*HEADER    ANTIMICROBIAL PROTEIN                   20-JUN-19   6S2D              
*TITLE     WINTER FLOUNDER 1 IN SDS MICELLES                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PLEUROCIDIN-LIKE PREPROPOLYPEPTIDE;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: PSEUDOPLEURONECTES AMERICANUS;                  
*SOURCE   4 ORGANISM_COMMON: WINTER FLOUNDER;                                    
*SOURCE   5 ORGANISM_TAXID: 8265                                                 
*KEYWDS    WINTER FLOUNDER, AMP, ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    100                                                                   
*AUTHOR    M.CLARKE,A.J.MASON                                                    
*REVDAT   1   15-JUL-20 6S2D    0                                                
# Restraints file 1: WF1-noes.tab
VARS INDEX GROUP RESID_I RESNAME_I ATOMNAME_I SEGNAME_I RESID_J RESNAME_J ATOMNAME_J SEGNAME_J D_LO D_HI FC W S
FORMAT %4d %3d  %5d %6s %6s %4s  %5d %6s %6s %4s  %9.3f %9.3f %.2f %.2f %.2f

   1  1   10 GLY  HA1     A   11 LYS   HN     A    0.000   3.300 100.0 1.0 1.0
   1  1   10 GLY  HA2     A   11 LYS   HN     A    0.000   3.300 100.0 1.0 1.0
   2  1    4 ARG  HA      A    5 TRP   HN     A    0.000   5.000 100.0 1.0 1.0
   3  1   19 GLY  HA1     A   20 ALA   HN     A    0.000   3.300 100.0 1.0 1.0
   3  1   19 GLY  HA2     A   20 ALA   HN     A    0.000   3.300 100.0 1.0 1.0
   4  1   16 ILE  HA      A   20 ALA   HN     A    0.000   3.300 100.0 1.0 1.0
   5  1    3 GLY  HA1     A    4 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
   5  1    3 GLY  HA2     A    4 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
   6  1    3 GLY  HA1     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
   6  1    3 GLY  HA2     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
   7  1   21 LEU  HA      A   24 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
   8  1   13 GLY  HA1     A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   8  1   13 GLY  HA2     A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
   9  1    5 TRP  HA      A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  10  1   15 ILE  HA      A   18 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  11  1   15 ILE  HA      A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  12  1   18 GLY  HA1     A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  12  1   18 GLY  HA2     A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  13  1   11 LYS  HB1     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  13  2   11 LYS  HB2     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  14  1   11 LYS  HB1     A   12 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  14  2   11 LYS  HB2     A   12 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  15  1    4 ARG  HB1     A    5 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  15  1    4 ARG  HB2     A    5 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  16  1   16 ILE  HD1     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  16  1   16 ILE  HD2     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  16  1   16 ILE  HD3     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  17  1    9 ILE  HD1     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  17  1    9 ILE  HD2     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  17  1    9 ILE  HD3     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  18  1   15 ILE  HB      A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  19  1   12 ALA  HB1     A   15 ILE   HN     A    0.000   3.300 100.0 1.0 1.0
  19  1   12 ALA  HB2     A   15 ILE   HN     A    0.000   3.300 100.0 1.0 1.0
  19  1   12 ALA  HB3     A   15 ILE   HN     A    0.000   3.300 100.0 1.0 1.0
  20  1   20 ALA  HB1     A   22 ASP   HN     A    0.000   5.000 100.0 1.0 1.0
  20  1   20 ALA  HB2     A   22 ASP   HN     A    0.000   5.000 100.0 1.0 1.0
  20  1   20 ALA  HB3     A   22 ASP   HN     A    0.000   5.000 100.0 1.0 1.0
  21  1    4 ARG  HB1     A    7 GLU   HN     A    0.000   3.300 100.0 1.0 1.0
  21  1    4 ARG  HB2     A    7 GLU   HN     A    0.000   3.300 100.0 1.0 1.0
  22  1   20 ALA  HB1     A   24 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  22  1   20 ALA  HB2     A   24 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  22  1   20 ALA  HB3     A   24 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  23  1    9 ILE  HD1     A   10 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  23  1    9 ILE  HD2     A   10 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  23  1    9 ILE  HD3     A   10 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  24  1    7 GLU  HG1     A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  24  1    7 GLU  HG2     A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD11    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD12    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD13    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD21    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD22    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  25  1    6 LEU  HD23    A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  26  1    5 TRP  HA      A    8 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  27  1    5 TRP  HB1     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  27  2    5 TRP  HB2     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  28  1    5 TRP  HB1     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  28  2    5 TRP  HB2     A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  29  1    4 ARG  HA      A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  30  1    8 ARG  HN      A    9 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  31  1   18 GLY  HN      A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  32  1   18 GLY  HN      A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  33  1   10 GLY  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  34  1    3 GLY  HN      A    4 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  35  1   19 GLY  HN      A   21 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  36  1   12 ALA  HN      A   16 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  37  1   15 ILE  HN      A   19 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  38  1   13 GLY  HN      A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  39  1    5 TRP  HN      A    7 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  40  1   21 LEU  HN      A   24 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  41  1   16 ILE  HN      A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  42  1   11 LSY  HN      A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  43  1   12 ALA  HB1     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  43  1   12 ALA  HB2     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  43  1   12 ALA  HB3     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  44  1    8 ARG  HB1     A   10 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  44  1    8 ARG  HB2     A   10 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  45  1   13 GLY  HA1     A   16 ILE   HB     A    0.000   5.000 100.0 1.0 1.0
  45  1   13 GLY  HA2     A   16 ILE   HB     A    0.000   5.000 100.0 1.0 1.0
  46  1    6 LEU  HA      A    8 ARG   HB1    A    0.000   5.000 100.0 1.0 1.0
  46  1    6 LEU  HA      A    8 ARG   HB2    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA1     A   20 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA1     A   20 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA1     A   20 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA2     A   20 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA2     A   20 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  47  1   19 GLY  HA2     A   20 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA1     A   20 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA1     A   20 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA1     A   20 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA2     A   20 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA2     A   20 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  48  1   18 GLY  HA2     A   20 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  49  1    3 GLY  HA1     A    6 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  49  1    3 GLY  HA1     A    6 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  49  1    3 GLY  HA2     A    6 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  49  1    3 GLY  HA2     A    6 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  50  1   15 ILE  HA      A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  51  1   17 ILE  HD1     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  51  1   17 ILE  HD2     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  51  1   17 ILE  HD3     A   20 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  52  1   16 ILE  HA      A   17 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  53  1    2 LYS  HA      A    5 TRP   HN     A    0.000   5.000 100.0 1.0 1.0
  54  1   11 LYS  HB1     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  54  1   11 LYS  HB2     A   13 GLY   HN     A    0.000   5.000 100.0 1.0 1.0
  55  1    4 ARG  HN      A    5 TRP   HN     A    0.000   2.700 100.0 1.0 1.0
  56  1    3 GLY  HA1     A    4 ARG   HA     A    0.000   2.700 100.0 1.0 1.0
  56  1    3 GLY  HA2     A    4 ARG   HA     A    0.000   2.700 100.0 1.0 1.0
  57  1   15 ILE  HA      A   16 ILE   HB     A    0.000   5.000 100.0 1.0 1.0
  58  1    9 ILE  HA      A   11 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  58  1    9 ILE  HA      A   11 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  59  1    2 LYS  HA      A    4 ARG   HB1    A    0.000   5.000 100.0 1.0 1.0
  59  1    2 LYS  HA      A    4 ARG   HB2    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA1     A   12 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA1     A   12 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA1     A   12 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA2     A   12 ALA   HB1    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA2     A   12 ALA   HB2    A    0.000   5.000 100.0 1.0 1.0
  60  1   10 GLY  HA2     A   12 ALA   HB3    A    0.000   5.000 100.0 1.0 1.0
  61  1    1 GLY  HA1     A    2 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  61  1    1 GLY  HA1     A    2 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  61  1    1 GLY  HA2     A    2 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  61  1    1 GLY  HA2     A    2 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  62  1   22 ASP  HB1     A   24 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  62  1   22 ASP  HB1     A   24 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  62  1   22 ASP  HB2     A   24 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  62  1   22 ASP  HB2     A   24 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  63  1    3 GLY  HA1     A    6 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  63  1    3 GLY  HA2     A    6 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  64  1    4 ARG  HA      A    6 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  65  1   11 LYS  HB1     A   14 PHE   HN     A    0.000   5.000 100.0 1.0 1.0
  65  1   11 LYS  HB2     A   14 PHE   HN     A    0.000   5.000 100.0 1.0 1.0

































































  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  61.083  -0.427   1.242
    2    H2   GLY   1           HT2      GLY   1  61.592  -0.908  -0.306
    3    H3   GLY   1           HT3      GLY   1  61.537  -2.036   0.964
    4    HA2  GLY   1           HA1      GLY   1  59.581  -1.411  -0.879
    5    HA3  GLY   1           HA2      GLY   1  59.508  -2.563   0.468
    6    H    LYS   2           HN       LYS   2  59.172  -1.512   2.683
    7    HA   LYS   2           HA       LYS   2  56.690  -0.026   2.546
    8    HB2  LYS   2           HB2      LYS   2  58.543  -0.532   4.915
    9    HB3  LYS   2           HB1      LYS   2  56.855   0.024   5.004
   10    HG2  LYS   2           HG2      LYS   2  56.023  -2.043   4.106
   11    HG3  LYS   2           HG1      LYS   2  57.650  -2.565   3.613
   12    HD2  LYS   2           HD2      LYS   2  56.893  -3.719   5.688
   13    HD3  LYS   2           HD1      LYS   2  58.347  -2.732   5.965
   14    HE2  LYS   2           HE2      LYS   2  56.421  -2.553   7.701
   15    HE3  LYS   2           HE1      LYS   2  57.125  -1.037   7.095
   16    HZ1  LYS   2           HZ1      LYS   2  54.760  -2.291   5.818
   17    HZ2  LYS   2           HZ2      LYS   2  55.312  -0.691   5.679
   18    HZ3  LYS   2           HZ3      LYS   2  54.605  -1.225   7.128
   19    H    GLY   3           HN       GLY   3  57.977   1.487   5.093
   20    HA2  GLY   3           HA1      GLY   3  58.212   3.895   5.348
   21    HA3  GLY   3           HA2      GLY   3  59.683   3.552   4.285
   22    H    ARG   4           HN       ARG   4  56.640   3.655   4.912
   23    HA   ARG   4           HA       ARG   4  56.248   5.783   4.667
   24    HB2  ARG   4           HB2      ARG   4  56.204   5.112   1.770
   25    HB3  ARG   4           HB1      ARG   4  54.818   6.110   2.265
   26    HG2  ARG   4           HG2      ARG   4  56.102   7.993   2.695
   27    HG3  ARG   4           HG1      ARG   4  57.514   7.075   3.235
   28    HD2  ARG   4           HD2      ARG   4  57.861   8.285   1.053
   29    HD3  ARG   4           HD1      ARG   4  58.104   6.528   0.926
   30    HE   ARG   4           HE       ARG   4  56.194   6.418  -0.472
   31   HH11  ARG   4          HH11      ARG   4  56.944   9.297  -1.167
   32   HH12  ARG   4          HH12      ARG   4  55.410  10.085  -1.012
