data_nef_c25229_2muq

save_entry_information
   _nef_nmr_meta_data.sf_category     nef_nmr_meta_data
   _nef_nmr_meta_data.sf_framecode    entry_information
   _nef_nmr_meta_data.format_name     nmr_exchange_format
   _nef_nmr_meta_data.format_version  1.1

   loop_
      _nef_related_entries.database_name
      _nef_related_entries.database_accession_code

     PDB    2MUQ     
     BMRB   25229    

   stop_

save_

save_assembly
   _nef_molecular_system.sf_category   nef_molecular_system
   _nef_molecular_system.sf_framecode  assembly

   loop_
      _nef_covalent_links.chain_code_1
      _nef_covalent_links.sequence_code_1
      _nef_covalent_links.residue_name_1
      _nef_covalent_links.atom_name_1
      _nef_covalent_links.chain_code_2
      _nef_covalent_links.sequence_code_2
      _nef_covalent_links.residue_name_2
      _nef_covalent_links.atom_name_2

     1   30   HIS   NE2   2   1   ZN   ZN    
     1   34   CYS   SG    2   1   ZN   ZN    
     1   11   CYS   SG    2   1   ZN   ZN    
     1   14   CYS   SG    2   1   ZN   ZN    

   stop_

   loop_
      _nef_sequence.index
      _nef_sequence.chain_code
      _nef_sequence.sequence_code
      _nef_sequence.residue_name
      _nef_sequence.linking
      _nef_sequence.residue_variant
      _nef_sequence.cis_peptide

     1    A   1    SER   start    .      .        
     2    A   2    HIS   middle   .      .        
     3    A   3    MET   middle   .      .        
     4    A   4    GLY   middle   .      false    
     5    A   5    ALA   middle   .      .        
     6    A   6    ALA   middle   .      .        
     7    A   7    ALA   middle   .      .        
     8    A   8    LEU   middle   .      .        
     9    A   9    ARG   middle   .      .        
     10   A   10   SER   middle   .      .        
     11   A   11   CYS   middle   -HG    .        
     12   A   12   PRO   middle   .      false    
     13   A   13   MET   middle   .      .        
     14   A   14   CYS   middle   -HG    .        
     15   A   15   GLN   middle   .      .        
     16   A   16   LYS   middle   .      .        
     17   A   17   GLU   middle   .      .        
     18   A   18   PHE   middle   .      .        
     19   A   19   ALA   middle   .      .        
     20   A   20   PRO   middle   .      false    
     21   A   21   ARG   middle   .      .        
     22   A   22   LEU   middle   .      .        
     23   A   23   THR   middle   .      .        
     24   A   24   GLN   middle   .      .        
     25   A   25   LEU   middle   .      .        
     26   A   26   ASP   middle   .      .        
     27   A   27   VAL   middle   .      .        
     28   A   28   ASP   middle   .      .        
     29   A   29   SER   middle   .      .        
     30   A   30   HIS   middle   -HE2   .        
     31   A   31   LEU   middle   .      .        
     32   A   32   ALA   middle   .      .        
     33   A   33   GLN   middle   .      .        
     34   A   34   CYS   middle   -HG    .        
     35   A   35   LEU   middle   .      .        
     36   A   36   ALA   middle   .      .        
     37   A   37   GLU   middle   .      .        
     38   A   38   SER   middle   .      .        
     39   A   39   THR   middle   .      .        
     40   A   40   GLU   middle   .      .        
     41   A   41   ASP   middle   .      .        
     42   A   42   VAL   middle   .      .        
     43   A   43   THR   middle   .      .        
     44   A   44   TRP   end      .      .        
     45   B   1    ZN    .        .      .        

   stop_

save_

save_assigned_chem_shift_list_1
   _nef_chemical_shift_list.sf_category   nef_chemical_shift_list
   _nef_chemical_shift_list.sf_framecode  assigned_chem_shift_list_1

   loop_
      _nef_chemical_shift.chain_code
      _nef_chemical_shift.sequence_code
      _nef_chemical_shift.residue_name
      _nef_chemical_shift.atom_name
      _nef_chemical_shift.element
      _nef_chemical_shift.isotope_number
      _nef_chemical_shift.value
      _nef_chemical_shift.value_uncertainty

     A   2    HIS   HA     H   1    4.650     0.020    
     A   2    HIS   HB2    H   1    3.117     0.020    
     A   2    HIS   HB3    H   1    3.117     0.020    
     A   2    HIS   HD2    H   1    7.053     0.020    
     A   2    HIS   HE1    H   1    7.880     0.020    
     A   2    HIS   CA     C   13   56.178    0.400    
     A   2    HIS   CB     C   13   31.096    0.400    
     A   2    HIS   CD2    C   13   119.559   0.400    
     A   2    HIS   CE1    C   13   138.247   0.400    
     A   3    MET   HA     H   1    4.450     0.020    
     A   3    MET   HBx    H   1    1.946     0.020    
     A   3    MET   HBy    H   1    2.077     0.020    
     A   3    MET   HE%    H   1    2.074     0.020    
     A   3    MET   HGx    H   1    2.449     0.020    
     A   3    MET   HGy    H   1    2.539     0.020    
     A   3    MET   CA     C   13   55.668    0.400    
     A   3    MET   CB     C   13   32.804    0.400    
     A   3    MET   CE     C   13   16.817    0.400    
     A   3    MET   CG     C   13   31.869    0.400    
     A   4    GLY   H      H   1    8.423     0.020    
     A   4    GLY   HA2    H   1    3.947     0.020    
     A   4    GLY   HA3    H   1    3.947     0.020    
     A   4    GLY   CA     C   13   45.269    0.400    
     A   4    GLY   N      N   15   110.404   0.400    
     A   5    ALA   H      H   1    8.191     0.020    
     A   5    ALA   HA     H   1    4.282     0.020    
     A   5    ALA   HB%    H   1    1.378     0.020    
     A   5    ALA   CA     C   13   52.493    0.400    
     A   5    ALA   CB     C   13   19.310    0.400    
     A   5    ALA   N      N   15   124.042   0.400    
     A   6    ALA   H      H   1    8.243     0.020    
     A   6    ALA   HA     H   1    4.283     0.020    
     A   6    ALA   HB%    H   1    1.369     0.020    
     A   6    ALA   CA     C   13   52.383    0.400    
     A   6    ALA   CB     C   13   19.313    0.400    
     A   6    ALA   N      N   15   122.851   0.400    
     A   7    ALA   H      H   1    8.167     0.020    
     A   7    ALA   HA     H   1    4.299     0.020    
     A   7    ALA   HB%    H   1    1.363     0.020    
     A   7    ALA   CA     C   13   52.266    0.400    
     A   7    ALA   CB     C   13   19.285    0.400    
     A   7    ALA   N      N   15   123.014   0.400    
     A   8    LEU   H      H   1    8.137     0.020    
     A   8    LEU   HA     H   1    4.428     0.020    
     A   8    LEU   HB2    H   1    1.703     0.020    
     A   8    LEU   HB3    H   1    1.703     0.020    
     A   8    LEU   HDx%   H   1    0.963     0.020    
     A   8    LEU   HDy%   H   1    0.985     0.020    
     A   8    LEU   HG     H   1    1.740     0.020    
     A   8    LEU   CA     C   13   54.962    0.400    
     A   8    LEU   CB     C   13   42.812    0.400    
     A   8    LEU   CD1    C   13   23.713    0.400    
     A   8    LEU   CD2    C   13   25.372    0.400    
     A   8    LEU   CG     C   13   27.101    0.400    
     A   8    LEU   N      N   15   121.468   0.400    
     A   9    ARG   H      H   1    8.661     0.020    
     A   9    ARG   HA     H   1    4.551     0.020    
     A   9    ARG   HBx    H   1    1.915     0.020    
     A   9    ARG   HBy    H   1    2.054     0.020    
     A   9    ARG   HDx    H   1    3.181     0.020    
     A   9    ARG   HDy    H   1    3.303     0.020    
     A   9    ARG   HG2    H   1    1.796     0.020    
     A   9    ARG   HG3    H   1    1.796     0.020    
     A   9    ARG   CA     C   13   56.074    0.400    
     A   9    ARG   CB     C   13   31.407    0.400    
     A   9    ARG   CD     C   13   43.267    0.400    
     A   9    ARG   CG     C   13   26.640    0.400    
     A   9    ARG   N      N   15   121.900   0.400    
     A   10   SER   H      H   1    7.916     0.020    
     A   10   SER   HA     H   1    4.699     0.020    
     A   10   SER   HBx    H   1    3.218     0.020    
     A   10   SER   HBy    H   1    3.445     0.020    
     A   10   SER   CA     C   13   56.024    0.400    
     A   10   SER   CB     C   13   65.807    0.400    
     A   10   SER   N      N   15   113.434   0.400    
     A   11   CYS   H      H   1    8.173     0.020    
     A   11   CYS   HA     H   1    4.672     0.020    
     A   11   CYS   HBx    H   1    2.508     0.020    
     A   11   CYS   HBy    H   1    3.129     0.020    
     A   11   CYS   CA     C   13   56.159    0.400    
     A   11   CYS   CB     C   13   31.388    0.400    
     A   11   CYS   N      N   15   125.462   0.400    
     A   12   PRO   HA     H   1    4.476     0.020    
     A   12   PRO   HBx    H   1    2.029     0.020    
     A   12   PRO   HBy    H   1    2.380     0.020    
     A   12   PRO   HDx    H   1    4.118     0.020    
     A   12   PRO   HDy    H   1    4.239     0.020    
     A   12   PRO   HGx    H   1    2.028     0.020    
     A   12   PRO   HGy    H   1    2.143     0.020    
     A   12   PRO   CA     C   13   64.257    0.400    
     A   12   PRO   CB     C   13   32.185    0.400    
     A   12   PRO   CD     C   13   51.264    0.400    
     A   12   PRO   CG     C   13   27.050    0.400    
     A   13   MET   H      H   1    9.132     0.020    
     A   13   MET   HA     H   1    4.549     0.020    
     A   13   MET   HBx    H   1    2.185     0.020    
     A   13   MET   HBy    H   1    2.310     0.020    
     A   13   MET   HE%    H   1    2.190     0.020    
     A   13   MET   HGx    H   1    2.415     0.020    
     A   13   MET   HGy    H   1    2.628     0.020    
     A   13   MET   CA     C   13   57.426    0.400    
     A   13   MET   CB     C   13   33.451    0.400    
     A   13   MET   CE     C   13   17.895    0.400    
     A   13   MET   CG     C   13   33.191    0.400    
     A   13   MET   N      N   15   120.537   0.400    
     A   14   CYS   H      H   1    8.331     0.020    
     A   14   CYS   HA     H   1    4.943     0.020    
     A   14   CYS   HBx    H   1    2.650     0.020    
     A   14   CYS   HBy    H   1    3.251     0.020    
     A   14   CYS   CA     C   13   58.945    0.400    
     A   14   CYS   CB     C   13   31.882    0.400    
     A   14   CYS   N      N   15   118.266   0.400    
     A   15   GLN   H      H   1    7.789     0.020    
     A   15   GLN   HA     H   1    4.010     0.020    
     A   15   GLN   HBx    H   1    2.258     0.020    
     A   15   GLN   HBy    H   1    2.376     0.020    
     A   15   GLN   HG2    H   1    2.182     0.020    
     A   15   GLN   HG3    H   1    2.182     0.020    
     A   15   GLN   CA     C   13   58.046    0.400    
     A   15   GLN   CB     C   13   25.591    0.400    
     A   15   GLN   CG     C   13   34.231    0.400    
     A   15   GLN   N      N   15   115.660   0.400    
     A   16   LYS   H      H   1    8.222     0.020    
     A   16   LYS   HA     H   1    3.975     0.020    
     A   16   LYS   HBx    H   1    1.146     0.020    
     A   16   LYS   HBy    H   1    1.797     0.020    
     A   16   LYS   HDx    H   1    1.200     0.020    
     A   16   LYS   HDy    H   1    1.412     0.020    
     A   16   LYS   HE2    H   1    2.853     0.020    
     A   16   LYS   HE3    H   1    2.853     0.020    
     A   16   LYS   HGx    H   1    0.921     0.020    
     A   16   LYS   HGy    H   1    1.118     0.020    
     A   16   LYS   CA     C   13   57.336    0.400    
     A   16   LYS   CB     C   13   33.252    0.400    
     A   16   LYS   CD     C   13   29.084    0.400    
     A   16   LYS   CE     C   13   41.790    0.400    
     A   16   LYS   CG     C   13   24.692    0.400    
     A   16   LYS   N      N   15   122.955   0.400    
     A   17   GLU   H      H   1    8.367     0.020    
     A   17   GLU   HA     H   1    4.075     0.020    
     A   17   GLU   HB2    H   1    1.856     0.020    
     A   17   GLU   HB3    H   1    1.856     0.020    
     A   17   GLU   HGx    H   1    2.034     0.020    
     A   17   GLU   HGy    H   1    2.267     0.020    
     A   17   GLU   CA     C   13   55.676    0.400    
     A   17   GLU   CB     C   13   30.687    0.400    
     A   17   GLU   CG     C   13   36.658    0.400    
     A   17   GLU   N      N   15   123.884   0.400    
     A   18   PHE   H      H   1    8.177     0.020    
     A   18   PHE   HA     H   1    4.714     0.020    
     A   18   PHE   HBx    H   1    2.710     0.020    
     A   18   PHE   HBy    H   1    2.912     0.020    
     A   18   PHE   HD1    H   1    6.896     0.020    
     A   18   PHE   HD2    H   1    6.896     0.020    
     A   18   PHE   HE1    H   1    6.800     0.020    
     A   18   PHE   HE2    H   1    6.800     0.020    
     A   18   PHE   HZ     H   1    6.929     0.020    
     A   18   PHE   CA     C   13   55.622    0.400    
     A   18   PHE   CB     C   13   38.844    0.400    
     A   18   PHE   CD1    C   13   131.094   0.400    
     A   18   PHE   CD2    C   13   131.094   0.400    
     A   18   PHE   CE1    C   13   130.443   0.400    
     A   18   PHE   CE2    C   13   130.443   0.400    
     A   18   PHE   CZ     C   13   128.174   0.400    
     A   18   PHE   N      N   15   123.877   0.400    
     A   19   ALA   H      H   1    8.433     0.020    
     A   19   ALA   HA     H   1    4.554     0.020    
     A   19   ALA   HB%    H   1    1.509     0.020    
     A   19   ALA   CA     C   13   50.993    0.400    
     A   19   ALA   CB     C   13   17.558    0.400    
     A   19   ALA   N      N   15   128.636   0.400    
