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

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

save_chemical_shift_set_1
   _Assigned_chem_shift_list.Sf_category                  assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                 chemical_shift_set_1
   _Assigned_chem_shift_list.Entry_ID                     5390
   _Assigned_chem_shift_list.ID                           1
   _Assigned_chem_shift_list.Sample_condition_list_ID     1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_cond_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID      1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chemical_shift_reference
   _Assigned_chem_shift_list.Chem_shift_1H_err            .
   _Assigned_chem_shift_list.Chem_shift_13C_err           .
   _Assigned_chem_shift_list.Chem_shift_15N_err           .
   _Assigned_chem_shift_list.Chem_shift_31P_err           .
   _Assigned_chem_shift_list.Chem_shift_2H_err            .
   _Assigned_chem_shift_list.Chem_shift_19F_err           .
   _Assigned_chem_shift_list.Error_derivation_method      .
   _Assigned_chem_shift_list.Details                      .
   _Assigned_chem_shift_list.Text_data_format             .
   _Assigned_chem_shift_list.Text_data                    .

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

     .   .   1   $sample_1   .   5390   1    
     .   .   2   $sample_2   .   5390   1    
     .   .   3   $sample_3   .   5390   1    

   stop_

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

     1     .   1   1   5    5    SER   N      N   15   116.95   0.05    .   1   .   .   .   .   1    .   .   .   5390   1    
     2     .   1   1   5    5    SER   H      H   1    8.329    0.005   .   1   .   .   .   .   1    .   .   .   5390   1    
     3     .   1   1   5    5    SER   CA     C   13   59.465   0.05    .   1   .   .   .   .   1    .   .   .   5390   1    
     4     .   1   1   5    5    SER   HA     H   1    4.4      0.005   .   1   .   .   .   .   1    .   .   .   5390   1    
     5     .   1   1   5    5    SER   CB     C   13   64.412   0.05    .   1   .   .   .   .   1    .   .   .   5390   1    
     6     .   1   1   5    5    SER   HB2    H   1    3.896    0.005   .   1   .   .   .   .   1    .   .   .   5390   1    
     7     .   1   1   6    6    GLU   N      N   15   122.85   0.05    .   1   .   .   .   .   2    .   .   .   5390   1    
     8     .   1   1   6    6    GLU   H      H   1    8.421    0.005   .   1   .   .   .   .   2    .   .   .   5390   1    
     9     .   1   1   6    6    GLU   CA     C   13   58.379   0.05    .   1   .   .   .   .   2    .   .   .   5390   1    
     10    .   1   1   6    6    GLU   HA     H   1    4.183    0.005   .   1   .   .   .   .   2    .   .   .   5390   1    
     11    .   1   1   6    6    GLU   CB     C   13   30.339   0.05    .   1   .   .   .   .   2    .   .   .   5390   1    
     12    .   1   1   6    6    GLU   CG     C   13   37.244   0.05    .   1   .   .   .   .   2    .   .   .   5390   1    
     13    .   1   1   6    6    GLU   HB2    H   1    2.059    0.005   .   1   .   .   .   .   2    .   .   .   5390   1    
     14    .   1   1   6    6    GLU   HG2    H   1    2.323    0.005   .   1   .   .   .   .   2    .   .   .   5390   1    
     15    .   1   1   7    7    ALA   N      N   15   122.1    0.05    .   1   .   .   .   .   3    .   .   .   5390   1    
     16    .   1   1   7    7    ALA   H      H   1    8.12     0.005   .   1   .   .   .   .   3    .   .   .   5390   1    
     17    .   1   1   7    7    ALA   CA     C   13   55.604   0.05    .   1   .   .   .   .   3    .   .   .   5390   1    
     18    .   1   1   7    7    ALA   HA     H   1    4.044    0.005   .   1   .   .   .   .   3    .   .   .   5390   1    
     19    .   1   1   7    7    ALA   CB     C   13   19.11    0.05    .   1   .   .   .   .   3    .   .   .   5390   1    
     20    .   1   1   7    7    ALA   HB1    H   1    1.396    0.005   .   1   .   .   .   .   3    .   .   .   5390   1    
     21    .   1   1   7    7    ALA   HB2    H   1    1.396    0.005   .   1   .   .   .   .   3    .   .   .   5390   1    
     22    .   1   1   7    7    ALA   HB3    H   1    1.396    0.005   .   1   .   .   .   .   3    .   .   .   5390   1    
     23    .   1   1   8    8    LEU   N      N   15   114.99   0.05    .   1   .   .   .   .   4    .   .   .   5390   1    
     24    .   1   1   8    8    LEU   H      H   1    7.858    0.005   .   1   .   .   .   .   4    .   .   .   5390   1    
     25    .   1   1   8    8    LEU   CA     C   13   57.315   0.05    .   1   .   .   .   .   4    .   .   .   5390   1    
     26    .   1   1   8    8    LEU   HA     H   1    4.01     0.005   .   1   .   .   .   .   4    .   .   .   5390   1    
     27    .   1   1   8    8    LEU   CB     C   13   41.946   0.05    .   1   .   .   .   .   4    .   .   .   5390   1    
     28    .   1   1   8    8    LEU   CG     C   13   27.36    0.05    .   1   .   .   .   .   4    .   .   .   5390   1    
     29    .   1   1   8    8    LEU   HG     H   1    1.649    0.005   .   1   .   .   .   .   4    .   .   .   5390   1    
     30    .   1   1   8    8    LEU   CD1    C   13   25.433   0.05    .   2   .   .   .   .   4    .   .   .   5390   1    
     31    .   1   1   8    8    LEU   HD11   H   1    0.785    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     32    .   1   1   8    8    LEU   HD12   H   1    0.785    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     33    .   1   1   8    8    LEU   HD13   H   1    0.785    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     34    .   1   1   8    8    LEU   CD2    C   13   24.301   0.05    .   2   .   .   .   .   4    .   .   .   5390   1    
     35    .   1   1   8    8    LEU   HD21   H   1    0.712    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     36    .   1   1   8    8    LEU   HD22   H   1    0.712    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     37    .   1   1   8    8    LEU   HD23   H   1    0.712    0.005   .   2   .   .   .   .   4    .   .   .   5390   1    
     38    .   1   1   8    8    LEU   HB2    H   1    1.592    0.005   .   1   .   .   .   .   4    .   .   .   5390   1    
     39    .   1   1   9    9    LYS   N      N   15   116.44   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     40    .   1   1   9    9    LYS   H      H   1    7.516    0.005   .   1   .   .   .   .   5    .   .   .   5390   1    
     41    .   1   1   9    9    LYS   CA     C   13   59.145   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     42    .   1   1   9    9    LYS   HA     H   1    3.942    0.005   .   1   .   .   .   .   5    .   .   .   5390   1    
     43    .   1   1   9    9    LYS   CB     C   13   32.664   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     44    .   1   1   9    9    LYS   CG     C   13   25.977   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     45    .   1   1   9    9    LYS   HG2    H   1    1.575    0.005   .   2   .   .   .   .   5    .   .   .   5390   1    
     46    .   1   1   9    9    LYS   HG3    H   1    1.433    0.005   .   2   .   .   .   .   5    .   .   .   5390   1    
     47    .   1   1   9    9    LYS   CD     C   13   30.064   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     48    .   1   1   9    9    LYS   CE     C   13   40.089   0.05    .   1   .   .   .   .   5    .   .   .   5390   1    
     49    .   1   1   9    9    LYS   HB2    H   1    1.913    0.005   .   1   .   .   .   .   5    .   .   .   5390   1    
     50    .   1   1   9    9    LYS   HD2    H   1    1.712    0.005   .   1   .   .   .   .   5    .   .   .   5390   1    
     51    .   1   1   9    9    LYS   HE2    H   1    2.952    0.005   .   1   .   .   .   .   5    .   .   .   5390   1    
     52    .   1   1   10   10   ILE   N      N   15   118.44   0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     53    .   1   1   10   10   ILE   H      H   1    7.641    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     54    .   1   1   10   10   ILE   CA     C   13   64.193   0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     55    .   1   1   10   10   ILE   HA     H   1    3.879    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     56    .   1   1   10   10   ILE   CB     C   13   38.43    0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     57    .   1   1   10   10   ILE   HB     H   1    1.929    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     58    .   1   1   10   10   ILE   CG1    C   13   28.972   0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     59    .   1   1   10   10   ILE   HG12   H   1    1.564    0.005   .   2   .   .   .   .   6    .   .   .   5390   1    
     60    .   1   1   10   10   ILE   HG13   H   1    1.246    0.005   .   2   .   .   .   .   6    .   .   .   5390   1    
     61    .   1   1   10   10   ILE   CG2    C   13   18.036   0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     62    .   1   1   10   10   ILE   HG21   H   1    0.843    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     63    .   1   1   10   10   ILE   HG22   H   1    0.843    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     64    .   1   1   10   10   ILE   HG23   H   1    0.843    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     65    .   1   1   10   10   ILE   CD1    C   13   14.306   0.05    .   1   .   .   .   .   6    .   .   .   5390   1    
     66    .   1   1   10   10   ILE   HD11   H   1    0.816    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     67    .   1   1   10   10   ILE   HD12   H   1    0.816    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     68    .   1   1   10   10   ILE   HD13   H   1    0.816    0.005   .   1   .   .   .   .   6    .   .   .   5390   1    
