###################################
     #  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                     30461
   _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'   .   .   .   30461   1    
     2   '2D 1H-1H NOESY'   .   .   .   30461   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    ALA   HA     H   1   4.061   0.020   .   .   .   .   .   .   A   1    ALA   HA     .   30461   1    
     2     .   1   .   1   1    1    ALA   HB1    H   1   1.507   0.020   .   .   .   .   .   .   A   1    ALA   HB1    .   30461   1    
     3     .   1   .   1   1    1    ALA   HB2    H   1   1.507   0.020   .   .   .   .   .   .   A   1    ALA   HB2    .   30461   1    
     4     .   1   .   1   1    1    ALA   HB3    H   1   1.507   0.020   .   .   .   .   .   .   A   1    ALA   HB3    .   30461   1    
     5     .   1   .   1   2    2    PHE   H      H   1   8.473   0.020   .   .   .   .   .   .   A   2    PHE   H      .   30461   1    
     6     .   1   .   1   2    2    PHE   HA     H   1   4.685   0.020   .   .   .   .   .   .   A   2    PHE   HA     .   30461   1    
     7     .   1   .   1   2    2    PHE   HB2    H   1   3.110   0.020   .   .   .   .   .   .   A   2    PHE   HB2    .   30461   1    
     8     .   1   .   1   2    2    PHE   HB3    H   1   3.030   0.020   .   .   .   .   .   .   A   2    PHE   HB3    .   30461   1    
     9     .   1   .   1   2    2    PHE   HD1    H   1   7.375   0.020   .   .   .   .   .   .   A   2    PHE   HD1    .   30461   1    
     10    .   1   .   1   2    2    PHE   HD2    H   1   7.375   0.020   .   .   .   .   .   .   A   2    PHE   HD2    .   30461   1    
     11    .   1   .   1   2    2    PHE   HE1    H   1   7.243   0.020   .   .   .   .   .   .   A   2    PHE   HE1    .   30461   1    
     12    .   1   .   1   2    2    PHE   HE2    H   1   7.243   0.020   .   .   .   .   .   .   A   2    PHE   HE2    .   30461   1    
     13    .   1   .   1   3    3    CYS   H      H   1   8.156   0.020   .   .   .   .   .   .   A   3    CYS   H      .   30461   1    
     14    .   1   .   1   3    3    CYS   HA     H   1   4.395   0.020   .   .   .   .   .   .   A   3    CYS   HA     .   30461   1    
     15    .   1   .   1   3    3    CYS   HB2    H   1   2.773   0.020   .   .   .   .   .   .   A   3    CYS   HB2    .   30461   1    
     16    .   1   .   1   3    3    CYS   HB3    H   1   2.670   0.020   .   .   .   .   .   .   A   3    CYS   HB3    .   30461   1    
     17    .   1   .   1   4    4    ASN   H      H   1   8.684   0.020   .   .   .   .   .   .   A   4    ASN   H      .   30461   1    
     18    .   1   .   1   4    4    ASN   HA     H   1   4.796   0.020   .   .   .   .   .   .   A   4    ASN   HA     .   30461   1    
     19    .   1   .   1   4    4    ASN   HB2    H   1   2.880   0.020   .   .   .   .   .   .   A   4    ASN   HB2    .   30461   1    
     20    .   1   .   1   4    4    ASN   HB3    H   1   2.772   0.020   .   .   .   .   .   .   A   4    ASN   HB3    .   30461   1    
     21    .   1   .   1   4    4    ASN   HD21   H   1   7.048   0.020   .   .   .   .   .   .   A   4    ASN   HD21   .   30461   1    
     22    .   1   .   1   4    4    ASN   HD22   H   1   7.870   0.020   .   .   .   .   .   .   A   4    ASN   HD22   .   30461   1    
     23    .   1   .   1   5    5    LEU   H      H   1   8.778   0.020   .   .   .   .   .   .   A   5    LEU   H      .   30461   1    
     24    .   1   .   1   5    5    LEU   HA     H   1   3.974   0.020   .   .   .   .   .   .   A   5    LEU   HA     .   30461   1    