     A   20   PRO   HA     H   1    4.355     0.020    
     A   20   PRO   HBx    H   1    1.949     0.020    
     A   20   PRO   HBy    H   1    2.386     0.020    
     A   20   PRO   HDx    H   1    3.823     0.020    
     A   20   PRO   HDy    H   1    3.885     0.020    
     A   20   PRO   HGx    H   1    2.063     0.020    
     A   20   PRO   HGy    H   1    2.105     0.020    
     A   20   PRO   CA     C   13   64.969    0.400    
     A   20   PRO   CB     C   13   31.916    0.400    
     A   20   PRO   CD     C   13   50.514    0.400    
     A   20   PRO   CG     C   13   27.579    0.400    
     A   21   ARG   H      H   1    7.660     0.020    
     A   21   ARG   HA     H   1    4.207     0.020    
     A   21   ARG   HB2    H   1    1.880     0.020    
     A   21   ARG   HB3    H   1    1.880     0.020    
     A   21   ARG   HD2    H   1    3.182     0.020    
     A   21   ARG   HD3    H   1    3.182     0.020    
     A   21   ARG   HGx    H   1    1.496     0.020    
     A   21   ARG   HGy    H   1    1.552     0.020    
     A   21   ARG   CA     C   13   56.305    0.400    
     A   21   ARG   CB     C   13   29.246    0.400    
     A   21   ARG   CD     C   13   43.115    0.400    
     A   21   ARG   CG     C   13   27.080    0.400    
     A   21   ARG   N      N   15   111.683   0.400    
     A   22   LEU   H      H   1    7.556     0.020    
     A   22   LEU   HA     H   1    4.393     0.020    
     A   22   LEU   HBx    H   1    1.552     0.020    
     A   22   LEU   HBy    H   1    1.748     0.020    
     A   22   LEU   HDx%   H   1    0.853     0.020    
     A   22   LEU   HDy%   H   1    1.024     0.020    
     A   22   LEU   HG     H   1    1.866     0.020    
     A   22   LEU   CA     C   13   55.717    0.400    
     A   22   LEU   CB     C   13   41.483    0.400    
     A   22   LEU   CD1    C   13   23.153    0.400    
     A   22   LEU   CD2    C   13   25.686    0.400    
     A   22   LEU   CG     C   13   27.659    0.400    
     A   22   LEU   N      N   15   121.417   0.400    
     A   23   THR   H      H   1    9.120     0.020    
     A   23   THR   HA     H   1    4.455     0.020    
     A   23   THR   HB     H   1    4.652     0.020    
     A   23   THR   HG2%   H   1    1.382     0.020    
     A   23   THR   CA     C   13   60.644    0.400    
     A   23   THR   CB     C   13   71.479    0.400    
     A   23   THR   CG2    C   13   21.635    0.400    
     A   23   THR   N      N   15   114.867   0.400    
     A   24   GLN   H      H   1    8.869     0.020    
     A   24   GLN   HA     H   1    3.726     0.020    
     A   24   GLN   HBx    H   1    1.961     0.020    
     A   24   GLN   HBy    H   1    2.180     0.020    
     A   24   GLN   HG2    H   1    2.409     0.020    
     A   24   GLN   HG3    H   1    2.409     0.020    
     A   24   GLN   CA     C   13   58.336    0.400    
     A   24   GLN   CB     C   13   28.002    0.400    
     A   24   GLN   CG     C   13   33.174    0.400    
     A   24   GLN   N      N   15   120.923   0.400    
     A   25   LEU   H      H   1    7.761     0.020    
     A   25   LEU   HA     H   1    4.189     0.020    
     A   25   LEU   HB2    H   1    1.592     0.020    
     A   25   LEU   HB3    H   1    1.592     0.020    
     A   25   LEU   HDx%   H   1    0.895     0.020    
     A   25   LEU   HDy%   H   1    0.900     0.020    
     A   25   LEU   HG     H   1    1.640     0.020    
     A   25   LEU   CA     C   13   57.972    0.400    
     A   25   LEU   CB     C   13   41.647    0.400    
     A   25   LEU   CD1    C   13   24.298    0.400    
     A   25   LEU   CD2    C   13   24.318    0.400    
     A   25   LEU   CG     C   13   27.125    0.400    
     A   25   LEU   N      N   15   118.215   0.400    
     A   26   ASP   H      H   1    7.539     0.020    
     A   26   ASP   HA     H   1    4.347     0.020    
     A   26   ASP   HBx    H   1    2.613     0.020    
     A   26   ASP   HBy    H   1    2.980     0.020    
     A   26   ASP   CA     C   13   57.532    0.400    
     A   26   ASP   CB     C   13   41.641    0.400    
     A   26   ASP   N      N   15   120.786   0.400    
     A   27   VAL   H      H   1    7.805     0.020    
     A   27   VAL   HA     H   1    2.900     0.020    
     A   27   VAL   HB     H   1    1.900     0.020    
     A   27   VAL   HGx%   H   1    0.240     0.020    
     A   27   VAL   HGy%   H   1    0.449     0.020    
     A   27   VAL   CA     C   13   66.764    0.400    
     A   27   VAL   CB     C   13   31.342    0.400    
     A   27   VAL   CG1    C   13   21.822    0.400    
     A   27   VAL   CG2    C   13   20.585    0.400    
     A   27   VAL   N      N   15   123.699   0.400    
     A   28   ASP   H      H   1    8.895     0.020    
     A   28   ASP   HA     H   1    4.357     0.020    
     A   28   ASP   HBx    H   1    2.621     0.020    
     A   28   ASP   HBy    H   1    2.785     0.020    
     A   28   ASP   CA     C   13   57.678    0.400    
     A   28   ASP   CB     C   13   39.900    0.400    
     A   28   ASP   N      N   15   120.628   0.400    
     A   29   SER   H      H   1    8.284     0.020    
     A   29   SER   HA     H   1    4.287     0.020    
     A   29   SER   HBx    H   1    4.003     0.020    
     A   29   SER   HBy    H   1    4.066     0.020    
     A   29   SER   CA     C   13   61.454    0.400    
     A   29   SER   CB     C   13   62.751    0.400    
     A   29   SER   N      N   15   115.786   0.400    
     A   30   HIS   H      H   1    7.831     0.020    
     A   30   HIS   HA     H   1    4.252     0.020    
     A   30   HIS   HBx    H   1    3.383     0.020    
     A   30   HIS   HBy    H   1    3.637     0.020    
     A   30   HIS   HD2    H   1    7.248     0.020    
     A   30   HIS   HE1    H   1    7.943     0.020    
     A   30   HIS   CA     C   13   60.442    0.400    
     A   30   HIS   CB     C   13   27.757    0.400    
     A   30   HIS   CD2    C   13   127.932   0.400    
     A   30   HIS   CE1    C   13   139.448   0.400    
     A   30   HIS   N      N   15   121.227   0.400    
     A   31   LEU   H      H   1    8.845     0.020    
     A   31   LEU   HA     H   1    3.996     0.020    
     A   31   LEU   HBx    H   1    1.621     0.020    
     A   31   LEU   HBy    H   1    1.997     0.020    
     A   31   LEU   HDx%   H   1    1.038     0.020    
     A   31   LEU   HDy%   H   1    1.273     0.020    
     A   31   LEU   HG     H   1    2.127     0.020    
     A   31   LEU   CA     C   13   58.555    0.400    
     A   31   LEU   CB     C   13   41.548    0.400    
     A   31   LEU   CD1    C   13   26.082    0.400    
     A   31   LEU   CD2    C   13   24.325    0.400    
     A   31   LEU   CG     C   13   27.462    0.400    
     A   31   LEU   N      N   15   119.378   0.400    
     A   32   ALA   H      H   1    7.889     0.020    
     A   32   ALA   HA     H   1    4.104     0.020    
     A   32   ALA   HB%    H   1    1.505     0.020    
     A   32   ALA   CA     C   13   54.722    0.400    
     A   32   ALA   CB     C   13   18.258    0.400    
     A   32   ALA   N      N   15   118.429   0.400    
     A   33   GLN   H      H   1    7.391     0.020    
     A   33   GLN   HA     H   1    4.204     0.020    
     A   33   GLN   HB2    H   1    2.102     0.020    
     A   33   GLN   HB3    H   1    2.102     0.020    
     A   33   GLN   HGx    H   1    2.337     0.020    
     A   33   GLN   HGy    H   1    2.452     0.020    
     A   33   GLN   CA     C   13   57.351    0.400    
     A   33   GLN   CB     C   13   29.017    0.400    
     A   33   GLN   CG     C   13   33.753    0.400    
     A   33   GLN   N      N   15   117.277   0.400    
     A   34   CYS   H      H   1    8.167     0.020    
     A   34   CYS   HA     H   1    3.901     0.020    
     A   34   CYS   HBx    H   1    2.431     0.020    
     A   34   CYS   HBy    H   1    2.826     0.020    
     A   34   CYS   CA     C   13   64.265    0.400    
     A   34   CYS   CB     C   13   28.501    0.400    
     A   34   CYS   N      N   15   122.933   0.400    
     A   35   LEU   H      H   1    8.225     0.020    
     A   35   LEU   HA     H   1    4.207     0.020    
     A   35   LEU   HB2    H   1    1.694     0.020    
     A   35   LEU   HB3    H   1    1.694     0.020    
     A   35   LEU   HDx%   H   1    0.920     0.020    
     A   35   LEU   HDy%   H   1    0.923     0.020    
     A   35   LEU   HG     H   1    1.661     0.020    
     A   35   LEU   CA     C   13   56.760    0.400    
     A   35   LEU   CB     C   13   42.071    0.400    
     A   35   LEU   CD1    C   13   24.457    0.400    
     A   35   LEU   CD2    C   13   24.424    0.400    
     A   35   LEU   CG     C   13   27.152    0.400    
     A   35   LEU   N      N   15   120.457   0.400    
     A   36   ALA   H      H   1    7.641     0.020    
     A   36   ALA   HA     H   1    4.200     0.020    
     A   36   ALA   HB%    H   1    1.467     0.020    
     A   36   ALA   CA     C   13   53.767    0.400    
     A   36   ALA   CB     C   13   18.605    0.400    
     A   36   ALA   N      N   15   122.336   0.400    
     A   37   GLU   H      H   1    8.057     0.020    
     A   37   GLU   HA     H   1    4.272     0.020    
     A   37   GLU   HBx    H   1    2.033     0.020    
     A   37   GLU   HBy    H   1    2.139     0.020    
     A   37   GLU   HGx    H   1    2.288     0.020    
     A   37   GLU   HGy    H   1    2.412     0.020    
     A   37   GLU   CA     C   13   56.975    0.400    
     A   37   GLU   CB     C   13   30.326    0.400    
     A   37   GLU   CG     C   13   36.396    0.400    
     A   37   GLU   N      N   15   117.925   0.400    
     A   38   SER   H      H   1    8.077     0.020    
     A   38   SER   HA     H   1    4.538     0.020    
     A   38   SER   HB2    H   1    3.974     0.020    
     A   38   SER   HB3    H   1    3.974     0.020    
     A   38   SER   CA     C   13   58.600    0.400    
     A   38   SER   CB     C   13   63.892    0.400    
     A   38   SER   N      N   15   115.753   0.400    
     A   39   THR   H      H   1    8.136     0.020    
     A   39   THR   HA     H   1    4.428     0.020    
     A   39   THR   HB     H   1    4.320     0.020    
     A   39   THR   HG2%   H   1    1.232     0.020    
     A   39   THR   CA     C   13   61.816    0.400    
     A   39   THR   CB     C   13   69.710    0.400    
     A   39   THR   CG2    C   13   21.469    0.400    
     A   39   THR   N      N   15   115.550   0.400    
     A   40   GLU   H      H   1    8.265     0.020    
     A   40   GLU   HA     H   1    4.317     0.020    
     A   40   GLU   HBx    H   1    1.929     0.020    
     A   40   GLU   HBy    H   1    2.061     0.020    
     A   40   GLU   HG2    H   1    2.272     0.020    
     A   40   GLU   HG3    H   1    2.272     0.020    
     A   40   GLU   CA     C   13   56.435    0.400    
     A   40   GLU   CB     C   13   30.509    0.400    
     A   40   GLU   CG     C   13   36.129    0.400    
     A   40   GLU   N      N   15   122.776   0.400    
     A   41   ASP   H      H   1    8.390     0.020    
     A   41   ASP   HA     H   1    4.587     0.020    
     A   41   ASP   HBx    H   1    2.551     0.020    
     A   41   ASP   HBy    H   1    2.664     0.020    
     A   41   ASP   CA     C   13   54.232    0.400    
     A   41   ASP   CB     C   13   41.015    0.400    
     A   41   ASP   N      N   15   121.819   0.400    
     A   42   VAL   H      H   1    7.996     0.020    
     A   42   VAL   HA     H   1    3.991     0.020    
     A   42   VAL   HB     H   1    1.876     0.020    
     A   42   VAL   HGx%   H   1    0.651     0.020    
     A   42   VAL   HGy%   H   1    0.795     0.020    
     A   42   VAL   CA     C   13   62.013    0.400    
     A   42   VAL   CB     C   13   32.773    0.400    
     A   42   VAL   CG1    C   13   20.914    0.400    
     A   42   VAL   CG2    C   13   20.159    0.400    
     A   42   VAL   N      N   15   120.623   0.400    
     A   43   THR   H      H   1    7.915     0.020    
     A   43   THR   HA     H   1    4.307     0.020    
     A   43   THR   HB     H   1    4.164     0.020    
     A   43   THR   HG2%   H   1    1.121     0.020    
     A   43   THR   CA     C   13   61.280    0.400    
     A   43   THR   CB     C   13   69.858    0.400    
     A   43   THR   CG2    C   13   21.293    0.400    
     A   43   THR   N      N   15   117.870   0.400    
     A   44   TRP   H      H   1    7.620     0.020    
     A   44   TRP   HA     H   1    4.543     0.020    
     A   44   TRP   HBx    H   1    3.171     0.020    
     A   44   TRP   HBy    H   1    3.327     0.020    
     A   44   TRP   HD1    H   1    7.202     0.020    
     A   44   TRP   HE1    H   1    10.080    0.020    
     A   44   TRP   HE3    H   1    7.670     0.020    
     A   44   TRP   HH2    H   1    7.215     0.020    
     A   44   TRP   HZ2    H   1    7.489     0.020    
     A   44   TRP   HZ3    H   1    7.153     0.020    
     A   44   TRP   CA     C   13   58.413    0.400    
     A   44   TRP   CB     C   13   30.215    0.400    
     A   44   TRP   CD1    C   13   126.822   0.400    
     A   44   TRP   CE3    C   13   121.226   0.400    
     A   44   TRP   CH2    C   13   124.389   0.400    
     A   44   TRP   CZ2    C   13   114.771   0.400    
     A   44   TRP   CZ3    C   13   121.767   0.400    
     A   44   TRP   N      N   15   128.689   0.400    
     A   44   TRP   NE1    N   15   129.000   0.400    

