   HB3    H   1   1.471    0.000   .   1   .   .   .   .   A   31   ALA   HB3    .   31207   1    
     179   .   1   .   1   32   32   LYS   H      H   1   8.868    0.000   .   1   .   .   .   .   A   32   LYS   H      .   31207   1    
     180   .   1   .   1   32   32   LYS   HA     H   1   4.002    0.001   .   1   .   .   .   .   A   32   LYS   HA     .   31207   1    
     181   .   1   .   1   32   32   LYS   HB2    H   1   1.976    0.000   .   2   .   .   .   .   A   32   LYS   HB2    .   31207   1    
     182   .   1   .   1   32   32   LYS   HB3    H   1   1.861    0.001   .   2   .   .   .   .   A   32   LYS   HB3    .   31207   1    
     183   .   1   .   1   32   32   LYS   HG2    H   1   1.434    0.000   .   2   .   .   .   .   A   32   LYS   HG2    .   31207   1    
     184   .   1   .   1   32   32   LYS   HG3    H   1   1.434    0.000   .   2   .   .   .   .   A   32   LYS   HG3    .   31207   1    
     185   .   1   .   1   32   32   LYS   HD2    H   1   1.717    0.000   .   2   .   .   .   .   A   32   LYS   HD2    .   31207   1    
     186   .   1   .   1   32   32   LYS   HD3    H   1   1.497    0.002   .   2   .   .   .   .   A   32   LYS   HD3    .   31207   1    
     187   .   1   .   1   32   32   LYS   HE2    H   1   3.005    0.000   .   2   .   .   .   .   A   32   LYS   HE2    .   31207   1    
     188   .   1   .   1   32   32   LYS   HE3    H   1   3.005    0.000   .   2   .   .   .   .   A   32   LYS   HE3    .   31207   1    
     189   .   1   .   1   33   33   GLY   H      H   1   8.793    0.000   .   1   .   .   .   .   A   33   GLY   H      .   31207   1    
     190   .   1   .   1   33   33   GLY   HA2    H   1   3.666    0.002   .   2   .   .   .   .   A   33   GLY   HA2    .   31207   1    
     191   .   1   .   1   34   34   GLY   H      H   1   7.600    0.000   .   1   .   .   .   .   A   34   GLY   H      .   31207   1    
     192   .   1   .   1   34   34   GLY   HA2    H   1   3.203    0.000   .   2   .   .   .   .   A   34   GLY   HA2    .   31207   1    
     193   .   1   .   1   35   35   PHE   H      H   1   7.600    0.001   .   1   .   .   .   .   A   35   PHE   H      .   31207   1    
     194   .   1   .   1   35   35   PHE   HA     H   1   4.346    0.001   .   1   .   .   .   .   A   35   PHE   HA     .   31207   1    
     195   .   1   .   1   35   35   PHE   HB2    H   1   3.337    0.001   .   2   .   .   .   .   A   35   PHE   HB2    .   31207   1    
     196   .   1   .   1   35   35   PHE   HB3    H   1   2.744    0.001   .   2   .   .   .   .   A   35   PHE   HB3    .   31207   1    
     197   .   1   .   1   35   35   PHE   HD1    H   1   7.328    0.000   .   3   .   .   .   .   A   35   PHE   HD1    .   31207   1    
     198   .   1   .   1   35   35   PHE   HD2    H   1   7.328    0.000   .   3   .   .   .   .   A   35   PHE   HD2    .   31207   1    
     199   .   1   .   1   35   35   PHE   HE1    H   1   7.371    0.001   .   3   .   .   .   .   A   35   PHE   HE1    .   31207   1    
     200   .   1   .   1   35   35   PHE   HE2    H   1   7.371    0.001   .   3   .   .   .   .   A   35   PHE   HE2    .   31207   1    
     201   .   1   .   1   36   36   VAL   H      H   1   7.640    0.001   .   1   .   .   .   .   A   36   VAL   H      .   31207   1    
     202   .   1   .   1   36   36   VAL   HA     H   1   4.449    0.000   .   1   .   .   .   .   A   36   VAL   HA     .   31207   1    
     203   .   1   .   1   36   36   VAL   HB     H   1   1.750    0.000   .   1   .   .   .   .   A   36   VAL   HB     .   31207   1    
     204   .   1   .   1   36   36   VAL   HG11   H   1   0.835    0.000   .   2   .   .   .   .   A   36   VAL   HG11   .   31207   1    
     205   .   1   .   1   36   36   VAL   HG12   H   1   0.835    0.000   .   2   .   .   .   .   A   36   VAL   HG12   .   31207   1    
     206   .   1   .   1   36   36   VAL   HG13   H   1   0.835    0.000   .   2   .   .   .   .   A   36   VAL   HG13   .   31207   1    
     207   .   1   .   1   36   36   VAL   HG21   H   1   0.951    0.000   .   2   .   .   .   .   A   36   VAL   HG21   .   31207   1    