     25    .   1   .   1   5    5    LEU   HB2    H   1   1.774   0.020   .   .   .   .   .   .   A   5    LEU   HB2    .   30461   1    
     26    .   1   .   1   5    5    LEU   HB3    H   1   1.562   0.020   .   .   .   .   .   .   A   5    LEU   HB3    .   30461   1    
     27    .   1   .   1   5    5    LEU   HG     H   1   1.474   0.020   .   .   .   .   .   .   A   5    LEU   HG     .   30461   1    
     28    .   1   .   1   5    5    LEU   HD11   H   1   0.945   0.020   .   .   .   .   .   .   A   5    LEU   HD11   .   30461   1    
     29    .   1   .   1   5    5    LEU   HD12   H   1   0.945   0.020   .   .   .   .   .   .   A   5    LEU   HD12   .   30461   1    
     30    .   1   .   1   5    5    LEU   HD13   H   1   0.945   0.020   .   .   .   .   .   .   A   5    LEU   HD13   .   30461   1    
     31    .   1   .   1   6    6    ARG   H      H   1   8.302   0.020   .   .   .   .   .   .   A   6    ARG   H      .   30461   1    
     32    .   1   .   1   6    6    ARG   HA     H   1   4.062   0.020   .   .   .   .   .   .   A   6    ARG   HA     .   30461   1    
     33    .   1   .   1   6    6    ARG   HB2    H   1   1.936   0.020   .   .   .   .   .   .   A   6    ARG   HB2    .   30461   1    
     34    .   1   .   1   6    6    ARG   HB3    H   1   1.773   0.020   .   .   .   .   .   .   A   6    ARG   HB3    .   30461   1    
     35    .   1   .   1   6    6    ARG   HG2    H   1   1.648   0.020   .   .   .   .   .   .   A   6    ARG   HG2    .   30461   1    
     36    .   1   .   1   6    6    ARG   HG3    H   1   1.648   0.020   .   .   .   .   .   .   A   6    ARG   HG3    .   30461   1    
     37    .   1   .   1   6    6    ARG   HD2    H   1   3.292   0.020   .   .   .   .   .   .   A   6    ARG   HD2    .   30461   1    
     38    .   1   .   1   6    6    ARG   HD3    H   1   3.292   0.020   .   .   .   .   .   .   A   6    ARG   HD3    .   30461   1    
     39    .   1   .   1   6    6    ARG   HE     H   1   7.292   0.020   .   .   .   .   .   .   A   6    ARG   HE     .   30461   1    
     40    .   1   .   1   7    7    ARG   H      H   1   7.995   0.020   .   .   .   .   .   .   A   7    ARG   H      .   30461   1    
     41    .   1   .   1   7    7    ARG   HA     H   1   4.017   0.020   .   .   .   .   .   .   A   7    ARG   HA     .   30461   1    
     42    .   1   .   1   7    7    ARG   HB2    H   1   1.929   0.020   .   .   .   .   .   .   A   7    ARG   HB2    .   30461   1    
     43    .   1   .   1   7    7    ARG   HB3    H   1   1.842   0.020   .   .   .   .   .   .   A   7    ARG   HB3    .   30461   1    
     44    .   1   .   1   7    7    ARG   HG2    H   1   1.663   0.020   .   .   .   .   .   .   A   7    ARG   HG2    .   30461   1    
     45    .   1   .   1   7    7    ARG   HG3    H   1   1.663   0.020   .   .   .   .   .   .   A   7    ARG   HG3    .   30461   1    
     46    .   1   .   1   7    7    ARG   HD2    H   1   3.241   0.020   .   .   .   .   .   .   A   7    ARG   HD2    .   30461   1    
     47    .   1   .   1   7    7    ARG   HD3    H   1   3.241   0.020   .   .   .   .   .   .   A   7    ARG   HD3    .   30461   1    
     48    .   1   .   1   7    7    ARG   HE     H   1   7.286   0.020   .   .   .   .   .   .   A   7    ARG   HE     .   30461   1    
     49    .   1   .   1   8    8    CYS   H      H   1   8.689   0.020   .   .   .   .   .   .   A   8    CYS   H      .   30461   1    
     50    .   1   .   1   8    8    CYS   HA     H   1   4.620   0.020   .   .   .   .   .   .   A   8    CYS   HA     .   30461   1    
     51    .   1   .   1   8    8    CYS   HB2    H   1   3.196   0.020   .   .   .   .   .   .   A   8    CYS   HB2    .   30461   1    