   stop_

save_

save_DYANA/DIANA_distance_constraints_2
   _nef_distance_restraint_list.sf_category       nef_distance_restraint_list
   _nef_distance_restraint_list.sf_framecode      DYANA/DIANA_distance_constraints_2
   _nef_distance_restraint_list.restraint_origin  noe
   _nef_distance_restraint_list.potential_type    upper-bound-parabolic

   loop_
      _nef_distance_restraint.index
      _nef_distance_restraint.restraint_id
      _nef_distance_restraint.chain_code_1
      _nef_distance_restraint.sequence_code_1
      _nef_distance_restraint.residue_name_1
      _nef_distance_restraint.atom_name_1
      _nef_distance_restraint.chain_code_2
      _nef_distance_restraint.sequence_code_2
      _nef_distance_restraint.residue_name_2
      _nef_distance_restraint.atom_name_2
      _nef_distance_restraint.weight
      _nef_distance_restraint.lower_limit
      _nef_distance_restraint.upper_limit

     1      1     A   5    ALA   HB%    A   6    ALA   H      1.0   .   4.15    
     2      2     A   6    ALA   HA     A   7    ALA   H      1.0   .   3.24    
     3      3     A   7    ALA   H      A   6    ALA   HB%    1.0   .   3.40    
     4      4     A   7    ALA   H      A   7    ALA   HB%    1.0   .   3.57    
     5      5     A   7    ALA   HA     A   8    LEU   H      1.0   .   2.71    
     6      6     A   7    ALA   HB%    A   8    LEU   H      1.0   .   3.37    
     7      7     A   7    ALA   HB%    A   27   VAL   HGy%   1.0   .   5.85    
     8      8     A   8    LEU   HA     A   8    LEU   HDx%   1.0   .   5.18    
     9      9     A   8    LEU   HA     A   8    LEU   HDy%   1.0   .   5.18    
     10     10    A   8    LEU   H      A   8    LEU   HB2    1.0   .   3.21    
     11     10    A   8    LEU   H      A   8    LEU   HB3    1.0   .   3.21    
     12     11    A   8    LEU   H      A   8    LEU   HG     1.0   .   3.24    
     13     12    A   8    LEU   H      A   8    LEU   HDy%   1.0   .   4.26    
     14     13    A   8    LEU   H      A   8    LEU   HDx%   1.0   .   4.26    
     15     14    A   8    LEU   H      A   8    LEU   HDy%   1.0   .   3.72    
     16     14    A   8    LEU   H      A   8    LEU   HDx%   1.0   .   3.72    
     17     15    A   8    LEU   HA     A   8    LEU   HDy%   1.0   .   4.04    
     18     15    A   8    LEU   HA     A   8    LEU   HDx%   1.0   .   4.04    
     19     16    A   8    LEU   HA     A   9    ARG   H      1.0   .   3.47    
     20     17    A   9    ARG   H      A   8    LEU   HB2    1.0   .   4.15    
     21     17    A   8    LEU   HB3    A   9    ARG   H      1.0   .   4.15    
     22     18    A   8    LEU   HDx%   A   9    ARG   H      1.0   .   5.67    
     23     19    A   9    ARG   H      A   8    LEU   HDy%   1.0   .   5.67    
     24     20    A   9    ARG   H      A   8    LEU   HDy%   1.0   .   4.72    
     25     20    A   8    LEU   HDx%   A   9    ARG   H      1.0   .   4.72    
     26     21    A   8    LEU   HA     A   10   SER   H      1.0   .   4.29    
     27     22    A   10   SER   H      A   8    LEU   HB2    1.0   .   3.71    
     28     22    A   8    LEU   HB3    A   10   SER   H      1.0   .   3.71    
     29     23    A   8    LEU   HDx%   A   10   SER   H      1.0   .   4.91    
     30     24    A   10   SER   H      A   8    LEU   HDy%   1.0   .   4.91    
     31     25    A   10   SER   H      A   8    LEU   HDy%   1.0   .   4.32    
     32     25    A   8    LEU   HDx%   A   10   SER   H      1.0   .   4.32    
     33     26    A   11   CYS   H      A   8    LEU   HB2    1.0   .   5.79    
     34     26    A   8    LEU   HB3    A   11   CYS   H      1.0   .   5.79    
     35     27    A   11   CYS   H      A   8    LEU   HDy%   1.0   .   5.99    
     36     27    A   8    LEU   HDx%   A   11   CYS   H      1.0   .   5.99    
     37     28    A   12   PRO   HDy    A   8    LEU   HDy%   1.0   .   5.81    
     38     29    A   8    LEU   HDx%   A   12   PRO   HDy    1.0   .   5.81    
     39     30    A   8    LEU   HDy%   A   12   PRO   HGy    1.0   .   5.57    
     40     30    A   8    LEU   HDx%   A   12   PRO   HGy    1.0   .   5.57    
     41     30    A   12   PRO   HGx    A   8    LEU   HDy%   1.0   .   5.57    
     42     30    A   8    LEU   HDx%   A   12   PRO   HGx    1.0   .   5.57    
     43     31    A   12   PRO   HDy    A   8    LEU   HDy%   1.0   .   5.05    
     44     31    A   8    LEU   HDx%   A   12   PRO   HDy    1.0   .   5.05    
     45     32    A   13   MET   H      A   8    LEU   HDy%   1.0   .   5.53    
     46     32    A   8    LEU   HDx%   A   13   MET   H      1.0   .   5.53    
     47     33    A   18   PHE   HD%    A   8    LEU   HB2    1.0   .   5.02    
     48     33    A   8    LEU   HB3    A   18   PHE   HD%    1.0   .   5.02    
     49     34    A   18   PHE   HE%    A   8    LEU   HB2    1.0   .   4.35    
     50     34    A   8    LEU   HB3    A   18   PHE   HE%    1.0   .   4.35    
     51     35    A   8    LEU   HG     A   18   PHE   HE%    1.0   .   6.06    
     52     36    A   18   PHE   HE%    A   8    LEU   HDy%   1.0   .   4.55    
     53     36    A   8    LEU   HDx%   A   18   PHE   HE%    1.0   .   4.55    
     54     37    A   8    LEU   H      A   27   VAL   HGx%   1.0   .   5.00    
     55     38    A   8    LEU   H      A   27   VAL   HGy%   1.0   .   5.64    
     56     39    A   9    ARG   HA     A   9    ARG   HDy    1.0   .   5.43    
     57     40    A   9    ARG   HA     A   9    ARG   HG2    1.0   .   4.07    
     58     40    A   9    ARG   HA     A   9    ARG   HG3    1.0   .   4.07    
     59     41    A   9    ARG   HA     A   9    ARG   HDx    1.0   .   5.43    
     60     42    A   9    ARG   H      A   9    ARG   HBx    1.0   .   4.16    
     61     43    A   9    ARG   H      A   9    ARG   HG2    1.0   .   4.26    
     62     43    A   9    ARG   H      A   9    ARG   HG3    1.0   .   4.26    
     63     44    A   9    ARG   H      A   9    ARG   HDy    1.0   .   5.33    
     64     44    A   9    ARG   H      A   9    ARG   HDx    1.0   .   5.33    
     65     45    A   9    ARG   HA     A   9    ARG   HDy    1.0   .   4.77    
     66     45    A   9    ARG   HA     A   9    ARG   HDx    1.0   .   4.77    
     67     46    A   10   SER   H      A   9    ARG   HA     1.0   .   3.26    
     68     47    A   10   SER   H      A   9    ARG   HBy    1.0   .   4.08    
     69     48    A   10   SER   H      A   9    ARG   HBx    1.0   .   4.38    
     70     49    A   10   SER   H      A   9    ARG   HDy    1.0   .   5.11    
     71     49    A   10   SER   H      A   9    ARG   HDx    1.0   .   5.11    
     72     50    A   9    ARG   H      A   10   SER   H      1.0   .   5.32    
     73     51    A   9    ARG   HA     A   18   PHE   HBx    1.0   .   5.93    
     74     52    A   9    ARG   HBx    A   18   PHE   HBx    1.0   .   6.11    
     75     53    A   9    ARG   HBy    A   18   PHE   HBx    1.0   .   6.11    
     76     54    A   18   PHE   HBx    A   9    ARG   HG2    1.0   .   6.11    
     77     54    A   9    ARG   HG3    A   18   PHE   HBx    1.0   .   6.11    
     78     55    A   18   PHE   HBy    A   9    ARG   HG2    1.0   .   6.46    
     79     55    A   9    ARG   HG3    A   18   PHE   HBy    1.0   .   6.46    
     80     56    A   9    ARG   HBy    A   18   PHE   HBy    1.0   .   6.61    
     81     57    A   18   PHE   HD%    A   9    ARG   HBx    1.0   .   5.65    
     82     58    A   18   PHE   HD%    A   9    ARG   HBy    1.0   .   4.83    
     83     59    A   18   PHE   HD%    A   9    ARG   HA     1.0   .   4.25    
     84     60    A   18   PHE   HD%    A   9    ARG   HG2    1.0   .   4.60    
     85     60    A   18   PHE   HD%    A   9    ARG   HG3    1.0   .   4.60    
     86     61    A   18   PHE   H      A   9    ARG   HG2    1.0   .   5.96    
     87     61    A   9    ARG   HG3    A   18   PHE   H      1.0   .   5.96    
     88     62    A   9    ARG   HBy    A   18   PHE   H      1.0   .   5.40    
     89     63    A   18   PHE   HD%    A   9    ARG   HDy    1.0   .   5.05    
     90     63    A   18   PHE   HD%    A   9    ARG   HDx    1.0   .   5.05    
     91     64    A   27   VAL   HGy%   A   9    ARG   HDy    1.0   .   5.76    
     92     65    A   27   VAL   HGy%   A   9    ARG   HDx    1.0   .   5.76    
     93     66    A   27   VAL   HGx%   A   9    ARG   HDy    1.0   .   5.60    
     94     66    A   27   VAL   HGx%   A   9    ARG   HDx    1.0   .   5.60    
     95     67    A   27   VAL   HGy%   A   9    ARG   HDy    1.0   .   4.90    
     96     67    A   27   VAL   HGy%   A   9    ARG   HDx    1.0   .   4.90    
     97     68    A   10   SER   H      A   10   SER   HBy    1.0   .   3.94    
     98     69    A   10   SER   H      A   10   SER   HBx    1.0   .   3.91    
     99     70    A   11   CYS   H      A   10   SER   HBy    1.0   .   3.41    
     100    71    A   11   CYS   H      A   10   SER   HBx    1.0   .   3.13    
     101    72    A   11   CYS   H      A   10   SER   HA     1.0   .   2.63    
     102    73    A   10   SER   H      A   12   PRO   HDx    1.0   .   5.57    
     103    74    A   10   SER   H      A   12   PRO   HDy    1.0   .   5.52    
     104    75    A   10   SER   HBx    A   15   GLN   HA     1.0   .   5.01    
     105    76    A   10   SER   HBy    A   15   GLN   HA     1.0   .   6.66    
     106    77    A   10   SER   HBy    A   16   LYS   HA     1.0   .   7.00    
     107    78    A   10   SER   HBx    A   16   LYS   H      1.0   .   4.75    
     108    79    A   10   SER   HBy    A   16   LYS   H      1.0   .   5.88    
     109    80    A   10   SER   HBx    A   17   GLU   HA     1.0   .   4.64    
     110    81    A   10   SER   HBy    A   17   GLU   HA     1.0   .   4.27    
     111    82    A   10   SER   HA     A   17   GLU   HA     1.0   .   4.05    
     112    83    A   10   SER   HBx    A   17   GLU   HGy    1.0   .   6.31    
     113    84    A   10   SER   HBy    A   17   GLU   HGy    1.0   .   6.02    
     114    85    A   10   SER   HA     A   17   GLU   H      1.0   .   5.83    
     115    86    A   10   SER   HBy    A   17   GLU   H      1.0   .   5.41    
     116    87    A   10   SER   HBx    A   17   GLU   H      1.0   .   5.74    
     117    88    A   10   SER   H      A   17   GLU   HA     1.0   .   5.70    
     118    89    A   18   PHE   HBx    A   10   SER   HA     1.0   .   4.84    
     119    90    A   18   PHE   HE%    A   10   SER   HA     1.0   .   3.84    
     120    91    A   10   SER   H      A   18   PHE   HBy    1.0   .   6.42    
     121    92    A   10   SER   H      A   18   PHE   HBx    1.0   .   5.16    
     122    93    A   18   PHE   H      A   10   SER   HA     1.0   .   3.27    
     123    94    A   18   PHE   H      A   10   SER   HBy    1.0   .   4.10    
     124    95    A   18   PHE   H      A   10   SER   HBx    1.0   .   4.31    
     125    96    A   10   SER   H      A   18   PHE   HD%    1.0   .   3.97    
     126    97    A   10   SER   H      A   18   PHE   HE%    1.0   .   4.66    
     127    98    A   11   CYS   H      A   11   CYS   HBy    1.0   .   2.88    
     128    99    A   11   CYS   H      A   11   CYS   HBx    1.0   .   2.87    
     129    100   A   12   PRO   HDx    A   11   CYS   HBx    1.0   .   5.51    
     130    101   A   12   PRO   HDy    A   11   CYS   HBx    1.0   .   5.61    
     131    102   A   12   PRO   HDx    A   11   CYS   HBy    1.0   .   6.42    
     132    103   A   12   PRO   HDy    A   11   CYS   HBy    1.0   .   6.25    
     133    104   A   12   PRO   HDy    A   11   CYS   HA     1.0   .   3.84    
     134    105   A   11   CYS   H      A   12   PRO   HDx    1.0   .   4.57    
     135    106   A   11   CYS   H      A   12   PRO   HDy    1.0   .   4.44    
     136    107   A   11   CYS   H      A   12   PRO   HA     1.0   .   5.46    
     137    108   A   13   MET   H      A   11   CYS   HA     1.0   .   4.22    
     138    109   A   13   MET   H      A   11   CYS   HBy    1.0   .   4.31    
     139    110   A   13   MET   H      A   11   CYS   HBx    1.0   .   4.78    
     140    111   A   11   CYS   HA     A   14   CYS   H      1.0   .   4.75    
     141    112   A   11   CYS   HBy    A   14   CYS   H      1.0   .   3.52    
     142    113   A   11   CYS   HBx    A   14   CYS   H      1.0   .   4.83    
     143    114   A   15   GLN   HA     A   11   CYS   HBy    1.0   .   6.35    
     144    115   A   11   CYS   HBy    A   15   GLN   H      1.0   .   4.10    
     145    116   A   11   CYS   HA     A   15   GLN   H      1.0   .   5.30    
     146    117   A   11   CYS   H      A   15   GLN   HA     1.0   .   5.20    
     147    118   A   11   CYS   H      A   15   GLN   HG2    1.0   .   6.61    
     148    118   A   11   CYS   H      A   15   GLN   HG3    1.0   .   6.61    
     149    119   A   16   LYS   HA     A   11   CYS   HBx    1.0   .   6.63    
     150    120   A   11   CYS   HBx    A   16   LYS   HBx    1.0   .   5.86    
     151    121   A   11   CYS   HBx    A   16   LYS   HBy    1.0   .   5.29    
     152    122   A   11   CYS   HBx    A   16   LYS   HGx    1.0   .   6.20    
     153    123   A   11   CYS   HBx    A   16   LYS   HGy    1.0   .   6.14    
     154    124   A   16   LYS   HA     A   11   CYS   HBy    1.0   .   6.73    
     155    125   A   11   CYS   HBy    A   16   LYS   HBx    1.0   .   5.87    
     156    126   A   11   CYS   HBy    A   16   LYS   HBy    1.0   .   5.44    
     157    127   A   11   CYS   HBy    A   16   LYS   HGx    1.0   .   6.71    
     158    128   A   11   CYS   HBy    A   16   LYS   HGy    1.0   .   6.63    
     159    129   A   11   CYS   H      A   16   LYS   HA     1.0   .   5.54    
     160    130   A   11   CYS   H      A   16   LYS   HBx    1.0   .   5.35    
     161    131   A   11   CYS   H      A   16   LYS   HBy    1.0   .   4.17    
     162    132   A   11   CYS   H      A   16   LYS   HGx    1.0   .   4.72    
     163    133   A   11   CYS   H      A   16   LYS   HGy    1.0   .   6.25    
     164    134   A   16   LYS   H      A   11   CYS   HBx    1.0   .   4.00    
     165    135   A   16   LYS   H      A   11   CYS   HBy    1.0   .   3.07    
     166    136   A   16   LYS   H      A   11   CYS   HA     1.0   .   4.67    
     167    137   A   11   CYS   H      A   17   GLU   HA     1.0   .   3.79    
     168    138   A   11   CYS   H      A   17   GLU   HB2    1.0   .   5.77    
     169    138   A   11   CYS   H      A   17   GLU   HB3    1.0   .   5.77    
     170    139   A   11   CYS   H      A   17   GLU   HGx    1.0   .   5.75    
     171    140   A   11   CYS   HBx    A   18   PHE   HZ     1.0   .   3.50    
     172    141   A   18   PHE   HE%    A   11   CYS   HBx    1.0   .   3.98    
     173    142   A   18   PHE   HD%    A   11   CYS   HBy    1.0   .   5.82    
     174    143   A   18   PHE   HD%    A   11   CYS   HBx    1.0   .   4.74    
     175    144   A   18   PHE   HE%    A   11   CYS   HA     1.0   .   4.29    
     176    145   A   18   PHE   HE%    A   11   CYS   HBy    1.0   .   4.65    
     177    146   A   11   CYS   HA     A   18   PHE   HZ     1.0   .   3.89    
     178    147   A   11   CYS   HBy    A   18   PHE   HZ     1.0   .   4.07    
     179    148   A   11   CYS   H      A   18   PHE   HBx    1.0   .   5.96    
     180    149   A   11   CYS   H      A   18   PHE   HE%    1.0   .   4.06    
     181    150   A   11   CYS   H      A   18   PHE   HD%    1.0   .   4.56    
     182    151   A   11   CYS   H      A   18   PHE   HZ     1.0   .   4.59    
     183    152   A   11   CYS   HA     A   30   HIS   HD2    1.0   .   5.48    
     184    153   A   11   CYS   HBy    A   30   HIS   HD2    1.0   .   4.58    
     185    154   A   11   CYS   HBx    A   30   HIS   HD2    1.0   .   3.84    
     186    155   A   11   CYS   HBx    A   31   LEU   HA     1.0   .   6.94    
     187    156   A   11   CYS   HBx    A   31   LEU   HDy%   1.0   .   5.34    
     188    157   A   11   CYS   HBy    A   31   LEU   HDy%   1.0   .   5.96    
     189    158   A   11   CYS   HA     A   31   LEU   HDy%   1.0   .   4.70    
     190    159   A   11   CYS   H      A   31   LEU   HDy%   1.0   .   5.04    
     191    160   A   11   CYS   HBx    A   31   LEU   H      1.0   .   6.08    
     192    161   A   12   PRO   HDx    A   13   MET   HE%    1.0   .   5.91    
     193    162   A   12   PRO   HGx    A   13   MET   H      1.0   .   3.83    
     194    163   A   13   MET   H      A   12   PRO   HGy    1.0   .   4.68    
     195    164   A   13   MET   H      A   12   PRO   HBy    1.0   .   4.46    