     69    .   1   1   11   11   LEU   N      N   15   115.9    0.05    .   1   .   .   .   .   7    .   .   .   5390   1    
     70    .   1   1   11   11   LEU   H      H   1    7.524    0.005   .   1   .   .   .   .   7    .   .   .   5390   1    
     71    .   1   1   11   11   LEU   CA     C   13   56.371   0.05    .   1   .   .   .   .   7    .   .   .   5390   1    
     72    .   1   1   11   11   LEU   HA     H   1    4.068    0.005   .   1   .   .   .   .   7    .   .   .   5390   1    
     73    .   1   1   11   11   LEU   CB     C   13   41.925   0.05    .   1   .   .   .   .   7    .   .   .   5390   1    
     74    .   1   1   11   11   LEU   CD1    C   13   26.451   0.05    .   2   .   .   .   .   7    .   .   .   5390   1    
     75    .   1   1   11   11   LEU   HD11   H   1    0.842    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     76    .   1   1   11   11   LEU   HD12   H   1    0.842    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     77    .   1   1   11   11   LEU   HD13   H   1    0.842    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     78    .   1   1   11   11   LEU   CD2    C   13   23.846   0.05    .   2   .   .   .   .   7    .   .   .   5390   1    
     79    .   1   1   11   11   LEU   HD21   H   1    0.743    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     80    .   1   1   11   11   LEU   HD22   H   1    0.743    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     81    .   1   1   11   11   LEU   HD23   H   1    0.743    0.005   .   2   .   .   .   .   7    .   .   .   5390   1    
     82    .   1   1   11   11   LEU   HB2    H   1    1.93     0.005   .   1   .   .   .   .   7    .   .   .   5390   1    
     83    .   1   1   12   12   ASN   N      N   15   112.82   0.05    .   1   .   .   .   .   8    .   .   .   5390   1    
     84    .   1   1   12   12   ASN   H      H   1    7.38     0.005   .   1   .   .   .   .   8    .   .   .   5390   1    
     85    .   1   1   12   12   ASN   CA     C   13   52.292   0.05    .   1   .   .   .   .   8    .   .   .   5390   1    
     86    .   1   1   12   12   ASN   HA     H   1    4.969    0.005   .   1   .   .   .   .   8    .   .   .   5390   1    
     87    .   1   1   12   12   ASN   CB     C   13   39.001   0.05    .   1   .   .   .   .   8    .   .   .   5390   1    
     88    .   1   1   12   12   ASN   HB2    H   1    2.485    0.005   .   2   .   .   .   .   8    .   .   .   5390   1    
     89    .   1   1   12   12   ASN   HB3    H   1    2.962    0.005   .   2   .   .   .   .   8    .   .   .   5390   1    
     90    .   1   1   12   12   ASN   ND2    N   15   109.93   0.05    .   1   .   .   .   .   8    .   .   .   5390   1    
     91    .   1   1   12   12   ASN   HD21   H   1    7.424    0.005   .   2   .   .   .   .   8    .   .   .   5390   1    
     92    .   1   1   12   12   ASN   HD22   H   1    7.141    0.005   .   2   .   .   .   .   8    .   .   .   5390   1    
     93    .   1   1   13   13   ASN   N      N   15   119.5    0.05    .   1   .   .   .   .   9    .   .   .   5390   1    
     94    .   1   1   13   13   ASN   H      H   1    7.737    0.005   .   1   .   .   .   .   9    .   .   .   5390   1    
     95    .   1   1   13   13   ASN   CA     C   13   52.982   0.05    .   1   .   .   .   .   9    .   .   .   5390   1    
     96    .   1   1   13   13   ASN   HA     H   1    4.827    0.005   .   1   .   .   .   .   9    .   .   .   5390   1    
     97    .   1   1   13   13   ASN   CB     C   13   40.555   0.05    .   1   .   .   .   .   9    .   .   .   5390   1    
     98    .   1   1   13   13   ASN   HB2    H   1    2.72     0.005   .   2   .   .   .   .   9    .   .   .   5390   1    
     99    .   1   1   13   13   ASN   HB3    H   1    2.992    0.005   .   2   .   .   .   .   9    .   .   .   5390   1    
     100   .   1   1   13   13   ASN   ND2    N   15   113.61   0.05    .   1   .   .   .   .   9    .   .   .   5390   1    
     101   .   1   1   13   13   ASN   HD21   H   1    7.694    0.005   .   2   .   .   .   .   9    .   .   .   5390   1    
     102   .   1   1   13   13   ASN   HD22   H   1    6.932    0.005   .   2   .   .   .   .   9    .   .   .   5390   1    
     103   .   1   1   14   14   ILE   N      N   15   120.61   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     104   .   1   1   14   14   ILE   H      H   1    8.044    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     105   .   1   1   14   14   ILE   CA     C   13   64.544   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     106   .   1   1   14   14   ILE   HA     H   1    3.994    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     107   .   1   1   14   14   ILE   CB     C   13   39.553   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     108   .   1   1   14   14   ILE   HB     H   1    1.915    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     109   .   1   1   14   14   ILE   CG1    C   13   30.761   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     110   .   1   1   14   14   ILE   HG12   H   1    1.392    0.005   .   2   .   .   .   .   10   .   .   .   5390   1    
     111   .   1   1   14   14   ILE   HG13   H   1    1.437    0.005   .   2   .   .   .   .   10   .   .   .   5390   1    
     112   .   1   1   14   14   ILE   CG2    C   13   18.097   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     113   .   1   1   14   14   ILE   HG21   H   1    0.992    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     114   .   1   1   14   14   ILE   HG22   H   1    0.992    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     115   .   1   1   14   14   ILE   HG23   H   1    0.992    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     116   .   1   1   14   14   ILE   CD1    C   13   14.967   0.05    .   1   .   .   .   .   10   .   .   .   5390   1    
     117   .   1   1   14   14   ILE   HD11   H   1    0.986    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     118   .   1   1   14   14   ILE   HD12   H   1    0.986    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     119   .   1   1   14   14   ILE   HD13   H   1    0.986    0.005   .   1   .   .   .   .   10   .   .   .   5390   1    
     120   .   1   1   15   15   ARG   N      N   15   121.49   0.05    .   1   .   .   .   .   11   .   .   .   5390   1    
     121   .   1   1   15   15   ARG   H      H   1    7.942    0.005   .   1   .   .   .   .   11   .   .   .   5390   1    
     122   .   1   1   15   15   ARG   CA     C   13   60.004   0.05    .   1   .   .   .   .   11   .   .   .   5390   1    
     123   .   1   1   15   15   ARG   HA     H   1    4.131    0.005   .   1   .   .   .   .   11   .   .   .   5390   1    
     124   .   1   1   15   15   ARG   CB     C   13   29.707   0.05    .   1   .   .   .   .   11   .   .   .   5390   1    
     125   .   1   1   15   15   ARG   CG     C   13   28.207   0.05    .   1   .   .   .   .   11   .   .   .   5390   1    
     126   .   1   1   15   15   ARG   CD     C   13   44.034   0.05    .   1   .   .   .   .   11   .   .   .   5390   1    
     127   .   1   1   15   15   ARG   HB2    H   1    1.975    0.005   .   1   .   .   .   .   11   .   .   .   5390   1    
     128   .   1   1   15   15   ARG   HG2    H   1    1.682    0.005   .   1   .   .   .   .   11   .   .   .   5390   1    
     129   .   1   1   15   15   ARG   HD2    H   1    3.268    0.005   .   1   .   .   .   .   11   .   .   .   5390   1    
     130   .   1   1   16   16   THR   N      N   15   117.09   0.05    .   1   .   .   .   .   12   .   .   .   5390   1    
     131   .   1   1   16   16   THR   H      H   1    7.752    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     132   .   1   1   16   16   THR   CA     C   13   66.039   0.05    .   1   .   .   .   .   12   .   .   .   5390   1    
     133   .   1   1   16   16   THR   HA     H   1    4.065    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     134   .   1   1   16   16   THR   CB     C   13   69.069   0.05    .   1   .   .   .   .   12   .   .   .   5390   1    
     135   .   1   1   16   16   THR   HB     H   1    4.243    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     136   .   1   1   16   16   THR   CG2    C   13   23.29    0.05    .   1   .   .   .   .   12   .   .   .   5390   1    
     137   .   1   1   16   16   THR   HG21   H   1    1.267    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     138   .   1   1   16   16   THR   HG22   H   1    1.267    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     139   .   1   1   16   16   THR   HG23   H   1    1.267    0.005   .   1   .   .   .   .   12   .   .   .   5390   1    
     140   .   1   1   17   17   LEU   N      N   15   123.59   0.05    .   1   .   .   .   .   13   .   .   .   5390   1    
     141   .   1   1   17   17   LEU   H      H   1    8.665    0.005   .   1   .   .   .   .   13   .   .   .   5390   1    
     142   .   1   1   17   17   LEU   CA     C   13   58.899   0.05    .   1   .   .   .   .   13   .   .   .   5390   1    
     143   .   1   1   17   17   LEU   HA     H   1    3.944    0.005   .   1   .   .   .   .   13   .   .   .   5390   1    
     144   .   1   1   17   17   LEU   CB     C   13   41.85    0.05    .   1   .   .   .   .   13   .   .   .   5390   1    
     145   .   1   1   17   17   LEU   CG     C   13   27.079   0.05    .   1   .   .   .   .   13   .   .   .   5390   1    
     146   .   1   1   17   17   LEU   HG     H   1    1.699    0.005   .   1   .   .   .   .   13   .   .   .   5390   1    
     147   .   1   1   17   17   LEU   CD1    C   13   24.291   0.05    .   2   .   .   .   .   13   .   .   .   5390   1    