     52    .   1   .   1   8    8    CYS   HB3    H   1   2.775   0.020   .   .   .   .   .   .   A   8    CYS   HB3    .   30461   1    
     53    .   1   .   1   9    9    GLU   H      H   1   9.056   0.020   .   .   .   .   .   .   A   9    GLU   H      .   30461   1    
     54    .   1   .   1   9    9    GLU   HA     H   1   3.804   0.020   .   .   .   .   .   .   A   9    GLU   HA     .   30461   1    
     55    .   1   .   1   9    9    GLU   HB2    H   1   2.414   0.020   .   .   .   .   .   .   A   9    GLU   HB2    .   30461   1    
     56    .   1   .   1   9    9    GLU   HB3    H   1   2.086   0.020   .   .   .   .   .   .   A   9    GLU   HB3    .   30461   1    
     57    .   1   .   1   9    9    GLU   HG2    H   1   2.673   0.020   .   .   .   .   .   .   A   9    GLU   HG2    .   30461   1    
     58    .   1   .   1   9    9    GLU   HG3    H   1   2.595   0.020   .   .   .   .   .   .   A   9    GLU   HG3    .   30461   1    
     59    .   1   .   1   10   10   LEU   H      H   1   8.126   0.020   .   .   .   .   .   .   A   10   LEU   H      .   30461   1    
     60    .   1   .   1   10   10   LEU   HA     H   1   4.101   0.020   .   .   .   .   .   .   A   10   LEU   HA     .   30461   1    
     61    .   1   .   1   10   10   LEU   HB2    H   1   1.890   0.020   .   .   .   .   .   .   A   10   LEU   HB2    .   30461   1    
     62    .   1   .   1   10   10   LEU   HB3    H   1   1.820   0.020   .   .   .   .   .   .   A   10   LEU   HB3    .   30461   1    
     63    .   1   .   1   10   10   LEU   HG     H   1   1.687   0.020   .   .   .   .   .   .   A   10   LEU   HG     .   30461   1    
     64    .   1   .   1   10   10   LEU   HD11   H   1   0.919   0.020   .   .   .   .   .   .   A   10   LEU   HD11   .   30461   1    
     65    .   1   .   1   10   10   LEU   HD12   H   1   0.919   0.020   .   .   .   .   .   .   A   10   LEU   HD12   .   30461   1    
     66    .   1   .   1   10   10   LEU   HD13   H   1   0.919   0.020   .   .   .   .   .   .   A   10   LEU   HD13   .   30461   1    
     67    .   1   .   1   11   11   SER   H      H   1   8.434   0.020   .   .   .   .   .   .   A   11   SER   H      .   30461   1    
     68    .   1   .   1   11   11   SER   HA     H   1   4.302   0.020   .   .   .   .   .   .   A   11   SER   HA     .   30461   1    
     69    .   1   .   1   11   11   SER   HB2    H   1   4.031   0.020   .   .   .   .   .   .   A   11   SER   HB2    .   30461   1    
     70    .   1   .   1   11   11   SER   HB3    H   1   4.031   0.020   .   .   .   .   .   .   A   11   SER   HB3    .   30461   1    
     71    .   1   .   1   12   12   CYS   H      H   1   8.270   0.020   .   .   .   .   .   .   A   12   CYS   H      .   30461   1    
     72    .   1   .   1   12   12   CYS   HA     H   1   4.484   0.020   .   .   .   .   .   .   A   12   CYS   HA     .   30461   1    
     73    .   1   .   1   12   12   CYS   HB2    H   1   2.390   0.020   .   .   .   .   .   .   A   12   CYS   HB2    .   30461   1    
     74    .   1   .   1   13   13   ARG   H      H   1   8.332   0.020   .   .   .   .   .   .   A   13   ARG   H      .   30461   1    
     75    .   1   .   1   13   13   ARG   HA     H   1   4.476   0.020   .   .   .   .   .   .   A   13   ARG   HA     .   30461   1    
     76    .   1   .   1   13   13   ARG   HB2    H   1   2.233   0.020   .   .   .   .   .   .   A   13   ARG   HB2    .   30461   1    
     77    .   1   .   1   13   13   ARG   HB3    H   1   2.085   0.020   .   .   .   .   .   .   A   13   ARG   HB3    .   30461   1    