     196    165   A   13   MET   H      A   12   PRO   HBx    1.0   .   4.46    
     197    166   A   13   MET   H      A   12   PRO   HDx    1.0   .   3.61    
     198    167   A   12   PRO   HDy    A   13   MET   H      1.0   .   4.03    
     199    168   A   13   MET   H      A   12   PRO   HBy    1.0   .   3.77    
     200    168   A   13   MET   H      A   12   PRO   HBx    1.0   .   3.77    
     201    169   A   12   PRO   HA     A   14   CYS   H      1.0   .   5.01    
     202    170   A   12   PRO   HDx    A   14   CYS   H      1.0   .   5.23    
     203    171   A   12   PRO   HGx    A   14   CYS   H      1.0   .   5.79    
     204    172   A   14   CYS   H      A   12   PRO   HGy    1.0   .   6.78    
     205    173   A   12   PRO   HDy    A   14   CYS   H      1.0   .   5.95    
     206    174   A   12   PRO   HA     A   15   GLN   H      1.0   .   4.59    
     207    175   A   12   PRO   HDy    A   18   PHE   HE%    1.0   .   4.87    
     208    176   A   12   PRO   HDx    A   18   PHE   HZ     1.0   .   5.42    
     209    177   A   12   PRO   HDy    A   18   PHE   HZ     1.0   .   6.03    
     210    178   A   12   PRO   HDy    A   31   LEU   HDy%   1.0   .   4.64    
     211    179   A   12   PRO   HDx    A   31   LEU   HDy%   1.0   .   4.43    
     212    180   A   13   MET   HE%    A   13   MET   HBx    1.0   .   5.00    
     213    181   A   13   MET   HE%    A   13   MET   HBy    1.0   .   5.00    
     214    182   A   13   MET   H      A   13   MET   HGy    1.0   .   4.70    
     215    183   A   13   MET   H      A   13   MET   HGx    1.0   .   4.70    
     216    184   A   13   MET   H      A   13   MET   HE%    1.0   .   4.02    
     217    185   A   13   MET   H      A   13   MET   HBy    1.0   .   3.54    
     218    186   A   13   MET   H      A   13   MET   HBx    1.0   .   3.54    
     219    187   A   13   MET   H      A   13   MET   HBx    1.0   .   3.03    
     220    187   A   13   MET   H      A   13   MET   HBy    1.0   .   3.03    
     221    188   A   13   MET   H      A   13   MET   HGx    1.0   .   4.07    
     222    188   A   13   MET   H      A   13   MET   HGy    1.0   .   4.07    
     223    189   A   13   MET   HE%    A   13   MET   HBx    1.0   .   4.34    
     224    189   A   13   MET   HE%    A   13   MET   HBy    1.0   .   4.34    
     225    190   A   14   CYS   H      A   13   MET   HGy    1.0   .   5.22    
     226    191   A   14   CYS   H      A   13   MET   HGx    1.0   .   5.22    
     227    192   A   14   CYS   H      A   13   MET   HBy    1.0   .   3.74    
     228    193   A   14   CYS   H      A   13   MET   HBx    1.0   .   3.74    
     229    194   A   14   CYS   H      A   13   MET   HE%    1.0   .   5.05    
     230    195   A   13   MET   H      A   14   CYS   HA     1.0   .   5.14    
     231    196   A   13   MET   H      A   14   CYS   HBx    1.0   .   6.48    
     232    197   A   13   MET   H      A   14   CYS   HBy    1.0   .   5.29    
     233    198   A   13   MET   H      A   14   CYS   H      1.0   .   4.27    
     234    199   A   14   CYS   H      A   13   MET   HBx    1.0   .   3.24    
     235    199   A   14   CYS   H      A   13   MET   HBy    1.0   .   3.24    
     236    200   A   14   CYS   H      A   13   MET   HGx    1.0   .   4.57    
     237    200   A   14   CYS   H      A   13   MET   HGy    1.0   .   4.57    
     238    201   A   13   MET   H      A   15   GLN   HA     1.0   .   5.29    
     239    202   A   15   GLN   H      A   13   MET   HA     1.0   .   4.92    
     240    203   A   13   MET   HE%    A   31   LEU   HBy    1.0   .   5.24    
     241    204   A   31   LEU   HDy%   A   13   MET   HE%    1.0   .   4.33    
     242    205   A   31   LEU   HA     A   13   MET   HE%    1.0   .   4.81    
     243    206   A   31   LEU   H      A   13   MET   HE%    1.0   .   5.15    
     244    207   A   13   MET   H      A   31   LEU   HDy%   1.0   .   4.63    
     245    208   A   13   MET   H      A   31   LEU   HDx%   1.0   .   6.58    
     246    209   A   13   MET   HE%    A   34   CYS   HBx    1.0   .   4.82    
     247    210   A   13   MET   HBy    A   34   CYS   HBx    1.0   .   5.62    
     248    211   A   34   CYS   HBx    A   13   MET   HBx    1.0   .   5.62    
     249    212   A   13   MET   HBy    A   34   CYS   HBy    1.0   .   5.01    
     250    213   A   34   CYS   HBy    A   13   MET   HBx    1.0   .   5.01    
     251    214   A   13   MET   HE%    A   34   CYS   HBy    1.0   .   4.62    
     252    215   A   13   MET   H      A   34   CYS   HBy    1.0   .   5.61    
     253    216   A   13   MET   H      A   34   CYS   HBx    1.0   .   6.25    
     254    217   A   13   MET   HE%    A   34   CYS   H      1.0   .   4.87    
     255    218   A   34   CYS   HBx    A   13   MET   HBx    1.0   .   4.87    
     256    218   A   13   MET   HBy    A   34   CYS   HBx    1.0   .   4.87    
     257    219   A   34   CYS   HBy    A   13   MET   HBx    1.0   .   4.34    
     258    219   A   13   MET   HBy    A   34   CYS   HBy    1.0   .   4.34    
     259    220   A   13   MET   HE%    A   35   LEU   HA     1.0   .   5.47    
     260    221   A   13   MET   HE%    A   35   LEU   HDx%   1.0   .   6.14    
     261    222   A   13   MET   HE%    A   35   LEU   HDy%   1.0   .   6.14    
     262    223   A   13   MET   HE%    A   35   LEU   HB2    1.0   .   5.69    
     263    223   A   13   MET   HE%    A   35   LEU   HB3    1.0   .   5.69    
     264    224   A   13   MET   HE%    A   35   LEU   H      1.0   .   3.89    
     265    225   A   35   LEU   H      A   13   MET   HGx    1.0   .   6.50    
     266    225   A   13   MET   HGy    A   35   LEU   H      1.0   .   6.50    
     267    226   A   13   MET   HE%    A   35   LEU   HDy%   1.0   .   5.36    
     268    226   A   13   MET   HE%    A   35   LEU   HDx%   1.0   .   5.36    
     269    227   A   13   MET   HE%    A   36   ALA   H      1.0   .   5.48    
     270    228   A   13   MET   HE%    A   37   GLU   H      1.0   .   6.62    
     271    229   A   14   CYS   H      A   14   CYS   HBx    1.0   .   3.89    
     272    230   A   14   CYS   H      A   14   CYS   HBy    1.0   .   3.45    
     273    231   A   14   CYS   HA     A   15   GLN   HG2    1.0   .   5.96    
     274    231   A   15   GLN   HG3    A   14   CYS   HA     1.0   .   5.96    
     275    232   A   15   GLN   H      A   14   CYS   HBx    1.0   .   4.55    
     276    233   A   15   GLN   H      A   14   CYS   HBy    1.0   .   4.55    
     277    234   A   15   GLN   HA     A   14   CYS   H      1.0   .   4.37    
     278    235   A   14   CYS   H      A   15   GLN   H      1.0   .   3.89    
     279    236   A   14   CYS   H      A   15   GLN   HBy    1.0   .   5.12    
     280    236   A   14   CYS   H      A   15   GLN   HBx    1.0   .   5.12    
     281    237   A   16   LYS   H      A   14   CYS   HBy    1.0   .   5.38    
     282    238   A   16   LYS   H      A   14   CYS   HBx    1.0   .   5.03    
     283    239   A   16   LYS   H      A   14   CYS   HA     1.0   .   5.29    
     284    240   A   14   CYS   H      A   31   LEU   HDy%   1.0   .   5.55    
     285    241   A   14   CYS   H      A   34   CYS   HBy    1.0   .   5.51    
     286    242   A   14   CYS   H      A   34   CYS   HBx    1.0   .   5.86    
     287    243   A   15   GLN   HA     A   15   GLN   HG2    1.0   .   4.06    
     288    243   A   15   GLN   HA     A   15   GLN   HG3    1.0   .   4.06    
     289    244   A   15   GLN   HA     A   15   GLN   H      1.0   .   2.64    
     290    245   A   15   GLN   H      A   15   GLN   HG2    1.0   .   3.90    
     291    245   A   15   GLN   H      A   15   GLN   HG3    1.0   .   3.90    
     292    246   A   15   GLN   H      A   15   GLN   HBx    1.0   .   4.19    
     293    247   A   15   GLN   H      A   15   GLN   HBy    1.0   .   4.19    
     294    248   A   15   GLN   H      A   15   GLN   HBy    1.0   .   3.51    
     295    248   A   15   GLN   H      A   15   GLN   HBx    1.0   .   3.51    
     296    249   A   15   GLN   H      A   16   LYS   HBx    1.0   .   5.33    
     297    250   A   15   GLN   H      A   16   LYS   HBy    1.0   .   5.20    
     298    251   A   15   GLN   HA     A   16   LYS   H      1.0   .   3.11    
     299    252   A   16   LYS   H      A   15   GLN   HG2    1.0   .   4.67    
     300    252   A   16   LYS   H      A   15   GLN   HG3    1.0   .   4.67    
     301    253   A   16   LYS   H      A   15   GLN   HBy    1.0   .   4.67    
     302    254   A   16   LYS   H      A   15   GLN   HBx    1.0   .   4.67    
     303    255   A   16   LYS   H      A   15   GLN   H      1.0   .   4.76    
     304    256   A   16   LYS   H      A   15   GLN   HBy    1.0   .   4.03    
     305    256   A   16   LYS   H      A   15   GLN   HBx    1.0   .   4.03    
     306    257   A   16   LYS   HBx    A   16   LYS   HE2    1.0   .   5.44    
     307    257   A   16   LYS   HBx    A   16   LYS   HE3    1.0   .   5.44    
     308    258   A   16   LYS   HA     A   16   LYS   HDy    1.0   .   5.87    
     309    259   A   16   LYS   HA     A   16   LYS   HDx    1.0   .   5.87    
     310    260   A   16   LYS   HBy    A   16   LYS   HE2    1.0   .   5.78    
     311    260   A   16   LYS   HBy    A   16   LYS   HE3    1.0   .   5.78    
     312    261   A   16   LYS   H      A   16   LYS   HBx    1.0   .   3.20    
     313    262   A   16   LYS   H      A   16   LYS   HBy    1.0   .   3.08    
     314    263   A   16   LYS   H      A   16   LYS   HDy    1.0   .   5.48    
     315    264   A   16   LYS   H      A   16   LYS   HDx    1.0   .   5.48    
     316    265   A   16   LYS   H      A   16   LYS   HGx    1.0   .   4.36    
     317    266   A   16   LYS   H      A   16   LYS   HGy    1.0   .   4.96    
     318    267   A   16   LYS   H      A   16   LYS   HE2    1.0   .   6.17    
     319    267   A   16   LYS   H      A   16   LYS   HE3    1.0   .   6.17    
     320    268   A   16   LYS   HA     A   16   LYS   HDy    1.0   .   5.14    
     321    268   A   16   LYS   HA     A   16   LYS   HDx    1.0   .   5.14    
     322    269   A   16   LYS   HA     A   17   GLU   H      1.0   .   2.51    
     323    270   A   17   GLU   H      A   16   LYS   HBx    1.0   .   3.94    
     324    271   A   17   GLU   H      A   16   LYS   HBy    1.0   .   4.33    
     325    272   A   17   GLU   H      A   16   LYS   HDy    1.0   .   5.29    
     326    273   A   17   GLU   H      A   16   LYS   HDx    1.0   .   5.29    
     327    274   A   17   GLU   H      A   16   LYS   HGx    1.0   .   3.81    
     328    275   A   17   GLU   H      A   16   LYS   HGy    1.0   .   3.98    
     329    276   A   17   GLU   H      A   16   LYS   HE2    1.0   .   5.28    
     330    276   A   17   GLU   H      A   16   LYS   HE3    1.0   .   5.28    
     331    277   A   16   LYS   H      A   17   GLU   H      1.0   .   5.21    
     332    278   A   17   GLU   H      A   16   LYS   HDy    1.0   .   4.53    
     333    278   A   17   GLU   H      A   16   LYS   HDx    1.0   .   4.53    
     334    279   A   18   PHE   HD%    A   16   LYS   HE2    1.0   .   4.73    
     335    279   A   18   PHE   HD%    A   16   LYS   HE3    1.0   .   4.73    
     336    280   A   18   PHE   HE%    A   16   LYS   HE2    1.0   .   5.26    
     337    280   A   18   PHE   HE%    A   16   LYS   HE3    1.0   .   5.26    
     338    281   A   18   PHE   HE%    A   16   LYS   HBy    1.0   .   5.29    
     339    282   A   18   PHE   H      A   16   LYS   HA     1.0   .   6.08    
     340    283   A   18   PHE   HD%    A   16   LYS   HDy    1.0   .   4.92    
     341    283   A   18   PHE   HD%    A   16   LYS   HDx    1.0   .   4.92    
     342    284   A   18   PHE   HE%    A   16   LYS   HDy    1.0   .   4.65    
     343    284   A   18   PHE   HE%    A   16   LYS   HDx    1.0   .   4.65    
     344    285   A   19   ALA   H      A   16   LYS   HE2    1.0   .   5.61    
     345    285   A   16   LYS   HE3    A   19   ALA   H      1.0   .   5.61    
     346    286   A   30   HIS   HE1    A   16   LYS   HE2    1.0   .   4.50    
     347    286   A   16   LYS   HE3    A   30   HIS   HE1    1.0   .   4.50    
     348    287   A   16   LYS   HBx    A   30   HIS   HE1    1.0   .   4.70    
     349    288   A   16   LYS   HBy    A   30   HIS   HE1    1.0   .   4.94    
     350    289   A   30   HIS   HE1    A   16   LYS   HDy    1.0   .   4.21    
     351    290   A   16   LYS   HDx    A   30   HIS   HE1    1.0   .   4.21    
     352    291   A   16   LYS   HGy    A   30   HIS   HE1    1.0   .   5.68    
     353    292   A   30   HIS   HE1    A   16   LYS   HDy    1.0   .   3.55    
     354    292   A   16   LYS   HDx    A   30   HIS   HE1    1.0   .   3.55    
     355    293   A   17   GLU   HGy    A   17   GLU   H      1.0   .   3.69    
     356    294   A   17   GLU   H      A   17   GLU   HGx    1.0   .   4.44    
     357    295   A   17   GLU   H      A   17   GLU   HB2    1.0   .   2.77    
     358    295   A   17   GLU   H      A   17   GLU   HB3    1.0   .   2.77    
     359    296   A   18   PHE   HBx    A   17   GLU   HB2    1.0   .   6.43    
     360    296   A   18   PHE   HBx    A   17   GLU   HB3    1.0   .   6.43    
     361    297   A   18   PHE   HBy    A   17   GLU   HB2    1.0   .   6.65    
     362    297   A   18   PHE   HBy    A   17   GLU   HB3    1.0   .   6.65    
     363    298   A   17   GLU   H      A   18   PHE   HA     1.0   .   6.13    
     364    299   A   18   PHE   H      A   17   GLU   HA     1.0   .   2.62    
     365    300   A   18   PHE   H      A   17   GLU   HGy    1.0   .   5.07    
     366    301   A   18   PHE   H      A   17   GLU   HGx    1.0   .   4.30    
     367    302   A   18   PHE   H      A   17   GLU   HB2    1.0   .   3.37    
     368    302   A   18   PHE   H      A   17   GLU   HB3    1.0   .   3.37    
     369    303   A   19   ALA   H      A   17   GLU   HB2    1.0   .   5.51    
     370    303   A   17   GLU   HB3    A   19   ALA   H      1.0   .   5.51    
     371    304   A   18   PHE   HD%    A   18   PHE   HA     1.0   .   2.97    
     372    305   A   18   PHE   HBy    A   18   PHE   H      1.0   .   3.77    
     373    306   A   18   PHE   HBx    A   18   PHE   H      1.0   .   3.27    
     374    307   A   18   PHE   HD%    A   18   PHE   H      1.0   .   3.34    
     375    308   A   18   PHE   HE%    A   18   PHE   H      1.0   .   4.99    
     376    309   A   19   ALA   H      A   18   PHE   HA     1.0   .   2.75    
     377    310   A   18   PHE   HBy    A   19   ALA   H      1.0   .   3.71    
     378    311   A   18   PHE   HBx    A   19   ALA   H      1.0   .   4.20    
     379    312   A   18   PHE   HD%    A   19   ALA   H      1.0   .   3.75    
     380    313   A   18   PHE   HA     A   22   LEU   HDx%   1.0   .   4.66    
     381    314   A   18   PHE   HBx    A   22   LEU   HBx    1.0   .   6.24    
     382    315   A   18   PHE   HBx    A   22   LEU   HBy    1.0   .   6.87    
     383    316   A   18   PHE   HBx    A   22   LEU   HDx%   1.0   .   5.28    
     384    317   A   18   PHE   HBx    A   22   LEU   HDy%   1.0   .   6.23    
     385    318   A   18   PHE   HBy    A   22   LEU   HBx    1.0   .   5.69    
     386    319   A   18   PHE   HBy    A   22   LEU   HDy%   1.0   .   5.97    
     387    320   A   18   PHE   HBy    A   22   LEU   HDx%   1.0   .   4.87    
     388    321   A   18   PHE   HD%    A   22   LEU   HDx%   1.0   .   3.55    
     389    322   A   18   PHE   HD%    A   22   LEU   HDy%   1.0   .   4.69    
     390    323   A   18   PHE   HE%    A   22   LEU   HDy%   1.0   .   5.42    
     391    324   A   18   PHE   HBy    A   22   LEU   H      1.0   .   5.27    
     392    325   A   18   PHE   HBx    A   22   LEU   H      1.0   .   6.47    
     393    326   A   18   PHE   H      A   22   LEU   HDx%   1.0   .   4.84    
     394    327   A   27   VAL   HGy%   A   18   PHE   HBy    1.0   .   5.15    
     395    328   A   27   VAL   HGx%   A   18   PHE   HBx    1.0   .   6.61    
     396    329   A   27   VAL   HGy%   A   18   PHE   HBx    1.0   .   5.34    
     397    330   A   18   PHE   HBy    A   27   VAL   HB     1.0   .   7.00    
     398    331   A   27   VAL   HGx%   A   18   PHE   HBy    1.0   .   6.66    
     399    332   A   18   PHE   HD%    A   27   VAL   HB     1.0   .   5.99    
     400    333   A   27   VAL   HGx%   A   18   PHE   HZ     1.0   .   4.06    
     401    334   A   18   PHE   HE%    A   27   VAL   HGx%   1.0   .   3.89    