     148   .   1   1   17   17   LEU   HD11   H   1    0.888    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     149   .   1   1   17   17   LEU   HD12   H   1    0.888    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     150   .   1   1   17   17   LEU   HD13   H   1    0.888    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     151   .   1   1   17   17   LEU   CD2    C   13   24.335   0.05    .   2   .   .   .   .   13   .   .   .   5390   1    
     152   .   1   1   17   17   LEU   HD21   H   1    0.893    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     153   .   1   1   17   17   LEU   HD22   H   1    0.893    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     154   .   1   1   17   17   LEU   HD23   H   1    0.893    0.005   .   2   .   .   .   .   13   .   .   .   5390   1    
     155   .   1   1   17   17   LEU   HB2    H   1    2.028    0.005   .   1   .   .   .   .   13   .   .   .   5390   1    
     156   .   1   1   18   18   ARG   N      N   15   117.41   0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     157   .   1   1   18   18   ARG   H      H   1    8.585    0.005   .   1   .   .   .   .   14   .   .   .   5390   1    
     158   .   1   1   18   18   ARG   CA     C   13   60.922   0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     159   .   1   1   18   18   ARG   HA     H   1    3.798    0.005   .   1   .   .   .   .   14   .   .   .   5390   1    
     160   .   1   1   18   18   ARG   CB     C   13   30.696   0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     161   .   1   1   18   18   ARG   HB2    H   1    1.962    0.005   .   2   .   .   .   .   14   .   .   .   5390   1    
     162   .   1   1   18   18   ARG   HB3    H   1    1.841    0.005   .   2   .   .   .   .   14   .   .   .   5390   1    
     163   .   1   1   18   18   ARG   CG     C   13   28.533   0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     164   .   1   1   18   18   ARG   CD     C   13   45.09    0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     165   .   1   1   18   18   ARG   HG2    H   1    1.654    0.005   .   1   .   .   .   .   14   .   .   .   5390   1    
     166   .   1   1   18   18   ARG   HD2    H   1    3.229    0.005   .   1   .   .   .   .   14   .   .   .   5390   1    
     167   .   1   1   18   18   ARG   NE     N   15   109.51   0.05    .   1   .   .   .   .   14   .   .   .   5390   1    
     168   .   1   1   18   18   ARG   HE     H   1    9.103    0.005   .   1   .   .   .   .   14   .   .   .   5390   1    
     169   .   1   1   19   19   ALA   N      N   15   119.73   0.05    .   1   .   .   .   .   15   .   .   .   5390   1    
     170   .   1   1   19   19   ALA   H      H   1    7.488    0.005   .   1   .   .   .   .   15   .   .   .   5390   1    
     171   .   1   1   19   19   ALA   CA     C   13   55.666   0.05    .   1   .   .   .   .   15   .   .   .   5390   1    
     172   .   1   1   19   19   ALA   HA     H   1    4.169    0.005   .   1   .   .   .   .   15   .   .   .   5390   1    
     173   .   1   1   19   19   ALA   CB     C   13   18.803   0.05    .   1   .   .   .   .   15   .   .   .   5390   1    
     174   .   1   1   19   19   ALA   HB1    H   1    1.591    0.005   .   1   .   .   .   .   15   .   .   .   5390   1    
     175   .   1   1   19   19   ALA   HB2    H   1    1.591    0.005   .   1   .   .   .   .   15   .   .   .   5390   1    
     176   .   1   1   19   19   ALA   HB3    H   1    1.591    0.005   .   1   .   .   .   .   15   .   .   .   5390   1    
     177   .   1   1   20   20   GLN   N      N   15   116.95   0.05    .   1   .   .   .   .   16   .   .   .   5390   1    
     178   .   1   1   20   20   GLN   H      H   1    8.384    0.005   .   1   .   .   .   .   16   .   .   .   5390   1    
     179   .   1   1   20   20   GLN   CA     C   13   55.7     0.05    .   1   .   .   .   .   16   .   .   .   5390   1    
     180   .   1   1   20   20   GLN   HA     H   1    4.132    0.005   .   1   .   .   .   .   16   .   .   .   5390   1    
     181   .   1   1   20   20   GLN   CB     C   13   29.4     0.05    .   1   .   .   .   .   16   .   .   .   5390   1    
     182   .   1   1   20   20   GLN   HB2    H   1    1.974    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     183   .   1   1   20   20   GLN   HB3    H   1    2.204    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     184   .   1   1   20   20   GLN   CG     C   13   33.701   0.05    .   1   .   .   .   .   16   .   .   .   5390   1    
     185   .   1   1   20   20   GLN   HG2    H   1    2.424    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     186   .   1   1   20   20   GLN   HG3    H   1    2.497    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     187   .   1   1   20   20   GLN   NE2    N   15   111.32   0.05    .   1   .   .   .   .   16   .   .   .   5390   1    
     188   .   1   1   20   20   GLN   HE21   H   1    7.249    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     189   .   1   1   20   20   GLN   HE22   H   1    6.782    0.005   .   2   .   .   .   .   16   .   .   .   5390   1    
     190   .   1   1   21   21   ALA   N      N   15   122.24   0.05    .   1   .   .   .   .   17   .   .   .   5390   1    
     191   .   1   1   21   21   ALA   H      H   1    8.891    0.005   .   1   .   .   .   .   17   .   .   .   5390   1    
     192   .   1   1   21   21   ALA   CA     C   13   54.828   0.05    .   1   .   .   .   .   17   .   .   .   5390   1    
     193   .   1   1   21   21   ALA   HA     H   1    3.967    0.005   .   1   .   .   .   .   17   .   .   .   5390   1    
     194   .   1   1   21   21   ALA   CB     C   13   19.428   0.05    .   1   .   .   .   .   17   .   .   .   5390   1    
     195   .   1   1   21   21   ALA   HB1    H   1    1.415    0.005   .   1   .   .   .   .   17   .   .   .   5390   1    
     196   .   1   1   21   21   ALA   HB2    H   1    1.415    0.005   .   1   .   .   .   .   17   .   .   .   5390   1    
     197   .   1   1   21   21   ALA   HB3    H   1    1.415    0.005   .   1   .   .   .   .   17   .   .   .   5390   1    
     198   .   1   1   22   22   ARG   N      N   15   117.14   0.05    .   1   .   .   .   .   18   .   .   .   5390   1    
     199   .   1   1   22   22   ARG   H      H   1    7.443    0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     200   .   1   1   22   22   ARG   CA     C   13   56.01    0.05    .   1   .   .   .   .   18   .   .   .   5390   1    
     201   .   1   1   22   22   ARG   HA     H   1    4.062    0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     202   .   1   1   22   22   ARG   CB     C   13   30.9     0.05    .   1   .   .   .   .   18   .   .   .   5390   1    
     203   .   1   1   22   22   ARG   CG     C   13   27.101   0.05    .   1   .   .   .   .   18   .   .   .   5390   1    
     204   .   1   1   22   22   ARG   CD     C   13   45.09    0.05    .   1   .   .   .   .   18   .   .   .   5390   1    
     205   .   1   1   22   22   ARG   HB2    H   1    2.022    0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     206   .   1   1   22   22   ARG   HG2    H   1    1.876    0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     207   .   1   1   22   22   ARG   HD2    H   1    3.279    0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     208   .   1   1   22   22   ARG   HE     H   1    7.21     0.005   .   1   .   .   .   .   18   .   .   .   5390   1    
     209   .   1   1   23   23   GLU   N      N   15   114.6    0.05    .   1   .   .   .   .   19   .   .   .   5390   1    
     210   .   1   1   23   23   GLU   H      H   1    7.281    0.005   .   1   .   .   .   .   19   .   .   .   5390   1    
     211   .   1   1   23   23   GLU   CA     C   13   56.602   0.05    .   1   .   .   .   .   19   .   .   .   5390   1    
     212   .   1   1   23   23   GLU   HA     H   1    4.438    0.005   .   1   .   .   .   .   19   .   .   .   5390   1    
     213   .   1   1   23   23   GLU   CB     C   13   29.9     0.05    .   1   .   .   .   .   19   .   .   .   5390   1    
     214   .   1   1   23   23   GLU   CG     C   13   35.61    0.05    .   1   .   .   .   .   19   .   .   .   5390   1    
     215   .   1   1   23   23   GLU   HB2    H   1    1.996    0.005   .   1   .   .   .   .   19   .   .   .   5390   1    
     216   .   1   1   23   23   GLU   HG2    H   1    2.387    0.005   .   2   .   .   .   .   19   .   .   .   5390   1    
     217   .   1   1   23   23   GLU   HG3    H   1    2.314    0.005   .   2   .   .   .   .   19   .   .   .   5390   1    
     218   .   1   1   24   24   SER   N      N   15   115.6    0.05    .   1   .   .   .   .   20   .   .   .   5390   1    
     219   .   1   1   24   24   SER   H      H   1    7.626    0.005   .   1   .   .   .   .   20   .   .   .   5390   1    
     220   .   1   1   24   24   SER   CA     C   13   58.232   0.05    .   1   .   .   .   .   20   .   .   .   5390   1    
     221   .   1   1   24   24   SER   HA     H   1    4.942    0.005   .   1   .   .   .   .   20   .   .   .   5390   1    
     222   .   1   1   24   24   SER   CB     C   13   66.228   0.05    .   1   .   .   .   .   20   .   .   .   5390   1    
     223   .   1   1   24   24   SER   HB2    H   1    3.711    0.005   .   2   .   .   .   .   20   .   .   .   5390   1    
     224   .   1   1   24   24   SER   HB3    H   1    3.865    0.005   .   2   .   .   .   .   20   .   .   .   5390   1    
     225   .   1   1   25   25   THR   N      N   15   114.08   0.05    .   1   .   .   .   .   21   .   .   .   5390   1    
