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

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

save_assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Sf_category                  assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                 assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Entry_ID                     16577
   _Assigned_chem_shift_list.ID                           1
   _Assigned_chem_shift_list.Name                         .
   _Assigned_chem_shift_list.Sample_condition_list_ID     1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID      1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chemical_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err            .
   _Assigned_chem_shift_list.Chem_shift_13C_err           .
   _Assigned_chem_shift_list.Chem_shift_15N_err           .
   _Assigned_chem_shift_list.Chem_shift_31P_err           .
   _Assigned_chem_shift_list.Chem_shift_2H_err            .
   _Assigned_chem_shift_list.Chem_shift_19F_err           .
   _Assigned_chem_shift_list.Error_derivation_method      .
   _Assigned_chem_shift_list.Details                      .
   _Assigned_chem_shift_list.Text_data_format             .
   _Assigned_chem_shift_list.Text_data                    .

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

     1   '2D 1H-15N HSQC'    .   .   .   16577   1    
     2   '3D CBCA(CO)NH'     .   .   .   16577   1    
     3   '3D HNCO'           .   .   .   16577   1    
     4   '3D HNCACB'         .   .   .   16577   1    
     5   '3D HNCA'           .   .   .   16577   1    
     6   '3D HBHA(CO)NH'     .   .   .   16577   1    
     7   '3D 1H-15N NOESY'   .   .   .   16577   1    

   stop_

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

     1     .   3   .   3   3    3    HIS   HA     H   1    4.680     0.000   .   1   .   .   .   .   .   3    H   HA    .   16577   1    
     2     .   3   .   3   3    3    HIS   HB2    H   1    3.156     0.000   .   2   .   .   .   .   .   3    H   HB2   .   16577   1    
     3     .   3   .   3   3    3    HIS   C      C   13   174.771   0.000   .   1   .   .   .   .   .   3    H   C     .   16577   1    
     4     .   3   .   3   3    3    HIS   CA     C   13   55.866    0.037   .   1   .   .   .   .   .   3    H   CA    .   16577   1    
     5     .   3   .   3   3    3    HIS   CB     C   13   29.790    0.000   .   1   .   .   .   .   .   3    H   CB    .   16577   1    
     6     .   3   .   3   4    4    MET   H      H   1    8.341     0.003   .   1   .   .   .   .   .   4    M   HN    .   16577   1    
     7     .   3   .   3   4    4    MET   C      C   13   175.951   0.000   .   1   .   .   .   .   .   4    M   C     .   16577   1    
     8     .   3   .   3   4    4    MET   CA     C   13   55.919    0.131   .   1   .   .   .   .   .   4    M   CA    .   16577   1    
     9     .   3   .   3   4    4    MET   CB     C   13   32.670    0.231   .   1   .   .   .   .   .   4    M   CB    .   16577   1    
     10    .   3   .   3   4    4    MET   N      N   15   121.938   0.033   .   1   .   .   .   .   .   4    M   N     .   16577   1    
     11    .   3   .   3   5    5    LEU   H      H   1    8.300     0.003   .   1   .   .   .   .   .   5    L   HN    .   16577   1    
     12    .   3   .   3   5    5    LEU   HA     H   1    4.329     0.000   .   1   .   .   .   .   .   5    L   HA    .   16577   1    
     13    .   3   .   3   5    5    LEU   HB2    H   1    1.595     0.000   .   2   .   .   .   .   .   5    L   HB2   .   16577   1    
     14    .   3   .   3   5    5    LEU   C      C   13   177.221   0.000   .   1   .   .   .   .   .   5    L   C     .   16577   1    
     15    .   3   .   3   5    5    LEU   CA     C   13   55.453    0.159   .   1   .   .   .   .   .   5    L   CA    .   16577   1    
     16    .   3   .   3   5    5    LEU   CB     C   13   42.083    0.256   .   1   .   .   .   .   .   5    L   CB    .   16577   1    
     17    .   3   .   3   5    5    LEU   N      N   15   123.735   0.031   .   1   .   .   .   .   .   5    L   N     .   16577   1    
     18    .   3   .   3   6    6    GLU   H      H   1    8.306     0.004   .   1   .   .   .   .   .   6    E   HN    .   16577   1    
     19    .   3   .   3   6    6    GLU   HA     H   1    4.274     0.000   .   1   .   .   .   .   .   6    E   HA    .   16577   1    
     20    .   3   .   3   6    6    GLU   HB2    H   1    2.275     0.000   .   2   .   .   .   .   .   6    E   HB2   .   16577   1    
     21    .   3   .   3   6    6    GLU   HB3    H   1    1.997     0.000   .   2   .   .   .   .   .   6    E   HB3   .   16577   1    
     22    .   3   .   3   6    6    GLU   C      C   13   176.841   0.000   .   1   .   .   .   .   .   6    E   C     .   16577   1    
     23    .   3   .   3   6    6    GLU   CA     C   13   56.832    0.110   .   1   .   .   .   .   .   6    E   CA    .   16577   1    
     24    .   3   .   3   6    6    GLU   CB     C   13   30.142    0.279   .   1   .   .   .   .   .   6    E   CB    .   16577   1    
     25    .   3   .   3   6    6    GLU   N      N   15   121.823   0.161   .   1   .   .   .   .   .   6    E   N     .   16577   1    
     26    .   3   .   3   7    7    GLY   H      H   1    8.369     0.005   .   1   .   .   .   .   .   7    G   HN    .   16577   1    
     27    .   3   .   3   7    7    GLY   HA2    H   1    3.934     0.014   .   2   .   .   .   .   .   7    G   HA    .   16577   1    
     28    .   3   .   3   7    7    GLY   HA3    H   1    3.934     0.014   .   2   .   .   .   .   .   7    G   HA    .   16577   1    
     29    .   3   .   3   7    7    GLY   C      C   13   173.812   0.000   .   1   .   .   .   .   .   7    G   C     .   16577   1    
     30    .   3   .   3   7    7    GLY   CA     C   13   45.331    0.049   .   1   .   .   .   .   .   7    G   CA    .   16577   1    
     31    .   3   .   3   7    7    GLY   N      N   15   110.256   0.133   .   1   .   .   .   .   .   7    G   N     .   16577   1    
     32    .   3   .   3   8    8    ARG   H      H   1    7.927     0.004   .   1   .   .   .   .   .   8    R   HN    .   16577   1    
     33    .   3   .   3   8    8    ARG   HA     H   1    4.308     0.000   .   1   .   .   .   .   .   8    R   HA    .   16577   1    
     34    .   3   .   3   8    8    ARG   HB2    H   1    1.737     0.000   .   2   .   .   .   .   .   8    R   HB2   .   16577   1    
     35    .   3   .   3   8    8    ARG   C      C   13   176.029   0.000   .   1   .   .   .   .   .   8    R   C     .   16577   1    
     36    .   3   .   3   8    8    ARG   CA     C   13   55.813    0.011   .   1   .   .   .   .   .   8    R   CA    .   16577   1    
     37    .   3   .   3   8    8    ARG   CB     C   13   31.287    0.041   .   1   .   .   .   .   .   8    R   CB    .   16577   1    
     38    .   3   .   3   8    8    ARG   N      N   15   120.802   0.092   .   1   .   .   .   .   .   8    R   N     .   16577   1    
     39    .   3   .   3   9    9    LYS   H      H   1    8.630     0.002   .   1   .   .   .   .   .   9    K   HN    .   16577   1    
     40    .   3   .   3   9    9    LYS   C      C   13   176.070   0.000   .   1   .   .   .   .   .   9    K   C     .   16577   1    
     41    .   3   .   3   9    9    LYS   CA     C   13   56.041    0.108   .   1   .   .   .   .   .   9    K   CA    .   16577   1    
     42    .   3   .   3   9    9    LYS   CB     C   13   33.330    0.206   .   1   .   .   .   .   .   9    K   CB    .   16577   1    