     402    335   A   18   PHE   HD%    A   27   VAL   HA     1.0   .   4.81    
     403    336   A   18   PHE   HD%    A   27   VAL   HGx%   1.0   .   4.10    
     404    337   A   27   VAL   HGy%   A   18   PHE   HD%    1.0   .   3.85    
     405    338   A   18   PHE   HE%    A   27   VAL   HA     1.0   .   4.43    
     406    339   A   27   VAL   HGy%   A   18   PHE   HE%    1.0   .   4.39    
     407    340   A   18   PHE   HE%    A   27   VAL   HB     1.0   .   4.95    
     408    341   A   18   PHE   HZ     A   27   VAL   HA     1.0   .   4.64    
     409    342   A   27   VAL   HGy%   A   18   PHE   HZ     1.0   .   5.01    
     410    343   A   18   PHE   HE%    A   30   HIS   HBy    1.0   .   4.08    
     411    344   A   18   PHE   HZ     A   30   HIS   HBx    1.0   .   4.79    
     412    345   A   18   PHE   HZ     A   30   HIS   HD2    1.0   .   4.72    
     413    346   A   18   PHE   HE%    A   30   HIS   HD2    1.0   .   5.92    
     414    347   A   18   PHE   HD%    A   30   HIS   HBy    1.0   .   5.02    
     415    348   A   18   PHE   HD%    A   30   HIS   HBx    1.0   .   5.63    
     416    349   A   18   PHE   HE%    A   30   HIS   HBx    1.0   .   4.37    
     417    350   A   18   PHE   HZ     A   30   HIS   HBy    1.0   .   4.15    
     418    351   A   18   PHE   HE%    A   30   HIS   H      1.0   .   5.14    
     419    352   A   18   PHE   HZ     A   30   HIS   H      1.0   .   5.36    
     420    353   A   18   PHE   HE%    A   31   LEU   HG     1.0   .   4.89    
     421    354   A   18   PHE   HD%    A   31   LEU   HDy%   1.0   .   5.39    
     422    355   A   18   PHE   HE%    A   31   LEU   HDy%   1.0   .   4.06    
     423    356   A   18   PHE   HE%    A   31   LEU   HDx%   1.0   .   5.00    
     424    357   A   18   PHE   HZ     A   31   LEU   HA     1.0   .   5.25    
     425    358   A   18   PHE   HZ     A   31   LEU   HG     1.0   .   4.34    
     426    359   A   18   PHE   HZ     A   31   LEU   HDy%   1.0   .   3.71    
     427    360   A   18   PHE   HZ     A   31   LEU   HDx%   1.0   .   4.52    
     428    361   A   19   ALA   H      A   19   ALA   HB%    1.0   .   2.67    
     429    362   A   19   ALA   HA     A   20   PRO   HDy    1.0   .   3.29    
     430    362   A   19   ALA   HA     A   20   PRO   HDx    1.0   .   3.29    
     431    363   A   19   ALA   HA     A   20   PRO   HGx    1.0   .   5.00    
     432    363   A   19   ALA   HA     A   20   PRO   HGy    1.0   .   5.00    
     433    364   A   19   ALA   HB%    A   20   PRO   HDx    1.0   .   4.11    
     434    365   A   19   ALA   HB%    A   20   PRO   HDy    1.0   .   4.11    
     435    366   A   19   ALA   HB%    A   20   PRO   HGx    1.0   .   5.63    
     436    366   A   19   ALA   HB%    A   20   PRO   HGy    1.0   .   5.63    
     437    367   A   19   ALA   H      A   20   PRO   HDy    1.0   .   4.57    
     438    367   A   19   ALA   H      A   20   PRO   HDx    1.0   .   4.57    
     439    368   A   19   ALA   HA     A   20   PRO   HDy    1.0   .   3.29    
     440    368   A   19   ALA   HA     A   20   PRO   HDx    1.0   .   3.29    
     441    369   A   19   ALA   HB%    A   20   PRO   HBx    1.0   .   5.92    
     442    369   A   19   ALA   HB%    A   20   PRO   HBy    1.0   .   5.92    
     443    370   A   19   ALA   HB%    A   20   PRO   HDy    1.0   .   3.40    
     444    370   A   19   ALA   HB%    A   20   PRO   HDx    1.0   .   3.40    
     445    371   A   19   ALA   HB%    A   21   ARG   HB2    1.0   .   6.07    
     446    371   A   19   ALA   HB%    A   21   ARG   HB3    1.0   .   6.07    
     447    372   A   19   ALA   HA     A   21   ARG   H      1.0   .   5.59    
     448    373   A   19   ALA   HB%    A   21   ARG   H      1.0   .   4.05    
     449    374   A   19   ALA   HB%    A   21   ARG   HGx    1.0   .   4.48    
     450    374   A   19   ALA   HB%    A   21   ARG   HGy    1.0   .   4.48    
     451    375   A   19   ALA   HB%    A   22   LEU   HG     1.0   .   4.57    
     452    376   A   22   LEU   HDx%   A   19   ALA   HB%    1.0   .   4.40    
     453    377   A   22   LEU   HDy%   A   19   ALA   HB%    1.0   .   4.99    
     454    378   A   22   LEU   HBx    A   19   ALA   HB%    1.0   .   6.04    
     455    379   A   22   LEU   H      A   19   ALA   HA     1.0   .   5.27    
     456    380   A   22   LEU   H      A   19   ALA   HB%    1.0   .   3.82    
     457    381   A   19   ALA   H      A   22   LEU   HBx    1.0   .   4.79    
     458    382   A   19   ALA   H      A   22   LEU   HBy    1.0   .   5.12    
     459    383   A   19   ALA   H      A   22   LEU   HG     1.0   .   4.08    
     460    384   A   19   ALA   H      A   22   LEU   HDx%   1.0   .   3.28    
     461    385   A   19   ALA   H      A   22   LEU   HDy%   1.0   .   4.35    
     462    386   A   27   VAL   HGy%   A   19   ALA   H      1.0   .   5.83    
     463    387   A   21   ARG   H      A   20   PRO   HBx    1.0   .   3.96    
     464    387   A   20   PRO   HBy    A   21   ARG   H      1.0   .   3.96    
     465    388   A   21   ARG   H      A   20   PRO   HGx    1.0   .   4.39    
     466    388   A   20   PRO   HGy    A   21   ARG   H      1.0   .   4.39    
     467    389   A   21   ARG   H      A   20   PRO   HDy    1.0   .   4.32    
     468    389   A   20   PRO   HDx    A   21   ARG   H      1.0   .   4.32    
     469    390   A   22   LEU   H      A   20   PRO   HA     1.0   .   4.17    
     470    391   A   22   LEU   H      A   20   PRO   HBx    1.0   .   5.19    
     471    391   A   22   LEU   H      A   20   PRO   HBy    1.0   .   5.19    
     472    392   A   22   LEU   H      A   20   PRO   HDy    1.0   .   5.06    
     473    392   A   22   LEU   H      A   20   PRO   HDx    1.0   .   5.06    
     474    393   A   21   ARG   HA     A   21   ARG   HD2    1.0   .   5.73    
     475    393   A   21   ARG   HA     A   21   ARG   HD3    1.0   .   5.73    
     476    394   A   21   ARG   H      A   21   ARG   HD2    1.0   .   5.03    
     477    394   A   21   ARG   H      A   21   ARG   HD3    1.0   .   5.03    
     478    395   A   21   ARG   H      A   21   ARG   HB2    1.0   .   3.65    
     479    395   A   21   ARG   HB3    A   21   ARG   H      1.0   .   3.65    
     480    396   A   21   ARG   H      A   21   ARG   HGx    1.0   .   3.80    
     481    396   A   21   ARG   H      A   21   ARG   HGy    1.0   .   3.80    
     482    397   A   22   LEU   H      A   21   ARG   HD2    1.0   .   5.10    
     483    397   A   22   LEU   H      A   21   ARG   HD3    1.0   .   5.10    
     484    398   A   22   LEU   H      A   21   ARG   HB2    1.0   .   3.90    
     485    398   A   22   LEU   H      A   21   ARG   HB3    1.0   .   3.90    
     486    399   A   22   LEU   H      A   21   ARG   HGx    1.0   .   3.88    
     487    399   A   22   LEU   H      A   21   ARG   HGy    1.0   .   3.88    
     488    400   A   21   ARG   H      A   22   LEU   HG     1.0   .   5.52    
     489    401   A   22   LEU   HBx    A   21   ARG   H      1.0   .   5.67    
     490    402   A   22   LEU   H      A   21   ARG   H      1.0   .   5.77    
     491    403   A   22   LEU   HA     A   21   ARG   HGx    1.0   .   5.47    
     492    403   A   21   ARG   HGy    A   22   LEU   HA     1.0   .   5.47    
     493    404   A   22   LEU   HDy%   A   21   ARG   HGx    1.0   .   5.61    
     494    404   A   22   LEU   HDy%   A   21   ARG   HGy    1.0   .   5.61    
     495    405   A   22   LEU   HDx%   A   22   LEU   HA     1.0   .   4.68    
     496    406   A   22   LEU   HDy%   A   22   LEU   HA     1.0   .   3.72    
     497    407   A   22   LEU   HDx%   A   22   LEU   HBy    1.0   .   4.20    
     498    408   A   22   LEU   HBy    A   22   LEU   H      1.0   .   3.76    
     499    409   A   22   LEU   HBx    A   22   LEU   H      1.0   .   2.99    
     500    410   A   22   LEU   H      A   22   LEU   HG     1.0   .   3.05    
     501    411   A   22   LEU   HDx%   A   22   LEU   H      1.0   .   3.80    
     502    412   A   22   LEU   HDy%   A   22   LEU   H      1.0   .   3.70    
     503    413   A   22   LEU   HA     A   23   THR   HG2%   1.0   .   5.35    
     504    414   A   22   LEU   HA     A   23   THR   H      1.0   .   2.60    
     505    415   A   22   LEU   HBx    A   23   THR   H      1.0   .   4.18    
     506    416   A   22   LEU   HBy    A   23   THR   H      1.0   .   3.39    
     507    417   A   22   LEU   HG     A   23   THR   H      1.0   .   4.83    
     508    418   A   22   LEU   HDx%   A   23   THR   H      1.0   .   4.63    
     509    419   A   22   LEU   HDy%   A   23   THR   H      1.0   .   3.68    
     510    420   A   22   LEU   H      A   23   THR   HA     1.0   .   5.73    
     511    421   A   22   LEU   H      A   23   THR   HG2%   1.0   .   5.64    
     512    422   A   22   LEU   HA     A   26   ASP   HBy    1.0   .   5.42    
     513    423   A   22   LEU   HBy    A   26   ASP   HBy    1.0   .   4.81    
     514    424   A   22   LEU   HBx    A   26   ASP   HBy    1.0   .   5.74    
     515    425   A   22   LEU   HDx%   A   26   ASP   HBy    1.0   .   5.08    
     516    426   A   22   LEU   HDx%   A   26   ASP   HBx    1.0   .   5.26    
     517    427   A   22   LEU   HG     A   26   ASP   HBy    1.0   .   5.65    
     518    428   A   22   LEU   HDy%   A   26   ASP   HBy    1.0   .   4.97    
     519    429   A   22   LEU   HA     A   26   ASP   HBx    1.0   .   5.16    
     520    430   A   22   LEU   HBx    A   26   ASP   HBx    1.0   .   5.22    
     521    431   A   22   LEU   HBy    A   26   ASP   HBx    1.0   .   4.34    
     522    432   A   22   LEU   HG     A   26   ASP   HBx    1.0   .   5.37    
     523    433   A   22   LEU   HDy%   A   26   ASP   HBx    1.0   .   4.93    
     524    434   A   22   LEU   HA     A   26   ASP   H      1.0   .   5.47    
     525    435   A   22   LEU   HDx%   A   26   ASP   H      1.0   .   6.01    
     526    436   A   22   LEU   HDy%   A   26   ASP   H      1.0   .   4.96    
     527    437   A   22   LEU   H      A   26   ASP   HBx    1.0   .   5.89    
     528    438   A   22   LEU   H      A   26   ASP   HBy    1.0   .   6.34    
     529    439   A   22   LEU   HDy%   A   27   VAL   HA     1.0   .   5.98    
     530    440   A   27   VAL   HGy%   A   22   LEU   HDy%   1.0   .   4.93    
     531    441   A   27   VAL   HGy%   A   22   LEU   HBy    1.0   .   4.66    
     532    442   A   27   VAL   HGy%   A   22   LEU   HBx    1.0   .   4.91    
     533    443   A   22   LEU   HDx%   A   27   VAL   HA     1.0   .   5.86    
     534    444   A   27   VAL   HGy%   A   22   LEU   HDx%   1.0   .   4.80    
     535    445   A   27   VAL   HGy%   A   22   LEU   HG     1.0   .   5.72    
     536    446   A   22   LEU   HA     A   27   VAL   H      1.0   .   6.03    
     537    447   A   22   LEU   HBy    A   27   VAL   H      1.0   .   4.18    
     538    448   A   22   LEU   HBx    A   27   VAL   H      1.0   .   5.80    
     539    449   A   22   LEU   HDy%   A   27   VAL   H      1.0   .   4.70    
     540    450   A   22   LEU   HDx%   A   27   VAL   H      1.0   .   4.74    
     541    451   A   27   VAL   HGy%   A   22   LEU   H      1.0   .   5.85    
     542    452   A   22   LEU   HDx%   A   30   HIS   HBy    1.0   .   7.00    
     543    453   A   22   LEU   HDx%   A   30   HIS   H      1.0   .   6.28    
     544    454   A   22   LEU   HDy%   A   30   HIS   H      1.0   .   6.01    
     545    455   A   23   THR   HG2%   A   23   THR   HA     1.0   .   3.90    
     546    456   A   23   THR   HG2%   A   23   THR   H      1.0   .   3.26    
     547    457   A   23   THR   H      A   23   THR   HB     1.0   .   3.96    
     548    458   A   23   THR   HB     A   24   GLN   H      1.0   .   4.38    
     549    459   A   23   THR   HG2%   A   24   GLN   H      1.0   .   5.33    
     550    460   A   23   THR   HB     A   25   LEU   H      1.0   .   3.16    
     551    461   A   23   THR   HA     A   25   LEU   H      1.0   .   4.47    
     552    462   A   23   THR   HG2%   A   25   LEU   H      1.0   .   4.43    
     553    463   A   23   THR   HG2%   A   26   ASP   HBx    1.0   .   6.27    
     554    464   A   26   ASP   H      A   23   THR   HB     1.0   .   4.08    
     555    465   A   23   THR   HA     A   26   ASP   H      1.0   .   4.57    
     556    466   A   23   THR   HG2%   A   26   ASP   H      1.0   .   4.82    
     557    467   A   23   THR   H      A   26   ASP   HBx    1.0   .   3.18    
     558    468   A   23   THR   H      A   26   ASP   HBy    1.0   .   3.49    
     559    469   A   23   THR   H      A   26   ASP   HA     1.0   .   4.93    
     560    470   A   27   VAL   H      A   23   THR   HB     1.0   .   5.71    
     561    471   A   23   THR   HA     A   27   VAL   H      1.0   .   5.31    
     562    472   A   23   THR   HG2%   A   27   VAL   H      1.0   .   6.27    
     563    473   A   27   VAL   HGy%   A   23   THR   H      1.0   .   4.73    
     564    474   A   24   GLN   H      A   24   GLN   HG2    1.0   .   4.69    
     565    474   A   24   GLN   H      A   24   GLN   HG3    1.0   .   4.69    
     566    475   A   24   GLN   H      A   25   LEU   HB2    1.0   .   4.92    
     567    475   A   24   GLN   H      A   25   LEU   HB3    1.0   .   4.92    
     568    476   A   24   GLN   H      A   25   LEU   HDy%   1.0   .   6.17    
     569    477   A   25   LEU   H      A   24   GLN   HG2    1.0   .   4.04    
     570    477   A   25   LEU   H      A   24   GLN   HG3    1.0   .   4.04    
     571    478   A   25   LEU   H      A   24   GLN   HBy    1.0   .   4.22    
     572    479   A   25   LEU   H      A   24   GLN   HBx    1.0   .   4.22    
     573    480   A   25   LEU   H      A   24   GLN   HBy    1.0   .   3.67    
     574    480   A   25   LEU   H      A   24   GLN   HBx    1.0   .   3.67    
     575    481   A   26   ASP   HA     A   24   GLN   HA     1.0   .   7.00    
     576    482   A   26   ASP   HBx    A   24   GLN   H      1.0   .   5.69    
     577    483   A   26   ASP   H      A   24   GLN   HA     1.0   .   4.44    
     578    484   A   26   ASP   H      A   24   GLN   HG2    1.0   .   5.31    
     579    484   A   26   ASP   H      A   24   GLN   HG3    1.0   .   5.31    
     580    485   A   26   ASP   H      A   24   GLN   HBx    1.0   .   6.09    
     581    486   A   26   ASP   H      A   24   GLN   HBy    1.0   .   6.09    
     582    487   A   27   VAL   HB     A   24   GLN   HA     1.0   .   3.92    
     583    488   A   27   VAL   HGx%   A   24   GLN   HA     1.0   .   5.24    
     584    489   A   27   VAL   HGy%   A   24   GLN   HA     1.0   .   4.56    
     585    490   A   27   VAL   H      A   24   GLN   HA     1.0   .   3.81    
     586    491   A   27   VAL   H      A   24   GLN   HG2    1.0   .   5.63    
     587    491   A   27   VAL   H      A   24   GLN   HG3    1.0   .   5.63    
     588    492   A   27   VAL   H      A   24   GLN   HBy    1.0   .   6.38    
     589    493   A   27   VAL   H      A   24   GLN   HBx    1.0   .   6.38    
     590    494   A   27   VAL   H      A   24   GLN   HBy    1.0   .   5.58    
     591    494   A   27   VAL   H      A   24   GLN   HBx    1.0   .   5.58    
     592    495   A   24   GLN   HA     A   28   ASP   HA     1.0   .   7.00    
     593    496   A   25   LEU   HA     A   25   LEU   HDx%   1.0   .   4.29    
     594    497   A   25   LEU   HDy%   A   25   LEU   HA     1.0   .   4.87    
     595    498   A   25   LEU   H      A   25   LEU   HB2    1.0   .   2.66    
     596    498   A   25   LEU   H      A   25   LEU   HB3    1.0   .   2.66    
     597    499   A   25   LEU   H      A   25   LEU   HG     1.0   .   3.43    
     598    500   A   25   LEU   H      A   25   LEU   HDy%   1.0   .   3.99    
     599    501   A   26   ASP   H      A   25   LEU   HB2    1.0   .   3.50    
     600    501   A   26   ASP   H      A   25   LEU   HB3    1.0   .   3.50    
     601    502   A   26   ASP   H      A   25   LEU   HG     1.0   .   4.41    
     602    503   A   25   LEU   H      A   26   ASP   HA     1.0   .   5.23    
     603    504   A   26   ASP   HBx    A   25   LEU   H      1.0   .   4.97    
     604    505   A   26   ASP   H      A   25   LEU   HDx%   1.0   .   4.50    
     605    506   A   26   ASP   H      A   25   LEU   H      1.0   .   4.43    
     606    507   A   27   VAL   H      A   25   LEU   HA     1.0   .   4.65    
     607    508   A   27   VAL   H      A   25   LEU   HG     1.0   .   5.61    