     226   .   1   1   25   25   THR   H      H   1    8.709    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     227   .   1   1   25   25   THR   CA     C   13   62.161   0.05    .   1   .   .   .   .   21   .   .   .   5390   1    
     228   .   1   1   25   25   THR   HA     H   1    4.364    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     229   .   1   1   25   25   THR   CB     C   13   70.202   0.05    .   1   .   .   .   .   21   .   .   .   5390   1    
     230   .   1   1   25   25   THR   HB     H   1    4.347    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     231   .   1   1   25   25   THR   CG2    C   13   24.368   0.05    .   1   .   .   .   .   21   .   .   .   5390   1    
     232   .   1   1   25   25   THR   HG21   H   1    1.271    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     233   .   1   1   25   25   THR   HG22   H   1    1.271    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     234   .   1   1   25   25   THR   HG23   H   1    1.271    0.005   .   1   .   .   .   .   21   .   .   .   5390   1    
     235   .   1   1   26   26   LEU   N      N   15   123.47   0.05    .   1   .   .   .   .   22   .   .   .   5390   1    
     236   .   1   1   26   26   LEU   H      H   1    9.094    0.005   .   1   .   .   .   .   22   .   .   .   5390   1    
     237   .   1   1   26   26   LEU   CA     C   13   55.11    0.05    .   1   .   .   .   .   22   .   .   .   5390   1    
     238   .   1   1   26   26   LEU   HA     H   1    4.048    0.005   .   1   .   .   .   .   22   .   .   .   5390   1    
     239   .   1   1   26   26   LEU   CB     C   13   42.402   0.05    .   1   .   .   .   .   22   .   .   .   5390   1    
     240   .   1   1   26   26   LEU   HB2    H   1    1.883    0.005   .   1   .   .   .   .   22   .   .   .   5390   1    
     241   .   1   1   26   26   LEU   CD1    C   13   22.999   0.05    .   2   .   .   .   .   22   .   .   .   5390   1    
     242   .   1   1   26   26   LEU   HD11   H   1    0.896    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     243   .   1   1   26   26   LEU   HD12   H   1    0.896    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     244   .   1   1   26   26   LEU   HD13   H   1    0.896    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     245   .   1   1   26   26   LEU   CD2    C   13   22.894   0.05    .   2   .   .   .   .   22   .   .   .   5390   1    
     246   .   1   1   26   26   LEU   HD21   H   1    0.817    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     247   .   1   1   26   26   LEU   HD22   H   1    0.817    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     248   .   1   1   26   26   LEU   HD23   H   1    0.817    0.005   .   2   .   .   .   .   22   .   .   .   5390   1    
     249   .   1   1   27   27   GLU   N      N   15   117.21   0.05    .   1   .   .   .   .   23   .   .   .   5390   1    
     250   .   1   1   27   27   GLU   H      H   1    8.749    0.005   .   1   .   .   .   .   23   .   .   .   5390   1    
     251   .   1   1   27   27   GLU   CA     C   13   56.6     0.05    .   1   .   .   .   .   23   .   .   .   5390   1    
     252   .   1   1   27   27   GLU   HA     H   1    4.092    0.005   .   1   .   .   .   .   23   .   .   .   5390   1    
     253   .   1   1   27   27   GLU   CB     C   13   29.91    0.05    .   1   .   .   .   .   23   .   .   .   5390   1    
     254   .   1   1   27   27   GLU   CG     C   13   35.59    0.05    .   1   .   .   .   .   23   .   .   .   5390   1    
     255   .   1   1   27   27   GLU   HB2    H   1    2.089    0.005   .   2   .   .   .   .   23   .   .   .   5390   1    
     256   .   1   1   27   27   GLU   HB3    H   1    1.957    0.005   .   2   .   .   .   .   23   .   .   .   5390   1    
     257   .   1   1   27   27   GLU   HG2    H   1    2.351    0.005   .   1   .   .   .   .   23   .   .   .   5390   1    
     258   .   1   1   28   28   THR   N      N   15   116.99   0.05    .   1   .   .   .   .   24   .   .   .   5390   1    
     259   .   1   1   28   28   THR   H      H   1    7.715    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     260   .   1   1   28   28   THR   CA     C   13   67.052   0.05    .   1   .   .   .   .   24   .   .   .   5390   1    
     261   .   1   1   28   28   THR   HA     H   1    3.969    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     262   .   1   1   28   28   THR   CB     C   13   69.04    0.05    .   1   .   .   .   .   24   .   .   .   5390   1    
     263   .   1   1   28   28   THR   HB     H   1    4.286    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     264   .   1   1   28   28   THR   CG2    C   13   22.496   0.05    .   1   .   .   .   .   24   .   .   .   5390   1    
     265   .   1   1   28   28   THR   HG21   H   1    1.246    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     266   .   1   1   28   28   THR   HG22   H   1    1.246    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     267   .   1   1   28   28   THR   HG23   H   1    1.246    0.005   .   1   .   .   .   .   24   .   .   .   5390   1    
     268   .   1   1   29   29   LEU   N      N   15   121.66   0.05    .   1   .   .   .   .   25   .   .   .   5390   1    
     269   .   1   1   29   29   LEU   H      H   1    7.862    0.005   .   1   .   .   .   .   25   .   .   .   5390   1    
     270   .   1   1   29   29   LEU   CA     C   13   58.767   0.05    .   1   .   .   .   .   25   .   .   .   5390   1    
     271   .   1   1   29   29   LEU   HA     H   1    4.049    0.005   .   1   .   .   .   .   25   .   .   .   5390   1    
     272   .   1   1   29   29   LEU   CB     C   13   42.86    0.05    .   1   .   .   .   .   25   .   .   .   5390   1    
     273   .   1   1   29   29   LEU   CD2    C   13   24.118   0.05    .   2   .   .   .   .   25   .   .   .   5390   1    
     274   .   1   1   29   29   LEU   HD21   H   1    0.954    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     275   .   1   1   29   29   LEU   HD22   H   1    0.954    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     276   .   1   1   29   29   LEU   HD23   H   1    0.954    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     277   .   1   1   29   29   LEU   HD11   H   1    0.852    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     278   .   1   1   29   29   LEU   HD12   H   1    0.852    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     279   .   1   1   29   29   LEU   HD13   H   1    0.852    0.005   .   2   .   .   .   .   25   .   .   .   5390   1    
     280   .   1   1   29   29   LEU   CD1    C   13   24.31    0.05    .   2   .   .   .   .   25   .   .   .   5390   1    
     281   .   1   1   29   29   LEU   HB2    H   1    2.119    0.005   .   1   .   .   .   .   25   .   .   .   5390   1    
     282   .   1   1   29   29   LEU   CG     C   13   28.17    0.05    .   1   .   .   .   .   25   .   .   .   5390   1    
     283   .   1   1   29   29   LEU   HG     H   1    1.463    0.005   .   1   .   .   .   .   25   .   .   .   5390   1    
     284   .   1   1   30   30   GLU   N      N   15   117.38   0.05    .   1   .   .   .   .   26   .   .   .   5390   1    
     285   .   1   1   30   30   GLU   H      H   1    8.832    0.005   .   1   .   .   .   .   26   .   .   .   5390   1    
     286   .   1   1   30   30   GLU   CA     C   13   60.042   0.05    .   1   .   .   .   .   26   .   .   .   5390   1    
     287   .   1   1   30   30   GLU   HA     H   1    4.003    0.005   .   1   .   .   .   .   26   .   .   .   5390   1    
     288   .   1   1   30   30   GLU   CB     C   13   30.142   0.05    .   1   .   .   .   .   26   .   .   .   5390   1    
     289   .   1   1   30   30   GLU   CG     C   13   36.995   0.05    .   1   .   .   .   .   26   .   .   .   5390   1    
     290   .   1   1   30   30   GLU   HB2    H   1    2.158    0.005   .   1   .   .   .   .   26   .   .   .   5390   1    
     291   .   1   1   30   30   GLU   HG2    H   1    2.481    0.005   .   1   .   .   .   .   26   .   .   .   5390   1    
     292   .   1   1   31   31   GLU   N      N   15   121.27   0.05    .   1   .   .   .   .   27   .   .   .   5390   1    
     293   .   1   1   31   31   GLU   H      H   1    7.861    0.005   .   1   .   .   .   .   27   .   .   .   5390   1    
     294   .   1   1   31   31   GLU   CA     C   13   59.808   0.05    .   1   .   .   .   .   27   .   .   .   5390   1    
     295   .   1   1   31   31   GLU   HA     H   1    4.135    0.005   .   1   .   .   .   .   27   .   .   .   5390   1    
     296   .   1   1   31   31   GLU   CB     C   13   30.263   0.05    .   1   .   .   .   .   27   .   .   .   5390   1    
     297   .   1   1   31   31   GLU   CG     C   13   36.773   0.05    .   1   .   .   .   .   27   .   .   .   5390   1    
     298   .   1   1   31   31   GLU   HB2    H   1    2.114    0.005   .   1   .   .   .   .   27   .   .   .   5390   1    
     299   .   1   1   31   31   GLU   HG2    H   1    2.364    0.005   .   1   .   .   .   .   27   .   .   .   5390   1    
     300   .   1   1   32   32   MET   N      N   15   120.38   0.05    .   1   .   .   .   .   28   .   .   .   5390   1    
     301   .   1   1   32   32   MET   H      H   1    8.157    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     302   .   1   1   32   32   MET   CA     C   13   59.676   0.05    .   1   .   .   .   .   28   .   .   .   5390   1    
     303   .   1   1   32   32   MET   HA     H   1    3.982    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     304   .   1   1   32   32   MET   CB     C   13   33.212   0.05    .   1   .   .   .   .   28   .   .   .   5390   1    
     305   .   1   1   32   32   MET   CG     C   13   33.104   0.05    .   1   .   .   .   .   28   .   .   .   5390   1    