   33   HH21  ARG   4          HH21      ARG   4  53.954   7.482   0.757
   34   HH22  ARG   4          HH22      ARG   4  53.717   9.058   0.078
   35    H    TRP   5           HN       TRP   5  55.269   2.778   4.292
   36    HA   TRP   5           HA       TRP   5  52.554   2.547   3.809
   37    HB2  TRP   5           HB2      TRP   5  54.013   0.686   4.560
   38    HB3  TRP   5           HB1      TRP   5  54.033   1.391   6.195
   39    HD1  TRP   5           HD1      TRP   5  51.140   0.659   3.695
   40    HE1  TRP   5           HE1      TRP   5  49.253  -0.613   4.950
   41    HE3  TRP   5           HE3      TRP   5  53.337   0.296   8.306
   42    HZ2  TRP   5           HZ2      TRP   5  48.790  -1.637   7.600
   43    HZ3  TRP   5           HZ3      TRP   5  52.153  -0.833  10.183
   44    HH2  TRP   5           HH2      TRP   5  49.884  -1.800   9.834
   45    H    LEU   6           HN       LEU   6  54.132   4.366   6.279
   46    HA   LEU   6           HA       LEU   6  51.603   4.789   7.823
   47    HB2  LEU   6           HB2      LEU   6  54.382   5.841   8.452
   48    HB3  LEU   6           HB1      LEU   6  52.991   5.673   9.550
   49    HG   LEU   6           HG       LEU   6  54.539   3.396   8.233
   50   HD11  LEU   6          HD11      LEU   6  54.280   4.237  11.156
   51   HD12  LEU   6          HD12      LEU   6  55.692   4.565  10.123
   52   HD13  LEU   6          HD13      LEU   6  55.254   2.888  10.526
   53   HD21  LEU   6          HD21      LEU   6  52.022   3.477   9.948
   54   HD22  LEU   6          HD22      LEU   6  53.066   2.035   9.899
   55   HD23  LEU   6          HD23      LEU   6  52.292   2.621   8.410
   56    H    GLU   7           HN       GLU   7  53.773   6.335   5.483
   57    HA   GLU   7           HA       GLU   7  53.036   9.051   6.162
   58    HB2  GLU   7           HB2      GLU   7  54.988   8.434   4.736
   59    HB3  GLU   7           HB1      GLU   7  53.861   7.926   3.456
   60    HG2  GLU   7           HG2      GLU   7  53.005  10.160   3.194
   61    HG3  GLU   7           HG1      GLU   7  53.815  10.718   4.677
   62    H    ARG   8           HN       ARG   8  51.308   6.457   4.755
   63    HA   ARG   8           HA       ARG   8  49.577   7.893   2.974
   64    HB2  ARG   8           HB2      ARG   8  48.786   5.471   4.633
   65    HB3  ARG   8           HB1      ARG   8  48.174   5.957   3.035
   66    HG2  ARG   8           HG2      ARG   8  51.015   5.039   3.672
   67    HG3  ARG   8           HG1      ARG   8  49.778   4.104   2.803
   68    HD2  ARG   8           HD2      ARG   8  49.699   6.117   1.151
   69    HD3  ARG   8           HD1      ARG   8  51.241   6.604   1.898
   70    HE   ARG   8           HE       ARG   8  51.551   3.895   1.232
   71   HH11  ARG   8          HH11      ARG   8  53.485   5.576   0.028
   72   HH12  ARG   8          HH12      ARG   8  53.027   5.680  -1.639
   73   HH21  ARG   8          HH21      ARG   8  49.786   4.575  -1.092
   74   HH22  ARG   8          HH22      ARG   8  50.933   5.113  -2.273
   75    H    ILE   9           HN       ILE   9  48.858   9.824   3.837
   76    HA   ILE   9           HA       ILE   9  47.821  10.164   6.461
   77    HB   ILE   9           HB       ILE   9  48.390  12.034   4.882
   78   HG12  ILE   9          HG12      ILE   9  45.516  12.089   5.919
   79   HG13  ILE   9          HG11      ILE   9  46.960  12.350   6.924
   80   HG21  ILE   9          HG21      ILE   9  47.185  10.893   2.916
   81   HG22  ILE   9          HG22      ILE   9  46.915  12.642   3.093
   82   HG23  ILE   9          HG23      ILE   9  45.668  11.490   3.629
   83   HD11  ILE   9           HD1      ILE   9  47.575  14.226   5.241
   84   HD12  ILE   9           HD2      ILE   9  46.222  14.539   6.353
   85   HD13  ILE   9           HD3      ILE   9  45.896  14.082   4.665
   86    H    GLY  10           HN       GLY  10  46.274   9.114   3.436
   87    HA2  GLY  10           HA1      GLY  10  44.328   7.866   3.177
   88    HA3  GLY  10           HA2      GLY  10  44.148   7.805   4.942
   89    H    LYS  11           HN       LYS  11  44.070  10.522   5.561
   90    HA   LYS  11           HA       LYS  11  41.327  11.148   4.644
   91    HB2  LYS  11           HB2      LYS  11  42.103  11.328   7.054
   92    HB3  LYS  11           HB1      LYS  11  43.104  12.712   6.554
   93    HG2  LYS  11           HG2      LYS  11  41.068  13.854   5.688
   94    HG3  LYS  11           HG1      LYS  11  40.077  12.482   6.242
   95    HD2  LYS  11           HD2      LYS  11  40.997  12.880   8.577
   96    HD3  LYS  11           HD1      LYS  11  41.733  14.379   7.958
   97    HE2  LYS  11           HE2      LYS  11  39.605  14.989   8.922
   98    HE3  LYS  11           HE1      LYS  11  39.413  15.062   7.154
   99    HZ1  LYS  11           HZ1      LYS  11  37.602  13.824   7.710
  100    HZ2  LYS  11           HZ2      LYS  11  38.331  13.126   9.076
  101    HZ3  LYS  11           HZ3      LYS  11  38.723  12.566   7.521
  102    H    ALA  12           HN       ALA  12  42.021  11.523   2.384
  103    HA   ALA  12           HA       ALA  12  43.716  13.840   1.831
  104    HB1  ALA  12           HB1      ALA  12  43.213  13.406  -0.468
  105    HB2  ALA  12           HB2      ALA  12  41.770  12.455  -0.041
  106    HB3  ALA  12           HB3      ALA  12  43.394  11.825   0.326
  107    H    GLY  13           HN       GLY  13  41.577  14.414   3.651
  108    HA2  GLY  13           HA1      GLY  13  40.091  16.156   3.996
  109    HA3  GLY  13           HA2      GLY  13  40.560  16.804   2.411
  110    H    PHE  14           HN       PHE  14  38.794  13.956   3.714
  111    HA   PHE  14           HA       PHE  14  36.798  12.998   3.032
  112    HB2  PHE  14           HB2      PHE  14  35.968  15.277   3.728
  113    HB3  PHE  14           HB1      PHE  14  36.094  15.783   2.026
  114    HD1  PHE  14           HD1      PHE  14  34.280  15.371   0.550
  115    HD2  PHE  14           HD2      PHE  14  34.599  13.099   4.208
  116    HE1  PHE  14           HE1      PHE  14  32.064  14.326   0.095
  117    HE2  PHE  14           HE2      PHE  14  32.382  12.056   3.751
  118    HZ   PHE  14           HZ       PHE  14  31.090  12.716   1.727
  119    H    ILE  15           HN       ILE  15  39.035  12.904   1.243
  120    HA   ILE  15           HA       ILE  15  39.511  12.311  -0.928
  121    HB   ILE  15           HB       ILE  15  36.511  11.970  -1.323
  122   HG12  ILE  15          HG12      ILE  15  37.035  10.794   0.713
  123   HG13  ILE  15          HG11      ILE  15  36.929   9.571  -0.568
  124   HG21  ILE  15          HG21      ILE  15  38.993  10.965  -2.752
  125   HG22  ILE  15          HG22      ILE  15  37.497  11.642  -3.422
  126   HG23  ILE  15          HG23      ILE  15  37.508   9.988  -2.780
  127   HD11  ILE  15           HD1      ILE  15  39.507   9.854  -0.784
  128   HD12  ILE  15           HD2      ILE  15  38.891   8.997   0.644
  129   HD13  ILE  15           HD3      ILE  15  39.410  10.692   0.781
  130    H    ILE  16           HN       ILE  16  39.956  14.694  -0.885
  131    HA   ILE  16           HA       ILE  16  38.501  15.951  -3.197
  132    HB   ILE  16           HB       ILE  16  39.463  17.306  -0.645
  133   HG12  ILE  16          HG12      ILE  16  37.208  15.984  -0.643
  134   HG13  ILE  16          HG11      ILE  16  37.205  17.646  -0.031
  135   HG21  ILE  16          HG21      ILE  16  38.305  18.426  -3.234
  136   HG22  ILE  16          HG22      ILE  16  39.873  18.805  -2.489
  137   HG23  ILE  16          HG23      ILE  16  38.371  19.357  -1.719
  138   HD11  ILE  16           HD1      ILE  16  36.205  18.488  -2.054
  139   HD12  ILE  16           HD2      ILE  16  35.281  17.040  -1.598
  140   HD13  ILE  16           HD3      ILE  16  36.471  16.955  -2.911
  141    H    ILE  17           HN       ILE  17  41.389  16.117  -1.046
  142    HA   ILE  17           HA       ILE  17  43.018  17.433  -3.042
  143    HB   ILE  17           HB       ILE  17  44.016  15.610  -0.807
  144   HG12  ILE  17          HG12      ILE  17  42.543  17.103   0.325
  145   HG13  ILE  17          HG11      ILE  17  44.151  17.824   0.524
  146   HG21  ILE  17          HG21      ILE  17  45.817  16.207  -2.230
  147   HG22  ILE  17          HG22      ILE  17  45.926  17.359  -0.883
  148   HG23  ILE  17          HG23      ILE  17  45.235  17.871  -2.438
  149   HD11  ILE  17           HD1      ILE  17  42.694  19.627  -0.074
  150   HD12  ILE  17           HD2      ILE  17  41.928  18.679  -1.367
  151   HD13  ILE  17           HD3      ILE  17  43.599  19.250  -1.555
  152    H    GLY  18           HN       GLY  18  42.522  14.058  -2.034
  153    HA2  GLY  18           HA1      GLY  18  44.306  13.054  -4.165
  154    HA3  GLY  18           HA2      GLY  18  43.398  12.092  -2.979
  155    H    GLY  19           HN       GLY  19  40.851  13.338  -3.396
  156    HA2  GLY  19           HA1      GLY  19  39.903  11.718  -5.562
  157    HA3  GLY  19           HA2      GLY  19  38.982  12.966  -4.700
  158    H    ALA  20           HN       ALA  20  40.863  15.125  -5.325
  159    HA   ALA  20           HA       ALA  20  39.667  16.029  -7.749
  160    HB1  ALA  20           HB1      ALA  20  40.577  17.623  -6.212
  161    HB2  ALA  20           HB2      ALA  20  41.536  17.741  -7.706
  162    HB3  ALA  20           HB3      ALA  20  42.190  16.877  -6.293
  163    H    LEU  21           HN       LEU  21  42.380  13.933  -7.168
  164    HA   LEU  21           HA       LEU  21  43.643  14.365  -9.772
  165    HB2  LEU  21           HB2      LEU  21  43.963  11.933  -7.981
  166    HB3  LEU  21           HB1      LEU  21  45.126  12.609  -9.146
  167    HG   LEU  21           HG       LEU  21  44.209  13.876  -6.526
  168   HD11  LEU  21          HD11      LEU  21  46.932  12.901  -7.501
  169   HD12  LEU  21          HD12      LEU  21  45.885  12.042  -6.346
  170   HD13  LEU  21          HD13      LEU  21  46.586  13.620  -5.910
  171   HD21  LEU  21          HD21      LEU  21  45.878  14.950  -8.839
  172   HD22  LEU  21          HD22      LEU  21  46.043  15.593  -7.187
  173   HD23  LEU  21          HD23      LEU  21  44.485  15.711  -8.034
  174    H    ASP  22           HN       ASP  22  40.888  12.676  -8.644
  175    HA   ASP  22           HA       ASP  22  40.805  10.365 -10.229
  176    HB2  ASP  22           HB2      ASP  22  38.557  12.303  -9.554
  177    HB3  ASP  22           HB1      ASP  22  38.322  10.663 -10.206
  178    H    HIS  23           HN       HIS  23  40.025  13.734 -11.130
  179    HA   HIS  23           HA       HIS  23  40.717  13.238 -13.896
  180    HB2  HIS  23           HB2      HIS  23  38.525  12.095 -13.883
  181    HB3  HIS  23           HB1      HIS  23  37.757  13.580 -13.270
  182    HD1  HIS  23           HD1      HIS  23  39.283  12.033 -16.356
  183    HD2  HIS  23           HD2      HIS  23  37.617  15.715 -15.190
  184    HE1  HIS  23           HE1      HIS  23  38.853  13.382 -18.483
  185    H    LEU  24           HN       LEU  24  39.758  15.168 -11.242
  186    HA   LEU  24           HA       LEU  24  39.535  17.668 -12.840
  187    HB2  LEU  24           HB2      LEU  24  39.279  16.960  -9.897
  188    HB3  LEU  24           HB1      LEU  24  39.390  18.653 -10.430
  189    HG   LEU  24           HG       LEU  24  37.414  18.387 -11.846
  190   HD11  LEU  24          HD11      LEU  24  37.641  15.474 -10.994
  191   HD12  LEU  24          HD12      LEU  24  37.560  16.143 -12.642
  192   HD13  LEU  24          HD13      LEU  24  36.116  16.158 -11.605
  193   HD21  LEU  24          HD21      LEU  24  37.089  18.933  -9.442
  194   HD22  LEU  24          HD22      LEU  24  36.969  17.197  -9.069
  195   HD23  LEU  24          HD23      LEU  24  35.730  17.978 -10.080
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  59.801   0.702  11.413
    2    H2   GLY   1           HT2      GLY   1  59.536  -0.155  12.857
    3    H3   GLY   1           HT3      GLY   1  59.820   1.520  12.896
    4    HA2  GLY   1           HA1      GLY   1  57.425   0.038  12.306
    5    HA3  GLY   1           HA2      GLY   1  57.633   1.625  13.072
    6    H    LYS   2           HN       LYS   2  58.442   0.136   9.900
    7    HA   LYS   2           HA       LYS   2  57.879   2.651   8.513
    8    HB2  LYS   2           HB2      LYS   2  58.373  -0.170   7.472
    9    HB3  LYS   2           HB1      LYS   2  58.293   1.300   6.468
   10    HG2  LYS   2           HG2      LYS   2  60.234   2.243   7.537
   11    HG3  LYS   2           HG1      LYS   2  60.219   0.996   8.807
   12    HD2  LYS   2           HD2      LYS   2  61.956   0.484   7.138
   13    HD3  LYS   2           HD1      LYS   2  60.672  -0.746   7.087
   14    HE2  LYS   2           HE2      LYS   2  60.522   1.665   5.249
   15    HE3  LYS   2           HE1      LYS   2  61.551   0.277   4.824
   16    HZ1  LYS   2           HZ1      LYS   2  58.907  -0.443   5.739
   17    HZ2  LYS   2           HZ2      LYS   2  59.785  -0.995   4.394
   18    HZ3  LYS   2           HZ3      LYS   2  58.911   0.460   4.304
   19    H    GLY   3           HN       GLY   3  55.667   1.827  10.068
   20    HA2  GLY   3           HA1      GLY   3  53.588   0.361   8.961
   21    HA3  GLY   3           HA2      GLY   3  53.288   2.021   9.653
   22    H    ARG   4           HN       ARG   4  54.204   3.580   8.809
   23    HA   ARG   4           HA       ARG   4  51.981   3.779   7.866
   24    HB2  ARG   4           HB2      ARG   4  54.083   5.937   7.322
   25    HB3  ARG   4           HB1      ARG   4  52.319   6.194   7.324
   26    HG2  ARG   4           HG2      ARG   4  52.252   5.306   9.682
   27    HG3  ARG   4           HG1      ARG   4  54.032   5.251   9.666
   28    HD2  ARG   4           HD2      ARG   4  52.251   7.705   9.378
   29    HD3  ARG   4           HD1      ARG   4  53.399   7.346  10.690