     608    509   A   27   VAL   HB     A   25   LEU   H      1.0   .   5.44    
     609    510   A   27   VAL   HGy%   A   25   LEU   H      1.0   .   5.29    
     610    511   A   25   LEU   HA     A   28   ASP   HBx    1.0   .   4.08    
     611    512   A   25   LEU   HA     A   28   ASP   HBy    1.0   .   4.51    
     612    513   A   25   LEU   HA     A   28   ASP   H      1.0   .   4.04    
     613    514   A   25   LEU   HDx%   A   28   ASP   H      1.0   .   5.96    
     614    515   A   25   LEU   H      A   28   ASP   HBx    1.0   .   5.72    
     615    516   A   25   LEU   HA     A   29   SER   H      1.0   .   4.54    
     616    517   A   29   SER   H      A   25   LEU   HB2    1.0   .   5.24    
     617    517   A   25   LEU   HB3    A   29   SER   H      1.0   .   5.24    
     618    518   A   25   LEU   HG     A   29   SER   H      1.0   .   6.31    
     619    519   A   25   LEU   HDx%   A   29   SER   H      1.0   .   4.85    
     620    520   A   26   ASP   HBx    A   26   ASP   H      1.0   .   3.12    
     621    521   A   26   ASP   HBy    A   26   ASP   H      1.0   .   3.59    
     622    522   A   27   VAL   HGy%   A   26   ASP   HBy    1.0   .   5.81    
     623    523   A   27   VAL   HGy%   A   26   ASP   HBx    1.0   .   5.42    
     624    524   A   26   ASP   HBx    A   27   VAL   H      1.0   .   3.42    
     625    525   A   26   ASP   HBy    A   27   VAL   H      1.0   .   3.68    
     626    526   A   27   VAL   HA     A   26   ASP   H      1.0   .   5.47    
     627    527   A   27   VAL   HB     A   26   ASP   H      1.0   .   4.89    
     628    528   A   27   VAL   HGx%   A   26   ASP   H      1.0   .   5.93    
     629    529   A   27   VAL   HGy%   A   26   ASP   H      1.0   .   4.21    
     630    530   A   26   ASP   H      A   27   VAL   H      1.0   .   4.35    
     631    531   A   26   ASP   HBx    A   28   ASP   H      1.0   .   6.18    
     632    532   A   26   ASP   HBy    A   28   ASP   H      1.0   .   5.76    
     633    533   A   26   ASP   HA     A   29   SER   HBx    1.0   .   4.15    
     634    533   A   26   ASP   HA     A   29   SER   HBy    1.0   .   4.15    
     635    534   A   26   ASP   HA     A   29   SER   HBy    1.0   .   4.87    
     636    535   A   26   ASP   HA     A   29   SER   H      1.0   .   3.88    
     637    536   A   26   ASP   HBy    A   29   SER   H      1.0   .   5.36    
     638    537   A   26   ASP   HBx    A   29   SER   H      1.0   .   5.84    
     639    538   A   26   ASP   H      A   29   SER   HBx    1.0   .   4.95    
     640    538   A   26   ASP   H      A   29   SER   HBy    1.0   .   4.95    
     641    539   A   30   HIS   H      A   26   ASP   HBy    1.0   .   5.23    
     642    540   A   30   HIS   H      A   26   ASP   HBx    1.0   .   6.34    
     643    541   A   30   HIS   H      A   26   ASP   HA     1.0   .   4.85    
     644    542   A   27   VAL   HGy%   A   27   VAL   HA     1.0   .   3.73    
     645    543   A   27   VAL   HGx%   A   27   VAL   HA     1.0   .   3.99    
     646    544   A   27   VAL   HB     A   27   VAL   H      1.0   .   2.90    
     647    545   A   27   VAL   HGx%   A   27   VAL   H      1.0   .   3.83    
     648    546   A   27   VAL   HGy%   A   27   VAL   H      1.0   .   2.89    
     649    547   A   27   VAL   HGx%   A   28   ASP   HA     1.0   .   4.99    
     650    548   A   27   VAL   HB     A   28   ASP   H      1.0   .   3.13    
     651    549   A   27   VAL   HGx%   A   28   ASP   H      1.0   .   3.71    
     652    550   A   27   VAL   HGy%   A   28   ASP   H      1.0   .   3.89    
     653    551   A   27   VAL   H      A   28   ASP   HBx    1.0   .   5.08    
     654    552   A   27   VAL   H      A   28   ASP   HBy    1.0   .   6.19    
     655    553   A   27   VAL   H      A   28   ASP   H      1.0   .   4.56    
     656    554   A   27   VAL   HB     A   29   SER   H      1.0   .   5.05    
     657    555   A   27   VAL   HGx%   A   29   SER   H      1.0   .   4.92    
     658    556   A   27   VAL   HGy%   A   29   SER   H      1.0   .   5.48    
     659    557   A   27   VAL   HA     A   29   SER   H      1.0   .   4.60    
     660    558   A   27   VAL   H      A   29   SER   HBx    1.0   .   5.31    
     661    558   A   27   VAL   H      A   29   SER   HBy    1.0   .   5.31    
     662    559   A   27   VAL   HA     A   30   HIS   HBx    1.0   .   5.17    
     663    560   A   27   VAL   HGx%   A   30   HIS   HBx    1.0   .   6.94    
     664    561   A   27   VAL   HA     A   30   HIS   HBy    1.0   .   4.60    
     665    562   A   27   VAL   HGx%   A   30   HIS   HBy    1.0   .   6.21    
     666    563   A   27   VAL   HGy%   A   30   HIS   HBy    1.0   .   6.30    
     667    564   A   27   VAL   HA     A   30   HIS   H      1.0   .   3.95    
     668    565   A   27   VAL   HGx%   A   30   HIS   H      1.0   .   4.76    
     669    566   A   27   VAL   HGy%   A   30   HIS   H      1.0   .   5.61    
     670    567   A   27   VAL   HB     A   30   HIS   H      1.0   .   6.08    
     671    568   A   30   HIS   HBy    A   27   VAL   H      1.0   .   6.27    
     672    569   A   30   HIS   HBx    A   27   VAL   H      1.0   .   6.78    
     673    570   A   27   VAL   HGx%   A   31   LEU   HG     1.0   .   4.59    
     674    571   A   27   VAL   HGx%   A   31   LEU   HDy%   1.0   .   4.92    
     675    572   A   27   VAL   HGx%   A   31   LEU   HDx%   1.0   .   3.91    
     676    573   A   31   LEU   HDx%   A   27   VAL   HA     1.0   .   6.57    
     677    574   A   27   VAL   HGx%   A   31   LEU   HBx    1.0   .   6.23    
     678    575   A   31   LEU   H      A   27   VAL   HA     1.0   .   4.54    
     679    576   A   27   VAL   HGx%   A   31   LEU   H      1.0   .   4.00    
     680    577   A   27   VAL   HGy%   A   31   LEU   H      1.0   .   5.85    
     681    578   A   31   LEU   HG     A   27   VAL   H      1.0   .   6.96    
     682    579   A   27   VAL   HGx%   A   32   ALA   H      1.0   .   6.24    
     683    580   A   28   ASP   HBx    A   28   ASP   H      1.0   .   3.20    
     684    581   A   28   ASP   HBy    A   28   ASP   H      1.0   .   3.48    
     685    582   A   28   ASP   HBx    A   29   SER   H      1.0   .   3.58    
     686    583   A   28   ASP   HBy    A   29   SER   H      1.0   .   3.62    
     687    584   A   28   ASP   H      A   29   SER   HBy    1.0   .   5.60    
     688    585   A   28   ASP   H      A   29   SER   HA     1.0   .   5.33    
     689    586   A   28   ASP   H      A   29   SER   H      1.0   .   4.44    
     690    587   A   30   HIS   H      A   28   ASP   HBx    1.0   .   6.20    
     691    588   A   30   HIS   H      A   28   ASP   HBy    1.0   .   5.76    
     692    589   A   30   HIS   H      A   28   ASP   HA     1.0   .   5.23    
     693    590   A   28   ASP   HA     A   31   LEU   HBx    1.0   .   4.30    
     694    591   A   31   LEU   HBy    A   28   ASP   HA     1.0   .   4.87    
     695    592   A   31   LEU   HG     A   28   ASP   HA     1.0   .   5.38    
     696    593   A   31   LEU   HDx%   A   28   ASP   HA     1.0   .   4.23    
     697    594   A   31   LEU   H      A   28   ASP   HA     1.0   .   3.70    
     698    595   A   31   LEU   H      A   28   ASP   HBy    1.0   .   5.55    
     699    596   A   28   ASP   H      A   31   LEU   HBx    1.0   .   5.40    
     700    597   A   31   LEU   HDx%   A   28   ASP   H      1.0   .   4.92    
     701    598   A   31   LEU   H      A   28   ASP   HBx    1.0   .   5.97    
     702    599   A   28   ASP   HA     A   32   ALA   H      1.0   .   4.44    
     703    600   A   28   ASP   HBy    A   32   ALA   H      1.0   .   5.74    
     704    601   A   28   ASP   HBx    A   32   ALA   H      1.0   .   6.43    
     705    602   A   29   SER   H      A   29   SER   HBy    1.0   .   3.13    
     706    603   A   29   SER   H      A   29   SER   HBx    1.0   .   3.06    
     707    604   A   30   HIS   H      A   29   SER   HBy    1.0   .   3.34    
     708    605   A   30   HIS   H      A   29   SER   HBx    1.0   .   3.46    
     709    606   A   30   HIS   HBy    A   29   SER   H      1.0   .   5.08    
     710    607   A   30   HIS   HBx    A   29   SER   H      1.0   .   5.55    
     711    608   A   29   SER   H      A   30   HIS   HA     1.0   .   5.49    
     712    609   A   30   HIS   H      A   29   SER   H      1.0   .   4.37    
     713    610   A   31   LEU   H      A   29   SER   HBx    1.0   .   4.77    
     714    610   A   31   LEU   H      A   29   SER   HBy    1.0   .   4.77    
     715    611   A   31   LEU   H      A   29   SER   HA     1.0   .   4.75    
     716    612   A   29   SER   H      A   31   LEU   HBx    1.0   .   5.76    
     717    613   A   31   LEU   HG     A   29   SER   H      1.0   .   5.71    
     718    614   A   31   LEU   HDx%   A   29   SER   H      1.0   .   5.53    
     719    615   A   29   SER   HA     A   32   ALA   HB%    1.0   .   4.15    
     720    616   A   29   SER   HBy    A   32   ALA   HB%    1.0   .   6.16    
     721    617   A   32   ALA   H      A   29   SER   HA     1.0   .   4.03    
     722    618   A   29   SER   HBy    A   32   ALA   H      1.0   .   5.73    
     723    619   A   29   SER   H      A   32   ALA   HB%    1.0   .   5.20    
     724    620   A   29   SER   HBy    A   33   GLN   H      1.0   .   6.06    
     725    621   A   30   HIS   HE1    A   30   HIS   HA     1.0   .   5.59    
     726    622   A   30   HIS   HBy    A   30   HIS   H      1.0   .   3.18    
     727    623   A   30   HIS   HBx    A   30   HIS   H      1.0   .   3.15    
     728    624   A   30   HIS   HD2    A   30   HIS   H      1.0   .   5.20    
     729    625   A   31   LEU   HA     A   30   HIS   HBy    1.0   .   6.77    
     730    626   A   31   LEU   HDy%   A   30   HIS   HBy    1.0   .   6.47    
     731    627   A   31   LEU   HDx%   A   30   HIS   HBy    1.0   .   7.00    
     732    628   A   30   HIS   HD2    A   31   LEU   HA     1.0   .   3.73    
     733    629   A   30   HIS   HD2    A   31   LEU   HG     1.0   .   4.86    
     734    630   A   30   HIS   HD2    A   31   LEU   HDy%   1.0   .   3.81    
     735    631   A   30   HIS   HD2    A   31   LEU   HDx%   1.0   .   5.72    
     736    632   A   31   LEU   H      A   30   HIS   HBy    1.0   .   3.23    
     737    633   A   31   LEU   H      A   30   HIS   HBx    1.0   .   3.99    
     738    634   A   31   LEU   HA     A   30   HIS   H      1.0   .   5.47    
     739    635   A   30   HIS   H      A   31   LEU   HBx    1.0   .   4.76    
     740    636   A   31   LEU   HBy    A   30   HIS   H      1.0   .   6.34    
     741    637   A   30   HIS   H      A   31   LEU   HG     1.0   .   4.69    
     742    638   A   31   LEU   HDy%   A   30   HIS   H      1.0   .   5.83    
     743    639   A   31   LEU   HDx%   A   30   HIS   H      1.0   .   6.57    
     744    640   A   31   LEU   H      A   30   HIS   H      1.0   .   4.20    
     745    641   A   30   HIS   HBx    A   32   ALA   H      1.0   .   5.66    
     746    642   A   30   HIS   HBy    A   32   ALA   H      1.0   .   5.05    
     747    643   A   30   HIS   H      A   32   ALA   HB%    1.0   .   5.18    
     748    644   A   32   ALA   H      A   30   HIS   HA     1.0   .   4.69    
     749    645   A   30   HIS   HA     A   33   GLN   HB2    1.0   .   4.41    
     750    645   A   30   HIS   HA     A   33   GLN   HB3    1.0   .   4.41    
     751    646   A   30   HIS   HA     A   33   GLN   HGy    1.0   .   5.74    
     752    646   A   30   HIS   HA     A   33   GLN   HGx    1.0   .   5.74    
     753    647   A   30   HIS   HA     A   33   GLN   H      1.0   .   3.96    
     754    648   A   30   HIS   H      A   33   GLN   HB2    1.0   .   5.81    
     755    648   A   30   HIS   H      A   33   GLN   HB3    1.0   .   5.81    
     756    649   A   30   HIS   HBy    A   33   GLN   H      1.0   .   5.65    
     757    650   A   30   HIS   HBx    A   33   GLN   H      1.0   .   5.89    
     758    651   A   30   HIS   HA     A   33   GLN   HGy    1.0   .   5.74    
     759    651   A   30   HIS   HA     A   33   GLN   HGx    1.0   .   5.74    
     760    652   A   34   CYS   HBx    A   30   HIS   HE1    1.0   .   5.10    
     761    653   A   30   HIS   HD2    A   34   CYS   HBy    1.0   .   4.87    
     762    654   A   30   HIS   HD2    A   34   CYS   HBx    1.0   .   4.27    
     763    655   A   30   HIS   HE1    A   34   CYS   HA     1.0   .   6.18    
     764    656   A   34   CYS   H      A   30   HIS   HA     1.0   .   4.59    
     765    657   A   31   LEU   HA     A   31   LEU   HDx%   1.0   .   5.38    
     766    658   A   31   LEU   HA     A   31   LEU   HDy%   1.0   .   3.84    
     767    659   A   31   LEU   H      A   31   LEU   HBx    1.0   .   3.06    
     768    660   A   31   LEU   H      A   31   LEU   HBy    1.0   .   3.66    
     769    661   A   31   LEU   H      A   31   LEU   HG     1.0   .   2.94    
     770    662   A   31   LEU   HDy%   A   31   LEU   H      1.0   .   3.67    
     771    663   A   31   LEU   H      A   31   LEU   HDx%   1.0   .   3.85    
     772    664   A   31   LEU   HBx    A   32   ALA   HA     1.0   .   6.36    
     773    665   A   31   LEU   HBx    A   32   ALA   H      1.0   .   3.37    
     774    666   A   31   LEU   HBy    A   32   ALA   H      1.0   .   3.91    
     775    667   A   31   LEU   HDy%   A   32   ALA   H      1.0   .   4.99    
     776    668   A   31   LEU   HDx%   A   32   ALA   H      1.0   .   4.99    
     777    669   A   31   LEU   HG     A   32   ALA   H      1.0   .   4.88    
     778    670   A   31   LEU   H      A   32   ALA   HB%    1.0   .   4.62    
     779    671   A   31   LEU   H      A   32   ALA   HA     1.0   .   5.42    
     780    672   A   31   LEU   H      A   32   ALA   H      1.0   .   4.34    
     781    673   A   31   LEU   HBx    A   33   GLN   H      1.0   .   5.40    
     782    674   A   31   LEU   HBy    A   33   GLN   H      1.0   .   6.47    
     783    675   A   31   LEU   HA     A   33   GLN   H      1.0   .   5.07    
     784    676   A   31   LEU   H      A   33   GLN   HB2    1.0   .   6.03    
     785    676   A   31   LEU   H      A   33   GLN   HB3    1.0   .   6.03    
     786    677   A   31   LEU   HA     A   34   CYS   HBx    1.0   .   4.52    
     787    678   A   31   LEU   HDy%   A   34   CYS   HBx    1.0   .   5.95    
     788    679   A   31   LEU   HA     A   34   CYS   HBy    1.0   .   4.56    
     789    680   A   31   LEU   HDy%   A   34   CYS   HBy    1.0   .   5.69    
     790    681   A   31   LEU   H      A   34   CYS   HBy    1.0   .   5.99    
     791    682   A   31   LEU   H      A   34   CYS   HBx    1.0   .   5.20    
     792    683   A   31   LEU   HA     A   34   CYS   H      1.0   .   3.74    
     793    684   A   31   LEU   HDy%   A   34   CYS   H      1.0   .   5.37    
     794    685   A   31   LEU   HA     A   35   LEU   H      1.0   .   4.18    
     795    686   A   31   LEU   HDy%   A   35   LEU   H      1.0   .   5.16    
     796    687   A   31   LEU   H      A   35   LEU   HDy%   1.0   .   5.77    
     797    687   A   31   LEU   H      A   35   LEU   HDx%   1.0   .   5.77    
     798    688   A   31   LEU   HA     A   36   ALA   H      1.0   .   6.84    
     799    689   A   32   ALA   H      A   32   ALA   HB%    1.0   .   2.66    
     800    690   A   32   ALA   HB%    A   33   GLN   HB2    1.0   .   5.93    
     801    690   A   32   ALA   HB%    A   33   GLN   HB3    1.0   .   5.93    
     802    691   A   32   ALA   HB%    A   33   GLN   H      1.0   .   3.29    
     803    692   A   32   ALA   H      A   33   GLN   HA     1.0   .   5.14    
     804    693   A   32   ALA   H      A   33   GLN   HB2    1.0   .   4.55    
     805    693   A   32   ALA   H      A   33   GLN   HB3    1.0   .   4.55    
     806    694   A   32   ALA   H      A   33   GLN   H      1.0   .   4.28    
     807    695   A   32   ALA   H      A   33   GLN   HGy    1.0   .   4.73    
     808    695   A   32   ALA   H      A   33   GLN   HGx    1.0   .   4.73    
     809    696   A   32   ALA   HB%    A   33   GLN   HGy    1.0   .   5.92    
     810    696   A   32   ALA   HB%    A   33   GLN   HGx    1.0   .   5.92    
     811    697   A   34   CYS   HBx    A   32   ALA   H      1.0   .   5.22    
     812    698   A   34   CYS   HBy    A   32   ALA   H      1.0   .   5.61    
     813    699   A   34   CYS   H      A   32   ALA   HA     1.0   .   4.72    