     306   .   1   1   32   32   MET   CE     C   13   17.568   0.05    .   1   .   .   .   .   28   .   .   .   5390   1    
     307   .   1   1   32   32   MET   HE1    H   1    2.104    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     308   .   1   1   32   32   MET   HE2    H   1    2.104    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     309   .   1   1   32   32   MET   HE3    H   1    2.104    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     310   .   1   1   32   32   MET   HB2    H   1    2.156    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     311   .   1   1   32   32   MET   HG2    H   1    2.631    0.005   .   1   .   .   .   .   28   .   .   .   5390   1    
     312   .   1   1   33   33   LEU   N      N   15   119.91   0.05    .   1   .   .   .   .   29   .   .   .   5390   1    
     313   .   1   1   33   33   LEU   H      H   1    8.269    0.005   .   1   .   .   .   .   29   .   .   .   5390   1    
     314   .   1   1   33   33   LEU   CA     C   13   58.954   0.05    .   1   .   .   .   .   29   .   .   .   5390   1    
     315   .   1   1   33   33   LEU   HA     H   1    4.035    0.005   .   1   .   .   .   .   29   .   .   .   5390   1    
     316   .   1   1   33   33   LEU   CB     C   13   41.665   0.05    .   1   .   .   .   .   29   .   .   .   5390   1    
     317   .   1   1   33   33   LEU   HB2    H   1    1.923    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     318   .   1   1   33   33   LEU   HB3    H   1    2.038    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     319   .   1   1   33   33   LEU   HG     H   1    1.407    0.005   .   1   .   .   .   .   29   .   .   .   5390   1    
     320   .   1   1   33   33   LEU   CD1    C   13   26.958   0.05    .   2   .   .   .   .   29   .   .   .   5390   1    
     321   .   1   1   33   33   LEU   HD11   H   1    0.927    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     322   .   1   1   33   33   LEU   HD12   H   1    0.927    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     323   .   1   1   33   33   LEU   HD13   H   1    0.927    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     324   .   1   1   33   33   LEU   CD2    C   13   27.401   0.05    .   2   .   .   .   .   29   .   .   .   5390   1    
     325   .   1   1   33   33   LEU   HD21   H   1    0.842    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     326   .   1   1   33   33   LEU   HD22   H   1    0.842    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     327   .   1   1   33   33   LEU   HD23   H   1    0.842    0.005   .   2   .   .   .   .   29   .   .   .   5390   1    
     328   .   1   1   34   34   GLU   N      N   15   118.02   0.05    .   1   .   .   .   .   30   .   .   .   5390   1    
     329   .   1   1   34   34   GLU   H      H   1    7.796    0.005   .   1   .   .   .   .   30   .   .   .   5390   1    
     330   .   1   1   34   34   GLU   CA     C   13   60.06    0.05    .   1   .   .   .   .   30   .   .   .   5390   1    
     331   .   1   1   34   34   GLU   HA     H   1    4.075    0.005   .   1   .   .   .   .   30   .   .   .   5390   1    
     332   .   1   1   34   34   GLU   CB     C   13   30.007   0.05    .   1   .   .   .   .   30   .   .   .   5390   1    
     333   .   1   1   34   34   GLU   CG     C   13   37.107   0.05    .   1   .   .   .   .   30   .   .   .   5390   1    
     334   .   1   1   34   34   GLU   HB2    H   1    2.196    0.005   .   1   .   .   .   .   30   .   .   .   5390   1    
     335   .   1   1   34   34   GLU   HG2    H   1    2.462    0.005   .   1   .   .   .   .   30   .   .   .   5390   1    
     336   .   1   1   35   35   LYS   N      N   15   118.41   0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     337   .   1   1   35   35   LYS   H      H   1    7.826    0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     338   .   1   1   35   35   LYS   CA     C   13   56.2     0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     339   .   1   1   35   35   LYS   HA     H   1    3.978    0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     340   .   1   1   35   35   LYS   CB     C   13   33.101   0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     341   .   1   1   35   35   LYS   HB2    H   1    2.04     0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     342   .   1   1   35   35   LYS   CG     C   13   24.71    0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     343   .   1   1   35   35   LYS   CD     C   13   29.052   0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     344   .   1   1   35   35   LYS   CE     C   13   41.93    0.05    .   1   .   .   .   .   31   .   .   .   5390   1    
     345   .   1   1   35   35   LYS   HG2    H   1    1.402    0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     346   .   1   1   35   35   LYS   HD2    H   1    1.634    0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     347   .   1   1   35   35   LYS   HE2    H   1    2.995    0.005   .   1   .   .   .   .   31   .   .   .   5390   1    
     348   .   1   1   36   36   LEU   N      N   15   119.63   0.05    .   1   .   .   .   .   32   .   .   .   5390   1    
     349   .   1   1   36   36   LEU   H      H   1    8.571    0.005   .   1   .   .   .   .   32   .   .   .   5390   1    
     350   .   1   1   36   36   LEU   CA     C   13   55.1     0.05    .   1   .   .   .   .   32   .   .   .   5390   1    
     351   .   1   1   36   36   LEU   HA     H   1    4.106    0.005   .   1   .   .   .   .   32   .   .   .   5390   1    
     352   .   1   1   36   36   LEU   CB     C   13   42.4     0.05    .   1   .   .   .   .   32   .   .   .   5390   1    
     353   .   1   1   36   36   LEU   HB2    H   1    1.992    0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     354   .   1   1   36   36   LEU   HB3    H   1    2.176    0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     355   .   1   1   36   36   LEU   CD1    C   13   27.213   0.05    .   2   .   .   .   .   32   .   .   .   5390   1    
     356   .   1   1   36   36   LEU   HD11   H   1    0.91     0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     357   .   1   1   36   36   LEU   HD12   H   1    0.91     0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     358   .   1   1   36   36   LEU   HD13   H   1    0.91     0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     359   .   1   1   36   36   LEU   CD2    C   13   27.134   0.05    .   2   .   .   .   .   32   .   .   .   5390   1    
     360   .   1   1   36   36   LEU   HD21   H   1    0.854    0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     361   .   1   1   36   36   LEU   HD22   H   1    0.854    0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     362   .   1   1   36   36   LEU   HD23   H   1    0.854    0.005   .   2   .   .   .   .   32   .   .   .   5390   1    
     363   .   1   1   36   36   LEU   CG     C   13   26.95    0.05    .   1   .   .   .   .   32   .   .   .   5390   1    
     364   .   1   1   36   36   LEU   HG     H   1    1.651    0.005   .   1   .   .   .   .   32   .   .   .   5390   1    
     365   .   1   1   37   37   GLU   N      N   15   119.08   0.05    .   1   .   .   .   .   33   .   .   .   5390   1    
     366   .   1   1   37   37   GLU   H      H   1    8.631    0.005   .   1   .   .   .   .   33   .   .   .   5390   1    
     367   .   1   1   37   37   GLU   CA     C   13   61.088   0.05    .   1   .   .   .   .   33   .   .   .   5390   1    
     368   .   1   1   37   37   GLU   HA     H   1    3.797    0.005   .   1   .   .   .   .   33   .   .   .   5390   1    
     369   .   1   1   37   37   GLU   CB     C   13   29.586   0.05    .   1   .   .   .   .   33   .   .   .   5390   1    
     370   .   1   1   37   37   GLU   CG     C   13   37.156   0.05    .   1   .   .   .   .   33   .   .   .   5390   1    
     371   .   1   1   37   37   GLU   HG2    H   1    2.209    0.005   .   2   .   .   .   .   33   .   .   .   5390   1    
     372   .   1   1   37   37   GLU   HG3    H   1    2.155    0.005   .   2   .   .   .   .   33   .   .   .   5390   1    
     373   .   1   1   37   37   GLU   HB2    H   1    2.188    0.005   .   1   .   .   .   .   33   .   .   .   5390   1    
     374   .   1   1   38   38   VAL   N      N   15   119.68   0.05    .   1   .   .   .   .   34   .   .   .   5390   1    
     375   .   1   1   38   38   VAL   H      H   1    7.713    0.005   .   1   .   .   .   .   34   .   .   .   5390   1    
     376   .   1   1   38   38   VAL   CA     C   13   67.304   0.05    .   1   .   .   .   .   34   .   .   .   5390   1    
     377   .   1   1   38   38   VAL   HA     H   1    3.693    0.005   .   1   .   .   .   .   34   .   .   .   5390   1    
     378   .   1   1   38   38   VAL   CB     C   13   31.986   0.05    .   1   .   .   .   .   34   .   .   .   5390   1    
     379   .   1   1   38   38   VAL   HB     H   1    2.432    0.005   .   1   .   .   .   .   34   .   .   .   5390   1    
     380   .   1   1   38   38   VAL   CG1    C   13   23.562   0.05    .   2   .   .   .   .   34   .   .   .   5390   1    
     381   .   1   1   38   38   VAL   HG11   H   1    1.612    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     382   .   1   1   38   38   VAL   HG12   H   1    1.612    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     383   .   1   1   38   38   VAL   HG13   H   1    1.612    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     384   .   1   1   38   38   VAL   CG2    C   13   21.734   0.05    .   2   .   .   .   .   34   .   .   .   5390   1    