   30    HE   ARG   4           HE       ARG   4  54.981   7.357   8.407
   31   HH11  ARG   4          HH11      ARG   4  53.691   9.249   6.870
   32   HH12  ARG   4          HH12      ARG   4  54.024  10.791   7.586
   33   HH21  ARG   4          HH21      ARG   4  54.996   9.459  10.637
   34   HH22  ARG   4          HH22      ARG   4  54.762  10.909   9.720
   35    H    TRP   5           HN       TRP   5  54.516   2.715   6.258
   36    HA   TRP   5           HA       TRP   5  54.647   3.596   3.615
   37    HB2  TRP   5           HB2      TRP   5  55.920   1.659   4.608
   38    HB3  TRP   5           HB1      TRP   5  54.470   0.655   4.384
   39    HD1  TRP   5           HD1      TRP   5  53.704   0.134   1.880
   40    HE1  TRP   5           HE1      TRP   5  54.982   0.137  -0.384
   41    HE3  TRP   5           HE3      TRP   5  57.823   2.833   3.282
   42    HZ2  TRP   5           HZ2      TRP   5  57.461   1.181  -1.414
   43    HZ3  TRP   5           HZ3      TRP   5  59.631   3.319   1.642
   44    HH2  TRP   5           HH2      TRP   5  59.454   2.498  -0.703
   45    H    LEU   6           HN       LEU   6  51.919   2.246   5.223
   46    HA   LEU   6           HA       LEU   6  50.439   1.954   2.616
   47    HB2  LEU   6           HB2      LEU   6  50.534  -0.142   3.867
   48    HB3  LEU   6           HB1      LEU   6  49.978   0.673   5.344
   49    HG   LEU   6           HG       LEU   6  47.800   1.149   4.309
   50   HD11  LEU   6          HD11      LEU   6  47.383  -0.050   2.011
   51   HD12  LEU   6          HD12      LEU   6  49.153   0.004   1.836
   52   HD13  LEU   6          HD13      LEU   6  48.226   1.514   2.003
   53   HD21  LEU   6          HD21      LEU   6  48.236  -1.068   5.410
   54   HD22  LEU   6          HD22      LEU   6  48.614  -1.747   3.808
   55   HD23  LEU   6          HD23      LEU   6  46.976  -1.145   4.156
   56    H    GLU   7           HN       GLU   7  50.724   3.660   5.674
   57    HA   GLU   7           HA       GLU   7  48.056   4.989   5.178
   58    HB2  GLU   7           HB2      GLU   7  48.565   3.764   7.414
   59    HB3  GLU   7           HB1      GLU   7  49.674   5.111   7.752
   60    HG2  GLU   7           HG2      GLU   7  47.573   5.727   8.738
   61    HG3  GLU   7           HG1      GLU   7  47.701   6.681   7.243
   62    H    ARG   8           HN       ARG   8  50.121   5.721   3.519
   63    HA   ARG   8           HA       ARG   8  51.752   7.851   4.524
   64    HB2  ARG   8           HB2      ARG   8  51.958   6.558   2.307
   65    HB3  ARG   8           HB1      ARG   8  50.694   7.644   1.682
   66    HG2  ARG   8           HG2      ARG   8  52.175   9.592   2.479
   67    HG3  ARG   8           HG1      ARG   8  53.462   8.386   2.715
   68    HD2  ARG   8           HD2      ARG   8  53.137   7.680   0.307
   69    HD3  ARG   8           HD1      ARG   8  52.022   9.053   0.113
   70    HE   ARG   8           HE       ARG   8  54.888   9.233   0.089
   71   HH11  ARG   8          HH11      ARG   8  55.914  11.184   0.714
   72   HH12  ARG   8          HH12      ARG   8  54.929  12.569   1.042
   73   HH21  ARG   8          HH21      ARG   8  51.937  10.836   0.776
   74   HH22  ARG   8          HH22      ARG   8  52.677  12.373   1.076
   75    H    ILE   9           HN       ILE   9  51.297   9.871   5.094
   76    HA   ILE   9           HA       ILE   9  48.670  10.874   5.279
   77    HB   ILE   9           HB       ILE   9  50.557  11.821   6.557
   78   HG12  ILE   9          HG12      ILE   9  50.064  14.189   6.352
   79   HG13  ILE   9          HG11      ILE   9  49.486  13.990   4.688
   80   HG21  ILE   9          HG21      ILE   9  52.283  13.160   5.483
   81   HG22  ILE   9          HG22      ILE   9  51.492  12.980   3.899
   82   HG23  ILE   9          HG23      ILE   9  52.222  11.566   4.696
   83   HD11  ILE   9           HD1      ILE   9  47.488  12.915   5.385
   84   HD12  ILE   9           HD2      ILE   9  47.724  14.164   6.627
   85   HD13  ILE   9           HD3      ILE   9  48.168  12.476   6.970
   86    H    GLY  10           HN       GLY  10  50.544  10.379   2.511
   87    HA2  GLY  10           HA1      GLY  10  50.220  12.420   0.746
   88    HA3  GLY  10           HA2      GLY  10  49.914  10.734   0.287
   89    H    LYS  11           HN       LYS  11  47.599  10.611   2.205
   90    HA   LYS  11           HA       LYS  11  45.579  11.445   0.295
   91    HB2  LYS  11           HB2      LYS  11  44.034  10.865   2.344
   92    HB3  LYS  11           HB1      LYS  11  44.950   9.560   1.554
   93    HG2  LYS  11           HG2      LYS  11  46.608   9.525   3.272
   94    HG3  LYS  11           HG1      LYS  11  46.070  11.084   3.940
   95    HD2  LYS  11           HD2      LYS  11  43.976  10.102   4.700
   96    HD3  LYS  11           HD1      LYS  11  44.354   8.564   3.887
   97    HE2  LYS  11           HE2      LYS  11  44.869   8.349   6.267
   98    HE3  LYS  11           HE1      LYS  11  46.390   8.351   5.343
   99    HZ1  LYS  11           HZ1      LYS  11  45.193  10.578   6.901
  100    HZ2  LYS  11           HZ2      LYS  11  46.444  10.818   5.778
  101    HZ3  LYS  11           HZ3      LYS  11  46.696   9.827   7.134
  102    H    ALA  12           HN       ALA  12  45.503  13.598  -0.081
  103    HA   ALA  12           HA       ALA  12  45.900  15.632   1.867
  104    HB1  ALA  12           HB1      ALA  12  45.948  16.005  -0.570
  105    HB2  ALA  12           HB2      ALA  12  44.825  17.122   0.242
  106    HB3  ALA  12           HB3      ALA  12  44.195  15.714  -0.646
  107    H    GLY  13           HN       GLY  13  43.498  13.333   1.815
  108    HA2  GLY  13           HA1      GLY  13  41.387  13.199   2.762
  109    HA3  GLY  13           HA2      GLY  13  42.065  14.292   3.985
  110    H    PHE  14           HN       PHE  14  41.222  14.743   0.525
  111    HA   PHE  14           HA       PHE  14  38.938  16.441   1.218
  112    HB2  PHE  14           HB2      PHE  14  41.062  17.885   1.572
  113    HB3  PHE  14           HB1      PHE  14  41.248  17.827  -0.196
  114    HD1  PHE  14           HD1      PHE  14  40.165  19.507  -1.472
  115    HD2  PHE  14           HD2      PHE  14  38.605  18.481   2.421
  116    HE1  PHE  14           HE1      PHE  14  38.464  21.313  -1.679
  117    HE2  PHE  14           HE2      PHE  14  36.904  20.289   2.213
  118    HZ   PHE  14           HZ       PHE  14  36.807  21.676   0.146
  119    H    ILE  15           HN       ILE  15  41.383  15.638  -1.294
  120    HA   ILE  15           HA       ILE  15  39.223  14.742  -3.080
  121    HB   ILE  15           HB       ILE  15  40.049  16.233  -4.987
  122   HG12  ILE  15          HG12      ILE  15  41.269  17.768  -2.643
  123   HG13  ILE  15          HG11      ILE  15  42.187  16.903  -3.894
  124   HG21  ILE  15          HG21      ILE  15  38.870  17.832  -2.678
  125   HG22  ILE  15          HG22      ILE  15  37.928  16.617  -3.573
  126   HG23  ILE  15          HG23      ILE  15  38.577  18.036  -4.420
  127   HD11  ILE  15           HD1      ILE  15  42.186  19.151  -4.648
  128   HD12  ILE  15           HD2      ILE  15  40.486  19.400  -4.183
  129   HD13  ILE  15           HD3      ILE  15  40.886  18.390  -5.596
  130    H    ILE  16           HN       ILE  16  40.925  13.102  -2.030
  131    HA   ILE  16           HA       ILE  16  42.723  12.403  -4.312
  132    HB   ILE  16           HB       ILE  16  43.499  12.763  -1.399
  133   HG12  ILE  16          HG12      ILE  16  43.867  14.543  -3.278
  134   HG13  ILE  16          HG11      ILE  16  45.217  14.170  -2.195
  135   HG21  ILE  16          HG21      ILE  16  45.699  11.565  -2.068
  136   HG22  ILE  16          HG22      ILE  16  44.769  10.883  -3.425
  137   HG23  ILE  16          HG23      ILE  16  44.278  10.547  -1.750
  138   HD11  ILE  16           HD1      ILE  16  44.915  12.733  -4.862
  139   HD12  ILE  16           HD2      ILE  16  46.366  12.919  -3.857
  140   HD13  ILE  16           HD3      ILE  16  45.713  14.312  -4.742
  141    H    ILE  17           HN       ILE  17  41.382  11.450  -1.126
  142    HA   ILE  17           HA       ILE  17  41.624   8.622  -1.672
  143    HB   ILE  17           HB       ILE  17  40.385   8.233   0.328
  144   HG12  ILE  17          HG12      ILE  17  38.408   9.575   0.037
  145   HG13  ILE  17          HG11      ILE  17  39.177  10.142   1.527
  146   HG21  ILE  17          HG21      ILE  17  42.148  10.702   0.487
  147   HG22  ILE  17          HG22      ILE  17  42.542   9.022   0.894
  148   HG23  ILE  17          HG23      ILE  17  41.452   9.954   1.941
  149   HD11  ILE  17           HD1      ILE  17  40.257  11.996   0.154
  150   HD12  ILE  17           HD2      ILE  17  38.489  12.087   0.277
  151   HD13  ILE  17           HD3      ILE  17  39.241  11.480  -1.211
  152    H    GLY  18           HN       GLY  18  39.903  10.780  -3.325
  153    HA2  GLY  18           HA1      GLY  18  38.171   8.814  -4.492
  154    HA3  GLY  18           HA2      GLY  18  37.239   9.845  -3.388
  155    H    GLY  19           HN       GLY  19  39.293  12.055  -4.024
  156    HA2  GLY  19           HA1      GLY  19  37.694  13.343  -6.037
  157    HA3  GLY  19           HA2      GLY  19  39.248  13.916  -5.400
  158    H    ALA  20           HN       ALA  20  41.111  12.225  -6.130
  159    HA   ALA  20           HA       ALA  20  42.432  11.627  -7.936
  160    HB1  ALA  20           HB1      ALA  20  40.589   9.894  -8.084
  161    HB2  ALA  20           HB2      ALA  20  41.449  10.225  -9.607
  162    HB3  ALA  20           HB3      ALA  20  39.833  10.918  -9.327
  163    H    LEU  21           HN       LEU  21  40.577  14.257  -7.896
  164    HA   LEU  21           HA       LEU  21  40.386  16.140  -9.242
  165    HB2  LEU  21           HB2      LEU  21  42.840  15.153 -10.734
  166    HB3  LEU  21           HB1      LEU  21  42.351  16.827 -10.378
  167    HG   LEU  21           HG       LEU  21  43.270  14.738  -8.351
  168   HD11  LEU  21          HD11      LEU  21  45.091  15.697  -9.710
  169   HD12  LEU  21          HD12      LEU  21  45.167  16.323  -8.046
  170   HD13  LEU  21          HD13      LEU  21  44.513  17.341  -9.351
  171   HD21  LEU  21          HD21      LEU  21  43.196  16.805  -6.803
  172   HD22  LEU  21          HD22      LEU  21  41.629  16.089  -7.242
  173   HD23  LEU  21          HD23      LEU  21  42.188  17.573  -8.053
  174    H    ASP  22           HN       ASP  22  39.482  13.295 -10.213
  175    HA   ASP  22           HA       ASP  22  39.488  13.560 -13.123
  176    HB2  ASP  22           HB2      ASP  22  39.370  11.367 -11.928
  177    HB3  ASP  22           HB1      ASP  22  37.748  11.810 -11.340
  178    H    HIS  23           HN       HIS  23  38.501  15.910 -11.767
  179    HA   HIS  23           HA       HIS  23  36.714  17.387 -11.878
  180    HB2  HIS  23           HB2      HIS  23  37.062  16.888 -14.321
  181    HB3  HIS  23           HB1      HIS  23  35.799  15.641 -14.196
  182    HD1  HIS  23           HD1      HIS  23  33.399  16.385 -14.354
  183    HD2  HIS  23           HD2      HIS  23  36.058  19.592 -13.796
  184    HE1  HIS  23           HE1      HIS  23  32.041  18.541 -14.543
  185    H    LEU  24           HN       LEU  24  36.474  14.712 -10.401
  186    HA   LEU  24           HA       LEU  24  33.819  13.751 -10.545
  187    HB2  LEU  24           HB2      LEU  24  35.491  12.568  -9.264
  188    HB3  LEU  24           HB1      LEU  24  35.756  13.969  -8.205
  189    HG   LEU  24           HG       LEU  24  33.551  13.732  -7.216
  190   HD11  LEU  24          HD11      LEU  24  33.128  11.710  -9.452
  191   HD12  LEU  24          HD12      LEU  24  32.132  13.125  -9.031
  192   HD13  LEU  24          HD13      LEU  24  32.128  11.692  -7.979
  193   HD21  LEU  24          HD21      LEU  24  33.790  11.565  -6.148
  194   HD22  LEU  24          HD22      LEU  24  35.421  12.206  -6.457
  195   HD23  LEU  24          HD23      LEU  24  34.745  10.942  -7.514
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  63.043   1.217   6.819
    2    H2   GLY   1           HT2      GLY   1  62.638   1.720   8.391
    3    H3   GLY   1           HT3      GLY   1  63.909   2.474   7.552
    4    HA2  GLY   1           HA1      GLY   1  62.005   3.871   7.562
    5    HA3  GLY   1           HA2      GLY   1  62.382   3.307   5.922
    6    H    LYS   2           HN       LYS   2  60.465   3.228   4.923
    7    HA   LYS   2           HA       LYS   2  58.298   2.545   4.445
    8    HB2  LYS   2           HB2      LYS   2  58.824   0.267   6.393
    9    HB3  LYS   2           HB1      LYS   2  57.689   0.288   5.023
   10    HG2  LYS   2           HG2      LYS   2  59.587   0.526   3.447
   11    HG3  LYS   2           HG1      LYS   2  60.725   0.502   4.816
   12    HD2  LYS   2           HD2      LYS   2  59.972  -1.760   5.435
   13    HD3  LYS   2           HD1      LYS   2  58.783  -1.740   4.110
   14    HE2  LYS   2           HE2      LYS   2  60.566  -1.585   2.447
   15    HE3  LYS   2           HE1      LYS   2  61.793  -1.444   3.728
   16    HZ1  LYS   2           HZ1      LYS   2  61.625  -3.634   4.255
   17    HZ2  LYS   2           HZ2      LYS   2  61.203  -3.744   2.612
   18    HZ3  LYS   2           HZ3      LYS   2  59.994  -3.756   3.806
   19    H    GLY   3           HN       GLY   3  56.623   0.949   6.368
   20    HA2  GLY   3           HA1      GLY   3  54.754   1.660   7.727
   21    HA3  GLY   3           HA2      GLY   3  56.125   2.207   8.832
   22    H    ARG   4           HN       ARG   4  54.494   2.253   6.157
   23    HA   ARG   4           HA       ARG   4  52.759   3.442   6.869
   24    HB2  ARG   4           HB2      ARG   4  54.582   5.722   6.251
   25    HB3  ARG   4           HB1      ARG   4  52.944   5.947   5.610
   26    HG2  ARG   4           HG2      ARG   4  52.732   5.056   8.404