     43    .   3   .   3   9    9    LYS   N      N   15   125.308   0.030   .   1   .   .   .   .   .   9    K   N     .   16577   1    
     44    .   3   .   3   10   10   LYS   H      H   1    8.334     0.002   .   1   .   .   .   .   .   10   K   HN    .   16577   1    
     45    .   3   .   3   10   10   LYS   C      C   13   176.442   0.000   .   1   .   .   .   .   .   10   K   C     .   16577   1    
     46    .   3   .   3   10   10   LYS   CA     C   13   56.245    0.074   .   1   .   .   .   .   .   10   K   CA    .   16577   1    
     47    .   3   .   3   10   10   LYS   CB     C   13   33.028    0.305   .   1   .   .   .   .   .   10   K   CB    .   16577   1    
     48    .   3   .   3   10   10   LYS   N      N   15   124.642   0.050   .   1   .   .   .   .   .   10   K   N     .   16577   1    
     49    .   3   .   3   11   11   ARG   H      H   1    8.278     0.003   .   1   .   .   .   .   .   11   R   HN    .   16577   1    
     50    .   3   .   3   11   11   ARG   C      C   13   173.231   0.000   .   1   .   .   .   .   .   11   R   C     .   16577   1    
     51    .   3   .   3   11   11   ARG   CA     C   13   56.085    0.110   .   1   .   .   .   .   .   11   R   CA    .   16577   1    
     52    .   3   .   3   11   11   ARG   CB     C   13   30.613    0.081   .   1   .   .   .   .   .   11   R   CB    .   16577   1    
     53    .   3   .   3   11   11   ARG   N      N   15   121.241   0.040   .   1   .   .   .   .   .   11   R   N     .   16577   1    
     54    .   3   .   3   12   12   VAL   H      H   1    7.433     0.012   .   1   .   .   .   .   .   12   V   HN    .   16577   1    
     55    .   3   .   3   12   12   VAL   CA     C   13   58.721    0.173   .   1   .   .   .   .   .   12   V   CA    .   16577   1    
     56    .   3   .   3   12   12   VAL   CB     C   13   34.047    0.000   .   1   .   .   .   .   .   12   V   CB    .   16577   1    
     57    .   3   .   3   12   12   VAL   N      N   15   121.652   0.040   .   1   .   .   .   .   .   12   V   N     .   16577   1    
     58    .   3   .   3   13   13   PRO   C      C   13   177.109   0.000   .   1   .   .   .   .   .   13   P   C     .   16577   1    
     59    .   3   .   3   13   13   PRO   CA     C   13   61.750    0.090   .   1   .   .   .   .   .   13   P   CA    .   16577   1    
     60    .   3   .   3   13   13   PRO   CB     C   13   32.344    0.000   .   1   .   .   .   .   .   13   P   CB    .   16577   1    
     61    .   3   .   3   14   14   TYR   H      H   1    9.806     0.003   .   1   .   .   .   .   .   14   Y   HN    .   16577   1    
     62    .   3   .   3   14   14   TYR   HD1    H   1    6.961     0.001   .   3   .   .   .   .   .   14   Y   HD1   .   16577   1    
     63    .   3   .   3   14   14   TYR   C      C   13   177.306   0.000   .   1   .   .   .   .   .   14   Y   C     .   16577   1    
     64    .   3   .   3   14   14   TYR   CA     C   13   53.802    0.048   .   1   .   .   .   .   .   14   Y   CA    .   16577   1    
     65    .   3   .   3   14   14   TYR   CB     C   13   34.467    0.000   .   1   .   .   .   .   .   14   Y   CB    .   16577   1    
     66    .   3   .   3   14   14   TYR   N      N   15   126.633   0.039   .   1   .   .   .   .   .   14   Y   N     .   16577   1    
     67    .   3   .   3   15   15   THR   H      H   1    9.123     0.008   .   1   .   .   .   .   .   15   T   HN    .   16577   1    
     68    .   3   .   3   15   15   THR   C      C   13   175.626   0.000   .   1   .   .   .   .   .   15   T   C     .   16577   1    
     69    .   3   .   3   15   15   THR   CA     C   13   60.871    0.067   .   1   .   .   .   .   .   15   T   CA    .   16577   1    
     70    .   3   .   3   15   15   THR   CB     C   13   70.819    0.055   .   1   .   .   .   .   .   15   T   CB    .   16577   1    
     71    .   3   .   3   15   15   THR   N      N   15   112.568   0.098   .   1   .   .   .   .   .   15   T   N     .   16577   1    
     72    .   3   .   3   16   16   LYS   H      H   1    8.833     0.008   .   1   .   .   .   .   .   16   K   HN    .   16577   1    
     73    .   3   .   3   16   16   LYS   HA     H   1    4.039     0.000   .   1   .   .   .   .   .   16   K   HA    .   16577   1    
     74    .   3   .   3   16   16   LYS   C      C   13   179.619   0.000   .   1   .   .   .   .   .   16   K   C     .   16577   1    
     75    .   3   .   3   16   16   LYS   CA     C   13   59.761    0.146   .   1   .   .   .   .   .   16   K   CA    .   16577   1    
     76    .   3   .   3   16   16   LYS   CB     C   13   31.518    0.260   .   1   .   .   .   .   .   16   K   CB    .   16577   1    
     77    .   3   .   3   16   16   LYS   N      N   15   119.593   0.036   .   1   .   .   .   .   .   16   K   N     .   16577   1    
     78    .   3   .   3   17   17   VAL   H      H   1    7.633     0.006   .   1   .   .   .   .   .   17   V   HN    .   16577   1    
     79    .   3   .   3   17   17   VAL   HA     H   1    3.778     0.007   .   1   .   .   .   .   .   17   V   HA    .   16577   1    
     80    .   3   .   3   17   17   VAL   HB     H   1    1.963     0.000   .   1   .   .   .   .   .   17   V   HB    .   16577   1    
     81    .   3   .   3   17   17   VAL   C      C   13   178.514   0.000   .   1   .   .   .   .   .   17   V   C     .   16577   1    
     82    .   3   .   3   17   17   VAL   CA     C   13   65.817    0.077   .   1   .   .   .   .   .   17   V   CA    .   16577   1    
     83    .   3   .   3   17   17   VAL   CB     C   13   31.634    0.425   .   1   .   .   .   .   .   17   V   CB    .   16577   1    
     84    .   3   .   3   17   17   VAL   N      N   15   117.079   0.121   .   1   .   .   .   .   .   17   V   N     .   16577   1    
     85    .   3   .   3   18   18   GLN   H      H   1    7.460     0.008   .   1   .   .   .   .   .   18   Q   HN    .   16577   1    
     86    .   3   .   3   18   18   GLN   C      C   13   177.806   0.000   .   1   .   .   .   .   .   18   Q   C     .   16577   1    
     87    .   3   .   3   18   18   GLN   CA     C   13   59.645    0.115   .   1   .   .   .   .   .   18   Q   CA    .   16577   1    
     88    .   3   .   3   18   18   GLN   CB     C   13   28.431    0.351   .   1   .   .   .   .   .   18   Q   CB    .   16577   1    
     89    .   3   .   3   18   18   GLN   N      N   15   121.165   0.033   .   1   .   .   .   .   .   18   Q   N     .   16577   1    
     90    .   3   .   3   19   19   LEU   H      H   1    8.557     0.005   .   1   .   .   .   .   .   19   L   HN    .   16577   1    
     91    .   3   .   3   19   19   LEU   C      C   13   178.555   0.000   .   1   .   .   .   .   .   19   L   C     .   16577   1    
     92    .   3   .   3   19   19   LEU   CA     C   13   57.644    0.011   .   1   .   .   .   .   .   19   L   CA    .   16577   1    
     93    .   3   .   3   19   19   LEU   CB     C   13   41.781    0.000   .   1   .   .   .   .   .   19   L   CB    .   16577   1    
     94    .   3   .   3   19   19   LEU   N      N   15   117.135   0.085   .   1   .   .   .   .   .   19   L   N     .   16577   1    
     95    .   3   .   3   20   20   LYS   H      H   1    8.061     0.006   .   1   .   .   .   .   .   20   K   HN    .   16577   1    
     96    .   3   .   3   20   20   LYS   C      C   13   179.405   0.000   .   1   .   .   .   .   .   20   K   C     .   16577   1    