     78    .   1   .   1   13   13   ARG   HG2    H   1   1.858   0.020   .   .   .   .   .   .   A   13   ARG   HG2    .   30461   1    
     79    .   1   .   1   13   13   ARG   HG3    H   1   1.858   0.020   .   .   .   .   .   .   A   13   ARG   HG3    .   30461   1    
     80    .   1   .   1   13   13   ARG   HD2    H   1   3.280   0.020   .   .   .   .   .   .   A   13   ARG   HD2    .   30461   1    
     81    .   1   .   1   13   13   ARG   HD3    H   1   3.280   0.020   .   .   .   .   .   .   A   13   ARG   HD3    .   30461   1    
     82    .   1   .   1   13   13   ARG   HE     H   1   7.260   0.020   .   .   .   .   .   .   A   13   ARG   HE     .   30461   1    
     83    .   1   .   1   14   14   SER   H      H   1   7.719   0.020   .   .   .   .   .   .   A   14   SER   H      .   30461   1    
     84    .   1   .   1   14   14   SER   HA     H   1   4.383   0.020   .   .   .   .   .   .   A   14   SER   HA     .   30461   1    
     85    .   1   .   1   14   14   SER   HB2    H   1   4.070   0.020   .   .   .   .   .   .   A   14   SER   HB2    .   30461   1    
     86    .   1   .   1   14   14   SER   HB3    H   1   4.070   0.020   .   .   .   .   .   .   A   14   SER   HB3    .   30461   1    
     87    .   1   .   1   15   15   LEU   H      H   1   7.391   0.020   .   .   .   .   .   .   A   15   LEU   H      .   30461   1    
     88    .   1   .   1   15   15   LEU   HA     H   1   4.559   0.020   .   .   .   .   .   .   A   15   LEU   HA     .   30461   1    
     89    .   1   .   1   15   15   LEU   HB2    H   1   1.851   0.020   .   .   .   .   .   .   A   15   LEU   HB2    .   30461   1    
     90    .   1   .   1   15   15   LEU   HB3    H   1   1.851   0.020   .   .   .   .   .   .   A   15   LEU   HB3    .   30461   1    
     91    .   1   .   1   15   15   LEU   HG     H   1   1.753   0.020   .   .   .   .   .   .   A   15   LEU   HG     .   30461   1    
     92    .   1   .   1   15   15   LEU   HD11   H   1   0.992   0.020   .   .   .   .   .   .   A   15   LEU   HD11   .   30461   1    
     93    .   1   .   1   15   15   LEU   HD12   H   1   0.992   0.020   .   .   .   .   .   .   A   15   LEU   HD12   .   30461   1    
     94    .   1   .   1   15   15   LEU   HD13   H   1   0.992   0.020   .   .   .   .   .   .   A   15   LEU   HD13   .   30461   1    
     95    .   1   .   1   15   15   LEU   HD21   H   1   0.881   0.020   .   .   .   .   .   .   A   15   LEU   HD21   .   30461   1    
     96    .   1   .   1   15   15   LEU   HD22   H   1   0.881   0.020   .   .   .   .   .   .   A   15   LEU   HD22   .   30461   1    
     97    .   1   .   1   15   15   LEU   HD23   H   1   0.881   0.020   .   .   .   .   .   .   A   15   LEU   HD23   .   30461   1    
     98    .   1   .   1   16   16   GLY   H      H   1   8.168   0.020   .   .   .   .   .   .   A   16   GLY   H      .   30461   1    
     99    .   1   .   1   16   16   GLY   HA2    H   1   4.155   0.020   .   .   .   .   .   .   A   16   GLY   HA2    .   30461   1    
     100   .   1   .   1   16   16   GLY   HA3    H   1   3.982   0.020   .   .   .   .   .   .   A   16   GLY   HA3    .   30461   1    
     101   .   1   .   1   17   17   LEU   H      H   1   7.447   0.020   .   .   .   .   .   .   A   17   LEU   H      .   30461   1    
     102   .   1   .   1   17   17   LEU   HA     H   1   4.648   0.020   .   .   .   .   .   .   A   17   LEU   HA     .   30461   1    
     103   .   1   .   1   17   17   LEU   HB2    H   1   1.436   0.020   .   .   .   .   .   .   A   17   LEU   HB2    .   30461   1    