   27    HG3  ARG   4           HG1      ARG   4  53.851   6.425   8.324
   28    HD2  ARG   4           HD2      ARG   4  51.160   6.569   6.920
   29    HD3  ARG   4           HD1      ARG   4  51.310   6.913   8.656
   30    HE   ARG   4           HE       ARG   4  52.098   9.014   7.972
   31   HH11  ARG   4          HH11      ARG   4  54.799   7.970   7.319
   32   HH12  ARG   4          HH12      ARG   4  54.988   8.423   5.657
   33   HH21  ARG   4          HH21      ARG   4  51.605   9.000   5.155
   34   HH22  ARG   4          HH22      ARG   4  53.180   9.007   4.433
   35    H    TRP   5           HN       TRP   5  54.769   2.631   4.510
   36    HA   TRP   5           HA       TRP   5  53.849   3.425   2.010
   37    HB2  TRP   5           HB2      TRP   5  54.695   0.702   3.048
   38    HB3  TRP   5           HB1      TRP   5  54.254   0.928   1.340
   39    HD1  TRP   5           HD1      TRP   5  56.036   3.738   3.213
   40    HE1  TRP   5           HE1      TRP   5  58.428   4.053   2.253
   41    HE3  TRP   5           HE3      TRP   5  56.224  -0.363   0.153
   42    HZ2  TRP   5           HZ2      TRP   5  60.165   2.690   0.404
   43    HZ3  TRP   5           HZ3      TRP   5  58.260  -0.835  -1.201
   44    HH2  TRP   5           HH2      TRP   5  60.229   0.687  -1.078
   45    H    LEU   6           HN       LEU   6  52.118   1.779   4.483
   46    HA   LEU   6           HA       LEU   6  49.853   1.130   2.610
   47    HB2  LEU   6           HB2      LEU   6  50.232   0.115   5.448
   48    HB3  LEU   6           HB1      LEU   6  49.151  -0.516   4.183
   49    HG   LEU   6           HG       LEU   6  52.203  -0.569   4.125
   50   HD11  LEU   6          HD11      LEU   6  50.207  -2.863   4.299
   51   HD12  LEU   6          HD12      LEU   6  51.026  -2.158   5.714
   52   HD13  LEU   6          HD13      LEU   6  51.978  -2.957   4.441
   53   HD21  LEU   6          HD21      LEU   6  51.691  -2.123   2.105
   54   HD22  LEU   6          HD22      LEU   6  51.487  -0.376   1.852
   55   HD23  LEU   6          HD23      LEU   6  50.062  -1.408   2.126
   56    H    GLU   7           HN       GLU   7  50.953   3.222   5.206
   57    HA   GLU   7           HA       GLU   7  48.086   4.055   5.721
   58    HB2  GLU   7           HB2      GLU   7  50.625   4.316   7.374
   59    HB3  GLU   7           HB1      GLU   7  49.115   5.176   7.755
   60    HG2  GLU   7           HG2      GLU   7  47.916   3.010   7.882
   61    HG3  GLU   7           HG1      GLU   7  49.427   2.150   7.498
   62    H    ARG   8           HN       ARG   8  50.309   4.731   3.579
   63    HA   ARG   8           HA       ARG   8  51.113   7.410   3.870
   64    HB2  ARG   8           HB2      ARG   8  51.730   5.813   2.009
   65    HB3  ARG   8           HB1      ARG   8  50.139   6.146   1.283
   66    HG2  ARG   8           HG2      ARG   8  50.682   8.561   1.193
   67    HG3  ARG   8           HG1      ARG   8  52.276   8.230   1.912
   68    HD2  ARG   8           HD2      ARG   8  52.942   6.899  -0.001
   69    HD3  ARG   8           HD1      ARG   8  51.298   6.964  -0.682
   70    HE   ARG   8           HE       ARG   8  53.324   9.017  -0.956
   71   HH11  ARG   8          HH11      ARG   8  52.412  11.249  -0.710
   72   HH12  ARG   8          HH12      ARG   8  50.849  11.478  -1.421
   73   HH21  ARG   8          HH21      ARG   8  50.238   8.086  -1.810
   74   HH22  ARG   8          HH22      ARG   8  49.618   9.687  -2.043
   75    H    ILE   9           HN       ILE   9  49.751   8.919   4.683
   76    HA   ILE   9           HA       ILE   9  46.970   9.069   4.174
   77    HB   ILE   9           HB       ILE   9  47.906  10.339   6.006
   78   HG12  ILE   9          HG12      ILE   9  46.910  12.531   5.671
   79   HG13  ILE   9          HG11      ILE   9  47.036  12.384   3.906
   80   HG21  ILE   9          HG21      ILE   9  49.554  12.041   5.812
   81   HG22  ILE   9          HG22      ILE   9  49.376  12.144   4.048
   82   HG23  ILE   9          HG23      ILE   9  50.145  10.720   4.782
   83   HD11  ILE   9           HD1      ILE   9  45.335  10.731   3.803
   84   HD12  ILE   9           HD2      ILE   9  44.729  11.890   5.009
   85   HD13  ILE   9           HD3      ILE   9  45.464  10.359   5.540
   86    H    GLY  10           HN       GLY  10  46.056   9.127   2.238
   87    HA2  GLY  10           HA1      GLY  10  47.362  10.674   0.042
   88    HA3  GLY  10           HA2      GLY  10  46.060   9.480  -0.123
   89    H    LYS  11           HN       LYS  11  44.341  10.484   1.921
   90    HA   LYS  11           HA       LYS  11  42.931  12.463   0.382
   91    HB2  LYS  11           HB2      LYS  11  42.625  11.609   3.288
   92    HB3  LYS  11           HB1      LYS  11  41.458  12.605   2.386
   93    HG2  LYS  11           HG2      LYS  11  41.143  10.792   0.747
   94    HG3  LYS  11           HG1      LYS  11  42.348   9.796   1.599
   95    HD2  LYS  11           HD2      LYS  11  40.928   9.866   3.648
   96    HD3  LYS  11           HD1      LYS  11  39.707  10.800   2.750
   97    HE2  LYS  11           HE2      LYS  11  39.090   8.422   2.753
   98    HE3  LYS  11           HE1      LYS  11  39.527   8.927   1.103
   99    HZ1  LYS  11           HZ1      LYS  11  40.531   6.782   1.872
  100    HZ2  LYS  11           HZ2      LYS  11  41.452   7.670   2.989
  101    HZ3  LYS  11           HZ3      LYS  11  41.649   7.932   1.321
  102    H    ALA  12           HN       ALA  12  43.861  14.393   0.014
  103    HA   ALA  12           HA       ALA  12  45.502  15.750   1.977
  104    HB1  ALA  12           HB1      ALA  12  45.500  17.588   0.411
  105    HB2  ALA  12           HB2      ALA  12  44.072  16.935  -0.427
  106    HB3  ALA  12           HB3      ALA  12  45.628  16.073  -0.512
  107    H    GLY  13           HN       GLY  13  42.312  15.053   2.057
  108    HA2  GLY  13           HA1      GLY  13  40.463  16.004   3.081
  109    HA3  GLY  13           HA2      GLY  13  41.651  16.660   4.223
  110    H    PHE  14           HN       PHE  14  40.805  17.332   0.789
  111    HA   PHE  14           HA       PHE  14  39.770  19.971   1.483
  112    HB2  PHE  14           HB2      PHE  14  42.347  20.185   1.597
  113    HB3  PHE  14           HB1      PHE  14  42.325  19.970  -0.169
  114    HD1  PHE  14           HD1      PHE  14  40.569  21.953   2.524
  115    HD2  PHE  14           HD2      PHE  14  42.117  21.917  -1.507
  116    HE1  PHE  14           HE1      PHE  14  39.963  24.356   2.267
  117    HE2  PHE  14           HE2      PHE  14  41.509  24.317  -1.761
  118    HZ   PHE  14           HZ       PHE  14  40.465  25.546   0.137
  119    H    ILE  15           HN       ILE  15  41.279  18.011  -1.138
  120    HA   ILE  15           HA       ILE  15  38.791  18.233  -2.695
  121    HB   ILE  15           HB       ILE  15  40.041  19.104  -4.751
  122   HG12  ILE  15          HG12      ILE  15  42.084  19.816  -2.592
  123   HG13  ILE  15          HG11      ILE  15  42.341  18.719  -3.963
  124   HG21  ILE  15          HG21      ILE  15  39.997  21.116  -2.466
  125   HG22  ILE  15          HG22      ILE  15  38.507  20.487  -3.208
  126   HG23  ILE  15          HG23      ILE  15  39.670  21.403  -4.190
  127   HD11  ILE  15           HD1      ILE  15  43.312  20.756  -4.685
  128   HD12  ILE  15           HD2      ILE  15  41.999  21.733  -3.991
  129   HD13  ILE  15           HD3      ILE  15  41.709  20.764  -5.457
  130    H    ILE  16           HN       ILE  16  39.461  15.985  -1.746
  131    HA   ILE  16           HA       ILE  16  40.671  14.485  -4.050
  132    HB   ILE  16           HB       ILE  16  41.249  14.187  -1.079
  133   HG12  ILE  16          HG12      ILE  16  42.674  15.812  -2.236
  134   HG13  ILE  16          HG11      ILE  16  43.619  14.383  -1.782
  135   HG21  ILE  16          HG21      ILE  16  41.444  12.151  -3.302
  136   HG22  ILE  16          HG22      ILE  16  41.094  11.919  -1.576
  137   HG23  ILE  16          HG23      ILE  16  42.767  12.190  -2.112
  138   HD11  ILE  16           HD1      ILE  16  42.982  13.592  -4.274
  139   HD12  ILE  16           HD2      ILE  16  44.352  14.678  -3.981
  140   HD13  ILE  16           HD3      ILE  16  42.798  15.340  -4.529
  141    H    ILE  17           HN       ILE  17  39.345  13.644  -0.822
  142    HA   ILE  17           HA       ILE  17  37.732  11.530  -1.985
  143    HB   ILE  17           HB       ILE  17  38.535  11.318   0.326
  144   HG12  ILE  17          HG12      ILE  17  36.464  10.698   1.454
  145   HG13  ILE  17          HG11      ILE  17  35.507  11.753   0.394
  146   HG21  ILE  17          HG21      ILE  17  38.504  13.808   0.772
  147   HG22  ILE  17          HG22      ILE  17  37.839  12.820   2.094
  148   HG23  ILE  17          HG23      ILE  17  36.744  13.689   0.994
  149   HD11  ILE  17           HD1      ILE  17  37.207   9.525  -0.782
  150   HD12  ILE  17           HD2      ILE  17  35.775  10.327  -1.475
  151   HD13  ILE  17           HD3      ILE  17  35.588   9.182  -0.126
  152    H    GLY  18           HN       GLY  18  37.158  14.850  -0.853
  153    HA2  GLY  18           HA1      GLY  18  34.270  14.688  -1.252
  154    HA3  GLY  18           HA2      GLY  18  35.223  16.146  -0.914
  155    H    GLY  19           HN       GLY  19  37.027  16.155  -3.003
  156    HA2  GLY  19           HA1      GLY  19  35.335  17.184  -5.127
  157    HA3  GLY  19           HA2      GLY  19  37.108  17.086  -5.128
  158    H    ALA  20           HN       ALA  20  37.447  14.326  -4.735
  159    HA   ALA  20           HA       ALA  20  37.635  12.416  -6.038
  160    HB1  ALA  20           HB1      ALA  20  35.583  11.469  -6.877
  161    HB2  ALA  20           HB2      ALA  20  34.794  13.065  -6.888
  162    HB3  ALA  20           HB3      ALA  20  35.223  12.294  -5.342
  163    H    LEU  21           HN       LEU  21  38.568  14.870  -7.185
  164    HA   LEU  21           HA       LEU  21  37.699  14.987  -9.972
  165    HB2  LEU  21           HB2      LEU  21  40.288  16.090  -8.828
  166    HB3  LEU  21           HB1      LEU  21  39.368  16.671 -10.234
  167    HG   LEU  21           HG       LEU  21  38.422  16.750  -7.332
  168   HD11  LEU  21          HD11      LEU  21  38.776  19.141  -7.472
  169   HD12  LEU  21          HD12      LEU  21  39.173  19.034  -9.204
  170   HD13  LEU  21          HD13      LEU  21  40.280  18.346  -7.993
  171   HD21  LEU  21          HD21      LEU  21  36.638  18.283  -8.434
  172   HD22  LEU  21          HD22      LEU  21  36.471  16.532  -8.699
  173   HD23  LEU  21          HD23      LEU  21  37.151  17.566  -9.980
  174    H    ASP  22           HN       ASP  22  38.133  13.483 -11.420
  175    HA   ASP  22           HA       ASP  22  39.275  11.868 -12.617
  176    HB2  ASP  22           HB2      ASP  22  41.795  13.148 -11.510
  177    HB3  ASP  22           HB1      ASP  22  41.630  12.188 -12.997
  178    H    HIS  23           HN       HIS  23  41.664  12.215  -9.964
  179    HA   HIS  23           HA       HIS  23  42.359   9.596  -9.593
  180    HB2  HIS  23           HB2      HIS  23  41.702  11.482  -7.296
  181    HB3  HIS  23           HB1      HIS  23  42.832  10.108  -7.261
  182    HD1  HIS  23           HD1      HIS  23  44.580  10.370  -9.612
  183    HD2  HIS  23           HD2      HIS  23  43.155  13.794  -7.631
  184    HE1  HIS  23           HE1      HIS  23  46.176  12.287 -10.162
  185    H    LEU  24           HN       LEU  24  39.309  11.084  -8.649
  186    HA   LEU  24           HA       LEU  24  37.414  10.181  -7.656
  187    HB2  LEU  24           HB2      LEU  24  37.199   9.296  -9.892
  188    HB3  LEU  24           HB1      LEU  24  38.327   7.973  -9.535
  189    HG   LEU  24           HG       LEU  24  36.747   6.939  -8.004
  190   HD11  LEU  24          HD11      LEU  24  35.716   8.760  -6.865
  191   HD12  LEU  24          HD12      LEU  24  34.397   8.046  -7.821
  192   HD13  LEU  24          HD13      LEU  24  35.200   9.532  -8.383
  193   HD21  LEU  24          HD21      LEU  24  36.437   6.546 -10.448
  194   HD22  LEU  24          HD22      LEU  24  35.281   7.899 -10.502
  195   HD23  LEU  24          HD23      LEU  24  34.902   6.441  -9.553
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  62.447  -0.324  10.841
    2    H2   GLY   1           HT2      GLY   1  61.107  -1.296  11.225
    3    H3   GLY   1           HT3      GLY   1  60.891   0.160  10.377
    4    HA2  GLY   1           HA1      GLY   1  62.730  -1.396   8.995
    5    HA3  GLY   1           HA2      GLY   1  61.309  -2.387   9.381
    6    H    LYS   2           HN       LYS   2  59.154  -1.403   8.903
    7    HA   LYS   2           HA       LYS   2  59.179   0.649   6.749
    8    HB2  LYS   2           HB2      LYS   2  58.186  -2.203   6.342
    9    HB3  LYS   2           HB1      LYS   2  57.818  -0.843   5.254
   10    HG2  LYS   2           HG2      LYS   2  60.336  -0.486   5.028
   11    HG3  LYS   2           HG1      LYS   2  60.551  -2.032   5.884
   12    HD2  LYS   2           HD2      LYS   2  59.212  -3.187   4.154
   13    HD3  LYS   2           HD1      LYS   2  58.977  -1.643   3.300
   14    HE2  LYS   2           HE2      LYS   2  61.677  -2.943   3.864
   15    HE3  LYS   2           HE1      LYS   2  60.827  -2.980   2.301
   16    HZ1  LYS   2           HZ1      LYS   2  62.482  -0.961   3.345
   17    HZ2  LYS   2           HZ2      LYS   2  60.914  -0.325   3.188
   18    HZ3  LYS   2           HZ3      LYS   2  61.695  -1.009   1.842
   19    H    GLY   3           HN       GLY   3  58.242   1.065   9.246
   20    HA2  GLY   3           HA1      GLY   3  55.616   0.349   9.961
   21    HA3  GLY   3           HA2      GLY   3  56.247   2.046  10.174
   22    H    ARG   4           HN       ARG   4  56.850   3.049   8.568