     97    .   3   .   3   20   20   LYS   CA     C   13   59.635    0.048   .   1   .   .   .   .   .   20   K   CA    .   16577   1    
     98    .   3   .   3   20   20   LYS   CB     C   13   32.046    0.375   .   1   .   .   .   .   .   20   K   CB    .   16577   1    
     99    .   3   .   3   20   20   LYS   N      N   15   118.807   0.052   .   1   .   .   .   .   .   20   K   N     .   16577   1    
     100   .   3   .   3   21   21   GLU   H      H   1    7.011     0.009   .   1   .   .   .   .   .   21   E   HN    .   16577   1    
     101   .   3   .   3   21   21   GLU   HA     H   1    4.150     0.000   .   1   .   .   .   .   .   21   E   HA    .   16577   1    
     102   .   3   .   3   21   21   GLU   C      C   13   178.465   0.000   .   1   .   .   .   .   .   21   E   C     .   16577   1    
     103   .   3   .   3   21   21   GLU   CA     C   13   58.456    0.092   .   1   .   .   .   .   .   21   E   CA    .   16577   1    
     104   .   3   .   3   21   21   GLU   CB     C   13   28.966    0.091   .   1   .   .   .   .   .   21   E   CB    .   16577   1    
     105   .   3   .   3   21   21   GLU   N      N   15   118.492   0.115   .   1   .   .   .   .   .   21   E   N     .   16577   1    
     106   .   3   .   3   22   22   LEU   H      H   1    7.522     0.010   .   1   .   .   .   .   .   22   L   HN    .   16577   1    
     107   .   3   .   3   22   22   LEU   HA     H   1    3.804     0.000   .   1   .   .   .   .   .   22   L   HA    .   16577   1    
     108   .   3   .   3   22   22   LEU   HB2    H   1    -1.015    0.001   .   2   .   .   .   .   .   22   L   HB2   .   16577   1    
     109   .   3   .   3   22   22   LEU   HD21   H   1    -0.294    0.006   .   2   .   .   .   .   .   22   L   HD2   .   16577   1    
     110   .   3   .   3   22   22   LEU   HD22   H   1    -0.294    0.006   .   2   .   .   .   .   .   22   L   HD2   .   16577   1    
     111   .   3   .   3   22   22   LEU   HD23   H   1    -0.294    0.006   .   2   .   .   .   .   .   22   L   HD2   .   16577   1    
     112   .   3   .   3   22   22   LEU   C      C   13   177.941   0.000   .   1   .   .   .   .   .   22   L   C     .   16577   1    
     113   .   3   .   3   22   22   LEU   CA     C   13   58.557    0.104   .   1   .   .   .   .   .   22   L   CA    .   16577   1    
     114   .   3   .   3   22   22   LEU   CB     C   13   37.384    0.000   .   1   .   .   .   .   .   22   L   CB    .   16577   1    
     115   .   3   .   3   22   22   LEU   CD2    C   13   23.518    0.007   .   2   .   .   .   .   .   22   L   CD2   .   16577   1    
     116   .   3   .   3   22   22   LEU   N      N   15   121.133   0.039   .   1   .   .   .   .   .   22   L   N     .   16577   1    
     117   .   3   .   3   23   23   GLU   H      H   1    8.556     0.005   .   1   .   .   .   .   .   23   E   HN    .   16577   1    
     118   .   3   .   3   23   23   GLU   C      C   13   180.273   0.000   .   1   .   .   .   .   .   23   E   C     .   16577   1    
     119   .   3   .   3   23   23   GLU   CA     C   13   58.698    0.182   .   1   .   .   .   .   .   23   E   CA    .   16577   1    
     120   .   3   .   3   23   23   GLU   CB     C   13   28.606    0.000   .   1   .   .   .   .   .   23   E   CB    .   16577   1    
     121   .   3   .   3   23   23   GLU   N      N   15   116.855   0.060   .   1   .   .   .   .   .   23   E   N     .   16577   1    
     122   .   3   .   3   24   24   ARG   H      H   1    7.827     0.007   .   1   .   .   .   .   .   24   R   HN    .   16577   1    
     123   .   3   .   3   24   24   ARG   C      C   13   179.315   0.000   .   1   .   .   .   .   .   24   R   C     .   16577   1    
     124   .   3   .   3   24   24   ARG   CA     C   13   59.522    0.193   .   1   .   .   .   .   .   24   R   CA    .   16577   1    
     125   .   3   .   3   24   24   ARG   CB     C   13   28.889    0.000   .   1   .   .   .   .   .   24   R   CB    .   16577   1    
     126   .   3   .   3   24   24   ARG   N      N   15   121.241   0.036   .   1   .   .   .   .   .   24   R   N     .   16577   1    
     127   .   3   .   3   25   25   GLU   H      H   1    7.760     0.006   .   1   .   .   .   .   .   25   E   HN    .   16577   1    
     128   .   3   .   3   25   25   GLU   C      C   13   179.073   0.000   .   1   .   .   .   .   .   25   E   C     .   16577   1    
     129   .   3   .   3   25   25   GLU   CA     C   13   58.878    0.107   .   1   .   .   .   .   .   25   E   CA    .   16577   1    
     130   .   3   .   3   25   25   GLU   CB     C   13   28.987    0.164   .   1   .   .   .   .   .   25   E   CB    .   16577   1    
     131   .   3   .   3   25   25   GLU   N      N   15   119.576   0.080   .   1   .   .   .   .   .   25   E   N     .   16577   1    
     132   .   3   .   3   26   26   TYR   H      H   1    8.960     0.004   .   1   .   .   .   .   .   26   Y   HN    .   16577   1    
     133   .   3   .   3   26   26   TYR   C      C   13   175.945   0.000   .   1   .   .   .   .   .   26   Y   C     .   16577   1    
     134   .   3   .   3   26   26   TYR   CA     C   13   61.396    0.074   .   1   .   .   .   .   .   26   Y   CA    .   16577   1    
     135   .   3   .   3   26   26   TYR   CB     C   13   37.821    0.347   .   1   .   .   .   .   .   26   Y   CB    .   16577   1    
     136   .   3   .   3   26   26   TYR   N      N   15   123.893   0.054   .   1   .   .   .   .   .   26   Y   N     .   16577   1    
     137   .   3   .   3   27   27   ALA   H      H   1    7.811     0.006   .   1   .   .   .   .   .   27   A   HN    .   16577   1    
     138   .   3   .   3   27   27   ALA   HA     H   1    4.046     0.018   .   1   .   .   .   .   .   27   A   HA    .   16577   1    
     139   .   3   .   3   27   27   ALA   HB1    H   1    1.531     0.007   .   1   .   .   .   .   .   27   A   HB    .   16577   1    
     140   .   3   .   3   27   27   ALA   HB2    H   1    1.531     0.007   .   1   .   .   .   .   .   27   A   HB    .   16577   1    
     141   .   3   .   3   27   27   ALA   HB3    H   1    1.531     0.007   .   1   .   .   .   .   .   27   A   HB    .   16577   1    
     142   .   3   .   3   27   27   ALA   C      C   13   179.233   0.000   .   1   .   .   .   .   .   27   A   C     .   16577   1    
     143   .   3   .   3   27   27   ALA   CA     C   13   53.931    0.208   .   1   .   .   .   .   .   27   A   CA    .   16577   1    
     144   .   3   .   3   27   27   ALA   CB     C   13   17.867    0.472   .   1   .   .   .   .   .   27   A   CB    .   16577   1    
     145   .   3   .   3   27   27   ALA   N      N   15   116.872   0.114   .   1   .   .   .   .   .   27   A   N     .   16577   1    
     146   .   3   .   3   28   28   THR   H      H   1    7.564     0.007   .   1   .   .   .   .   .   28   T   HN    .   16577   1    
     147   .   3   .   3   28   28   THR   HA     H   1    4.209     0.006   .   1   .   .   .   .   .   28   T   HA    .   16577   1    
     148   .   3   .   3   28   28   THR   HB     H   1    4.427     0.000   .   1   .   .   .   .   .   28   T   HB    .   16577   1    
     149   .   3   .   3   28   28   THR   HG21   H   1    1.324     0.000   .   1   .   .   .   .   .   28   T   HG2   .   16577   1    
     150   .   3   .   3   28   28   THR   HG22   H   1    1.324     0.000   .   1   .   .   .   .   .   28   T   HG2   .   16577   1    
     151   .   3   .   3   28   28   THR   HG23   H   1    1.324     0.000   .   1   .   .   .   .   .   28   T   HG2   .   16577   1    