     104   .   1   .   1   17   17   LEU   HB3    H   1   1.436   0.020   .   .   .   .   .   .   A   17   LEU   HB3    .   30461   1    
     105   .   1   .   1   17   17   LEU   HG     H   1   1.273   0.020   .   .   .   .   .   .   A   17   LEU   HG     .   30461   1    
     106   .   1   .   1   17   17   LEU   HD11   H   1   0.732   0.020   .   .   .   .   .   .   A   17   LEU   HD11   .   30461   1    
     107   .   1   .   1   17   17   LEU   HD12   H   1   0.732   0.020   .   .   .   .   .   .   A   17   LEU   HD12   .   30461   1    
     108   .   1   .   1   17   17   LEU   HD13   H   1   0.732   0.020   .   .   .   .   .   .   A   17   LEU   HD13   .   30461   1    
     109   .   1   .   1   18   18   LEU   H      H   1   8.637   0.020   .   .   .   .   .   .   A   18   LEU   H      .   30461   1    
     110   .   1   .   1   18   18   LEU   HA     H   1   4.310   0.020   .   .   .   .   .   .   A   18   LEU   HA     .   30461   1    
     111   .   1   .   1   18   18   LEU   HB2    H   1   1.443   0.020   .   .   .   .   .   .   A   18   LEU   HB2    .   30461   1    
     112   .   1   .   1   18   18   LEU   HB3    H   1   1.443   0.020   .   .   .   .   .   .   A   18   LEU   HB3    .   30461   1    
     113   .   1   .   1   18   18   LEU   HG     H   1   1.210   0.020   .   .   .   .   .   .   A   18   LEU   HG     .   30461   1    
     114   .   1   .   1   18   18   LEU   HD11   H   1   0.811   0.020   .   .   .   .   .   .   A   18   LEU   HD11   .   30461   1    
     115   .   1   .   1   18   18   LEU   HD12   H   1   0.811   0.020   .   .   .   .   .   .   A   18   LEU   HD12   .   30461   1    
     116   .   1   .   1   18   18   LEU   HD13   H   1   0.811   0.020   .   .   .   .   .   .   A   18   LEU   HD13   .   30461   1    
     117   .   1   .   1   18   18   LEU   HD21   H   1   0.734   0.020   .   .   .   .   .   .   A   18   LEU   HD21   .   30461   1    
     118   .   1   .   1   18   18   LEU   HD22   H   1   0.734   0.020   .   .   .   .   .   .   A   18   LEU   HD22   .   30461   1    
     119   .   1   .   1   18   18   LEU   HD23   H   1   0.734   0.020   .   .   .   .   .   .   A   18   LEU   HD23   .   30461   1    
     120   .   1   .   1   19   19   GLY   H      H   1   8.035   0.020   .   .   .   .   .   .   A   19   GLY   H      .   30461   1    
     121   .   1   .   1   19   19   GLY   HA2    H   1   5.180   0.020   .   .   .   .   .   .   A   19   GLY   HA2    .   30461   1    
     122   .   1   .   1   19   19   GLY   HA3    H   1   2.983   0.020   .   .   .   .   .   .   A   19   GLY   HA3    .   30461   1    
     123   .   1   .   1   20   20   LYS   H      H   1   8.824   0.020   .   .   .   .   .   .   A   20   LYS   H      .   30461   1    
     124   .   1   .   1   20   20   LYS   HA     H   1   4.385   0.020   .   .   .   .   .   .   A   20   LYS   HA     .   30461   1    
     125   .   1   .   1   20   20   LYS   HB2    H   1   1.671   0.020   .   .   .   .   .   .   A   20   LYS   HB2    .   30461   1    
     126   .   1   .   1   20   20   LYS   HB3    H   1   1.671   0.020   .   .   .   .   .   .   A   20   LYS   HB3    .   30461   1    
     127   .   1   .   1   20   20   LYS   HG2    H   1   1.280   0.020   .   .   .   .   .   .   A   20   LYS   HG2    .   30461   1    
     128   .   1   .   1   20   20   LYS   HG3    H   1   1.280   0.020   .   .   .   .   .   .   A   20   LYS   HG3    .   30461   1    
     129   .   1   .   1   20   20   LYS   HD2    H   1   1.537   0.020   .   .   .   .   .   .   A   20   LYS   HD2    .   30461   1    
     130   .   1   .   1   20   20   LYS   HD3    H   1   1.537   0.020   .   .   .   .   .   .   A   20   LYS   HD3    .   30461   1    