     208   .   1   .   1   36   36   VAL   HG22   H   1   0.951    0.000   .   2   .   .   .   .   A   36   VAL   HG22   .   31207   1    
     209   .   1   .   1   36   36   VAL   HG23   H   1   0.951    0.000   .   2   .   .   .   .   A   36   VAL   HG23   .   31207   1    
     210   .   1   .   1   37   37   CYS   H      H   1   8.850    0.001   .   1   .   .   .   .   A   37   CYS   H      .   31207   1    
     211   .   1   .   1   37   37   CYS   HA     H   1   5.110    0.000   .   1   .   .   .   .   A   37   CYS   HA     .   31207   1    
     212   .   1   .   1   37   37   CYS   HB2    H   1   3.268    0.000   .   2   .   .   .   .   A   37   CYS   HB2    .   31207   1    
     213   .   1   .   1   37   37   CYS   HB3    H   1   2.647    0.000   .   2   .   .   .   .   A   37   CYS   HB3    .   31207   1    
     214   .   1   .   1   38   38   LYS   H      H   1   9.034    0.000   .   1   .   .   .   .   A   38   LYS   H      .   31207   1    
     215   .   1   .   1   38   38   LYS   HA     H   1   4.347    0.000   .   1   .   .   .   .   A   38   LYS   HA     .   31207   1    
     216   .   1   .   1   38   38   LYS   HB2    H   1   1.583    0.001   .   2   .   .   .   .   A   38   LYS   HB2    .   31207   1    
     217   .   1   .   1   38   38   LYS   HB3    H   1   1.583    0.001   .   2   .   .   .   .   A   38   LYS   HB3    .   31207   1    
     218   .   1   .   1   38   38   LYS   HG2    H   1   1.243    0.000   .   2   .   .   .   .   A   38   LYS   HG2    .   31207   1    
     219   .   1   .   1   38   38   LYS   HG3    H   1   1.180    0.000   .   2   .   .   .   .   A   38   LYS   HG3    .   31207   1    
     220   .   1   .   1   38   38   LYS   HD2    H   1   1.625    0.000   .   2   .   .   .   .   A   38   LYS   HD2    .   31207   1    
     221   .   1   .   1   38   38   LYS   HD3    H   1   1.625    0.000   .   2   .   .   .   .   A   38   LYS   HD3    .   31207   1    
     222   .   1   .   1   38   38   LYS   HE2    H   1   3.004    0.000   .   2   .   .   .   .   A   38   LYS   HE2    .   31207   1    
     223   .   1   .   1   38   38   LYS   HE3    H   1   3.004    0.000   .   2   .   .   .   .   A   38   LYS   HE3    .   31207   1    
     224   .   1   .   1   39   39   CYS   H      H   1   8.128    0.000   .   1   .   .   .   .   A   39   CYS   H      .   31207   1    
     225   .   1   .   1   39   39   CYS   HA     H   1   5.293    0.001   .   1   .   .   .   .   A   39   CYS   HA     .   31207   1    
     226   .   1   .   1   39   39   CYS   HB2    H   1   1.966    0.000   .   2   .   .   .   .   A   39   CYS   HB2    .   31207   1    
     227   .   1   .   1   39   39   CYS   HB3    H   1   1.428    0.000   .   2   .   .   .   .   A   39   CYS   HB3    .   31207   1    
     228   .   1   .   1   40   40   TYR   H      H   1   8.226    0.001   .   1   .   .   .   .   A   40   TYR   H      .   31207   1    
     229   .   1   .   1   40   40   TYR   HA     H   1   5.009    0.001   .   1   .   .   .   .   A   40   TYR   HA     .   31207   1    
     230   .   1   .   1   40   40   TYR   HB2    H   1   3.218    0.001   .   2   .   .   .   .   A   40   TYR   HB2    .   31207   1    
     231   .   1   .   1   40   40   TYR   HB3    H   1   2.880    0.001   .   2   .   .   .   .   A   40   TYR   HB3    .   31207   1    
     232   .   1   .   1   40   40   TYR   HD1    H   1   7.017    0.000   .   3   .   .   .   .   A   40   TYR   HD1    .   31207   1    
     233   .   1   .   1   40   40   TYR   HD2    H   1   7.017    0.000   .   3   .   .   .   .   A   40   TYR   HD2    .   31207   1    
     234   .   1   .   1   40   40   TYR   HE1    H   1   6.690    0.000   .   3   .   .   .   .   A   40   TYR   HE1    .   31207   1    
     235   .   1   .   1   40   40   TYR   HE2    H   1   6.690    0.000   .   3   .   .   .   .   A   40   TYR   HE2    .   31207   1    
     236   .   1   .   1   41   41   NH2   HN1    H   1   7.868    0.000   .   2   .   .   .   .   A   41   NH2   HN1    .   31207   1    
     237   .   1   .   1   41   41   NH2   HN2    H   1   8.210    0.000   .   2   .   .   .   .   A   41   NH2   HN2    .   31207   1    

   stop_

save_