     152   .   3   .   3   28   28   THR   C      C   13   174.532   0.000   .   1   .   .   .   .   .   28   T   C     .   16577   1    
     153   .   3   .   3   28   28   THR   CA     C   13   64.340    0.092   .   1   .   .   .   .   .   28   T   CA    .   16577   1    
     154   .   3   .   3   28   28   THR   CB     C   13   69.453    0.147   .   1   .   .   .   .   .   28   T   CB    .   16577   1    
     155   .   3   .   3   28   28   THR   N      N   15   112.470   0.178   .   1   .   .   .   .   .   28   T   N     .   16577   1    
     156   .   3   .   3   29   29   ASN   H      H   1    8.078     0.006   .   1   .   .   .   .   .   29   N   HN    .   16577   1    
     157   .   3   .   3   29   29   ASN   C      C   13   173.115   0.000   .   1   .   .   .   .   .   29   N   C     .   16577   1    
     158   .   3   .   3   29   29   ASN   CA     C   13   54.045    0.122   .   1   .   .   .   .   .   29   N   CA    .   16577   1    
     159   .   3   .   3   29   29   ASN   CB     C   13   40.669    0.111   .   1   .   .   .   .   .   29   N   CB    .   16577   1    
     160   .   3   .   3   29   29   ASN   N      N   15   120.852   0.049   .   1   .   .   .   .   .   29   N   N     .   16577   1    
     161   .   3   .   3   30   30   LYS   H      H   1    8.056     0.006   .   1   .   .   .   .   .   30   K   HN    .   16577   1    
     162   .   3   .   3   30   30   LYS   C      C   13   174.401   0.000   .   1   .   .   .   .   .   30   K   C     .   16577   1    
     163   .   3   .   3   30   30   LYS   CA     C   13   57.412    0.065   .   1   .   .   .   .   .   30   K   CA    .   16577   1    
     164   .   3   .   3   30   30   LYS   CB     C   13   32.411    0.214   .   1   .   .   .   .   .   30   K   CB    .   16577   1    
     165   .   3   .   3   30   30   LYS   N      N   15   121.925   0.074   .   1   .   .   .   .   .   30   K   N     .   16577   1    
     166   .   3   .   3   31   31   PHE   H      H   1    7.820     0.008   .   1   .   .   .   .   .   31   F   HN    .   16577   1    
     167   .   3   .   3   31   31   PHE   HA     H   1    4.656     0.000   .   1   .   .   .   .   .   31   F   HA    .   16577   1    
     168   .   3   .   3   31   31   PHE   C      C   13   175.026   0.000   .   1   .   .   .   .   .   31   F   C     .   16577   1    
     169   .   3   .   3   31   31   PHE   CA     C   13   56.453    0.074   .   1   .   .   .   .   .   31   F   CA    .   16577   1    
     170   .   3   .   3   31   31   PHE   CB     C   13   40.539    0.156   .   1   .   .   .   .   .   31   F   CB    .   16577   1    
     171   .   3   .   3   31   31   PHE   N      N   15   116.093   0.069   .   1   .   .   .   .   .   31   F   N     .   16577   1    
     172   .   3   .   3   32   32   ILE   H      H   1    7.735     0.010   .   1   .   .   .   .   .   32   I   HN    .   16577   1    
     173   .   3   .   3   32   32   ILE   C      C   13   175.021   0.000   .   1   .   .   .   .   .   32   I   C     .   16577   1    
     174   .   3   .   3   32   32   ILE   CA     C   13   58.530    0.052   .   1   .   .   .   .   .   32   I   CA    .   16577   1    
     175   .   3   .   3   32   32   ILE   CB     C   13   40.186    0.230   .   1   .   .   .   .   .   32   I   CB    .   16577   1    
     176   .   3   .   3   32   32   ILE   N      N   15   119.334   0.128   .   1   .   .   .   .   .   32   I   N     .   16577   1    
     177   .   3   .   3   33   33   THR   H      H   1    7.113     0.038   .   1   .   .   .   .   .   33   T   HN    .   16577   1    
     178   .   3   .   3   33   33   THR   HA     H   1    4.446     0.000   .   1   .   .   .   .   .   33   T   HA    .   16577   1    
     179   .   3   .   3   33   33   THR   HB     H   1    4.663     0.008   .   1   .   .   .   .   .   33   T   HB    .   16577   1    
     180   .   3   .   3   33   33   THR   HG21   H   1    1.330     0.000   .   1   .   .   .   .   .   33   T   HG2   .   16577   1    
     181   .   3   .   3   33   33   THR   HG22   H   1    1.330     0.000   .   1   .   .   .   .   .   33   T   HG2   .   16577   1    
     182   .   3   .   3   33   33   THR   HG23   H   1    1.330     0.000   .   1   .   .   .   .   .   33   T   HG2   .   16577   1    
     183   .   3   .   3   33   33   THR   C      C   13   175.740   0.000   .   1   .   .   .   .   .   33   T   C     .   16577   1    
     184   .   3   .   3   33   33   THR   CA     C   13   60.058    0.180   .   1   .   .   .   .   .   33   T   CA    .   16577   1    
     185   .   3   .   3   33   33   THR   CB     C   13   71.360    0.105   .   1   .   .   .   .   .   33   T   CB    .   16577   1    
     186   .   3   .   3   33   33   THR   N      N   15   116.312   0.070   .   1   .   .   .   .   .   33   T   N     .   16577   1    
     187   .   3   .   3   34   34   LYS   H      H   1    9.554     0.010   .   1   .   .   .   .   .   34   K   HN    .   16577   1    
     188   .   3   .   3   34   34   LYS   C      C   13   178.016   0.000   .   1   .   .   .   .   .   34   K   C     .   16577   1    
     189   .   3   .   3   34   34   LYS   CA     C   13   60.448    0.125   .   1   .   .   .   .   .   34   K   CA    .   16577   1    
     190   .   3   .   3   34   34   LYS   CB     C   13   32.509    0.000   .   1   .   .   .   .   .   34   K   CB    .   16577   1    
     191   .   3   .   3   34   34   LYS   N      N   15   122.624   0.039   .   1   .   .   .   .   .   34   K   N     .   16577   1    
     192   .   3   .   3   35   35   ASP   H      H   1    8.608     0.008   .   1   .   .   .   .   .   35   D   HN    .   16577   1    
     193   .   3   .   3   35   35   ASP   HA     H   1    4.379     0.000   .   1   .   .   .   .   .   35   D   HA    .   16577   1    
     194   .   3   .   3   35   35   ASP   C      C   13   178.945   0.000   .   1   .   .   .   .   .   35   D   C     .   16577   1    
     195   .   3   .   3   35   35   ASP   CA     C   13   57.501    0.120   .   1   .   .   .   .   .   35   D   CA    .   16577   1    
     196   .   3   .   3   35   35   ASP   CB     C   13   40.596    0.043   .   1   .   .   .   .   .   35   D   CB    .   16577   1    
     197   .   3   .   3   35   35   ASP   N      N   15   118.347   0.128   .   1   .   .   .   .   .   35   D   N     .   16577   1    
     198   .   3   .   3   36   36   LYS   H      H   1    7.355     0.007   .   1   .   .   .   .   .   36   K   HN    .   16577   1    
     199   .   3   .   3   36   36   LYS   C      C   13   178.112   0.000   .   1   .   .   .   .   .   36   K   C     .   16577   1    
     200   .   3   .   3   36   36   LYS   CA     C   13   58.476    0.053   .   1   .   .   .   .   .   36   K   CA    .   16577   1    
     201   .   3   .   3   36   36   LYS   CB     C   13   32.335    0.316   .   1   .   .   .   .   .   36   K   CB    .   16577   1    
     202   .   3   .   3   36   36   LYS   N      N   15   120.005   0.058   .   1   .   .   .   .   .   36   K   N     .   16577   1    
     203   .   3   .   3   37   37   ARG   H      H   1    8.873     0.005   .   1   .   .   .   .   .   37   R   HN    .   16577   1    
     204   .   3   .   3   37   37   ARG   C      C   13   177.881   0.000   .   1   .   .   .   .   .   37   R   C     .   16577   1    
     205   .   3   .   3   37   37   ARG   CA     C   13   59.904    0.120   .   1   .   .   .   .   .   37   R   CA    .   16577   1    