   23    HA   ARG   4           HA       ARG   4  54.652   4.008   8.908
   24    HB2  ARG   4           HB2      ARG   4  56.570   5.094   6.790
   25    HB3  ARG   4           HB1      ARG   4  55.223   6.027   7.488
   26    HG2  ARG   4           HG2      ARG   4  56.148   5.789   9.734
   27    HG3  ARG   4           HG1      ARG   4  57.426   4.704   9.132
   28    HD2  ARG   4           HD2      ARG   4  58.311   6.987   9.433
   29    HD3  ARG   4           HD1      ARG   4  58.303   6.546   7.708
   30    HE   ARG   4           HE       ARG   4  55.852   7.830   8.151
   31   HH11  ARG   4          HH11      ARG   4  58.885   8.525   7.054
   32   HH12  ARG   4          HH12      ARG   4  58.855  10.215   7.429
   33   HH21  ARG   4          HH21      ARG   4  55.934  10.022   9.288
   34   HH22  ARG   4          HH22      ARG   4  57.185  11.063   8.695
   35    H    TRP   5           HN       TRP   5  55.357   1.911   6.612
   36    HA   TRP   5           HA       TRP   5  54.102   2.424   4.171
   37    HB2  TRP   5           HB2      TRP   5  55.182   0.262   4.853
   38    HB3  TRP   5           HB1      TRP   5  53.713  -0.129   5.780
   39    HD1  TRP   5           HD1      TRP   5  51.440  -0.479   4.378
   40    HE1  TRP   5           HE1      TRP   5  51.016  -1.242   1.929
   41    HE3  TRP   5           HE3      TRP   5  56.116   0.333   2.458
   42    HZ2  TRP   5           HZ2      TRP   5  52.527  -1.458  -0.513
   43    HZ3  TRP   5           HZ3      TRP   5  56.602  -0.159   0.065
   44    HH2  TRP   5           HH2      TRP   5  54.813  -1.053  -1.420
   45    H    LEU   6           HN       LEU   6  52.669   2.352   7.297
   46    HA   LEU   6           HA       LEU   6  49.894   2.352   6.130
   47    HB2  LEU   6           HB2      LEU   6  49.112   1.613   8.276
   48    HB3  LEU   6           HB1      LEU   6  50.480   0.576   7.820
   49    HG   LEU   6           HG       LEU   6  51.793   2.619   9.205
   50   HD11  LEU   6          HD11      LEU   6  49.259   2.044  10.800
   51   HD12  LEU   6          HD12      LEU   6  49.482   3.528   9.846
   52   HD13  LEU   6          HD13      LEU   6  50.575   3.171  11.203
   53   HD21  LEU   6          HD21      LEU   6  52.119   0.171   9.501
   54   HD22  LEU   6          HD22      LEU   6  50.594   0.082  10.414
   55   HD23  LEU   6          HD23      LEU   6  51.969   1.004  11.066
   56    H    GLU   7           HN       GLU   7  52.353   4.218   7.843
   57    HA   GLU   7           HA       GLU   7  50.350   6.222   8.751
   58    HB2  GLU   7           HB2      GLU   7  52.535   5.471   9.988
   59    HB3  GLU   7           HB1      GLU   7  53.369   6.549   8.851
   60    HG2  GLU   7           HG2      GLU   7  51.917   8.433   9.578
   61    HG3  GLU   7           HG1      GLU   7  51.094   7.348  10.724
   62    H    ARG   8           HN       ARG   8  51.672   5.434   5.848
   63    HA   ARG   8           HA       ARG   8  52.696   7.880   4.819
   64    HB2  ARG   8           HB2      ARG   8  52.718   5.574   3.722
   65    HB3  ARG   8           HB1      ARG   8  51.028   5.879   3.250
   66    HG2  ARG   8           HG2      ARG   8  51.765   7.991   2.119
   67    HG3  ARG   8           HG1      ARG   8  53.452   7.580   2.511
   68    HD2  ARG   8           HD2      ARG   8  53.116   5.389   1.285
   69    HD3  ARG   8           HD1      ARG   8  51.528   5.997   0.756
   70    HE   ARG   8           HE       ARG   8  53.291   8.006   0.006
   71   HH11  ARG   8          HH11      ARG   8  52.458   7.379  -2.386
   72   HH12  ARG   8          HH12      ARG   8  53.500   6.186  -3.087
   73   HH21  ARG   8          HH21      ARG   8  54.917   5.262  -0.059
   74   HH22  ARG   8          HH22      ARG   8  54.893   4.987  -1.769
   75    H    ILE   9           HN       ILE   9  51.804   9.672   3.897
   76    HA   ILE   9           HA       ILE   9  49.045  10.265   4.647
   77    HB   ILE   9           HB       ILE   9  50.742  12.040   4.715
   78   HG12  ILE   9          HG12      ILE   9  49.570  13.793   3.434
   79   HG13  ILE   9          HG11      ILE   9  48.732  12.563   2.466
   80   HG21  ILE   9          HG21      ILE   9  52.001  12.775   2.856
   81   HG22  ILE   9          HG22      ILE   9  50.915  12.001   1.682
   82   HG23  ILE   9          HG23      ILE   9  52.009  11.007   2.673
   83   HD11  ILE   9           HD1      ILE   9  47.499  13.631   4.538
   84   HD12  ILE   9           HD2      ILE   9  48.507  12.522   5.495
   85   HD13  ILE   9           HD3      ILE   9  47.379  11.877   4.277
   86    H    GLY  10           HN       GLY  10  47.361   9.509   3.572
   87    HA2  GLY  10           HA1      GLY  10  47.506   9.419   0.559
   88    HA3  GLY  10           HA2      GLY  10  46.780   8.116   1.521
   89    H    LYS  11           HN       LYS  11  46.308  11.221   2.867
   90    HA   LYS  11           HA       LYS  11  43.433  11.112   2.097
   91    HB2  LYS  11           HB2      LYS  11  44.877  13.019   3.981
   92    HB3  LYS  11           HB1      LYS  11  43.120  12.767   3.841
   93    HG2  LYS  11           HG2      LYS  11  43.519  10.330   4.451
   94    HG3  LYS  11           HG1      LYS  11  45.203  10.774   4.821
   95    HD2  LYS  11           HD2      LYS  11  44.423  12.428   6.478
   96    HD3  LYS  11           HD1      LYS  11  42.730  12.026   6.095
   97    HE2  LYS  11           HE2      LYS  11  43.539  10.846   8.143
   98    HE3  LYS  11           HE1      LYS  11  43.076   9.713   6.850
   99    HZ1  LYS  11           HZ1      LYS  11  45.360   9.435   6.260
  100    HZ2  LYS  11           HZ2      LYS  11  45.229   9.193   7.936
  101    HZ3  LYS  11           HZ3      LYS  11  45.861  10.651   7.332
  102    H    ALA  12           HN       ALA  12  43.033  11.959   0.128
  103    HA   ALA  12           HA       ALA  12  44.575  14.242  -0.882
  104    HB1  ALA  12           HB1      ALA  12  43.810  12.626  -2.481
  105    HB2  ALA  12           HB2      ALA  12  42.863  14.108  -2.749
  106    HB3  ALA  12           HB3      ALA  12  42.139  12.733  -1.884
  107    H    GLY  13           HN       GLY  13  43.876  15.312   1.332
  108    HA2  GLY  13           HA1      GLY  13  42.610  16.950   2.381
  109    HA3  GLY  13           HA2      GLY  13  42.311  17.555   0.738
  110    H    PHE  14           HN       PHE  14  41.315  14.642   2.573
  111    HA   PHE  14           HA       PHE  14  39.220  13.734   2.926
  112    HB2  PHE  14           HB2      PHE  14  38.878  16.031   3.996
  113    HB3  PHE  14           HB1      PHE  14  38.091  16.523   2.477
  114    HD1  PHE  14           HD1      PHE  14  37.998  13.853   5.130
  115    HD2  PHE  14           HD2      PHE  14  35.788  16.042   2.137
  116    HE1  PHE  14           HE1      PHE  14  35.890  12.764   5.889
  117    HE2  PHE  14           HE2      PHE  14  33.681  14.954   2.897
  118    HZ   PHE  14           HZ       PHE  14  33.746  13.253   4.716
  119    H    ILE  15           HN       ILE  15  40.331  13.685   0.308
  120    HA   ILE  15           HA       ILE  15  39.702  13.129  -1.840
  121    HB   ILE  15           HB       ILE  15  36.825  12.981  -0.855
  122   HG12  ILE  15          HG12      ILE  15  39.045  10.895  -0.623
  123   HG13  ILE  15          HG11      ILE  15  38.293  11.764   0.735
  124   HG21  ILE  15          HG21      ILE  15  37.435  12.760  -3.334
  125   HG22  ILE  15          HG22      ILE  15  36.544  11.394  -2.630
  126   HG23  ILE  15          HG23      ILE  15  38.300  11.270  -2.894
  127   HD11  ILE  15           HD1      ILE  15  36.038  10.808  -0.175
  128   HD12  ILE  15           HD2      ILE  15  37.134   9.698   0.682
  129   HD13  ILE  15           HD3      ILE  15  37.061   9.678  -1.095
  130    H    ILE  16           HN       ILE  16  40.285  15.489  -2.106
  131    HA   ILE  16           HA       ILE  16  37.989  16.825  -3.485
  132    HB   ILE  16           HB       ILE  16  38.194  17.851  -1.189
  133   HG12  ILE  16          HG12      ILE  16  38.402  20.228  -2.004
  134   HG13  ILE  16          HG11      ILE  16  38.976  19.611  -3.566
  135   HG21  ILE  16          HG21      ILE  16  40.863  18.972  -2.116
  136   HG22  ILE  16          HG22      ILE  16  40.762  17.471  -1.165
  137   HG23  ILE  16          HG23      ILE  16  40.147  18.996  -0.488
  138   HD11  ILE  16           HD1      ILE  16  36.869  18.759  -4.160
  139   HD12  ILE  16           HD2      ILE  16  36.389  20.174  -3.197
  140   HD13  ILE  16           HD3      ILE  16  36.355  18.553  -2.467
  141    H    ILE  17           HN       ILE  17  41.515  16.990  -2.744
  142    HA   ILE  17           HA       ILE  17  42.041  18.301  -5.314
  143    HB   ILE  17           HB       ILE  17  43.568  18.726  -3.423
  144   HG12  ILE  17          HG12      ILE  17  45.714  18.282  -4.508
  145   HG13  ILE  17          HG11      ILE  17  44.999  16.999  -5.505
  146   HG21  ILE  17          HG21      ILE  17  44.322  15.781  -3.589
  147   HG22  ILE  17          HG22      ILE  17  43.195  16.444  -2.383
  148   HG23  ILE  17          HG23      ILE  17  44.890  16.980  -2.404
  149   HD11  ILE  17           HD1      ILE  17  45.334  19.389  -6.554
  150   HD12  ILE  17           HD2      ILE  17  43.880  19.821  -5.622
  151   HD13  ILE  17           HD3      ILE  17  43.803  18.532  -6.850
  152    H    GLY  18           HN       GLY  18  41.885  15.084  -3.971
  153    HA2  GLY  18           HA1      GLY  18  43.114  13.824  -6.349
  154    HA3  GLY  18           HA2      GLY  18  42.472  13.007  -4.908
  155    H    GLY  19           HN       GLY  19  39.929  13.871  -4.673
  156    HA2  GLY  19           HA1      GLY  19  38.539  12.320  -6.597
  157    HA3  GLY  19           HA2      GLY  19  37.806  13.532  -5.526
  158    H    ALA  20           HN       ALA  20  39.125  15.842  -6.424
  159    HA   ALA  20           HA       ALA  20  37.562  16.344  -8.857
  160    HB1  ALA  20           HB1      ALA  20  37.905  17.984  -6.960
  161    HB2  ALA  20           HB2      ALA  20  38.236  18.623  -8.587
  162    HB3  ALA  20           HB3      ALA  20  39.583  18.166  -7.519
  163    H    LEU  21           HN       LEU  21  39.190  14.366  -9.594
  164    HA   LEU  21           HA       LEU  21  40.845  15.668 -11.643
  165    HB2  LEU  21           HB2      LEU  21  42.201  15.274  -9.360
  166    HB3  LEU  21           HB1      LEU  21  42.319  13.613  -9.970
  167    HG   LEU  21           HG       LEU  21  43.151  16.112 -11.525
  168   HD11  LEU  21          HD11      LEU  21  44.590  15.656  -9.545
  169   HD12  LEU  21          HD12      LEU  21  45.454  15.360 -11.073
  170   HD13  LEU  21          HD13      LEU  21  44.835  13.991 -10.121
  171   HD21  LEU  21          HD21      LEU  21  42.532  14.336 -13.052
  172   HD22  LEU  21          HD22      LEU  21  43.384  13.119 -12.069
  173   HD23  LEU  21          HD23      LEU  21  44.308  14.352 -12.959
  174    H    ASP  22           HN       ASP  22  38.713  14.499 -12.368
  175    HA   ASP  22           HA       ASP  22  39.608  12.030 -13.684
  176    HB2  ASP  22           HB2      ASP  22  38.862  11.140 -11.501
  177    HB3  ASP  22           HB1      ASP  22  37.279  11.923 -11.725
  178    H    HIS  23           HN       HIS  23  37.060  14.383 -12.929
  179    HA   HIS  23           HA       HIS  23  36.393  14.601 -15.756
  180    HB2  HIS  23           HB2      HIS  23  34.094  13.823 -15.656
  181    HB3  HIS  23           HB1      HIS  23  35.167  12.505 -15.137
  182    HD1  HIS  23           HD1      HIS  23  32.021  13.308 -14.294
  183    HD2  HIS  23           HD2      HIS  23  35.507  13.521 -11.950
  184    HE1  HIS  23           HE1      HIS  23  31.302  13.192 -11.846
  185    H    LEU  24           HN       LEU  24  35.949  15.397 -12.382
  186    HA   LEU  24           HA       LEU  24  34.102  17.600 -12.861
  187    HB2  LEU  24           HB2      LEU  24  34.114  16.573 -10.682
  188    HB3  LEU  24           HB1      LEU  24  35.866  16.814 -10.509
  189    HG   LEU  24           HG       LEU  24  35.598  19.216 -10.321
  190   HD11  LEU  24          HD11      LEU  24  33.180  20.155 -10.345
  191   HD12  LEU  24          HD12      LEU  24  32.731  18.642 -11.168
  192   HD13  LEU  24          HD13      LEU  24  33.906  19.750 -11.917
  193   HD21  LEU  24          HD21      LEU  24  35.061  17.747  -8.318
  194   HD22  LEU  24          HD22      LEU  24  33.338  17.945  -8.719
  195   HD23  LEU  24          HD23      LEU  24  34.317  19.363  -8.273
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  56.736   3.406  -4.842
    2    H2   GLY   1           HT2      GLY   1  58.341   2.866  -4.690
    3    H3   GLY   1           HT3      GLY   1  57.578   3.655  -3.392
    4    HA2  GLY   1           HA1      GLY   1  56.544   1.156  -4.526
    5    HA3  GLY   1           HA2      GLY   1  57.803   1.172  -3.274
    6    H    LYS   2           HN       LYS   2  56.724   0.368  -1.557
    7    HA   LYS   2           HA       LYS   2  54.014   1.287  -0.908
    8    HB2  LYS   2           HB2      LYS   2  55.063  -1.038  -0.444
    9    HB3  LYS   2           HB1      LYS   2  55.890  -0.254   0.920
   10    HG2  LYS   2           HG2      LYS   2  53.767   0.374   1.929
   11    HG3  LYS   2           HG1      LYS   2  52.867  -0.177   0.499
   12    HD2  LYS   2           HD2      LYS   2  52.768  -1.852   2.325
   13    HD3  LYS   2           HD1      LYS   2  53.610  -2.495   0.897
   14    HE2  LYS   2           HE2      LYS   2  55.224  -1.164   3.092
   15    HE3  LYS   2           HE1      LYS   2  54.666  -2.841   3.300
   16    HZ1  LYS   2           HZ1      LYS   2  55.863  -2.205   0.724
   17    HZ2  LYS   2           HZ2      LYS   2  56.027  -3.589   1.694
   18    HZ3  LYS   2           HZ3      LYS   2  56.920  -2.188   2.050
   19    H    GLY   3           HN       GLY   3  55.542   3.515  -1.140