     131   .   1   .   1   20   20   LYS   HE2    H   1   2.853   0.020   .   .   .   .   .   .   A   20   LYS   HE2    .   30461   1    
     132   .   1   .   1   20   20   LYS   HE3    H   1   2.853   0.020   .   .   .   .   .   .   A   20   LYS   HE3    .   30461   1    
     133   .   1   .   1   21   21   CYS   H      H   1   8.254   0.020   .   .   .   .   .   .   A   21   CYS   H      .   30461   1    
     134   .   1   .   1   21   21   CYS   HA     H   1   5.254   0.020   .   .   .   .   .   .   A   21   CYS   HA     .   30461   1    
     135   .   1   .   1   21   21   CYS   HB2    H   1   2.905   0.020   .   .   .   .   .   .   A   21   CYS   HB2    .   30461   1    
     136   .   1   .   1   21   21   CYS   HB3    H   1   2.834   0.020   .   .   .   .   .   .   A   21   CYS   HB3    .   30461   1    
     137   .   1   .   1   22   22   ILE   H      H   1   9.043   0.020   .   .   .   .   .   .   A   22   ILE   H      .   30461   1    
     138   .   1   .   1   22   22   ILE   HA     H   1   4.283   0.020   .   .   .   .   .   .   A   22   ILE   HA     .   30461   1    
     139   .   1   .   1   22   22   ILE   HB     H   1   1.770   0.020   .   .   .   .   .   .   A   22   ILE   HB     .   30461   1    
     140   .   1   .   1   22   22   ILE   HG12   H   1   1.396   0.020   .   .   .   .   .   .   A   22   ILE   HG12   .   30461   1    
     141   .   1   .   1   22   22   ILE   HG13   H   1   1.091   0.020   .   .   .   .   .   .   A   22   ILE   HG13   .   30461   1    
     142   .   1   .   1   22   22   ILE   HG21   H   1   0.866   0.020   .   .   .   .   .   .   A   22   ILE   HG21   .   30461   1    
     143   .   1   .   1   22   22   ILE   HG22   H   1   0.866   0.020   .   .   .   .   .   .   A   22   ILE   HG22   .   30461   1    
     144   .   1   .   1   22   22   ILE   HG23   H   1   0.866   0.020   .   .   .   .   .   .   A   22   ILE   HG23   .   30461   1    
     145   .   1   .   1   22   22   ILE   HD11   H   1   0.785   0.020   .   .   .   .   .   .   A   22   ILE   HD11   .   30461   1    
     146   .   1   .   1   22   22   ILE   HD12   H   1   0.785   0.020   .   .   .   .   .   .   A   22   ILE   HD12   .   30461   1    
     147   .   1   .   1   22   22   ILE   HD13   H   1   0.785   0.020   .   .   .   .   .   .   A   22   ILE   HD13   .   30461   1    
     148   .   1   .   1   23   23   GLY   H      H   1   9.106   0.020   .   .   .   .   .   .   A   23   GLY   H      .   30461   1    
     149   .   1   .   1   23   23   GLY   HA2    H   1   3.885   0.020   .   .   .   .   .   .   A   23   GLY   HA2    .   30461   1    
     150   .   1   .   1   23   23   GLY   HA3    H   1   3.758   0.020   .   .   .   .   .   .   A   23   GLY   HA3    .   30461   1    
     151   .   1   .   1   24   24   GLU   H      H   1   8.810   0.020   .   .   .   .   .   .   A   24   GLU   H      .   30461   1    
     152   .   1   .   1   24   24   GLU   HA     H   1   4.052   0.020   .   .   .   .   .   .   A   24   GLU   HA     .   30461   1    
     153   .   1   .   1   24   24   GLU   HB2    H   1   2.031   0.020   .   .   .   .   .   .   A   24   GLU   HB2    .   30461   1    
     154   .   1   .   1   24   24   GLU   HB3    H   1   2.031   0.020   .   .   .   .   .   .   A   24   GLU   HB3    .   30461   1    
     155   .   1   .   1   24   24   GLU   HG2    H   1   2.413   0.020   .   .   .   .   .   .   A   24   GLU   HG2    .   30461   1    
     156   .   1   .   1   24   24   GLU   HG3    H   1   2.264   0.020   .   .   .   .   .   .   A   24   GLU   HG3    .   30461   1    