     385   .   1   1   38   38   VAL   HG21   H   1    0.925    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     386   .   1   1   38   38   VAL   HG22   H   1    0.925    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     387   .   1   1   38   38   VAL   HG23   H   1    0.925    0.005   .   2   .   .   .   .   34   .   .   .   5390   1    
     388   .   1   1   39   39   VAL   N      N   15   120      0.05    .   1   .   .   .   .   35   .   .   .   5390   1    
     389   .   1   1   39   39   VAL   H      H   1    7.881    0.005   .   1   .   .   .   .   35   .   .   .   5390   1    
     390   .   1   1   39   39   VAL   CA     C   13   62.2     0.05    .   1   .   .   .   .   35   .   .   .   5390   1    
     391   .   1   1   39   39   VAL   HA     H   1    3.738    0.005   .   1   .   .   .   .   35   .   .   .   5390   1    
     392   .   1   1   39   39   VAL   CB     C   13   32.912   0.05    .   1   .   .   .   .   35   .   .   .   5390   1    
     393   .   1   1   39   39   VAL   HB     H   1    2.08     0.005   .   1   .   .   .   .   35   .   .   .   5390   1    
     394   .   1   1   39   39   VAL   CG1    C   13   24.269   0.05    .   2   .   .   .   .   35   .   .   .   5390   1    
     395   .   1   1   39   39   VAL   HG11   H   1    1.071    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     396   .   1   1   39   39   VAL   HG12   H   1    1.071    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     397   .   1   1   39   39   VAL   HG13   H   1    1.071    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     398   .   1   1   39   39   VAL   CG2    C   13   21.916   0.05    .   2   .   .   .   .   35   .   .   .   5390   1    
     399   .   1   1   39   39   VAL   HG21   H   1    0.895    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     400   .   1   1   39   39   VAL   HG22   H   1    0.895    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     401   .   1   1   39   39   VAL   HG23   H   1    0.895    0.005   .   2   .   .   .   .   35   .   .   .   5390   1    
     402   .   1   1   40   40   VAL   N      N   15   121.39   0.05    .   1   .   .   .   .   36   .   .   .   5390   1    
     403   .   1   1   40   40   VAL   H      H   1    8.995    0.005   .   1   .   .   .   .   36   .   .   .   5390   1    
     404   .   1   1   40   40   VAL   CA     C   13   68.339   0.05    .   1   .   .   .   .   36   .   .   .   5390   1    
     405   .   1   1   40   40   VAL   HA     H   1    3.416    0.005   .   1   .   .   .   .   36   .   .   .   5390   1    
     406   .   1   1   40   40   VAL   CB     C   13   31.545   0.05    .   1   .   .   .   .   36   .   .   .   5390   1    
     407   .   1   1   40   40   VAL   HB     H   1    2.057    0.005   .   1   .   .   .   .   36   .   .   .   5390   1    
     408   .   1   1   40   40   VAL   CG1    C   13   21.95    0.05    .   2   .   .   .   .   36   .   .   .   5390   1    
     409   .   1   1   40   40   VAL   HG11   H   1    0.875    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     410   .   1   1   40   40   VAL   HG12   H   1    0.875    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     411   .   1   1   40   40   VAL   HG13   H   1    0.875    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     412   .   1   1   40   40   VAL   CG2    C   13   25.203   0.05    .   2   .   .   .   .   36   .   .   .   5390   1    
     413   .   1   1   40   40   VAL   HG21   H   1    0.962    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     414   .   1   1   40   40   VAL   HG22   H   1    0.962    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     415   .   1   1   40   40   VAL   HG23   H   1    0.962    0.005   .   2   .   .   .   .   36   .   .   .   5390   1    
     416   .   1   1   41   41   ASN   N      N   15   118.79   0.05    .   1   .   .   .   .   37   .   .   .   5390   1    
     417   .   1   1   41   41   ASN   H      H   1    8.559    0.005   .   1   .   .   .   .   37   .   .   .   5390   1    
     418   .   1   1   41   41   ASN   CA     C   13   57.532   0.05    .   1   .   .   .   .   37   .   .   .   5390   1    
     419   .   1   1   41   41   ASN   HA     H   1    4.449    0.005   .   1   .   .   .   .   37   .   .   .   5390   1    
     420   .   1   1   41   41   ASN   CB     C   13   38.543   0.05    .   1   .   .   .   .   37   .   .   .   5390   1    
     421   .   1   1   41   41   ASN   HB2    H   1    2.835    0.005   .   2   .   .   .   .   37   .   .   .   5390   1    
     422   .   1   1   41   41   ASN   HB3    H   1    3.017    0.005   .   2   .   .   .   .   37   .   .   .   5390   1    
     423   .   1   1   41   41   ASN   ND2    N   15   113.71   0.05    .   1   .   .   .   .   37   .   .   .   5390   1    
     424   .   1   1   41   41   ASN   HD21   H   1    7.586    0.005   .   2   .   .   .   .   37   .   .   .   5390   1    
     425   .   1   1   41   41   ASN   HD22   H   1    7.116    0.005   .   2   .   .   .   .   37   .   .   .   5390   1    
     426   .   1   1   42   42   GLU   N      N   15   120.44   0.05    .   1   .   .   .   .   38   .   .   .   5390   1    
     427   .   1   1   42   42   GLU   H      H   1    8.376    0.005   .   1   .   .   .   .   38   .   .   .   5390   1    
     428   .   1   1   42   42   GLU   CA     C   13   60.63    0.05    .   1   .   .   .   .   38   .   .   .   5390   1    
     429   .   1   1   42   42   GLU   HA     H   1    4.104    0.005   .   1   .   .   .   .   38   .   .   .   5390   1    
     430   .   1   1   42   42   GLU   CB     C   13   29.565   0.05    .   1   .   .   .   .   38   .   .   .   5390   1    
     431   .   1   1   42   42   GLU   CG     C   13   37.735   0.05    .   1   .   .   .   .   38   .   .   .   5390   1    
     432   .   1   1   42   42   GLU   HB2    H   1    2.015    0.005   .   1   .   .   .   .   38   .   .   .   5390   1    
     433   .   1   1   42   42   GLU   HG2    H   1    2.354    0.005   .   1   .   .   .   .   38   .   .   .   5390   1    
     434   .   1   1   43   43   ARG   N      N   15   120.94   0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     435   .   1   1   43   43   ARG   H      H   1    7.995    0.005   .   1   .   .   .   .   39   .   .   .   5390   1    
     436   .   1   1   43   43   ARG   CA     C   13   57.377   0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     437   .   1   1   43   43   ARG   HA     H   1    4.201    0.005   .   1   .   .   .   .   39   .   .   .   5390   1    
     438   .   1   1   43   43   ARG   CB     C   13   31.459   0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     439   .   1   1   43   43   ARG   CG     C   13   27.854   0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     440   .   1   1   43   43   ARG   CD     C   13   44.424   0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     441   .   1   1   43   43   ARG   HB2    H   1    1.907    0.005   .   2   .   .   .   .   39   .   .   .   5390   1    
     442   .   1   1   43   43   ARG   HB3    H   1    1.985    0.005   .   2   .   .   .   .   39   .   .   .   5390   1    
     443   .   1   1   43   43   ARG   HG2    H   1    1.51     0.005   .   2   .   .   .   .   39   .   .   .   5390   1    
     444   .   1   1   43   43   ARG   HG3    H   1    1.428    0.005   .   2   .   .   .   .   39   .   .   .   5390   1    
     445   .   1   1   43   43   ARG   HD2    H   1    3.221    0.005   .   1   .   .   .   .   39   .   .   .   5390   1    
     446   .   1   1   43   43   ARG   HE     H   1    8.111    0.05    .   1   .   .   .   .   39   .   .   .   5390   1    
     447   .   1   1   44   44   ARG   N      N   15   120.96   0.05    .   1   .   .   .   .   40   .   .   .   5390   1    
     448   .   1   1   44   44   ARG   H      H   1    8.934    0.005   .   1   .   .   .   .   40   .   .   .   5390   1    
     449   .   1   1   44   44   ARG   CA     C   13   60.421   0.05    .   1   .   .   .   .   40   .   .   .   5390   1    
     450   .   1   1   44   44   ARG   HA     H   1    3.968    0.005   .   1   .   .   .   .   40   .   .   .   5390   1    
     451   .   1   1   44   44   ARG   CB     C   13   30.4     0.05    .   1   .   .   .   .   40   .   .   .   5390   1    
     452   .   1   1   44   44   ARG   HB2    H   1    1.852    0.005   .   2   .   .   .   .   40   .   .   .   5390   1    
     453   .   1   1   44   44   ARG   HB3    H   1    1.805    0.005   .   2   .   .   .   .   40   .   .   .   5390   1    
     454   .   1   1   44   44   ARG   CG     C   13   27.449   0.05    .   1   .   .   .   .   40   .   .   .   5390   1    
     455   .   1   1   44   44   ARG   CD     C   13   43.194   0.05    .   1   .   .   .   .   40   .   .   .   5390   1    
     456   .   1   1   44   44   ARG   HG2    H   1    1.573    0.005   .   1   .   .   .   .   40   .   .   .   5390   1    
     457   .   1   1   44   44   ARG   HD2    H   1    2.983    0.005   .   1   .   .   .   .   40   .   .   .   5390   1    
     458   .   1   1   44   44   ARG   HE     H   1    8.268    0.005   .   1   .   .   .   .   40   .   .   .   5390   1    
     459   .   1   1   45   45   GLU   N      N   15   119.27   0.05    .   1   .   .   .   .   41   .   .   .   5390   1    
     460   .   1   1   45   45   GLU   H      H   1    7.956    0.005   .   1   .   .   .   .   41   .   .   .   5390   1    
     461   .   1   1   45   45   GLU   CA     C   13   59.905   0.05    .   1   .   .   .   .   41   .   .   .   5390   1    
     462   .   1   1   45   45   GLU   HA     H   1    4.108    0.005   .   1   .   .   .   .   41   .   .   .   5390   1    
     463   .   1   1   45   45   GLU   CB     C   13   30.024   0.05    .   1   .   .   .   .   41   .   .   .   5390   1    
     464   .   1   1   45   45   GLU   CG     C   13   36.787   0.05    .   1   .   .   .   .   41   .   .   .   5390   1    