   20    HA2  GLY   3           HA1      GLY   3  56.965   4.651   0.951
   21    HA3  GLY   3           HA2      GLY   3  55.622   5.570   0.121
   22    H    ARG   4           HN       ARG   4  53.771   4.752   0.245
   23    HA   ARG   4           HA       ARG   4  53.613   6.563   1.838
   24    HB2  ARG   4           HB2      ARG   4  51.076   4.921   1.322
   25    HB3  ARG   4           HB1      ARG   4  51.171   6.661   1.672
   26    HG2  ARG   4           HG2      ARG   4  51.123   6.835  -0.644
   27    HG3  ARG   4           HG1      ARG   4  52.870   6.560  -0.481
   28    HD2  ARG   4           HD2      ARG   4  51.866   5.081  -2.204
   29    HD3  ARG   4           HD1      ARG   4  52.522   4.130  -0.854
   30    HE   ARG   4           HE       ARG   4  50.334   3.306  -0.615
   31   HH11  ARG   4          HH11      ARG   4  50.037   5.814  -2.787
   32   HH12  ARG   4          HH12      ARG   4  48.436   6.279  -2.320
   33   HH21  ARG   4          HH21      ARG   4  48.370   4.229   0.476
   34   HH22  ARG   4          HH22      ARG   4  47.491   5.381  -0.473
   35    H    TRP   5           HN       TRP   5  53.903   3.499   2.647
   36    HA   TRP   5           HA       TRP   5  52.384   2.732   4.848
   37    HB2  TRP   5           HB2      TRP   5  54.303   1.428   3.973
   38    HB3  TRP   5           HB1      TRP   5  55.424   2.584   4.725
   39    HD1  TRP   5           HD1      TRP   5  52.285   0.683   6.024
   40    HE1  TRP   5           HE1      TRP   5  52.846  -0.379   8.328
   41    HE3  TRP   5           HE3      TRP   5  57.164   2.183   6.440
   42    HZ2  TRP   5           HZ2      TRP   5  55.117  -0.540  10.088
   43    HZ3  TRP   5           HZ3      TRP   5  58.508   1.560   8.441
   44    HH2  TRP   5           HH2      TRP   5  57.491   0.202  10.264
   45    H    LEU   6           HN       LEU   6  54.415   5.512   4.618
   46    HA   LEU   6           HA       LEU   6  54.101   6.054   7.569
   47    HB2  LEU   6           HB2      LEU   6  56.138   7.296   5.683
   48    HB3  LEU   6           HB1      LEU   6  56.089   7.395   7.458
   49    HG   LEU   6           HG       LEU   6  56.487   4.817   5.870
   50   HD11  LEU   6          HD11      LEU   6  58.828   4.970   6.538
   51   HD12  LEU   6          HD12      LEU   6  58.507   6.459   7.459
   52   HD13  LEU   6          HD13      LEU   6  58.377   6.464   5.683
   53   HD21  LEU   6          HD21      LEU   6  55.538   4.249   7.990
   54   HD22  LEU   6          HD22      LEU   6  56.465   5.510   8.838
   55   HD23  LEU   6          HD23      LEU   6  57.290   4.059   8.222
   56    H    GLU   7           HN       GLU   7  53.359   7.035   4.291
   57    HA   GLU   7           HA       GLU   7  52.559   9.772   5.204
   58    HB2  GLU   7           HB2      GLU   7  53.844   9.177   2.991
   59    HB3  GLU   7           HB1      GLU   7  52.249   8.674   2.387
   60    HG2  GLU   7           HG2      GLU   7  51.381  10.971   3.103
   61    HG3  GLU   7           HG1      GLU   7  53.074  11.430   3.402
   62    H    ARG   8           HN       ARG   8  51.186   7.323   6.140
   63    HA   ARG   8           HA       ARG   8  48.732   6.948   4.708
   64    HB2  ARG   8           HB2      ARG   8  49.692   5.471   6.546
   65    HB3  ARG   8           HB1      ARG   8  49.116   6.684   7.713
   66    HG2  ARG   8           HG2      ARG   8  46.808   6.421   6.865
   67    HG3  ARG   8           HG1      ARG   8  47.375   5.221   5.679
   68    HD2  ARG   8           HD2      ARG   8  46.489   3.998   7.568
   69    HD3  ARG   8           HD1      ARG   8  48.262   3.853   7.628
   70    HE   ARG   8           HE       ARG   8  47.502   6.121   9.181
   71   HH11  ARG   8          HH11      ARG   8  49.262   3.881  10.140
   72   HH12  ARG   8          HH12      ARG   8  48.303   3.188  11.405
   73   HH21  ARG   8          HH21      ARG   8  45.366   4.719  10.378
   74   HH22  ARG   8          HH22      ARG   8  46.097   3.662  11.539
   75    H    ILE   9           HN       ILE   9  46.669   7.795   4.988
   76    HA   ILE   9           HA       ILE   9  46.141   9.865   6.951
   77    HB   ILE   9           HB       ILE   9  47.425  11.332   5.543
   78   HG12  ILE   9          HG12      ILE   9  45.787  12.982   4.848
   79   HG13  ILE   9          HG11      ILE   9  44.516  11.748   4.706
   80   HG21  ILE   9          HG21      ILE   9  47.300   9.739   3.516
   81   HG22  ILE   9          HG22      ILE   9  47.284  11.482   3.176
   82   HG23  ILE   9          HG23      ILE   9  45.773  10.554   3.110
   83   HD11  ILE   9           HD1      ILE   9  44.384  11.446   7.060
   84   HD12  ILE   9           HD2      ILE   9  44.546  13.206   6.856
   85   HD13  ILE   9           HD3      ILE   9  45.956  12.234   7.340
   86    H    GLY  10           HN       GLY  10  44.322   8.758   7.477
   87    HA2  GLY  10           HA1      GLY  10  42.447   7.852   5.419
   88    HA3  GLY  10           HA2      GLY  10  42.232   7.765   7.178
   89    H    LYS  11           HN       LYS  11  43.105  10.805   5.694
   90    HA   LYS  11           HA       LYS  11  40.282  11.715   5.546
   91    HB2  LYS  11           HB2      LYS  11  42.288  12.824   7.551
   92    HB3  LYS  11           HB1      LYS  11  40.802  13.675   7.067
   93    HG2  LYS  11           HG2      LYS  11  39.508  11.586   7.763
   94    HG3  LYS  11           HG1      LYS  11  41.025  10.978   8.469
   95    HD2  LYS  11           HD2      LYS  11  41.176  13.049   9.860
   96    HD3  LYS  11           HD1      LYS  11  39.607  13.576   9.203
   97    HE2  LYS  11           HE2      LYS  11  40.041  10.934  10.660
   98    HE3  LYS  11           HE1      LYS  11  39.442  12.415  11.443
   99    HZ1  LYS  11           HZ1      LYS  11  37.462  11.563  10.834
  100    HZ2  LYS  11           HZ2      LYS  11  38.107  10.619   9.578
  101    HZ3  LYS  11           HZ3      LYS  11  37.820  12.276   9.338
  102    H    ALA  12           HN       ALA  12  41.218  11.690   3.292
  103    HA   ALA  12           HA       ALA  12  43.167  13.816   2.689
  104    HB1  ALA  12           HB1      ALA  12  41.501  11.929   0.994
  105    HB2  ALA  12           HB2      ALA  12  43.249  11.853   1.322
  106    HB3  ALA  12           HB3      ALA  12  42.589  13.158   0.307
  107    H    GLY  13           HN       GLY  13  41.041  14.893   4.100
  108    HA2  GLY  13           HA1      GLY  13  39.459  16.578   3.982
  109    HA3  GLY  13           HA2      GLY  13  40.276  17.070   2.484
  110    H    PHE  14           HN       PHE  14  38.729  13.944   3.004
  111    HA   PHE  14           HA       PHE  14  36.843  12.991   2.077
  112    HB2  PHE  14           HB2      PHE  14  35.786  15.256   2.834
  113    HB3  PHE  14           HB1      PHE  14  35.874  15.708   1.117
  114    HD1  PHE  14           HD1      PHE  14  34.342  14.791  -0.494
  115    HD2  PHE  14           HD2      PHE  14  34.495  13.185   3.510
  116    HE1  PHE  14           HE1      PHE  14  32.272  13.480  -0.940
  117    HE2  PHE  14           HE2      PHE  14  32.423  11.876   3.064
  118    HZ   PHE  14           HZ       PHE  14  31.340  11.983   0.821
  119    H    ILE  15           HN       ILE  15  39.045  12.710   0.649
  120    HA   ILE  15           HA       ILE  15  39.793  12.215  -1.453
  121    HB   ILE  15           HB       ILE  15  36.990  12.781  -2.502
  122   HG12  ILE  15          HG12      ILE  15  38.105  10.296  -1.120
  123   HG13  ILE  15          HG11      ILE  15  36.779  11.326  -0.538
  124   HG21  ILE  15          HG21      ILE  15  39.048  10.711  -3.368
  125   HG22  ILE  15          HG22      ILE  15  38.950  12.336  -4.081
  126   HG23  ILE  15          HG23      ILE  15  37.578  11.220  -4.233
  127   HD11  ILE  15           HD1      ILE  15  35.619  10.755  -2.809
  128   HD12  ILE  15           HD2      ILE  15  35.659   9.499  -1.549
  129   HD13  ILE  15           HD3      ILE  15  36.805   9.430  -2.908
  130    H    ILE  16           HN       ILE  16  40.865  14.300  -0.957
  131    HA   ILE  16           HA       ILE  16  40.412  16.159  -3.272
  132    HB   ILE  16           HB       ILE  16  41.003  16.951  -0.389
  133   HG12  ILE  16          HG12      ILE  16  38.555  16.406  -1.087
  134   HG13  ILE  16          HG11      ILE  16  38.862  17.951  -0.279
  135   HG21  ILE  16          HG21      ILE  16  40.942  18.571  -2.968
  136   HG22  ILE  16          HG22      ILE  16  42.289  18.396  -1.821
  137   HG23  ILE  16          HG23      ILE  16  40.843  19.318  -1.356
  138   HD11  ILE  16           HD1      ILE  16  38.705  19.175  -2.344
  139   HD12  ILE  16           HD2      ILE  16  37.323  18.061  -2.311
  140   HD13  ILE  16           HD3      ILE  16  38.735  17.690  -3.316
  141    H    ILE  17           HN       ILE  17  42.564  15.272  -0.531
  142    HA   ILE  17           HA       ILE  17  44.959  16.150  -1.939
  143    HB   ILE  17           HB       ILE  17  44.748  14.140   0.350
  144   HG12  ILE  17          HG12      ILE  17  43.597  16.126   1.083
  145   HG13  ILE  17          HG11      ILE  17  45.207  16.166   1.825
  146   HG21  ILE  17          HG21      ILE  17  47.099  15.260   0.818
  147   HG22  ILE  17          HG22      ILE  17  47.021  15.722  -0.897
  148   HG23  ILE  17          HG23      ILE  17  46.955  14.011  -0.435
  149   HD11  ILE  17           HD1      ILE  17  45.891  17.619  -0.233
  150   HD12  ILE  17           HD2      ILE  17  44.883  18.373   1.019
  151   HD13  ILE  17           HD3      ILE  17  44.145  17.809  -0.495
  152    H    GLY  18           HN       GLY  18  43.276  13.069  -1.381
  153    HA2  GLY  18           HA1      GLY  18  45.245  11.509  -2.857
  154    HA3  GLY  18           HA2      GLY  18  43.649  10.964  -2.296
  155    H    GLY  19           HN       GLY  19  41.874  12.603  -3.474
  156    HA2  GLY  19           HA1      GLY  19  41.820  11.601  -6.169
  157    HA3  GLY  19           HA2      GLY  19  40.747  12.839  -5.492
  158    H    ALA  20           HN       ALA  20  42.824  14.692  -4.749
  159    HA   ALA  20           HA       ALA  20  43.868  16.529  -5.697
  160    HB1  ALA  20           HB1      ALA  20  45.508  16.065  -7.477
  161    HB2  ALA  20           HB2      ALA  20  44.800  14.448  -7.705
  162    HB3  ALA  20           HB3      ALA  20  45.601  14.861  -6.171
  163    H    LEU  21           HN       LEU  21  41.230  15.187  -6.986
  164    HA   LEU  21           HA       LEU  21  39.807  15.707  -8.760
  165    HB2  LEU  21           HB2      LEU  21  40.938  18.513  -8.514
  166    HB3  LEU  21           HB1      LEU  21  39.278  18.017  -8.921
  167    HG   LEU  21           HG       LEU  21  40.665  17.652  -6.228
  168   HD11  LEU  21          HD11      LEU  21  38.960  19.258  -5.445
  169   HD12  LEU  21          HD12      LEU  21  38.304  19.380  -7.095
  170   HD13  LEU  21          HD13      LEU  21  39.945  19.974  -6.743
  171   HD21  LEU  21          HD21      LEU  21  39.205  15.773  -6.488
  172   HD22  LEU  21          HD22      LEU  21  37.961  16.748  -7.306
  173   HD23  LEU  21          HD23      LEU  21  38.256  16.959  -5.564
  174    H    ASP  22           HN       ASP  22  41.119  14.417 -10.254
  175    HA   ASP  22           HA       ASP  22  41.723  15.959 -12.634
  176    HB2  ASP  22           HB2      ASP  22  44.112  15.410 -12.816
  177    HB3  ASP  22           HB1      ASP  22  43.809  16.398 -11.368
  178    H    HIS  23           HN       HIS  23  39.978  13.837 -11.950
  179    HA   HIS  23           HA       HIS  23  39.314  11.765 -12.747
  180    HB2  HIS  23           HB2      HIS  23  41.471  12.112 -14.859
  181    HB3  HIS  23           HB1      HIS  23  39.968  11.167 -14.978
  182    HD1  HIS  23           HD1      HIS  23  38.365  13.618 -13.408
  183    HD2  HIS  23           HD2      HIS  23  40.445  13.734 -17.060
  184    HE1  HIS  23           HE1      HIS  23  37.476  15.617 -14.726
  185    H    LEU  24           HN       LEU  24  41.298  11.843 -10.677
  186    HA   LEU  24           HA       LEU  24  42.200   9.083 -10.858
  187    HB2  LEU  24           HB2      LEU  24  43.919  10.589 -12.187
  188    HB3  LEU  24           HB1      LEU  24  44.472  11.075 -10.571
  189    HG   LEU  24           HG       LEU  24  44.303   8.214 -11.630
  190   HD11  LEU  24          HD11      LEU  24  46.719   8.280 -11.658
  191   HD12  LEU  24          HD12      LEU  24  46.743   9.874 -10.865
  192   HD13  LEU  24          HD13      LEU  24  46.144   9.717 -12.535
  193   HD21  LEU  24          HD21      LEU  24  43.913   8.044  -9.291
  194   HD22  LEU  24          HD22      LEU  24  45.016   9.391  -8.914
  195   HD23  LEU  24          HD23      LEU  24  45.670   7.819  -9.436
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  62.186   5.027   0.188
    2    H2   GLY   1           HT2      GLY   1  62.117   6.433  -0.764
    3    H3   GLY   1           HT3      GLY   1  62.414   4.925  -1.488
    4    HA2  GLY   1           HA1      GLY   1  59.976   6.194  -0.875
    5    HA3  GLY   1           HA2      GLY   1  60.297   4.777  -1.895
    6    H    LYS   2           HN       LYS   2  58.124   4.242  -0.878
    7    HA   LYS   2           HA       LYS   2  56.891   3.009   0.658
    8    HB2  LYS   2           HB2      LYS   2  59.507   1.639   1.364
    9    HB3  LYS   2           HB1      LYS   2  57.865   0.952   1.345
   10    HG2  LYS   2           HG2      LYS   2  59.470   1.883  -1.077
   11    HG3  LYS   2           HG1      LYS   2  59.095   0.199  -0.638
   12    HD2  LYS   2           HD2      LYS   2  56.601   0.918  -0.752
   13    HD3  LYS   2           HD1      LYS   2  57.191   2.374  -1.589
   14    HE2  LYS   2           HE2      LYS   2  56.644   0.798  -3.313
   15    HE3  LYS   2           HE1      LYS   2  58.420   0.797  -3.193
   16    HZ1  LYS   2           HZ1      LYS   2  56.705  -1.369  -2.922