     814    700   A   34   CYS   H      A   32   ALA   HB%    1.0   .   5.06    
     815    701   A   32   ALA   HA     A   35   LEU   HB2    1.0   .   4.57    
     816    701   A   35   LEU   HB3    A   32   ALA   HA     1.0   .   4.57    
     817    702   A   35   LEU   H      A   32   ALA   HA     1.0   .   3.86    
     818    703   A   32   ALA   H      A   35   LEU   HG     1.0   .   5.52    
     819    704   A   32   ALA   H      A   35   LEU   HDy%   1.0   .   5.00    
     820    704   A   35   LEU   HDx%   A   32   ALA   H      1.0   .   5.00    
     821    705   A   32   ALA   HA     A   35   LEU   HDy%   1.0   .   5.08    
     822    705   A   35   LEU   HDx%   A   32   ALA   HA     1.0   .   5.08    
     823    706   A   36   ALA   H      A   32   ALA   HA     1.0   .   5.00    
     824    707   A   33   GLN   H      A   33   GLN   HB2    1.0   .   2.82    
     825    707   A   33   GLN   H      A   33   GLN   HB3    1.0   .   2.82    
     826    708   A   33   GLN   H      A   33   GLN   HGy    1.0   .   3.92    
     827    709   A   33   GLN   H      A   33   GLN   HGx    1.0   .   3.92    
     828    710   A   33   GLN   H      A   33   GLN   HGy    1.0   .   3.38    
     829    710   A   33   GLN   H      A   33   GLN   HGx    1.0   .   3.38    
     830    711   A   34   CYS   HBy    A   33   GLN   H      1.0   .   5.45    
     831    712   A   34   CYS   HBx    A   33   GLN   H      1.0   .   4.68    
     832    713   A   33   GLN   H      A   34   CYS   HA     1.0   .   5.27    
     833    714   A   34   CYS   H      A   33   GLN   HGx    1.0   .   5.09    
     834    715   A   34   CYS   H      A   33   GLN   HGy    1.0   .   5.09    
     835    716   A   34   CYS   H      A   33   GLN   HB2    1.0   .   3.19    
     836    716   A   34   CYS   H      A   33   GLN   HB3    1.0   .   3.19    
     837    717   A   34   CYS   H      A   33   GLN   H      1.0   .   4.03    
     838    718   A   34   CYS   H      A   33   GLN   HGy    1.0   .   4.47    
     839    718   A   34   CYS   H      A   33   GLN   HGx    1.0   .   4.47    
     840    719   A   35   LEU   H      A   33   GLN   HGy    1.0   .   7.00    
     841    719   A   35   LEU   H      A   33   GLN   HGx    1.0   .   7.00    
     842    720   A   35   LEU   H      A   33   GLN   HB2    1.0   .   5.46    
     843    720   A   35   LEU   H      A   33   GLN   HB3    1.0   .   5.46    
     844    721   A   33   GLN   H      A   35   LEU   HB2    1.0   .   6.84    
     845    721   A   35   LEU   HB3    A   33   GLN   H      1.0   .   6.84    
     846    722   A   36   ALA   HB%    A   33   GLN   HB2    1.0   .   6.20    
     847    722   A   33   GLN   HB3    A   36   ALA   HB%    1.0   .   6.20    
     848    723   A   36   ALA   HB%    A   33   GLN   HGy    1.0   .   6.69    
     849    723   A   33   GLN   HGx    A   36   ALA   HB%    1.0   .   6.69    
     850    724   A   33   GLN   HA     A   36   ALA   HA     1.0   .   6.41    
     851    725   A   33   GLN   HA     A   36   ALA   HB%    1.0   .   4.03    
     852    726   A   36   ALA   H      A   33   GLN   HA     1.0   .   3.68    
     853    727   A   36   ALA   H      A   33   GLN   HB2    1.0   .   5.18    
     854    727   A   36   ALA   H      A   33   GLN   HB3    1.0   .   5.18    
     855    728   A   36   ALA   H      A   33   GLN   HGy    1.0   .   5.40    
     856    728   A   36   ALA   H      A   33   GLN   HGx    1.0   .   5.40    
     857    729   A   34   CYS   HBy    A   34   CYS   H      1.0   .   3.22    
     858    730   A   34   CYS   HBx    A   34   CYS   H      1.0   .   2.88    
     859    731   A   34   CYS   HBy    A   35   LEU   H      1.0   .   3.41    
     860    732   A   34   CYS   HBx    A   35   LEU   H      1.0   .   3.70    
     861    733   A   34   CYS   H      A   35   LEU   HB2    1.0   .   4.78    
     862    733   A   34   CYS   H      A   35   LEU   HB3    1.0   .   4.78    
     863    734   A   34   CYS   H      A   35   LEU   HG     1.0   .   5.45    
     864    735   A   34   CYS   H      A   35   LEU   HDy%   1.0   .   5.29    
     865    735   A   34   CYS   H      A   35   LEU   HDx%   1.0   .   5.29    
     866    736   A   36   ALA   H      A   34   CYS   HA     1.0   .   4.50    
     867    737   A   34   CYS   HBy    A   36   ALA   H      1.0   .   5.27    
     868    738   A   34   CYS   HBx    A   36   ALA   H      1.0   .   5.81    
     869    739   A   34   CYS   H      A   36   ALA   HB%    1.0   .   5.45    
     870    740   A   37   GLU   H      A   34   CYS   HA     1.0   .   4.02    
     871    741   A   34   CYS   HBy    A   37   GLU   H      1.0   .   5.80    
     872    742   A   34   CYS   HBx    A   37   GLU   H      1.0   .   5.95    
     873    743   A   34   CYS   HA     A   37   GLU   HBy    1.0   .   4.79    
     874    743   A   34   CYS   HA     A   37   GLU   HBx    1.0   .   4.79    
     875    744   A   35   LEU   HDx%   A   35   LEU   HB2    1.0   .   3.95    
     876    744   A   35   LEU   HB3    A   35   LEU   HDx%   1.0   .   3.95    
     877    745   A   35   LEU   HB3    A   35   LEU   HDy%   1.0   .   3.95    
     878    745   A   35   LEU   HB2    A   35   LEU   HDy%   1.0   .   3.95    
     879    746   A   35   LEU   H      A   35   LEU   HB2    1.0   .   2.70    
     880    746   A   35   LEU   HB3    A   35   LEU   H      1.0   .   2.70    
     881    747   A   35   LEU   H      A   35   LEU   HG     1.0   .   3.30    
     882    748   A   35   LEU   H      A   35   LEU   HDx%   1.0   .   4.38    
     883    749   A   35   LEU   H      A   35   LEU   HDy%   1.0   .   4.38    
     884    750   A   35   LEU   H      A   35   LEU   HDy%   1.0   .   3.84    
     885    750   A   35   LEU   H      A   35   LEU   HDx%   1.0   .   3.84    
     886    751   A   35   LEU   HA     A   35   LEU   HDy%   1.0   .   3.88    
     887    751   A   35   LEU   HA     A   35   LEU   HDx%   1.0   .   3.88    
     888    752   A   36   ALA   HA     A   35   LEU   HB2    1.0   .   5.69    
     889    752   A   35   LEU   HB3    A   36   ALA   HA     1.0   .   5.69    
     890    753   A   35   LEU   HA     A   36   ALA   HA     1.0   .   7.00    
     891    754   A   36   ALA   HB%    A   35   LEU   HB2    1.0   .   7.00    
     892    754   A   35   LEU   HB3    A   36   ALA   HB%    1.0   .   7.00    
     893    755   A   36   ALA   H      A   35   LEU   HB2    1.0   .   3.70    
     894    755   A   35   LEU   HB3    A   36   ALA   H      1.0   .   3.70    
     895    756   A   36   ALA   H      A   35   LEU   HG     1.0   .   4.73    
     896    757   A   35   LEU   HDx%   A   36   ALA   H      1.0   .   5.26    
     897    758   A   36   ALA   H      A   35   LEU   HDy%   1.0   .   5.26    
     898    759   A   35   LEU   H      A   36   ALA   HA     1.0   .   5.47    
     899    760   A   35   LEU   H      A   36   ALA   HB%    1.0   .   4.32    
     900    761   A   35   LEU   H      A   36   ALA   H      1.0   .   4.50    
     901    762   A   36   ALA   H      A   35   LEU   HDy%   1.0   .   4.44    
     902    762   A   35   LEU   HDx%   A   36   ALA   H      1.0   .   4.44    
     903    763   A   37   GLU   H      A   35   LEU   HB2    1.0   .   5.36    
     904    763   A   35   LEU   HB3    A   37   GLU   H      1.0   .   5.36    
     905    764   A   35   LEU   HDx%   A   37   GLU   H      1.0   .   7.00    
     906    765   A   37   GLU   H      A   35   LEU   HDy%   1.0   .   7.00    
     907    766   A   37   GLU   H      A   35   LEU   HDy%   1.0   .   5.88    
     908    766   A   35   LEU   HDx%   A   37   GLU   H      1.0   .   5.88    
     909    767   A   35   LEU   HA     A   38   SER   HB2    1.0   .   5.16    
     910    767   A   35   LEU   HA     A   38   SER   HB3    1.0   .   5.16    
     911    768   A   38   SER   H      A   35   LEU   HB2    1.0   .   5.45    
     912    768   A   35   LEU   HB3    A   38   SER   H      1.0   .   5.45    
     913    769   A   38   SER   H      A   35   LEU   HDy%   1.0   .   5.28    
     914    769   A   35   LEU   HDx%   A   38   SER   H      1.0   .   5.28    
     915    770   A   36   ALA   H      A   36   ALA   HB%    1.0   .   2.67    
     916    771   A   36   ALA   HA     A   37   GLU   HA     1.0   .   7.00    
     917    772   A   37   GLU   H      A   36   ALA   HB%    1.0   .   3.23    
     918    773   A   36   ALA   H      A   37   GLU   H      1.0   .   5.14    
     919    774   A   36   ALA   H      A   37   GLU   HBy    1.0   .   5.09    
     920    774   A   36   ALA   H      A   37   GLU   HBx    1.0   .   5.09    
     921    775   A   36   ALA   H      A   37   GLU   HGx    1.0   .   5.60    
     922    775   A   36   ALA   H      A   37   GLU   HGy    1.0   .   5.60    
     923    776   A   36   ALA   HA     A   38   SER   H      1.0   .   4.54    
     924    777   A   36   ALA   HB%    A   38   SER   H      1.0   .   4.56    
     925    778   A   36   ALA   HA     A   39   THR   H      1.0   .   7.00    
     926    779   A   37   GLU   H      A   37   GLU   HGy    1.0   .   4.04    
     927    780   A   37   GLU   H      A   37   GLU   HGx    1.0   .   4.04    
     928    781   A   37   GLU   H      A   37   GLU   HBy    1.0   .   3.06    
     929    781   A   37   GLU   H      A   37   GLU   HBx    1.0   .   3.06    
     930    782   A   37   GLU   H      A   37   GLU   HBy    1.0   .   3.06    
     931    782   A   37   GLU   H      A   37   GLU   HBx    1.0   .   3.06    
     932    783   A   37   GLU   H      A   37   GLU   HGx    1.0   .   3.44    
     933    783   A   37   GLU   H      A   37   GLU   HGy    1.0   .   3.44    
     934    784   A   37   GLU   H      A   38   SER   HA     1.0   .   5.30    
     935    785   A   38   SER   H      A   37   GLU   HGy    1.0   .   5.12    
     936    786   A   38   SER   H      A   37   GLU   HGx    1.0   .   5.12    
     937    787   A   38   SER   H      A   37   GLU   HBy    1.0   .   4.39    
     938    788   A   37   GLU   HBx    A   38   SER   H      1.0   .   4.39    
     939    789   A   37   GLU   H      A   38   SER   HB2    1.0   .   4.97    
     940    789   A   37   GLU   H      A   38   SER   HB3    1.0   .   4.97    
     941    790   A   38   SER   H      A   37   GLU   HBy    1.0   .   3.77    
     942    790   A   37   GLU   HBx    A   38   SER   H      1.0   .   3.77    
     943    791   A   38   SER   H      A   38   SER   HB2    1.0   .   3.02    
     944    791   A   38   SER   HB3    A   38   SER   H      1.0   .   3.02    
     945    792   A   39   THR   H      A   38   SER   HA     1.0   .   3.39    
     946    793   A   39   THR   H      A   38   SER   HB2    1.0   .   4.15    
     947    793   A   38   SER   HB3    A   39   THR   H      1.0   .   4.15    
     948    794   A   38   SER   H      A   39   THR   HA     1.0   .   5.38    
     949    795   A   38   SER   H      A   39   THR   HB     1.0   .   6.45    
     950    796   A   38   SER   H      A   39   THR   HG2%   1.0   .   6.05    
     951    797   A   38   SER   HA     A   40   GLU   H      1.0   .   5.35    
     952    798   A   40   GLU   H      A   38   SER   HB2    1.0   .   4.99    
     953    798   A   38   SER   HB3    A   40   GLU   H      1.0   .   4.99    
     954    799   A   39   THR   HA     A   39   THR   HG2%   1.0   .   4.00    
     955    800   A   39   THR   H      A   39   THR   HB     1.0   .   4.14    
     956    801   A   39   THR   H      A   39   THR   HG2%   1.0   .   4.11    
     957    802   A   39   THR   HB     A   40   GLU   H      1.0   .   4.49    
     958    803   A   39   THR   HA     A   40   GLU   H      1.0   .   3.53    
     959    804   A   39   THR   HG2%   A   40   GLU   H      1.0   .   4.24    
     960    805   A   39   THR   H      A   40   GLU   H      1.0   .   5.58    
     961    806   A   39   THR   HA     A   41   ASP   H      1.0   .   5.01    
     962    807   A   39   THR   HB     A   41   ASP   H      1.0   .   5.12    
     963    808   A   39   THR   HG2%   A   41   ASP   H      1.0   .   5.41    
     964    809   A   40   GLU   H      A   40   GLU   HG2    1.0   .   3.89    
     965    809   A   40   GLU   H      A   40   GLU   HG3    1.0   .   3.89    
     966    810   A   40   GLU   H      A   40   GLU   HBx    1.0   .   4.10    
     967    811   A   40   GLU   H      A   40   GLU   HBy    1.0   .   4.10    
     968    812   A   40   GLU   H      A   40   GLU   HBy    1.0   .   3.23    
     969    812   A   40   GLU   H      A   40   GLU   HBx    1.0   .   3.23    
     970    813   A   41   ASP   H      A   40   GLU   HA     1.0   .   3.13    
     971    814   A   41   ASP   H      A   40   GLU   HG2    1.0   .   4.72    
     972    814   A   41   ASP   H      A   40   GLU   HG3    1.0   .   4.72    
     973    815   A   41   ASP   H      A   40   GLU   HBy    1.0   .   4.67    
     974    816   A   41   ASP   H      A   40   GLU   HBx    1.0   .   4.67    
     975    817   A   40   GLU   H      A   41   ASP   HA     1.0   .   5.37    
     976    818   A   40   GLU   HA     A   42   VAL   H      1.0   .   4.98    
     977    819   A   42   VAL   H      A   40   GLU   HG2    1.0   .   5.52    
     978    819   A   40   GLU   HG3    A   42   VAL   H      1.0   .   5.52    
     979    820   A   42   VAL   H      A   40   GLU   HBy    1.0   .   5.53    
     980    820   A   40   GLU   HBx    A   42   VAL   H      1.0   .   5.53    
     981    821   A   41   ASP   H      A   41   ASP   HBy    1.0   .   4.01    
     982    822   A   41   ASP   H      A   41   ASP   HBx    1.0   .   4.01    
     983    823   A   41   ASP   H      A   41   ASP   HBx    1.0   .   3.33    
     984    823   A   41   ASP   H      A   41   ASP   HBy    1.0   .   3.33    
     985    824   A   41   ASP   HA     A   42   VAL   H      1.0   .   3.14    
     986    825   A   42   VAL   H      A   41   ASP   HBy    1.0   .   4.78    
     987    826   A   42   VAL   H      A   41   ASP   HBx    1.0   .   4.78    
     988    827   A   41   ASP   H      A   42   VAL   HGx%   1.0   .   5.57    
     989    827   A   41   ASP   H      A   42   VAL   HGy%   1.0   .   5.57    
     990    828   A   41   ASP   HA     A   43   THR   H      1.0   .   5.78    
     991    829   A   43   THR   H      A   41   ASP   HBx    1.0   .   5.83    
     992    829   A   41   ASP   HBy    A   43   THR   H      1.0   .   5.83    
     993    830   A   42   VAL   H      A   42   VAL   HB     1.0   .   3.29    
     994    831   A   42   VAL   H      A   42   VAL   HGy%   1.0   .   4.23    
     995    832   A   42   VAL   H      A   42   VAL   HGx%   1.0   .   4.23    
     996    833   A   42   VAL   H      A   42   VAL   HGx%   1.0   .   3.34    
     997    833   A   42   VAL   H      A   42   VAL   HGy%   1.0   .   3.34    
     998    834   A   43   THR   H      A   42   VAL   HA     1.0   .   2.80    
     999    835   A   43   THR   H      A   42   VAL   HB     1.0   .   4.43    
     1000   836   A   42   VAL   HGy%   A   43   THR   H      1.0   .   4.75    
     1001   837   A   43   THR   H      A   42   VAL   HGx%   1.0   .   4.75    
     1002   838   A   42   VAL   H      A   43   THR   HA     1.0   .   5.50    
     1003   839   A   42   VAL   H      A   43   THR   HG2%   1.0   .   5.49    
     1004   840   A   43   THR   H      A   42   VAL   HGx%   1.0   .   3.95    
     1005   840   A   42   VAL   HGy%   A   43   THR   H      1.0   .   3.95    
     1006   841   A   42   VAL   HA     A   44   TRP   H      1.0   .   5.37    
     1007   842   A   42   VAL   HB     A   44   TRP   H      1.0   .   5.59    
     1008   843   A   44   TRP   H      A   42   VAL   HGx%   1.0   .   4.52    
     1009   843   A   42   VAL   HGy%   A   44   TRP   H      1.0   .   4.52    
     1010   844   A   43   THR   H      A   43   THR   HB     1.0   .   3.82    
     1011   845   A   43   THR   H      A   43   THR   HG2%   1.0   .   4.04    
     1012   846   A   44   TRP   H      A   43   THR   HB     1.0   .   4.20    
     1013   847   A   43   THR   HA     A   44   TRP   H      1.0   .   3.51    
     1014   848   A   43   THR   HG2%   A   44   TRP   H      1.0   .   4.64    
     1015   849   A   44   TRP   HA     A   44   TRP   HE3    1.0   .   5.51    
     1016   850   A   44   TRP   H      A   44   TRP   HD1    1.0   .   4.87    
     1017   851   A   44   TRP   H      A   44   TRP   HE3    1.0   .   5.57    
     1018   852   A   44   TRP   H      A   44   TRP   HBx    1.0   .   3.61    
     1019   852   A   44   TRP   H      A   44   TRP   HBy    1.0   .   3.61    