     465   .   1   1   45   45   GLU   HG2    H   1    2.436    0.005   .   2   .   .   .   .   41   .   .   .   5390   1    
     466   .   1   1   45   45   GLU   HG3    H   1    2.324    0.005   .   2   .   .   .   .   41   .   .   .   5390   1    
     467   .   1   1   45   45   GLU   HB2    H   1    2.166    0.005   .   1   .   .   .   .   41   .   .   .   5390   1    
     468   .   1   1   46   46   GLU   N      N   15   120.88   0.05    .   1   .   .   .   .   42   .   .   .   5390   1    
     469   .   1   1   46   46   GLU   H      H   1    8.121    0.005   .   1   .   .   .   .   42   .   .   .   5390   1    
     470   .   1   1   46   46   GLU   CA     C   13   59.792   0.05    .   1   .   .   .   .   42   .   .   .   5390   1    
     471   .   1   1   46   46   GLU   HA     H   1    4.127    0.005   .   1   .   .   .   .   42   .   .   .   5390   1    
     472   .   1   1   46   46   GLU   CB     C   13   30.624   0.05    .   1   .   .   .   .   42   .   .   .   5390   1    
     473   .   1   1   46   46   GLU   CG     C   13   36.799   0.05    .   1   .   .   .   .   42   .   .   .   5390   1    
     474   .   1   1   46   46   GLU   HB2    H   1    2.269    0.005   .   1   .   .   .   .   42   .   .   .   5390   1    
     475   .   1   1   46   46   GLU   HG2    H   1    2.477    0.005   .   1   .   .   .   .   42   .   .   .   5390   1    
     476   .   1   1   47   47   GLU   N      N   15   118.49   0.05    .   1   .   .   .   .   43   .   .   .   5390   1    
     477   .   1   1   47   47   GLU   H      H   1    8.347    0.005   .   1   .   .   .   .   43   .   .   .   5390   1    
     478   .   1   1   47   47   GLU   CA     C   13   59.072   0.05    .   1   .   .   .   .   43   .   .   .   5390   1    
     479   .   1   1   47   47   GLU   HA     H   1    4.272    0.005   .   1   .   .   .   .   43   .   .   .   5390   1    
     480   .   1   1   47   47   GLU   CB     C   13   29.92    0.05    .   1   .   .   .   .   43   .   .   .   5390   1    
     481   .   1   1   47   47   GLU   HB2    H   1    2.025    0.005   .   1   .   .   .   .   43   .   .   .   5390   1    
     482   .   1   1   47   47   GLU   CG     C   13   36.742   0.05    .   1   .   .   .   .   43   .   .   .   5390   1    
     483   .   1   1   47   47   GLU   HG2    H   1    2.347    0.005   .   2   .   .   .   .   43   .   .   .   5390   1    
     484   .   1   1   47   47   GLU   HG3    H   1    2.416    0.005   .   2   .   .   .   .   43   .   .   .   5390   1    
     485   .   1   1   48   48   SER   N      N   15   115.79   0.05    .   1   .   .   .   .   44   .   .   .   5390   1    
     486   .   1   1   48   48   SER   H      H   1    8.076    0.005   .   1   .   .   .   .   44   .   .   .   5390   1    
     487   .   1   1   48   48   SER   CA     C   13   60.809   0.05    .   1   .   .   .   .   44   .   .   .   5390   1    
     488   .   1   1   48   48   SER   HA     H   1    4.378    0.005   .   1   .   .   .   .   44   .   .   .   5390   1    
     489   .   1   1   48   48   SER   CB     C   13   63.748   0.05    .   1   .   .   .   .   44   .   .   .   5390   1    
     490   .   1   1   48   48   SER   HB2    H   1    4.026    0.005   .   1   .   .   .   .   44   .   .   .   5390   1    
     491   .   1   1   49   49   ALA   N      N   15   125.12   0.05    .   1   .   .   .   .   45   .   .   .   5390   1    
     492   .   1   1   49   49   ALA   H      H   1    8.061    0.005   .   1   .   .   .   .   45   .   .   .   5390   1    
     493   .   1   1   49   49   ALA   CA     C   13   54.236   0.05    .   1   .   .   .   .   45   .   .   .   5390   1    
     494   .   1   1   49   49   ALA   HA     H   1    4.301    0.005   .   1   .   .   .   .   45   .   .   .   5390   1    
     495   .   1   1   49   49   ALA   CB     C   13   19.176   0.05    .   1   .   .   .   .   45   .   .   .   5390   1    
     496   .   1   1   49   49   ALA   HB1    H   1    1.507    0.005   .   1   .   .   .   .   45   .   .   .   5390   1    
     497   .   1   1   49   49   ALA   HB2    H   1    1.507    0.005   .   1   .   .   .   .   45   .   .   .   5390   1    
     498   .   1   1   49   49   ALA   HB3    H   1    1.507    0.005   .   1   .   .   .   .   45   .   .   .   5390   1    
     499   .   1   1   50   50   ALA   N      N   15   121.88   0.05    .   1   .   .   .   .   46   .   .   .   5390   1    
     500   .   1   1   50   50   ALA   H      H   1    7.964    0.005   .   1   .   .   .   .   46   .   .   .   5390   1    
     501   .   1   1   50   50   ALA   CA     C   13   54.168   0.05    .   1   .   .   .   .   46   .   .   .   5390   1    
     502   .   1   1   50   50   ALA   HA     H   1    4.284    0.005   .   1   .   .   .   .   46   .   .   .   5390   1    
     503   .   1   1   50   50   ALA   CB     C   13   19.404   0.05    .   1   .   .   .   .   46   .   .   .   5390   1    
     504   .   1   1   50   50   ALA   HB1    H   1    1.493    0.005   .   1   .   .   .   .   46   .   .   .   5390   1    
     505   .   1   1   50   50   ALA   HB2    H   1    1.493    0.005   .   1   .   .   .   .   46   .   .   .   5390   1    
     506   .   1   1   50   50   ALA   HB3    H   1    1.493    0.005   .   1   .   .   .   .   46   .   .   .   5390   1    
     507   .   1   1   51   51   ALA   N      N   15   122.07   0.05    .   1   .   .   .   .   47   .   .   .   5390   1    
     508   .   1   1   51   51   ALA   H      H   1    7.976    0.005   .   1   .   .   .   .   47   .   .   .   5390   1    
     509   .   1   1   51   51   ALA   CA     C   13   53.912   0.05    .   1   .   .   .   .   47   .   .   .   5390   1    
     510   .   1   1   51   51   ALA   HA     H   1    4.288    0.005   .   1   .   .   .   .   47   .   .   .   5390   1    
     511   .   1   1   51   51   ALA   CB     C   13   19.39    0.05    .   1   .   .   .   .   47   .   .   .   5390   1    
     512   .   1   1   51   51   ALA   HB1    H   1    1.482    0.005   .   1   .   .   .   .   47   .   .   .   5390   1    
     513   .   1   1   51   51   ALA   HB2    H   1    1.482    0.005   .   1   .   .   .   .   47   .   .   .   5390   1    
     514   .   1   1   51   51   ALA   HB3    H   1    1.482    0.005   .   1   .   .   .   .   47   .   .   .   5390   1    
     515   .   1   1   52   52   ALA   N      N   15   122.17   0.05    .   1   .   .   .   .   48   .   .   .   5390   1    
     516   .   1   1   52   52   ALA   H      H   1    7.975    0.005   .   1   .   .   .   .   48   .   .   .   5390   1    
     517   .   1   1   52   52   ALA   CA     C   13   54.165   0.05    .   1   .   .   .   .   48   .   .   .   5390   1    
     518   .   1   1   52   52   ALA   HA     H   1    4.29     0.005   .   1   .   .   .   .   48   .   .   .   5390   1    
     519   .   1   1   52   52   ALA   CB     C   13   19.413   0.05    .   1   .   .   .   .   48   .   .   .   5390   1    
     520   .   1   1   52   52   ALA   HB1    H   1    1.485    0.005   .   1   .   .   .   .   48   .   .   .   5390   1    
     521   .   1   1   52   52   ALA   HB2    H   1    1.485    0.005   .   1   .   .   .   .   48   .   .   .   5390   1    
     522   .   1   1   52   52   ALA   HB3    H   1    1.485    0.005   .   1   .   .   .   .   48   .   .   .   5390   1    
     523   .   1   1   53   53   GLU   N      N   15   119.57   0.05    .   1   .   .   .   .   49   .   .   .   5390   1    
     524   .   1   1   53   53   GLU   H      H   1    8.079    0.005   .   1   .   .   .   .   49   .   .   .   5390   1    
     525   .   1   1   53   53   GLU   CA     C   13   58.017   0.05    .   1   .   .   .   .   49   .   .   .   5390   1    
     526   .   1   1   53   53   GLU   HA     H   1    4.265    0.005   .   1   .   .   .   .   49   .   .   .   5390   1    
     527   .   1   1   53   53   GLU   CB     C   13   30.367   0.05    .   1   .   .   .   .   49   .   .   .   5390   1    
     528   .   1   1   53   53   GLU   CG     C   13   36.841   0.05    .   1   .   .   .   .   49   .   .   .   5390   1    
     529   .   1   1   53   53   GLU   HB2    H   1    2.081    0.005   .   1   .   .   .   .   49   .   .   .   5390   1    
     530   .   1   1   53   53   GLU   HG2    H   1    2.333    0.005   .   1   .   .   .   .   49   .   .   .   5390   1    
     531   .   1   1   54   54   VAL   N      N   15   120.09   0.05    .   1   .   .   .   .   50   .   .   .   5390   1    
     532   .   1   1   54   54   VAL   H      H   1    7.931    0.005   .   1   .   .   .   .   50   .   .   .   5390   1    
     533   .   1   1   54   54   VAL   CA     C   13   63.691   0.05    .   1   .   .   .   .   50   .   .   .   5390   1    
     534   .   1   1   54   54   VAL   HA     H   1    3.996    0.005   .   1   .   .   .   .   50   .   .   .   5390   1    
     535   .   1   1   54   54   VAL   CB     C   13   33.111   0.05    .   1   .   .   .   .   50   .   .   .   5390   1    
     536   .   1   1   54   54   VAL   HB     H   1    2.158    0.005   .   1   .   .   .   .   50   .   .   .   5390   1    
     537   .   1   1   54   54   VAL   CG1    C   13   21.713   0.05    .   2   .   .   .   .   50   .   .   .   5390   1    
     538   .   1   1   54   54   VAL   HG11   H   1    1.008    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     539   .   1   1   54   54   VAL   HG12   H   1    1.008    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     540   .   1   1   54   54   VAL   HG13   H   1    1.008    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     541   .   1   1   54   54   VAL   CG2    C   13   21.711   0.05    .   2   .   .   .   .   50   .   .   .   5390   1    