     206   .   3   .   3   37   37   ARG   CB     C   13   30.286    0.000   .   1   .   .   .   .   .   37   R   CB    .   16577   1    
     207   .   3   .   3   37   37   ARG   N      N   15   120.990   0.058   .   1   .   .   .   .   .   37   R   N     .   16577   1    
     208   .   3   .   3   38   38   ARG   H      H   1    7.848     0.007   .   1   .   .   .   .   .   38   R   HN    .   16577   1    
     209   .   3   .   3   38   38   ARG   C      C   13   178.720   0.000   .   1   .   .   .   .   .   38   R   C     .   16577   1    
     210   .   3   .   3   38   38   ARG   CA     C   13   59.951    0.137   .   1   .   .   .   .   .   38   R   CA    .   16577   1    
     211   .   3   .   3   38   38   ARG   CB     C   13   29.700    0.212   .   1   .   .   .   .   .   38   R   CB    .   16577   1    
     212   .   3   .   3   38   38   ARG   N      N   15   119.018   0.050   .   1   .   .   .   .   .   38   R   N     .   16577   1    
     213   .   3   .   3   39   39   ARG   H      H   1    7.467     0.007   .   1   .   .   .   .   .   39   R   HN    .   16577   1    
     214   .   3   .   3   39   39   ARG   HA     H   1    4.157     0.000   .   1   .   .   .   .   .   39   R   HA    .   16577   1    
     215   .   3   .   3   39   39   ARG   C      C   13   178.907   0.000   .   1   .   .   .   .   .   39   R   C     .   16577   1    
     216   .   3   .   3   39   39   ARG   CA     C   13   59.563    0.084   .   1   .   .   .   .   .   39   R   CA    .   16577   1    
     217   .   3   .   3   39   39   ARG   CB     C   13   29.808    0.233   .   1   .   .   .   .   .   39   R   CB    .   16577   1    
     218   .   3   .   3   39   39   ARG   N      N   15   120.576   0.140   .   1   .   .   .   .   .   39   R   N     .   16577   1    
     219   .   3   .   3   40   40   ILE   H      H   1    8.717     0.006   .   1   .   .   .   .   .   40   I   HN    .   16577   1    
     220   .   3   .   3   40   40   ILE   C      C   13   180.193   0.000   .   1   .   .   .   .   .   40   I   C     .   16577   1    
     221   .   3   .   3   40   40   ILE   CA     C   13   64.185    0.039   .   1   .   .   .   .   .   40   I   CA    .   16577   1    
     222   .   3   .   3   40   40   ILE   CB     C   13   37.260    0.000   .   1   .   .   .   .   .   40   I   CB    .   16577   1    
     223   .   3   .   3   40   40   ILE   N      N   15   119.744   0.058   .   1   .   .   .   .   .   40   I   N     .   16577   1    
     224   .   3   .   3   41   41   SER   H      H   1    8.402     0.005   .   1   .   .   .   .   .   41   S   HN    .   16577   1    
     225   .   3   .   3   41   41   SER   C      C   13   176.218   0.000   .   1   .   .   .   .   .   41   S   C     .   16577   1    
     226   .   3   .   3   41   41   SER   CA     C   13   61.134    0.326   .   1   .   .   .   .   .   41   S   CA    .   16577   1    
     227   .   3   .   3   41   41   SER   CB     C   13   63.836    0.369   .   1   .   .   .   .   .   41   S   CB    .   16577   1    
     228   .   3   .   3   41   41   SER   N      N   15   119.683   0.104   .   1   .   .   .   .   .   41   S   N     .   16577   1    
     229   .   3   .   3   42   42   ALA   H      H   1    7.711     0.008   .   1   .   .   .   .   .   42   A   HN    .   16577   1    
     230   .   3   .   3   42   42   ALA   HA     H   1    4.217     0.006   .   1   .   .   .   .   .   42   A   HA    .   16577   1    
     231   .   3   .   3   42   42   ALA   HB1    H   1    1.573     0.021   .   1   .   .   .   .   .   42   A   HB    .   16577   1    
     232   .   3   .   3   42   42   ALA   HB2    H   1    1.573     0.021   .   1   .   .   .   .   .   42   A   HB    .   16577   1    
     233   .   3   .   3   42   42   ALA   HB3    H   1    1.573     0.021   .   1   .   .   .   .   .   42   A   HB    .   16577   1    
     234   .   3   .   3   42   42   ALA   C      C   13   180.181   0.000   .   1   .   .   .   .   .   42   A   C     .   16577   1    
     235   .   3   .   3   42   42   ALA   CA     C   13   54.927    0.096   .   1   .   .   .   .   .   42   A   CA    .   16577   1    
     236   .   3   .   3   42   42   ALA   CB     C   13   18.054    0.186   .   1   .   .   .   .   .   42   A   CB    .   16577   1    
     237   .   3   .   3   42   42   ALA   N      N   15   121.985   0.151   .   1   .   .   .   .   .   42   A   N     .   16577   1    
     238   .   3   .   3   43   43   THR   H      H   1    7.988     0.005   .   1   .   .   .   .   .   43   T   HN    .   16577   1    
     239   .   3   .   3   43   43   THR   HA     H   1    4.145     0.022   .   1   .   .   .   .   .   43   T   HA    .   16577   1    
     240   .   3   .   3   43   43   THR   C      C   13   176.242   0.000   .   1   .   .   .   .   .   43   T   C     .   16577   1    
     241   .   3   .   3   43   43   THR   CA     C   13   65.295    0.071   .   1   .   .   .   .   .   43   T   CA    .   16577   1    
     242   .   3   .   3   43   43   THR   CB     C   13   69.381    0.152   .   1   .   .   .   .   .   43   T   CB    .   16577   1    
     243   .   3   .   3   43   43   THR   N      N   15   111.449   0.125   .   1   .   .   .   .   .   43   T   N     .   16577   1    
     244   .   3   .   3   44   44   THR   H      H   1    7.961     0.008   .   1   .   .   .   .   .   44   T   HN    .   16577   1    
     245   .   3   .   3   44   44   THR   HG21   H   1    1.238     0.000   .   1   .   .   .   .   .   44   T   HG2   .   16577   1    
     246   .   3   .   3   44   44   THR   HG22   H   1    1.238     0.000   .   1   .   .   .   .   .   44   T   HG2   .   16577   1    
     247   .   3   .   3   44   44   THR   HG23   H   1    1.238     0.000   .   1   .   .   .   .   .   44   T   HG2   .   16577   1    
     248   .   3   .   3   44   44   THR   C      C   13   175.813   0.000   .   1   .   .   .   .   .   44   T   C     .   16577   1    
     249   .   3   .   3   44   44   THR   CA     C   13   63.033    0.074   .   1   .   .   .   .   .   44   T   CA    .   16577   1    
     250   .   3   .   3   44   44   THR   CB     C   13   72.108    0.112   .   1   .   .   .   .   .   44   T   CB    .   16577   1    
     251   .   3   .   3   44   44   THR   N      N   15   108.488   0.088   .   1   .   .   .   .   .   44   T   N     .   16577   1    
     252   .   3   .   3   45   45   ASN   H      H   1    8.079     0.011   .   1   .   .   .   .   .   45   N   HN    .   16577   1    
     253   .   3   .   3   45   45   ASN   HA     H   1    4.399     0.000   .   1   .   .   .   .   .   45   N   HA    .   16577   1    
     254   .   3   .   3   45   45   ASN   C      C   13   174.218   0.000   .   1   .   .   .   .   .   45   N   C     .   16577   1    
     255   .   3   .   3   45   45   ASN   CA     C   13   55.576    0.024   .   1   .   .   .   .   .   45   N   CA    .   16577   1    
     256   .   3   .   3   45   45   ASN   CB     C   13   37.594    0.154   .   1   .   .   .   .   .   45   N   CB    .   16577   1    
     257   .   3   .   3   45   45   ASN   N      N   15   117.396   0.129   .   1   .   .   .   .   .   45   N   N     .   16577   1    
     258   .   3   .   3   46   46   LEU   H      H   1    7.506     0.009   .   1   .   .   .   .   .   46   L   HN    .   16577   1    
     259   .   3   .   3   46   46   LEU   HA     H   1    4.507     0.000   .   1   .   .   .   .   .   46   L   HA    .   16577   1    
     260   .   3   .   3   46   46   LEU   C      C   13   177.084   0.000   .   1   .   .   .   .   .   46   L   C     .   16577   1    