   17    HZ2  LYS   2           HZ2      LYS   2  57.314  -1.065  -1.366
   18    HZ3  LYS   2           HZ3      LYS   2  58.379  -1.341  -2.660
   19    H    GLY   3           HN       GLY   3  56.976   2.073   3.051
   20    HA2  GLY   3           HA1      GLY   3  58.071   2.665   5.314
   21    HA3  GLY   3           HA2      GLY   3  57.913   4.409   4.804
   22    H    ARG   4           HN       ARG   4  56.364   4.941   3.692
   23    HA   ARG   4           HA       ARG   4  55.632   5.688   5.881
   24    HB2  ARG   4           HB2      ARG   4  54.014   6.332   3.368
   25    HB3  ARG   4           HB1      ARG   4  53.963   7.279   4.877
   26    HG2  ARG   4           HG2      ARG   4  56.388   7.700   4.720
   27    HG3  ARG   4           HG1      ARG   4  56.478   6.713   3.240
   28    HD2  ARG   4           HD2      ARG   4  55.039   8.265   2.043
   29    HD3  ARG   4           HD1      ARG   4  54.730   9.194   3.530
   30    HE   ARG   4           HE       ARG   4  57.515   9.222   3.202
   31   HH11  ARG   4          HH11      ARG   4  58.414  11.145   2.389
   32   HH12  ARG   4          HH12      ARG   4  57.582  11.999   1.133
   33   HH21  ARG   4          HH21      ARG   4  54.834   9.883   1.152
   34   HH22  ARG   4          HH22      ARG   4  55.554  11.285   0.434
   35    H    TRP   5           HN       TRP   5  54.516   3.095   4.418
   36    HA   TRP   5           HA       TRP   5  51.780   2.687   4.653
   37    HB2  TRP   5           HB2      TRP   5  53.481   0.954   4.015
   38    HB3  TRP   5           HB1      TRP   5  53.851   0.743   5.742
   39    HD1  TRP   5           HD1      TRP   5  52.229  -0.677   7.163
   40    HE1  TRP   5           HE1      TRP   5  50.064  -2.038   6.688
   41    HE3  TRP   5           HE3      TRP   5  51.257   0.984   2.420
   42    HZ2  TRP   5           HZ2      TRP   5  48.187  -2.340   4.525
   43    HZ3  TRP   5           HZ3      TRP   5  49.274   0.146   1.170
   44    HH2  TRP   5           HH2      TRP   5  47.739  -1.512   2.217
   45    H    LEU   6           HN       LEU   6  53.979   3.439   7.210
   46    HA   LEU   6           HA       LEU   6  51.903   2.814   9.295
   47    HB2  LEU   6           HB2      LEU   6  54.049   1.723   9.698
   48    HB3  LEU   6           HB1      LEU   6  54.913   3.258   9.481
   49    HG   LEU   6           HG       LEU   6  53.854   4.189  11.494
   50   HD11  LEU   6          HD11      LEU   6  51.672   3.255  11.580
   51   HD12  LEU   6          HD12      LEU   6  52.505   2.464  12.936
   52   HD13  LEU   6          HD13      LEU   6  52.274   1.590  11.401
   53   HD21  LEU   6          HD21      LEU   6  54.937   1.373  11.950
   54   HD22  LEU   6          HD22      LEU   6  54.861   2.667  13.170
   55   HD23  LEU   6          HD23      LEU   6  55.917   2.845  11.747
   56    H    GLU   7           HN       GLU   7  53.773   5.351   7.682
   57    HA   GLU   7           HA       GLU   7  52.806   7.377   9.678
   58    HB2  GLU   7           HB2      GLU   7  54.827   7.496   7.406
   59    HB3  GLU   7           HB1      GLU   7  54.325   8.908   8.366
   60    HG2  GLU   7           HG2      GLU   7  56.372   8.010   9.334
   61    HG3  GLU   7           HG1      GLU   7  55.027   7.658  10.446
   62    H    ARG   8           HN       ARG   8  51.485   5.845   7.177
   63    HA   ARG   8           HA       ARG   8  50.763   7.754   5.245
   64    HB2  ARG   8           HB2      ARG   8  50.186   5.310   5.210
   65    HB3  ARG   8           HB1      ARG   8  48.927   5.633   6.425
   66    HG2  ARG   8           HG2      ARG   8  47.756   7.130   4.916
   67    HG3  ARG   8           HG1      ARG   8  49.084   7.050   3.732
   68    HD2  ARG   8           HD2      ARG   8  47.295   5.562   2.998
   69    HD3  ARG   8           HD1      ARG   8  48.679   4.574   3.527
   70    HE   ARG   8           HE       ARG   8  47.111   4.797   5.807
   71   HH11  ARG   8          HH11      ARG   8  46.894   2.232   5.625
   72   HH12  ARG   8          HH12      ARG   8  45.526   1.797   4.655
   73   HH21  ARG   8          HH21      ARG   8  45.212   4.938   3.217
   74   HH22  ARG   8          HH22      ARG   8  44.574   3.329   3.291
   75    H    ILE   9           HN       ILE   9  49.872   9.690   5.416
   76    HA   ILE   9           HA       ILE   9  48.690  10.671   7.826
   77    HB   ILE   9           HB       ILE   9  47.911  12.584   6.425
   78   HG12  ILE   9          HG12      ILE   9  48.927  10.813   4.152
   79   HG13  ILE   9          HG11      ILE   9  47.253  11.355   4.407
   80   HG21  ILE   9          HG21      ILE   9  50.332  12.276   7.239
   81   HG22  ILE   9          HG22      ILE   9  50.103  13.385   5.869
   82   HG23  ILE   9          HG23      ILE   9  50.714  11.738   5.586
   83   HD11  ILE   9           HD1      ILE   9  48.227  13.770   4.286
   84   HD12  ILE   9           HD2      ILE   9  48.090  12.851   2.768
   85   HD13  ILE   9           HD3      ILE   9  49.667  12.998   3.579
   86    H    GLY  10           HN       GLY  10  47.362   8.976   5.043
   87    HA2  GLY  10           HA1      GLY  10  45.198   8.303   4.562
   88    HA3  GLY  10           HA2      GLY  10  45.031   8.121   6.321
   89    H    LYS  11           HN       LYS  11  45.366  10.930   4.111
   90    HA   LYS  11           HA       LYS  11  42.631  11.817   4.684
   91    HB2  LYS  11           HB2      LYS  11  43.911  12.478   6.760
   92    HB3  LYS  11           HB1      LYS  11  44.930  13.512   5.730
   93    HG2  LYS  11           HG2      LYS  11  42.968  14.791   5.006
   94    HG3  LYS  11           HG1      LYS  11  41.892  13.712   5.929
   95    HD2  LYS  11           HD2      LYS  11  43.109  14.370   8.026
   96    HD3  LYS  11           HD1      LYS  11  44.053  15.537   7.070
   97    HE2  LYS  11           HE2      LYS  11  41.952  16.670   6.385
   98    HE3  LYS  11           HE1      LYS  11  41.018  15.515   7.366
   99    HZ1  LYS  11           HZ1      LYS  11  41.330  16.903   9.054
  100    HZ2  LYS  11           HZ2      LYS  11  42.443  17.847   8.185
  101    HZ3  LYS  11           HZ3      LYS  11  42.972  16.478   9.043
  102    H    ALA  12           HN       ALA  12  42.720  11.591   2.342
  103    HA   ALA  12           HA       ALA  12  44.449  13.468   0.860
  104    HB1  ALA  12           HB1      ALA  12  43.830  11.176   0.035
  105    HB2  ALA  12           HB2      ALA  12  43.455  12.490  -1.104
  106    HB3  ALA  12           HB3      ALA  12  42.155  11.750  -0.140
  107    H    GLY  13           HN       GLY  13  43.087  15.003   2.583
  108    HA2  GLY  13           HA1      GLY  13  41.567  16.744   2.754
  109    HA3  GLY  13           HA2      GLY  13  41.846  16.940   1.011
  110    H    PHE  14           HN       PHE  14  40.252  14.368   2.936
  111    HA   PHE  14           HA       PHE  14  38.127  13.474   2.766
  112    HB2  PHE  14           HB2      PHE  14  37.568  15.944   3.246
  113    HB3  PHE  14           HB1      PHE  14  37.233  16.094   1.507
  114    HD1  PHE  14           HD1      PHE  14  35.109  15.447   0.653
  115    HD2  PHE  14           HD2      PHE  14  36.372  14.022   4.529
  116    HE1  PHE  14           HE1      PHE  14  32.854  14.452   1.024
  117    HE2  PHE  14           HE2      PHE  14  34.117  13.028   4.896
  118    HZ   PHE  14           HZ       PHE  14  32.360  13.242   3.145
  119    H    ILE  15           HN       ILE  15  39.826  12.703   0.802
  120    HA   ILE  15           HA       ILE  15  39.848  11.721  -1.285
  121    HB   ILE  15           HB       ILE  15  36.842  12.182  -1.433
  122   HG12  ILE  15          HG12      ILE  15  38.393   9.990   0.023
  123   HG13  ILE  15          HG11      ILE  15  37.365  11.230   0.780
  124   HG21  ILE  15          HG21      ILE  15  36.849  10.257  -2.860
  125   HG22  ILE  15          HG22      ILE  15  38.520   9.836  -2.411
  126   HG23  ILE  15          HG23      ILE  15  38.200  11.268  -3.417
  127   HD11  ILE  15           HD1      ILE  15  36.536   8.887  -0.964
  128   HD12  ILE  15           HD2      ILE  15  35.466  10.295  -0.747
  129   HD13  ILE  15           HD3      ILE  15  35.958   9.325   0.659
  130    H    ILE  16           HN       ILE  16  40.961  13.826  -1.771
  131    HA   ILE  16           HA       ILE  16  39.541  15.123  -4.076
  132    HB   ILE  16           HB       ILE  16  41.078  16.535  -1.848
  133   HG12  ILE  16          HG12      ILE  16  38.524  15.994  -1.650
  134   HG13  ILE  16          HG11      ILE  16  39.065  17.647  -1.311
  135   HG21  ILE  16          HG21      ILE  16  40.246  17.530  -4.600
  136   HG22  ILE  16          HG22      ILE  16  41.863  17.559  -3.858
  137   HG23  ILE  16          HG23      ILE  16  40.586  18.633  -3.245
  138   HD11  ILE  16           HD1      ILE  16  36.972  17.399  -2.786
  139   HD12  ILE  16           HD2      ILE  16  38.056  16.827  -4.069
  140   HD13  ILE  16           HD3      ILE  16  38.251  18.462  -3.406
  141    H    ILE  17           HN       ILE  17  42.714  15.369  -2.389
  142    HA   ILE  17           HA       ILE  17  44.113  15.481  -4.924
  143    HB   ILE  17           HB       ILE  17  45.104  16.499  -2.912
  144   HG12  ILE  17          HG12      ILE  17  47.367  15.586  -3.045
  145   HG13  ILE  17          HG11      ILE  17  46.764  14.057  -3.716
  146   HG21  ILE  17          HG21      ILE  17  45.786  15.196  -0.997
  147   HG22  ILE  17          HG22      ILE  17  45.386  13.670  -1.823
  148   HG23  ILE  17          HG23      ILE  17  44.089  14.786  -1.339
  149   HD11  ILE  17           HD1      ILE  17  47.752  15.863  -5.354
  150   HD12  ILE  17           HD2      ILE  17  46.188  16.683  -5.134
  151   HD13  ILE  17           HD3      ILE  17  46.244  15.035  -5.807
  152    H    GLY  18           HN       GLY  18  42.976  12.968  -2.809
  153    HA2  GLY  18           HA1      GLY  18  44.717  10.886  -3.945
  154    HA3  GLY  18           HA2      GLY  18  43.397  10.666  -2.779
  155    H    GLY  19           HN       GLY  19  41.158  11.439  -3.849
  156    HA2  GLY  19           HA1      GLY  19  40.679   9.473  -5.914
  157    HA3  GLY  19           HA2      GLY  19  39.516  10.659  -5.292
  158    H    ALA  20           HN       ALA  20  41.237  12.965  -5.890
  159    HA   ALA  20           HA       ALA  20  41.371  14.491  -7.636
  160    HB1  ALA  20           HB1      ALA  20  42.558  13.683  -9.646
  161    HB2  ALA  20           HB2      ALA  20  42.312  12.004  -9.107
  162    HB3  ALA  20           HB3      ALA  20  43.328  13.108  -8.149
  163    H    LEU  21           HN       LEU  21  38.792  13.235  -7.233
  164    HA   LEU  21           HA       LEU  21  37.652  12.475  -9.761
  165    HB2  LEU  21           HB2      LEU  21  35.553  12.525  -8.664
  166    HB3  LEU  21           HB1      LEU  21  36.713  12.067  -7.402
  167    HG   LEU  21           HG       LEU  21  35.476  14.824  -7.852
  168   HD11  LEU  21          HD11      LEU  21  34.489  14.447  -5.658
  169   HD12  LEU  21          HD12      LEU  21  35.381  12.917  -5.477
  170   HD13  LEU  21          HD13      LEU  21  34.100  13.062  -6.704
  171   HD21  LEU  21          HD21      LEU  21  36.769  15.389  -5.721
  172   HD22  LEU  21          HD22      LEU  21  37.772  15.201  -7.175
  173   HD23  LEU  21          HD23      LEU  21  37.692  13.891  -5.973
  174    H    ASP  22           HN       ASP  22  39.045  15.328  -8.991
  175    HA   ASP  22           HA       ASP  22  37.162  17.309  -9.786
  176    HB2  ASP  22           HB2      ASP  22  39.366  17.802  -8.759
  177    HB3  ASP  22           HB1      ASP  22  40.170  17.267 -10.255
  178    H    HIS  23           HN       HIS  23  39.092  15.020 -11.623
  179    HA   HIS  23           HA       HIS  23  37.487  15.398 -13.991
  180    HB2  HIS  23           HB2      HIS  23  38.889  17.475 -14.113
  181    HB3  HIS  23           HB1      HIS  23  40.341  16.445 -14.163
  182    HD1  HIS  23           HD1      HIS  23  37.197  15.309 -15.904
  183    HD2  HIS  23           HD2      HIS  23  40.852  17.144 -16.893
  184    HE1  HIS  23           HE1      HIS  23  37.405  15.269 -18.451
  185    H    LEU  24           HN       LEU  24  38.768  13.430 -12.074
  186    HA   LEU  24           HA       LEU  24  39.379  11.417 -14.085
  187    HB2  LEU  24           HB2      LEU  24  41.563  12.430 -14.124
  188    HB3  LEU  24           HB1      LEU  24  41.615  12.541 -12.353
  189    HG   LEU  24           HG       LEU  24  41.796  10.134 -12.128
  190   HD11  LEU  24          HD11      LEU  24  40.315   9.275 -13.792
  191   HD12  LEU  24          HD12      LEU  24  41.930   8.736 -14.308
  192   HD13  LEU  24          HD13      LEU  24  41.160  10.130 -15.105
  193   HD21  LEU  24          HD21      LEU  24  43.561  11.039 -14.446
  194   HD22  LEU  24          HD22      LEU  24  43.912   9.724 -13.299
  195   HD23  LEU  24          HD23      LEU  24  43.864  11.411 -12.732
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1  56.698  -1.977  -1.058
    2    H2   GLY   1           HT2      GLY   1  56.361  -1.582   0.560
    3    H3   GLY   1           HT3      GLY   1  56.990  -3.111   0.166
    4    HA2  GLY   1           HA1      GLY   1  58.970  -2.346   0.560
    5    HA3  GLY   1           HA2      GLY   1  58.763  -1.360  -0.901
    6    H    LYS   2           HN       LYS   2  57.639  -1.360   2.515
    7    HA   LYS   2           HA       LYS   2  57.542   0.368   4.049
    8    HB2  LYS   2           HB2      LYS   2  60.065   0.366   3.318
    9    HB3  LYS   2           HB1      LYS   2  59.653   1.866   2.458
   10    HG2  LYS   2           HG2      LYS   2  58.832   2.862   4.571
   11    HG3  LYS   2           HG1      LYS   2  59.197   1.351   5.435
   12    HD2  LYS   2           HD2      LYS   2  61.572   1.585   4.966