     542   .   1   1   54   54   VAL   HG21   H   1    0.986    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     543   .   1   1   54   54   VAL   HG22   H   1    0.986    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     544   .   1   1   54   54   VAL   HG23   H   1    0.986    0.005   .   2   .   .   .   .   50   .   .   .   5390   1    
     545   .   1   1   55   55   GLU   N      N   15   123.45   0.05    .   1   .   .   .   .   51   .   .   .   5390   1    
     546   .   1   1   55   55   GLU   H      H   1    8.279    0.005   .   1   .   .   .   .   51   .   .   .   5390   1    
     547   .   1   1   55   55   GLU   CA     C   13   58.386   0.05    .   1   .   .   .   .   51   .   .   .   5390   1    
     548   .   1   1   55   55   GLU   HA     H   1    4.223    0.005   .   1   .   .   .   .   51   .   .   .   5390   1    
     549   .   1   1   55   55   GLU   CB     C   13   30.545   0.05    .   1   .   .   .   .   51   .   .   .   5390   1    
     550   .   1   1   55   55   GLU   CG     C   13   36.773   0.05    .   1   .   .   .   .   51   .   .   .   5390   1    
     551   .   1   1   55   55   GLU   HB2    H   1    2.047    0.005   .   1   .   .   .   .   51   .   .   .   5390   1    
     552   .   1   1   55   55   GLU   HG2    H   1    2.294    0.005   .   1   .   .   .   .   51   .   .   .   5390   1    
     553   .   1   1   56   56   GLU   N      N   15   121.54   0.05    .   1   .   .   .   .   52   .   .   .   5390   1    
     554   .   1   1   56   56   GLU   H      H   1    8.345    0.005   .   1   .   .   .   .   52   .   .   .   5390   1    
     555   .   1   1   56   56   GLU   CA     C   13   58.186   0.05    .   1   .   .   .   .   52   .   .   .   5390   1    
     556   .   1   1   56   56   GLU   HA     H   1    4.213    0.005   .   1   .   .   .   .   52   .   .   .   5390   1    
     557   .   1   1   56   56   GLU   CB     C   13   30.546   0.05    .   1   .   .   .   .   52   .   .   .   5390   1    
     558   .   1   1   56   56   GLU   CG     C   13   36.776   0.05    .   1   .   .   .   .   52   .   .   .   5390   1    
     559   .   1   1   56   56   GLU   HB2    H   1    2.064    0.005   .   1   .   .   .   .   52   .   .   .   5390   1    
     560   .   1   1   56   56   GLU   HG2    H   1    2.305    0.005   .   1   .   .   .   .   52   .   .   .   5390   1    
     561   .   1   1   57   57   ARG   N      N   15   120.63   0.05    .   1   .   .   .   .   53   .   .   .   5390   1    
     562   .   1   1   57   57   ARG   H      H   1    8.245    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     563   .   1   1   57   57   ARG   CA     C   13   57.423   0.05    .   1   .   .   .   .   53   .   .   .   5390   1    
     564   .   1   1   57   57   ARG   HA     H   1    4.342    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     565   .   1   1   57   57   ARG   CB     C   13   31.105   0.05    .   1   .   .   .   .   53   .   .   .   5390   1    
     566   .   1   1   57   57   ARG   CG     C   13   27.87    0.05    .   1   .   .   .   .   53   .   .   .   5390   1    
     567   .   1   1   57   57   ARG   CD     C   13   43.515   0.05    .   1   .   .   .   .   53   .   .   .   5390   1    
     568   .   1   1   57   57   ARG   HB2    H   1    1.895    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     569   .   1   1   57   57   ARG   HG2    H   1    1.699    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     570   .   1   1   57   57   ARG   HD2    H   1    3.229    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     571   .   1   1   57   57   ARG   HE     H   1    8.235    0.005   .   1   .   .   .   .   53   .   .   .   5390   1    
     572   .   1   1   58   58   THR   N      N   15   113.84   0.05    .   1   .   .   .   .   54   .   .   .   5390   1    
     573   .   1   1   58   58   THR   H      H   1    8.053    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     574   .   1   1   58   58   THR   CA     C   13   62.739   0.05    .   1   .   .   .   .   54   .   .   .   5390   1    
     575   .   1   1   58   58   THR   HA     H   1    4.305    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     576   .   1   1   58   58   THR   CB     C   13   70.174   0.05    .   1   .   .   .   .   54   .   .   .   5390   1    
     577   .   1   1   58   58   THR   HB     H   1    4.268    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     578   .   1   1   58   58   THR   CG2    C   13   22.25    0.05    .   1   .   .   .   .   54   .   .   .   5390   1    
     579   .   1   1   58   58   THR   HG21   H   1    1.245    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     580   .   1   1   58   58   THR   HG22   H   1    1.245    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     581   .   1   1   58   58   THR   HG23   H   1    1.245    0.005   .   1   .   .   .   .   54   .   .   .   5390   1    
     582   .   1   1   59   59   ARG   N      N   15   123.51   0.05    .   1   .   .   .   .   55   .   .   .   5390   1    
     583   .   1   1   59   59   ARG   H      H   1    8.101    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     584   .   1   1   59   59   ARG   CA     C   13   56.995   0.05    .   1   .   .   .   .   55   .   .   .   5390   1    
     585   .   1   1   59   59   ARG   HA     H   1    4.342    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     586   .   1   1   59   59   ARG   CB     C   13   31.283   0.05    .   1   .   .   .   .   55   .   .   .   5390   1    
     587   .   1   1   59   59   ARG   CG     C   13   27.683   0.05    .   1   .   .   .   .   55   .   .   .   5390   1    
     588   .   1   1   59   59   ARG   CD     C   13   43.943   0.05    .   1   .   .   .   .   55   .   .   .   5390   1    
     589   .   1   1   59   59   ARG   HB2    H   1    1.858    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     590   .   1   1   59   59   ARG   HG2    H   1    1.672    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     591   .   1   1   59   59   ARG   HD2    H   1    3.222    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     592   .   1   1   59   59   ARG   HE     H   1    7.874    0.005   .   1   .   .   .   .   55   .   .   .   5390   1    
     593   .   1   1   60   60   LYS   N      N   15   123.57   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     594   .   1   1   60   60   LYS   H      H   1    8.268    0.005   .   1   .   .   .   .   56   .   .   .   5390   1    
     595   .   1   1   60   60   LYS   CA     C   13   56.524   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     596   .   1   1   60   60   LYS   HA     H   1    4.351    0.005   .   1   .   .   .   .   56   .   .   .   5390   1    
     597   .   1   1   60   60   LYS   CB     C   13   33.397   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     598   .   1   1   60   60   LYS   HB2    H   1    1.878    0.005   .   2   .   .   .   .   56   .   .   .   5390   1    
     599   .   1   1   60   60   LYS   HB3    H   1    1.794    0.005   .   2   .   .   .   .   56   .   .   .   5390   1    
     600   .   1   1   60   60   LYS   CG     C   13   25.161   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     601   .   1   1   60   60   LYS   CD     C   13   29.613   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     602   .   1   1   60   60   LYS   CE     C   13   42.689   0.05    .   1   .   .   .   .   56   .   .   .   5390   1    
     603   .   1   1   60   60   LYS   HG2    H   1    1.469    0.005   .   1   .   .   .   .   56   .   .   .   5390   1    
     604   .   1   1   60   60   LYS   HD2    H   1    1.705    0.005   .   1   .   .   .   .   56   .   .   .   5390   1    
     605   .   1   1   60   60   LYS   HE2    H   1    3.021    0.005   .   1   .   .   .   .   56   .   .   .   5390   1    
     606   .   1   1   61   61   LEU   N      N   15   129.91   0.05    .   1   .   .   .   .   57   .   .   .   5390   1    
     607   .   1   1   61   61   LEU   H      H   1    7.884    0.005   .   1   .   .   .   .   57   .   .   .   5390   1    
     608   .   1   1   61   61   LEU   CA     C   13   57.034   0.05    .   1   .   .   .   .   57   .   .   .   5390   1    
     609   .   1   1   61   61   LEU   HA     H   1    4.198    0.005   .   1   .   .   .   .   57   .   .   .   5390   1    
     610   .   1   1   61   61   LEU   CB     C   13   43.805   0.05    .   1   .   .   .   .   57   .   .   .   5390   1    
     611   .   1   1   61   61   LEU   CG     C   13   27.319   0.05    .   1   .   .   .   .   57   .   .   .   5390   1    
     612   .   1   1   61   61   LEU   HG     H   1    1.615    0.005   .   1   .   .   .   .   57   .   .   .   5390   1    
     613   .   1   1   61   61   LEU   CD1    C   13   25.318   0.05    .   2   .   .   .   .   57   .   .   .   5390   1    
     614   .   1   1   61   61   LEU   HD11   H   1    0.914    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     615   .   1   1   61   61   LEU   HD12   H   1    0.914    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     616   .   1   1   61   61   LEU   HD13   H   1    0.914    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     617   .   1   1   61   61   LEU   CD2    C   13   23.863   0.05    .   2   .   .   .   .   57   .   .   .   5390   1    
     618   .   1   1   61   61   LEU   HD21   H   1    0.882    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     619   .   1   1   61   61   LEU   HD22   H   1    0.882    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     620   .   1   1   61   61   LEU   HD23   H   1    0.882    0.005   .   2   .   .   .   .   57   .   .   .   5390   1    
     621   .   1   1   61   61   LEU   HB2    H   1    1.604    0.005   .   1   .   .   .   .   57   .   .   .   5390   1    

   stop_

save_