     261   .   3   .   3   46   46   LEU   CA     C   13   53.667    0.097   .   1   .   .   .   .   .   46   L   CA    .   16577   1    
     262   .   3   .   3   46   46   LEU   CB     C   13   43.743    0.201   .   1   .   .   .   .   .   46   L   CB    .   16577   1    
     263   .   3   .   3   46   46   LEU   N      N   15   120.277   0.153   .   1   .   .   .   .   .   46   L   N     .   16577   1    
     264   .   3   .   3   47   47   SER   H      H   1    9.578     0.028   .   1   .   .   .   .   .   47   S   HN    .   16577   1    
     265   .   3   .   3   47   47   SER   C      C   13   175.184   0.000   .   1   .   .   .   .   .   47   S   C     .   16577   1    
     266   .   3   .   3   47   47   SER   CA     C   13   57.553    0.137   .   1   .   .   .   .   .   47   S   CA    .   16577   1    
     267   .   3   .   3   47   47   SER   CB     C   13   64.866    0.069   .   1   .   .   .   .   .   47   S   CB    .   16577   1    
     268   .   3   .   3   47   47   SER   N      N   15   119.017   0.056   .   1   .   .   .   .   .   47   S   N     .   16577   1    
     269   .   3   .   3   48   48   GLU   H      H   1    9.120     0.004   .   1   .   .   .   .   .   48   E   HN    .   16577   1    
     270   .   3   .   3   48   48   GLU   C      C   13   178.729   0.000   .   1   .   .   .   .   .   48   E   C     .   16577   1    
     271   .   3   .   3   48   48   GLU   CA     C   13   61.786    0.084   .   1   .   .   .   .   .   48   E   CA    .   16577   1    
     272   .   3   .   3   48   48   GLU   CB     C   13   29.347    0.000   .   1   .   .   .   .   .   48   E   CB    .   16577   1    
     273   .   3   .   3   48   48   GLU   N      N   15   121.225   0.054   .   1   .   .   .   .   .   48   E   N     .   16577   1    
     274   .   3   .   3   49   49   ARG   H      H   1    8.337     0.011   .   1   .   .   .   .   .   49   R   HN    .   16577   1    
     275   .   3   .   3   49   49   ARG   C      C   13   178.119   0.000   .   1   .   .   .   .   .   49   R   C     .   16577   1    
     276   .   3   .   3   49   49   ARG   CA     C   13   59.083    0.055   .   1   .   .   .   .   .   49   R   CA    .   16577   1    
     277   .   3   .   3   49   49   ARG   CB     C   13   29.007    0.000   .   1   .   .   .   .   .   49   R   CB    .   16577   1    
     278   .   3   .   3   49   49   ARG   N      N   15   119.578   0.045   .   1   .   .   .   .   .   49   R   N     .   16577   1    
     279   .   3   .   3   50   50   GLN   H      H   1    8.135     0.012   .   1   .   .   .   .   .   50   Q   HN    .   16577   1    
     280   .   3   .   3   50   50   GLN   C      C   13   180.575   0.000   .   1   .   .   .   .   .   50   Q   C     .   16577   1    
     281   .   3   .   3   50   50   GLN   CA     C   13   59.789    0.040   .   1   .   .   .   .   .   50   Q   CA    .   16577   1    
     282   .   3   .   3   50   50   GLN   CB     C   13   29.465    0.000   .   1   .   .   .   .   .   50   Q   CB    .   16577   1    
     283   .   3   .   3   50   50   GLN   N      N   15   118.823   0.041   .   1   .   .   .   .   .   50   Q   N     .   16577   1    
     284   .   3   .   3   51   51   VAL   H      H   1    8.445     0.003   .   1   .   .   .   .   .   51   V   HN    .   16577   1    
     285   .   3   .   3   51   51   VAL   C      C   13   177.370   0.000   .   1   .   .   .   .   .   51   V   C     .   16577   1    
     286   .   3   .   3   51   51   VAL   CA     C   13   67.919    0.160   .   1   .   .   .   .   .   51   V   CA    .   16577   1    
     287   .   3   .   3   51   51   VAL   CB     C   13   30.543    0.000   .   1   .   .   .   .   .   51   V   CB    .   16577   1    
     288   .   3   .   3   51   51   VAL   N      N   15   121.699   0.042   .   1   .   .   .   .   .   51   V   N     .   16577   1    
     289   .   3   .   3   52   52   THR   H      H   1    8.475     0.004   .   1   .   .   .   .   .   52   T   HN    .   16577   1    
     290   .   3   .   3   52   52   THR   C      C   13   177.815   0.000   .   1   .   .   .   .   .   52   T   C     .   16577   1    
     291   .   3   .   3   52   52   THR   CA     C   13   67.831    0.468   .   1   .   .   .   .   .   52   T   CA    .   16577   1    
     292   .   3   .   3   52   52   THR   CB     C   13   69.778    0.000   .   1   .   .   .   .   .   52   T   CB    .   16577   1    
     293   .   3   .   3   52   52   THR   N      N   15   118.611   0.059   .   1   .   .   .   .   .   52   T   N     .   16577   1    
     294   .   3   .   3   53   53   ILE   H      H   1    8.704     0.006   .   1   .   .   .   .   .   53   I   HN    .   16577   1    
     295   .   3   .   3   53   53   ILE   HA     H   1    3.676     0.000   .   1   .   .   .   .   .   53   I   HA    .   16577   1    
     296   .   3   .   3   53   53   ILE   C      C   13   176.381   0.000   .   1   .   .   .   .   .   53   I   C     .   16577   1    
     297   .   3   .   3   53   53   ILE   CA     C   13   64.049    0.019   .   1   .   .   .   .   .   53   I   CA    .   16577   1    
     298   .   3   .   3   53   53   ILE   CB     C   13   37.605    0.162   .   1   .   .   .   .   .   53   I   CB    .   16577   1    
     299   .   3   .   3   53   53   ILE   N      N   15   123.775   0.046   .   1   .   .   .   .   .   53   I   N     .   16577   1    
     300   .   3   .   3   54   54   TRP   H      H   1    8.810     0.005   .   1   .   .   .   .   .   54   W   HN    .   16577   1    
     301   .   3   .   3   54   54   TRP   HD1    H   1    7.377     0.000   .   1   .   .   .   .   .   54   W   HD1   .   16577   1    
     302   .   3   .   3   54   54   TRP   HE1    H   1    9.914     0.003   .   1   .   .   .   .   .   54   W   HE1   .   16577   1    
     303   .   3   .   3   54   54   TRP   C      C   13   179.796   0.000   .   1   .   .   .   .   .   54   W   C     .   16577   1    
     304   .   3   .   3   54   54   TRP   CA     C   13   63.189    0.055   .   1   .   .   .   .   .   54   W   CA    .   16577   1    
     305   .   3   .   3   54   54   TRP   CB     C   13   27.954    0.000   .   1   .   .   .   .   .   54   W   CB    .   16577   1    
     306   .   3   .   3   54   54   TRP   N      N   15   123.464   0.064   .   1   .   .   .   .   .   54   W   N     .   16577   1    
     307   .   3   .   3   54   54   TRP   NE1    N   15   130.176   0.020   .   1   .   .   .   .   .   54   W   NE1   .   16577   1    
     308   .   3   .   3   55   55   PHE   H      H   1    8.629     0.007   .   1   .   .   .   .   .   55   F   HN    .   16577   1    
     309   .   3   .   3   55   55   PHE   C      C   13   176.933   0.000   .   1   .   .   .   .   .   55   F   C     .   16577   1    
     310   .   3   .   3   55   55   PHE   CA     C   13   63.642    0.099   .   1   .   .   .   .   .   55   F   CA    .   16577   1    
     311   .   3   .   3   55   55   PHE   CB     C   13   38.711    0.000   .   1   .   .   .   .   .   55   F   CB    .   16577   1    
     312   .   3   .   3   55   55   PHE   N      N   15   119.683   0.033   .   1   .   .   .   .   .   55   F   N     .   16577   1    
     313   .   3   .   3   56   56   GLN   H      H   1    7.747     0.006   .   1   .   .   .   .   .   56   Q   HN    .   16577   1    
     314   .   3   .   3   56   56   GLN   C      C   13   179.123   0.000   .   1   .   .   .   .   .   56   Q   C     .   16577   1    