     157   .   1   .   1   25   25   LYS   H      H   1   7.660   0.020   .   .   .   .   .   .   A   25   LYS   H      .   30461   1    
     158   .   1   .   1   25   25   LYS   HA     H   1   4.506   0.020   .   .   .   .   .   .   A   25   LYS   HA     .   30461   1    
     159   .   1   .   1   25   25   LYS   HB2    H   1   1.780   0.020   .   .   .   .   .   .   A   25   LYS   HB2    .   30461   1    
     160   .   1   .   1   25   25   LYS   HB3    H   1   1.780   0.020   .   .   .   .   .   .   A   25   LYS   HB3    .   30461   1    
     161   .   1   .   1   25   25   LYS   HG2    H   1   1.374   0.020   .   .   .   .   .   .   A   25   LYS   HG2    .   30461   1    
     162   .   1   .   1   25   25   LYS   HG3    H   1   1.374   0.020   .   .   .   .   .   .   A   25   LYS   HG3    .   30461   1    
     163   .   1   .   1   25   25   LYS   HD2    H   1   1.670   0.020   .   .   .   .   .   .   A   25   LYS   HD2    .   30461   1    
     164   .   1   .   1   25   25   LYS   HD3    H   1   1.670   0.020   .   .   .   .   .   .   A   25   LYS   HD3    .   30461   1    
     165   .   1   .   1   25   25   LYS   HE2    H   1   2.843   0.020   .   .   .   .   .   .   A   25   LYS   HE2    .   30461   1    
     166   .   1   .   1   25   25   LYS   HE3    H   1   2.843   0.020   .   .   .   .   .   .   A   25   LYS   HE3    .   30461   1    
     167   .   1   .   1   26   26   CYS   H      H   1   8.610   0.020   .   .   .   .   .   .   A   26   CYS   H      .   30461   1    
     168   .   1   .   1   26   26   CYS   HA     H   1   4.996   0.020   .   .   .   .   .   .   A   26   CYS   HA     .   30461   1    
     169   .   1   .   1   26   26   CYS   HB2    H   1   3.046   0.020   .   .   .   .   .   .   A   26   CYS   HB2    .   30461   1    
     170   .   1   .   1   26   26   CYS   HB3    H   1   2.671   0.020   .   .   .   .   .   .   A   26   CYS   HB3    .   30461   1    
     171   .   1   .   1   27   27   LYS   H      H   1   9.536   0.020   .   .   .   .   .   .   A   27   LYS   H      .   30461   1    
     172   .   1   .   1   27   27   LYS   HA     H   1   4.639   0.020   .   .   .   .   .   .   A   27   LYS   HA     .   30461   1    
     173   .   1   .   1   27   27   LYS   HB2    H   1   1.742   0.020   .   .   .   .   .   .   A   27   LYS   HB2    .   30461   1    
     174   .   1   .   1   27   27   LYS   HB3    H   1   1.607   0.020   .   .   .   .   .   .   A   27   LYS   HB3    .   30461   1    
     175   .   1   .   1   27   27   LYS   HG2    H   1   1.319   0.020   .   .   .   .   .   .   A   27   LYS   HG2    .   30461   1    
     176   .   1   .   1   27   27   LYS   HG3    H   1   1.319   0.020   .   .   .   .   .   .   A   27   LYS   HG3    .   30461   1    
     177   .   1   .   1   27   27   LYS   HD2    H   1   1.405   0.020   .   .   .   .   .   .   A   27   LYS   HD2    .   30461   1    
     178   .   1   .   1   27   27   LYS   HD3    H   1   1.405   0.020   .   .   .   .   .   .   A   27   LYS   HD3    .   30461   1    
     179   .   1   .   1   27   27   LYS   HE2    H   1   2.919   0.020   .   .   .   .   .   .   A   27   LYS   HE2    .   30461   1    
     180   .   1   .   1   27   27   LYS   HE3    H   1   2.919   0.020   .   .   .   .   .   .   A   27   LYS   HE3    .   30461   1    
     181   .   1   .   1   28   28   CYS   H      H   1   8.544   0.020   .   .   .   .   .   .   A   28   CYS   H      .   30461   1    
     182   .   1   .   1   28   28   CYS   HA     H   1   5.687   0.020   .   .   .   .   .   .   A   28   CYS   HA     .   30461   1    