   stop_

save_

save_DYANA/DIANA_distance_constraints_3
   _nef_distance_restraint_list.sf_category       nef_distance_restraint_list
   _nef_distance_restraint_list.sf_framecode      DYANA/DIANA_distance_constraints_3
   _nef_distance_restraint_list.restraint_origin  hbond
   _nef_distance_restraint_list.potential_type    upper-bound-parabolic

   loop_
      _nef_distance_restraint.index
      _nef_distance_restraint.restraint_id
      _nef_distance_restraint.chain_code_1
      _nef_distance_restraint.sequence_code_1
      _nef_distance_restraint.residue_name_1
      _nef_distance_restraint.atom_name_1
      _nef_distance_restraint.chain_code_2
      _nef_distance_restraint.sequence_code_2
      _nef_distance_restraint.residue_name_2
      _nef_distance_restraint.atom_name_2
      _nef_distance_restraint.weight
      _nef_distance_restraint.lower_limit
      _nef_distance_restraint.upper_limit

     1    1    A   16   LYS   H   A   11   CYS   O   1.0   .   2.5    
     2    2    A   11   CYS   O   A   16   LYS   N   1.0   .   3.5    
     3    3    A   11   CYS   H   A   16   LYS   O   1.0   .   2.5    
     4    4    A   16   LYS   O   A   11   CYS   N   1.0   .   3.5    
     5    5    A   22   LEU   H   A   19   ALA   O   1.0   .   2.5    
     6    6    A   19   ALA   O   A   22   LEU   N   1.0   .   3.5    
     7    7    A   27   VAL   H   A   23   THR   O   1.0   .   2.5    
     8    8    A   23   THR   O   A   27   VAL   N   1.0   .   3.5    
     9    9    A   28   ASP   H   A   24   GLN   O   1.0   .   2.5    
     10   10   A   24   GLN   O   A   28   ASP   N   1.0   .   3.5    
     11   11   A   29   SER   H   A   25   LEU   O   1.0   .   2.5    
     12   12   A   25   LEU   O   A   29   SER   N   1.0   .   3.5    
     13   13   A   30   HIS   H   A   26   ASP   O   1.0   .   2.5    
     14   14   A   26   ASP   O   A   30   HIS   N   1.0   .   3.5    
     15   15   A   31   LEU   H   A   27   VAL   O   1.0   .   2.5    
     16   16   A   27   VAL   O   A   31   LEU   N   1.0   .   3.5    
     17   17   A   32   ALA   H   A   28   ASP   O   1.0   .   2.5    
     18   18   A   28   ASP   O   A   32   ALA   N   1.0   .   3.5    
     19   19   A   33   GLN   H   A   29   SER   O   1.0   .   2.5    
     20   20   A   29   SER   O   A   33   GLN   N   1.0   .   3.5    
     21   21   A   34   CYS   H   A   30   HIS   O   1.0   .   2.5    
     22   22   A   30   HIS   O   A   34   CYS   N   1.0   .   3.5    
     23   23   A   35   LEU   H   A   31   LEU   O   1.0   .   2.5    
     24   24   A   31   LEU   O   A   35   LEU   N   1.0   .   3.5    
     25   25   A   36   ALA   H   A   32   ALA   O   1.0   .   2.5    
     26   26   A   32   ALA   O   A   36   ALA   N   1.0   .   3.5    
     27   27   A   37   GLU   H   A   33   GLN   O   1.0   .   2.5    
     28   28   A   33   GLN   O   A   37   GLU   N   1.0   .   3.5    

   stop_

save_

save_DYANA/DIANA_dihedral_4
   _nef_dihedral_restraint_list.sf_category       nef_dihedral_restraint_list
   _nef_dihedral_restraint_list.sf_framecode      DYANA/DIANA_dihedral_4
   _nef_dihedral_restraint_list.potential_type    square-well-parabolic
   _nef_dihedral_restraint_list.restraint_origin  .

   loop_
      _nef_dihedral_restraint.index
      _nef_dihedral_restraint.restraint_id
      _nef_dihedral_restraint.chain_code_1
      _nef_dihedral_restraint.sequence_code_1
      _nef_dihedral_restraint.residue_name_1
      _nef_dihedral_restraint.atom_name_1
      _nef_dihedral_restraint.chain_code_2
      _nef_dihedral_restraint.sequence_code_2
      _nef_dihedral_restraint.residue_name_2
      _nef_dihedral_restraint.atom_name_2
      _nef_dihedral_restraint.chain_code_3
      _nef_dihedral_restraint.sequence_code_3
      _nef_dihedral_restraint.residue_name_3
      _nef_dihedral_restraint.atom_name_3
      _nef_dihedral_restraint.chain_code_4
      _nef_dihedral_restraint.sequence_code_4
      _nef_dihedral_restraint.residue_name_4
      _nef_dihedral_restraint.atom_name_4
      _nef_dihedral_restraint.weight
      _nef_dihedral_restraint.lower_limit
      _nef_dihedral_restraint.upper_limit
      _nef_dihedral_restraint.name

     1    1    A   9    ARG   C   A   10   SER   N    A   10   SER   CA   A   10   SER   C   1.0   -152.4   -84.7   PHI    
     2    2    A   10   SER   N   A   10   SER   CA   A   10   SER   C    A   11   CYS   N   1.0   95.2     175.5   PSI    
     3    3    A   10   SER   C   A   11   CYS   N    A   11   CYS   CA   A   11   CYS   C   1.0   -158.6   -55.5   PHI    
     4    4    A   11   CYS   N   A   11   CYS   CA   A   11   CYS   C    A   12   PRO   N   1.0   71.3     175.9   PSI    
     5    5    A   12   PRO   C   A   13   MET   N    A   13   MET   CA   A   13   MET   C   1.0   -121.6   -55.5   PHI    
     6    6    A   13   MET   N   A   13   MET   CA   A   13   MET   C    A   14   CYS   N   1.0   -41.6    -0.5    PSI    
     7    7    A   17   GLU   C   A   18   PHE   N    A   18   PHE   CA   A   18   PHE   C   1.0   -143.1   -41.8   PHI    
     8    8    A   18   PHE   N   A   18   PHE   CA   A   18   PHE   C    A   19   ALA   N   1.0   73.6     176.3   PSI    
     9    9    A   18   PHE   C   A   19   ALA   N    A   19   ALA   CA   A   19   ALA   C   1.0   -132.5   -30.3   PHI    
     10   10   A   19   ALA   N   A   19   ALA   CA   A   19   ALA   C    A   20   PRO   N   1.0   93.2     187.5   PSI    
     11   11   A   20   PRO   C   A   21   ARG   N    A   21   ARG   CA   A   21   ARG   C   1.0   -98.8    -64.7   PHI    
     12   12   A   21   ARG   N   A   21   ARG   CA   A   21   ARG   C    A   22   LEU   N   1.0   -29.1    6.6     PSI    
     13   13   A   21   ARG   C   A   22   LEU   N    A   22   LEU   CA   A   22   LEU   C   1.0   -91.8    -49.2   PHI    
     14   14   A   22   LEU   N   A   22   LEU   CA   A   22   LEU   C    A   23   THR   N   1.0   81.4     201.2   PSI    
     15   15   A   22   LEU   C   A   23   THR   N    A   23   THR   CA   A   23   THR   C   1.0   -139.5   -50.1   PHI    
     16   16   A   23   THR   N   A   23   THR   CA   A   23   THR   C    A   24   GLN   N   1.0   147.4    178.5   PSI    
     17   17   A   23   THR   C   A   24   GLN   N    A   24   GLN   CA   A   24   GLN   C   1.0   -69.3    -48.7   PHI    
     18   18   A   24   GLN   N   A   24   GLN   CA   A   24   GLN   C    A   25   LEU   N   1.0   -49.6    -29.6   PSI    
     19   19   A   24   GLN   C   A   25   LEU   N    A   25   LEU   CA   A   25   LEU   C   1.0   -75.6    -52.7   PHI    
     20   20   A   25   LEU   N   A   25   LEU   CA   A   25   LEU   C    A   26   ASP   N   1.0   -51.8    -25.5   PSI    
     21   21   A   25   LEU   C   A   26   ASP   N    A   26   ASP   CA   A   26   ASP   C   1.0   -75.2    -55.2   PHI    
     22   22   A   26   ASP   N   A   26   ASP   CA   A   26   ASP   C    A   27   VAL   N   1.0   -51.9    -31.2   PSI    
     23   23   A   26   ASP   C   A   27   VAL   N    A   27   VAL   CA   A   27   VAL   C   1.0   -75.3    -55.3   PHI    
     24   24   A   27   VAL   N   A   27   VAL   CA   A   27   VAL   C    A   28   ASP   N   1.0   -53.5    -32.3   PSI    
     25   25   A   27   VAL   C   A   28   ASP   N    A   28   ASP   CA   A   28   ASP   C   1.0   -70.8    -50.8   PHI    
     26   26   A   28   ASP   N   A   28   ASP   CA   A   28   ASP   C    A   29   SER   N   1.0   -54.8    -34.8   PSI    
     27   27   A   28   ASP   C   A   29   SER   N    A   29   SER   CA   A   29   SER   C   1.0   -74.7    -54.7   PHI    
     28   28   A   29   SER   N   A   29   SER   CA   A   29   SER   C    A   30   HIS   N   1.0   -52.3    -32.3   PSI    
     29   29   A   29   SER   C   A   30   HIS   N    A   30   HIS   CA   A   30   HIS   C   1.0   -76.3    -54.2   PHI    
     30   30   A   30   HIS   N   A   30   HIS   CA   A   30   HIS   C    A   31   LEU   N   1.0   -52.5    -32.5   PSI    
     31   31   A   30   HIS   C   A   31   LEU   N    A   31   LEU   CA   A   31   LEU   C   1.0   -69.2    -49.2   PHI    
     32   32   A   31   LEU   N   A   31   LEU   CA   A   31   LEU   C    A   32   ALA   N   1.0   -70.4    -17.5   PSI    
     33   33   A   31   LEU   C   A   32   ALA   N    A   32   ALA   CA   A   32   ALA   C   1.0   -94.5    -37.9   PHI    
     34   34   A   32   ALA   N   A   32   ALA   CA   A   32   ALA   C    A   33   GLN   N   1.0   -59.7    -19.5   PSI    
     35   35   A   32   ALA   C   A   33   GLN   N    A   33   GLN   CA   A   33   GLN   C   1.0   -75.4    -55.4   PHI    
     36   36   A   33   GLN   N   A   33   GLN   CA   A   33   GLN   C    A   34   CYS   N   1.0   -49.3    -29.3   PSI    
     37   37   A   33   GLN   C   A   34   CYS   N    A   34   CYS   CA   A   34   CYS   C   1.0   -74.4    -54.4   PHI    
     38   38   A   34   CYS   N   A   34   CYS   CA   A   34   CYS   C    A   35   LEU   N   1.0   -55.0    -31.1   PSI    
     39   39   A   34   CYS   C   A   35   LEU   N    A   35   LEU   CA   A   35   LEU   C   1.0   -74.1    -54.1   PHI    
     40   40   A   35   LEU   N   A   35   LEU   CA   A   35   LEU   C    A   36   ALA   N   1.0   -48.1    -28.1   PSI    
     41   41   A   35   LEU   C   A   36   ALA   N    A   36   ALA   CA   A   36   ALA   C   1.0   -84.6    -47.0   PHI    
     42   42   A   36   ALA   N   A   36   ALA   CA   A   36   ALA   C    A   37   GLU   N   1.0   -52.9    -32.9   PSI    
     43   43   A   36   ALA   C   A   37   GLU   N    A   37   GLU   CA   A   37   GLU   C   1.0   -133.1   -54.0   PHI    
     44   44   A   37   GLU   N   A   37   GLU   CA   A   37   GLU   C    A   38   SER   N   1.0   -43.0    34.4    PSI    

   stop_

save_