     315   .   3   .   3   56   56   GLN   CA     C   13   59.750    0.175   .   1   .   .   .   .   .   56   Q   CA    .   16577   1    
     316   .   3   .   3   56   56   GLN   CB     C   13   28.349    0.000   .   1   .   .   .   .   .   56   Q   CB    .   16577   1    
     317   .   3   .   3   56   56   GLN   N      N   15   119.364   0.089   .   1   .   .   .   .   .   56   Q   N     .   16577   1    
     318   .   3   .   3   57   57   ASN   H      H   1    8.460     0.011   .   1   .   .   .   .   .   57   N   HN    .   16577   1    
     319   .   3   .   3   57   57   ASN   C      C   13   177.874   0.000   .   1   .   .   .   .   .   57   N   C     .   16577   1    
     320   .   3   .   3   57   57   ASN   CA     C   13   55.075    0.097   .   1   .   .   .   .   .   57   N   CA    .   16577   1    
     321   .   3   .   3   57   57   ASN   CB     C   13   38.805    0.065   .   1   .   .   .   .   .   57   N   CB    .   16577   1    
     322   .   3   .   3   57   57   ASN   N      N   15   117.795   0.047   .   1   .   .   .   .   .   57   N   N     .   16577   1    
     323   .   3   .   3   58   58   ARG   H      H   1    8.628     0.007   .   1   .   .   .   .   .   58   R   HN    .   16577   1    
     324   .   3   .   3   58   58   ARG   HB2    H   1    -0.541    0.000   .   2   .   .   .   .   .   58   R   HB2   .   16577   1    
     325   .   3   .   3   58   58   ARG   C      C   13   178.956   0.000   .   1   .   .   .   .   .   58   R   C     .   16577   1    
     326   .   3   .   3   58   58   ARG   CA     C   13   56.138    0.023   .   1   .   .   .   .   .   58   R   CA    .   16577   1    
     327   .   3   .   3   58   58   ARG   CB     C   13   27.628    0.000   .   1   .   .   .   .   .   58   R   CB    .   16577   1    
     328   .   3   .   3   58   58   ARG   N      N   15   128.105   0.094   .   1   .   .   .   .   .   58   R   N     .   16577   1    
     329   .   3   .   3   59   59   ARG   H      H   1    7.692     0.010   .   1   .   .   .   .   .   59   R   HN    .   16577   1    
     330   .   3   .   3   59   59   ARG   C      C   13   179.836   0.000   .   1   .   .   .   .   .   59   R   C     .   16577   1    
     331   .   3   .   3   59   59   ARG   CA     C   13   60.060    0.199   .   1   .   .   .   .   .   59   R   CA    .   16577   1    
     332   .   3   .   3   59   59   ARG   CB     C   13   30.247    0.000   .   1   .   .   .   .   .   59   R   CB    .   16577   1    
     333   .   3   .   3   59   59   ARG   N      N   15   120.941   0.071   .   1   .   .   .   .   .   59   R   N     .   16577   1    
     334   .   3   .   3   60   60   VAL   H      H   1    6.968     0.012   .   1   .   .   .   .   .   60   V   HN    .   16577   1    
     335   .   3   .   3   60   60   VAL   HA     H   1    3.726     0.000   .   1   .   .   .   .   .   60   V   HA    .   16577   1    
     336   .   3   .   3   60   60   VAL   C      C   13   178.198   0.000   .   1   .   .   .   .   .   60   V   C     .   16577   1    
     337   .   3   .   3   60   60   VAL   CA     C   13   66.322    0.152   .   1   .   .   .   .   .   60   V   CA    .   16577   1    
     338   .   3   .   3   60   60   VAL   CB     C   13   31.523    0.457   .   1   .   .   .   .   .   60   V   CB    .   16577   1    
     339   .   3   .   3   60   60   VAL   N      N   15   121.156   0.175   .   1   .   .   .   .   .   60   V   N     .   16577   1    
     340   .   3   .   3   61   61   LYS   H      H   1    7.463     0.011   .   1   .   .   .   .   .   61   K   HN    .   16577   1    
     341   .   3   .   3   61   61   LYS   C      C   13   178.033   0.000   .   1   .   .   .   .   .   61   K   C     .   16577   1    
     342   .   3   .   3   61   61   LYS   CA     C   13   59.591    0.061   .   1   .   .   .   .   .   61   K   CA    .   16577   1    
     343   .   3   .   3   61   61   LYS   CB     C   13   32.163    0.258   .   1   .   .   .   .   .   61   K   CB    .   16577   1    
     344   .   3   .   3   61   61   LYS   N      N   15   120.921   0.108   .   1   .   .   .   .   .   61   K   N     .   16577   1    
     345   .   3   .   3   62   62   GLU   H      H   1    7.811     0.009   .   1   .   .   .   .   .   62   E   HN    .   16577   1    
     346   .   3   .   3   62   62   GLU   C      C   13   177.804   0.000   .   1   .   .   .   .   .   62   E   C     .   16577   1    
     347   .   3   .   3   62   62   GLU   CA     C   13   59.215    0.172   .   1   .   .   .   .   .   62   E   CA    .   16577   1    
     348   .   3   .   3   62   62   GLU   CB     C   13   29.591    0.232   .   1   .   .   .   .   .   62   E   CB    .   16577   1    
     349   .   3   .   3   62   62   GLU   N      N   15   118.057   0.141   .   1   .   .   .   .   .   62   E   N     .   16577   1    
     350   .   3   .   3   63   63   LYS   H      H   1    7.632     0.005   .   1   .   .   .   .   .   63   K   HN    .   16577   1    
     351   .   3   .   3   63   63   LYS   HA     H   1    4.004     0.000   .   1   .   .   .   .   .   63   K   HA    .   16577   1    
     352   .   3   .   3   63   63   LYS   HB2    H   1    2.038     0.000   .   2   .   .   .   .   .   63   K   HB2   .   16577   1    
     353   .   3   .   3   63   63   LYS   C      C   13   178.339   0.000   .   1   .   .   .   .   .   63   K   C     .   16577   1    
     354   .   3   .   3   63   63   LYS   CA     C   13   59.154    0.018   .   1   .   .   .   .   .   63   K   CA    .   16577   1    
     355   .   3   .   3   63   63   LYS   CB     C   13   31.734    0.325   .   1   .   .   .   .   .   63   K   CB    .   16577   1    
     356   .   3   .   3   63   63   LYS   N      N   15   117.804   0.077   .   1   .   .   .   .   .   63   K   N     .   16577   1    
     357   .   3   .   3   64   64   LYS   H      H   1    7.900     0.009   .   1   .   .   .   .   .   64   K   HN    .   16577   1    
     358   .   3   .   3   64   64   LYS   HA     H   1    4.079     0.010   .   1   .   .   .   .   .   64   K   HA    .   16577   1    
     359   .   3   .   3   64   64   LYS   HB2    H   1    1.974     0.002   .   2   .   .   .   .   .   64   K   HB2   .   16577   1    
     360   .   3   .   3   64   64   LYS   C      C   13   178.968   0.000   .   1   .   .   .   .   .   64   K   C     .   16577   1    
     361   .   3   .   3   64   64   LYS   CA     C   13   59.104    0.046   .   1   .   .   .   .   .   64   K   CA    .   16577   1    
     362   .   3   .   3   64   64   LYS   CB     C   13   32.512    0.262   .   1   .   .   .   .   .   64   K   CB    .   16577   1    
     363   .   3   .   3   64   64   LYS   N      N   15   119.621   0.056   .   1   .   .   .   .   .   64   K   N     .   16577   1    
     364   .   3   .   3   65   65   VAL   H      H   1    8.035     0.008   .   1   .   .   .   .   .   65   V   HN    .   16577   1    
     365   .   3   .   3   65   65   VAL   HA     H   1    3.800     0.003   .   1   .   .   .   .   .   65   V   HA    .   16577   1    
     366   .   3   .   3   65   65   VAL   HB     H   1    2.261     0.030   .   1   .   .   .   .   .   65   V   HB    .   16577   1    
     367   .   3   .   3   65   65   VAL   C      C   13   178.231   0.000   .   1   .   .   .   .   .   65   V   C     .   16577   1    
     368   .   3   .   3   65   65   VAL   CA     C   13   65.452    0.079   .   1   .   .   .   .   .   65   V   CA    .   16577   1    
     369   .   3   .   3   65   65   VAL   CB     C   13   31.776    0.305   .   1   .   .   .   .   .   65   V   CB    .   16577   1    