     183   .   1   .   1   28   28   CYS   HB2    H   1   2.648   0.020   .   .   .   .   .   .   A   28   CYS   HB2    .   30461   1    
     184   .   1   .   1   28   28   CYS   HB3    H   1   2.944   0.020   .   .   .   .   .   .   A   28   CYS   HB3    .   30461   1    
     185   .   1   .   1   29   29   VAL   H      H   1   9.515   0.020   .   .   .   .   .   .   A   29   VAL   H      .   30461   1    
     186   .   1   .   1   29   29   VAL   HA     H   1   4.932   0.020   .   .   .   .   .   .   A   29   VAL   HA     .   30461   1    
     187   .   1   .   1   29   29   VAL   HB     H   1   2.280   0.020   .   .   .   .   .   .   A   29   VAL   HB     .   30461   1    
     188   .   1   .   1   29   29   VAL   HG11   H   1   0.733   0.020   .   .   .   .   .   .   A   29   VAL   HG11   .   30461   1    
     189   .   1   .   1   29   29   VAL   HG12   H   1   0.733   0.020   .   .   .   .   .   .   A   29   VAL   HG12   .   30461   1    
     190   .   1   .   1   29   29   VAL   HG13   H   1   0.733   0.020   .   .   .   .   .   .   A   29   VAL   HG13   .   30461   1    
     191   .   1   .   1   29   29   VAL   HG21   H   1   0.842   0.020   .   .   .   .   .   .   A   29   VAL   HG21   .   30461   1    
     192   .   1   .   1   29   29   VAL   HG22   H   1   0.842   0.020   .   .   .   .   .   .   A   29   VAL   HG22   .   30461   1    
     193   .   1   .   1   29   29   VAL   HG23   H   1   0.842   0.020   .   .   .   .   .   .   A   29   VAL   HG23   .   30461   1    
     194   .   1   .   1   30   30   PRO   HA     H   1   4.546   0.020   .   .   .   .   .   .   A   30   PRO   HA     .   30461   1    
     195   .   1   .   1   30   30   PRO   HB2    H   1   2.332   0.020   .   .   .   .   .   .   A   30   PRO   HB2    .   30461   1    
     196   .   1   .   1   30   30   PRO   HB3    H   1   2.047   0.020   .   .   .   .   .   .   A   30   PRO   HB3    .   30461   1    
     197   .   1   .   1   30   30   PRO   HG2    H   1   1.906   0.020   .   .   .   .   .   .   A   30   PRO   HG2    .   30461   1    
     198   .   1   .   1   30   30   PRO   HG3    H   1   1.906   0.020   .   .   .   .   .   .   A   30   PRO   HG3    .   30461   1    
     199   .   1   .   1   30   30   PRO   HD2    H   1   3.806   0.020   .   .   .   .   .   .   A   30   PRO   HD2    .   30461   1    
     200   .   1   .   1   30   30   PRO   HD3    H   1   3.631   0.020   .   .   .   .   .   .   A   30   PRO   HD3    .   30461   1    
     201   .   1   .   1   31   31   TYR   H      H   1   8.392   0.020   .   .   .   .   .   .   A   31   TYR   H      .   30461   1    
     202   .   1   .   1   31   31   TYR   HA     H   1   4.263   0.020   .   .   .   .   .   .   A   31   TYR   HA     .   30461   1    
     203   .   1   .   1   31   31   TYR   HB2    H   1   3.109   0.020   .   .   .   .   .   .   A   31   TYR   HB2    .   30461   1    
     204   .   1   .   1   31   31   TYR   HB3    H   1   2.913   0.020   .   .   .   .   .   .   A   31   TYR   HB3    .   30461   1    
     205   .   1   .   1   31   31   TYR   HD1    H   1   7.225   0.020   .   .   .   .   .   .   A   31   TYR   HD1    .   30461   1    
     206   .   1   .   1   31   31   TYR   HD2    H   1   7.225   0.020   .   .   .   .   .   .   A   31   TYR   HD2    .   30461   1    
     207   .   1   .   1   31   31   TYR   HE1    H   1   6.721   0.020   .   .   .   .   .   .   A   31   TYR   HE1    .   30461   1    
     208   .   1   .   1   31   31   TYR   HE2    H   1   6.721   0.020   .   .   .   .   .   .   A   31   TYR   HE2    .   30461   1    

   stop_

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