     370   .   3   .   3   65   65   VAL   N      N   15   119.788   0.145   .   1   .   .   .   .   .   65   V   N     .   16577   1    
     371   .   3   .   3   66   66   ILE   H      H   1    8.061     0.004   .   1   .   .   .   .   .   66   I   HN    .   16577   1    
     372   .   3   .   3   66   66   ILE   C      C   13   177.970   0.000   .   1   .   .   .   .   .   66   I   C     .   16577   1    
     373   .   3   .   3   66   66   ILE   CA     C   13   63.762    0.213   .   1   .   .   .   .   .   66   I   CA    .   16577   1    
     374   .   3   .   3   66   66   ILE   CB     C   13   37.845    0.260   .   1   .   .   .   .   .   66   I   CB    .   16577   1    
     375   .   3   .   3   66   66   ILE   N      N   15   120.928   0.045   .   1   .   .   .   .   .   66   I   N     .   16577   1    
     376   .   3   .   3   67   67   ASN   H      H   1    8.108     0.004   .   1   .   .   .   .   .   67   N   HN    .   16577   1    
     377   .   3   .   3   67   67   ASN   HA     H   1    4.589     0.000   .   1   .   .   .   .   .   67   N   HA    .   16577   1    
     378   .   3   .   3   67   67   ASN   HB2    H   1    2.873     0.000   .   2   .   .   .   .   .   67   N   HB2   .   16577   1    
     379   .   3   .   3   67   67   ASN   C      C   13   176.524   0.000   .   1   .   .   .   .   .   67   N   C     .   16577   1    
     380   .   3   .   3   67   67   ASN   CA     C   13   54.822    0.053   .   1   .   .   .   .   .   67   N   CA    .   16577   1    
     381   .   3   .   3   67   67   ASN   CB     C   13   38.589    0.050   .   1   .   .   .   .   .   67   N   CB    .   16577   1    
     382   .   3   .   3   67   67   ASN   N      N   15   119.198   0.054   .   1   .   .   .   .   .   67   N   N     .   16577   1    
     383   .   3   .   3   68   68   LYS   H      H   1    7.865     0.004   .   1   .   .   .   .   .   68   K   HN    .   16577   1    
     384   .   3   .   3   68   68   LYS   HA     H   1    4.344     0.000   .   1   .   .   .   .   .   68   K   HA    .   16577   1    
     385   .   3   .   3   68   68   LYS   HB2    H   1    1.839     0.000   .   2   .   .   .   .   .   68   K   HB2   .   16577   1    
     386   .   3   .   3   68   68   LYS   C      C   13   177.406   0.000   .   1   .   .   .   .   .   68   K   C     .   16577   1    
     387   .   3   .   3   68   68   LYS   CA     C   13   57.721    0.052   .   1   .   .   .   .   .   68   K   CA    .   16577   1    
     388   .   3   .   3   68   68   LYS   CB     C   13   32.558    0.197   .   1   .   .   .   .   .   68   K   CB    .   16577   1    
     389   .   3   .   3   68   68   LYS   N      N   15   121.078   0.185   .   1   .   .   .   .   .   68   K   N     .   16577   1    
     390   .   3   .   3   69   69   LEU   H      H   1    7.915     0.005   .   1   .   .   .   .   .   69   L   HN    .   16577   1    
     391   .   3   .   3   69   69   LEU   C      C   13   177.720   0.000   .   1   .   .   .   .   .   69   L   C     .   16577   1    
     392   .   3   .   3   69   69   LEU   CA     C   13   55.827    0.044   .   1   .   .   .   .   .   69   L   CA    .   16577   1    
     393   .   3   .   3   69   69   LEU   CB     C   13   42.050    0.221   .   1   .   .   .   .   .   69   L   CB    .   16577   1    
     394   .   3   .   3   69   69   LEU   N      N   15   121.247   0.075   .   1   .   .   .   .   .   69   L   N     .   16577   1    
     395   .   3   .   3   70   70   LYS   H      H   1    7.953     0.004   .   1   .   .   .   .   .   70   K   HN    .   16577   1    
     396   .   3   .   3   70   70   LYS   HA     H   1    4.359     0.000   .   1   .   .   .   .   .   70   K   HA    .   16577   1    
     397   .   3   .   3   70   70   LYS   HB2    H   1    1.916     0.000   .   2   .   .   .   .   .   70   K   HB2   .   16577   1    
     398   .   3   .   3   70   70   LYS   C      C   13   176.888   0.000   .   1   .   .   .   .   .   70   K   C     .   16577   1    
     399   .   3   .   3   70   70   LYS   CA     C   13   56.738    0.128   .   1   .   .   .   .   .   70   K   CA    .   16577   1    
     400   .   3   .   3   70   70   LYS   CB     C   13   32.740    0.275   .   1   .   .   .   .   .   70   K   CB    .   16577   1    
     401   .   3   .   3   70   70   LYS   N      N   15   120.974   0.049   .   1   .   .   .   .   .   70   K   N     .   16577   1    
     402   .   3   .   3   71   71   THR   H      H   1    8.044     0.005   .   1   .   .   .   .   .   71   T   HN    .   16577   1    
     403   .   3   .   3   71   71   THR   HA     H   1    4.417     0.045   .   1   .   .   .   .   .   71   T   HA    .   16577   1    
     404   .   3   .   3   71   71   THR   HG21   H   1    1.255     0.000   .   1   .   .   .   .   .   71   T   HG2   .   16577   1    
     405   .   3   .   3   71   71   THR   HG22   H   1    1.255     0.000   .   1   .   .   .   .   .   71   T   HG2   .   16577   1    
     406   .   3   .   3   71   71   THR   HG23   H   1    1.255     0.000   .   1   .   .   .   .   .   71   T   HG2   .   16577   1    
     407   .   3   .   3   71   71   THR   C      C   13   174.730   0.000   .   1   .   .   .   .   .   71   T   C     .   16577   1    
     408   .   3   .   3   71   71   THR   CA     C   13   61.930    0.052   .   1   .   .   .   .   .   71   T   CA    .   16577   1    
     409   .   3   .   3   71   71   THR   CB     C   13   69.852    0.032   .   1   .   .   .   .   .   71   T   CB    .   16577   1    
     410   .   3   .   3   71   71   THR   N      N   15   114.488   0.145   .   1   .   .   .   .   .   71   T   N     .   16577   1    
     411   .   3   .   3   72   72   THR   H      H   1    8.043     0.007   .   1   .   .   .   .   .   72   T   HN    .   16577   1    
     412   .   3   .   3   72   72   THR   HA     H   1    4.465     0.000   .   1   .   .   .   .   .   72   T   HA    .   16577   1    
     413   .   3   .   3   72   72   THR   HG21   H   1    1.244     0.000   .   1   .   .   .   .   .   72   T   HG2   .   16577   1    
     414   .   3   .   3   72   72   THR   HG22   H   1    1.244     0.000   .   1   .   .   .   .   .   72   T   HG2   .   16577   1    
     415   .   3   .   3   72   72   THR   HG23   H   1    1.244     0.000   .   1   .   .   .   .   .   72   T   HG2   .   16577   1    
     416   .   3   .   3   72   72   THR   C      C   13   173.777   0.000   .   1   .   .   .   .   .   72   T   C     .   16577   1    
     417   .   3   .   3   72   72   THR   CA     C   13   61.727    0.047   .   1   .   .   .   .   .   72   T   CA    .   16577   1    
     418   .   3   .   3   72   72   THR   CB     C   13   70.015    0.042   .   1   .   .   .   .   .   72   T   CB    .   16577   1    
     419   .   3   .   3   72   72   THR   N      N   15   115.923   0.153   .   1   .   .   .   .   .   72   T   N     .   16577   1    
     420   .   3   .   3   73   73   SER   H      H   1    7.943     0.003   .   1   .   .   .   .   .   73   S   HN    .   16577   1    
     421   .   3   .   3   73   73   SER   CA     C   13   60.277    0.251   .   1   .   .   .   .   .   73   S   CA    .   16577   1    
     422   .   3   .   3   73   73   SER   CB     C   13   65.003    0.063   .   1   .   .   .   .   .   73   S   CB    .   16577   1    
     423   .   3   .   3   73   73   SER   N      N   15   123.847   0.055   .   1   .   .   .   .   .   73   S   N     .   16577   1    

   stop_

save_