   13    HD3  LYS   2           HD1      LYS   2  61.269   2.994   3.921
   14    HE2  LYS   2           HE2      LYS   2  60.296   4.192   5.907
   15    HE3  LYS   2           HE1      LYS   2  60.775   2.812   6.924
   16    HZ1  LYS   2           HZ1      LYS   2  62.491   4.738   5.479
   17    HZ2  LYS   2           HZ2      LYS   2  63.081   3.201   5.895
   18    HZ3  LYS   2           HZ3      LYS   2  62.551   4.266   7.107
   19    H    GLY   3           HN       GLY   3  56.274   0.491   1.172
   20    HA2  GLY   3           HA1      GLY   3  55.854   3.063   0.201
   21    HA3  GLY   3           HA2      GLY   3  54.457   1.913   0.429
   22    H    ARG   4           HN       ARG   4  54.052   1.263   2.263
   23    HA   ARG   4           HA       ARG   4  52.357   2.975   1.995
   24    HB2  ARG   4           HB2      ARG   4  52.451   1.083   4.391
   25    HB3  ARG   4           HB1      ARG   4  50.996   2.009   3.947
   26    HG2  ARG   4           HG2      ARG   4  51.101   1.006   1.650
   27    HG3  ARG   4           HG1      ARG   4  52.485   0.017   2.175
   28    HD2  ARG   4           HD2      ARG   4  49.652  -0.047   3.300
   29    HD3  ARG   4           HD1      ARG   4  50.468  -1.328   2.373
   30    HE   ARG   4           HE       ARG   4  50.680  -0.994   5.189
   31   HH11  ARG   4          HH11      ARG   4  51.833  -3.009   2.965
   32   HH12  ARG   4          HH12      ARG   4  53.460  -3.116   3.548
   33   HH21  ARG   4          HH21      ARG   4  53.141  -0.425   5.712
   34   HH22  ARG   4          HH22      ARG   4  54.201  -1.652   5.105
   35    H    TRP   5           HN       TRP   5  54.967   3.311   3.786
   36    HA   TRP   5           HA       TRP   5  54.566   4.625   6.201
   37    HB2  TRP   5           HB2      TRP   5  56.787   4.306   5.167
   38    HB3  TRP   5           HB1      TRP   5  56.421   5.583   3.983
   39    HD1  TRP   5           HD1      TRP   5  56.206   8.089   4.905
   40    HE1  TRP   5           HE1      TRP   5  57.175   9.264   7.013
   41    HE3  TRP   5           HE3      TRP   5  57.441   3.944   7.645
   42    HZ2  TRP   5           HZ2      TRP   5  58.324   8.480   9.534
   43    HZ3  TRP   5           HZ3      TRP   5  58.472   4.181   9.899
   44    HH2  TRP   5           HH2      TRP   5  58.914   6.443  10.845
   45    H    LEU   6           HN       LEU   6  53.439   5.639   3.101
   46    HA   LEU   6           HA       LEU   6  52.639   8.324   4.207
   47    HB2  LEU   6           HB2      LEU   6  54.200   8.169   2.139
   48    HB3  LEU   6           HB1      LEU   6  52.773   7.565   1.270
   49    HG   LEU   6           HG       LEU   6  51.584   9.721   2.300
   50   HD11  LEU   6          HD11      LEU   6  54.542  10.479   2.372
   51   HD12  LEU   6          HD12      LEU   6  53.411  10.470   3.745
   52   HD13  LEU   6          HD13      LEU   6  53.201  11.643   2.430
   53   HD21  LEU   6          HD21      LEU   6  51.928   9.346  -0.109
   54   HD22  LEU   6          HD22      LEU   6  53.622   9.874   0.032
   55   HD23  LEU   6          HD23      LEU   6  52.301  11.036   0.307
   56    H    GLU   7           HN       GLU   7  51.551   5.220   2.957
   57    HA   GLU   7           HA       GLU   7  48.840   6.268   2.345
   58    HB2  GLU   7           HB2      GLU   7  49.903   3.417   2.411
   59    HB3  GLU   7           HB1      GLU   7  48.335   3.944   1.759
   60    HG2  GLU   7           HG2      GLU   7  51.025   4.976   0.763
   61    HG3  GLU   7           HG1      GLU   7  50.132   3.637   0.003
   62    H    ARG   8           HN       ARG   8  50.171   6.288   5.119
   63    HA   ARG   8           HA       ARG   8  48.944   4.414   6.837
   64    HB2  ARG   8           HB2      ARG   8  49.388   7.371   7.405
   65    HB3  ARG   8           HB1      ARG   8  49.245   6.070   8.607
   66    HG2  ARG   8           HG2      ARG   8  51.408   6.190   6.455
   67    HG3  ARG   8           HG1      ARG   8  51.629   6.767   8.121
   68    HD2  ARG   8           HD2      ARG   8  52.480   4.582   8.263
   69    HD3  ARG   8           HD1      ARG   8  50.795   4.322   8.767
   70    HE   ARG   8           HE       ARG   8  51.041   4.031   5.906
   71   HH11  ARG   8          HH11      ARG   8  52.832   2.564   8.333
   72   HH12  ARG   8          HH12      ARG   8  52.325   0.948   7.976
   73   HH21  ARG   8          HH21      ARG   8  49.913   1.926   5.686
   74   HH22  ARG   8          HH22      ARG   8  50.672   0.586   6.478
   75    H    ILE   9           HN       ILE   9  47.562   6.985   4.983
   76    HA   ILE   9           HA       ILE   9  44.879   6.175   5.747
   77    HB   ILE   9           HB       ILE   9  45.283   7.589   7.701
   78   HG12  ILE   9          HG12      ILE   9  43.517   9.252   7.441
   79   HG13  ILE   9          HG11      ILE   9  43.677   9.221   5.674
   80   HG21  ILE   9          HG21      ILE   9  46.059   9.869   7.548
   81   HG22  ILE   9          HG22      ILE   9  45.964   9.845   5.771
   82   HG23  ILE   9          HG23      ILE   9  47.189   8.864   6.613
   83   HD11  ILE   9           HD1      ILE   9  41.745   7.839   6.778
   84   HD12  ILE   9           HD2      ILE   9  43.025   6.681   7.211
   85   HD13  ILE   9           HD3      ILE   9  42.709   7.065   5.502
   86    H    GLY  10           HN       GLY  10  47.001   8.648   4.306
   87    HA2  GLY  10           HA1      GLY  10  46.830   9.815   2.321
   88    HA3  GLY  10           HA2      GLY  10  46.018   8.368   1.695
   89    H    LYS  11           HN       LYS  11  43.701   8.193   1.916
   90    HA   LYS  11           HA       LYS  11  42.316  10.459   1.046
   91    HB2  LYS  11           HB2      LYS  11  41.287   8.052   2.593
   92    HB3  LYS  11           HB1      LYS  11  40.249   9.230   1.752
   93    HG2  LYS  11           HG2      LYS  11  41.257   8.685  -0.391
   94    HG3  LYS  11           HG1      LYS  11  42.477   7.653   0.394
   95    HD2  LYS  11           HD2      LYS  11  40.616   6.195   1.255
   96    HD3  LYS  11           HD1      LYS  11  39.464   7.181   0.321
   97    HE2  LYS  11           HE2      LYS  11  41.711   5.420  -0.725
   98    HE3  LYS  11           HE1      LYS  11  39.971   5.315  -1.083
   99    HZ1  LYS  11           HZ1      LYS  11  40.141   7.509  -2.152
  100    HZ2  LYS  11           HZ2      LYS  11  41.117   6.345  -2.911
  101    HZ3  LYS  11           HZ3      LYS  11  41.816   7.508  -1.889
  102    H    ALA  12           HN       ALA  12  42.484  12.361   2.102
  103    HA   ALA  12           HA       ALA  12  42.348  12.542   5.000
  104    HB1  ALA  12           HB1      ALA  12  42.074  14.598   2.780
  105    HB2  ALA  12           HB2      ALA  12  43.509  14.264   3.781
  106    HB3  ALA  12           HB3      ALA  12  42.065  15.005   4.513
  107    H    GLY  13           HN       GLY  13  40.124  11.559   2.861
  108    HA2  GLY  13           HA1      GLY  13  37.807  11.591   2.757
  109    HA3  GLY  13           HA2      GLY  13  37.924  11.571   4.527
  110    H    PHE  14           HN       PHE  14  38.893  14.184   2.279
  111    HA   PHE  14           HA       PHE  14  36.494  15.729   2.781
  112    HB2  PHE  14           HB2      PHE  14  37.760  15.818   5.019
  113    HB3  PHE  14           HB1      PHE  14  38.980  16.793   4.168
  114    HD1  PHE  14           HD1      PHE  14  35.222  16.598   4.565
  115    HD2  PHE  14           HD2      PHE  14  38.692  19.143   4.196
  116    HE1  PHE  14           HE1      PHE  14  33.781  18.608   4.844
  117    HE2  PHE  14           HE2      PHE  14  37.248  21.150   4.475
  118    HZ   PHE  14           HZ       PHE  14  34.780  20.884   4.694
  119    H    ILE  15           HN       ILE  15  39.696  15.299   1.479
  120    HA   ILE  15           HA       ILE  15  39.032  17.190  -0.674
  121    HB   ILE  15           HB       ILE  15  41.236  18.434  -0.448
  122   HG12  ILE  15          HG12      ILE  15  41.148  17.234   2.361
  123   HG13  ILE  15          HG11      ILE  15  42.292  16.755   1.085
  124   HG21  ILE  15          HG21      ILE  15  38.941  19.301   0.331
  125   HG22  ILE  15          HG22      ILE  15  40.364  20.064   1.073
  126   HG23  ILE  15          HG23      ILE  15  39.440  18.843   1.976
  127   HD11  ILE  15           HD1      ILE  15  43.500  18.338   2.378
  128   HD12  ILE  15           HD2      ILE  15  42.091  19.409   2.546
  129   HD13  ILE  15           HD3      ILE  15  42.930  19.278   0.981
  130    H    ILE  16           HN       ILE  16  39.170  14.566  -0.924
  131    HA   ILE  16           HA       ILE  16  41.598  14.237  -2.620
  132    HB   ILE  16           HB       ILE  16  40.770  12.515  -0.275
  133   HG12  ILE  16          HG12      ILE  16  42.719  14.242  -0.275
  134   HG13  ILE  16          HG11      ILE  16  43.035  12.631   0.385
  135   HG21  ILE  16          HG21      ILE  16  42.359  10.712  -1.293
  136   HG22  ILE  16          HG22      ILE  16  42.070  11.535  -2.843
  137   HG23  ILE  16          HG23      ILE  16  40.709  10.831  -1.943
  138   HD11  ILE  16           HD1      ILE  16  44.327  11.973  -1.487
  139   HD12  ILE  16           HD2      ILE  16  44.794  13.670  -1.246
  140   HD13  ILE  16           HD3      ILE  16  43.650  13.240  -2.531
  141    H    ILE  17           HN       ILE  17  38.578  12.725  -1.413
  142    HA   ILE  17           HA       ILE  17  38.151  11.254  -3.881
  143    HB   ILE  17           HB       ILE  17  35.708  11.090  -2.851
  144   HG12  ILE  17          HG12      ILE  17  35.587  11.533  -0.461
  145   HG13  ILE  17          HG11      ILE  17  37.290  12.030  -0.412
  146   HG21  ILE  17          HG21      ILE  17  37.276   9.225  -2.822
  147   HG22  ILE  17          HG22      ILE  17  36.537   9.375  -1.209
  148   HG23  ILE  17          HG23      ILE  17  38.193   9.964  -1.489
  149   HD11  ILE  17           HD1      ILE  17  36.846  14.024  -1.666
  150   HD12  ILE  17           HD2      ILE  17  35.547  13.919  -0.457
  151   HD13  ILE  17           HD3      ILE  17  35.229  13.451  -2.142
  152    H    GLY  18           HN       GLY  18  38.298  14.427  -3.557
  153    HA2  GLY  18           HA1      GLY  18  36.623  14.910  -5.879
  154    HA3  GLY  18           HA2      GLY  18  35.915  15.592  -4.401
  155    H    GLY  19           HN       GLY  19  38.538  16.110  -3.167
  156    HA2  GLY  19           HA1      GLY  19  38.893  18.785  -4.005
  157    HA3  GLY  19           HA2      GLY  19  40.067  17.841  -3.067
  158    H    ALA  20           HN       ALA  20  40.351  15.796  -5.178
  159    HA   ALA  20           HA       ALA  20  42.534  17.032  -6.595
  160    HB1  ALA  20           HB1      ALA  20  42.786  14.913  -7.680
  161    HB2  ALA  20           HB2      ALA  20  41.096  14.467  -7.341
  162    HB3  ALA  20           HB3      ALA  20  42.272  14.580  -6.010
  163    H    LEU  21           HN       LEU  21  39.601  15.496  -8.000
  164    HA   LEU  21           HA       LEU  21  38.475  15.982  -9.966
  165    HB2  LEU  21           HB2      LEU  21  37.966  18.010  -8.457
  166    HB3  LEU  21           HB1      LEU  21  39.179  18.885  -9.415
  167    HG   LEU  21           HG       LEU  21  37.774  17.973 -11.496
  168   HD11  LEU  21          HD11      LEU  21  35.326  17.895 -10.945
  169   HD12  LEU  21          HD12      LEU  21  35.740  17.905  -9.215
  170   HD13  LEU  21          HD13      LEU  21  36.229  16.537 -10.241
  171   HD21  LEU  21          HD21      LEU  21  36.354  20.016 -11.392
  172   HD22  LEU  21          HD22      LEU  21  38.037  20.358 -10.925
  173   HD23  LEU  21          HD23      LEU  21  36.778  20.212  -9.675
  174    H    ASP  22           HN       ASP  22  40.985  15.106 -10.484
  175    HA   ASP  22           HA       ASP  22  41.496  16.316 -13.074
  176    HB2  ASP  22           HB2      ASP  22  43.905  16.923 -12.541
  177    HB3  ASP  22           HB1      ASP  22  42.679  18.013 -11.850
  178    H    HIS  23           HN       HIS  23  41.129  14.155 -13.703
  179    HA   HIS  23           HA       HIS  23  41.758  11.974 -14.183
  180    HB2  HIS  23           HB2      HIS  23  44.569  13.024 -13.672
  181    HB3  HIS  23           HB1      HIS  23  44.121  11.595 -14.635
  182    HD1  HIS  23           HD1      HIS  23  43.306  15.361 -14.569
  183    HD2  HIS  23           HD2      HIS  23  43.803  12.205 -17.306
  184    HE1  HIS  23           HE1      HIS  23  43.078  16.345 -16.915
  185    H    LEU  24           HN       LEU  24  41.283  12.816 -11.335
  186    HA   LEU  24           HA       LEU  24  42.015  10.285 -10.134
  187    HB2  LEU  24           HB2      LEU  24  44.212  11.247  -9.885
  188    HB3  LEU  24           HB1      LEU  24  43.539  12.784  -9.303
  189    HG   LEU  24           HG       LEU  24  42.804  11.769  -7.228
  190   HD11  LEU  24          HD11      LEU  24  43.534   9.163  -8.622
  191   HD12  LEU  24          HD12      LEU  24  41.984   9.623  -7.875
  192   HD13  LEU  24          HD13      LEU  24  43.394   9.269  -6.850
  193   HD21  LEU  24          HD21      LEU  24  45.238  12.370  -7.480
  194   HD22  LEU  24          HD22      LEU  24  45.571  10.670  -7.890
  195   HD23  LEU  24          HD23      LEU  24  44.944  11.091  -6.278
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  60.064   1.451   6.631
    2    H2   GLY   1           HT2      GLY   1  61.438   2.316   6.127
    3    H3   GLY   1           HT3      GLY   1  61.505   0.626   6.294
    4    HA2  GLY   1           HA1      GLY   1  61.280   1.666   3.989
    5    HA3  GLY   1           HA2      GLY   1  60.354   0.217   4.422
    6    H    LYS   2           HN       LYS   2  60.032   2.823   2.671
    7    HA   LYS   2           HA       LYS   2  57.731   4.192   3.685
    8    HB2  LYS   2           HB2      LYS   2  58.445   3.715   0.766
    9    HB3  LYS   2           HB1      LYS   2  57.470   5.046   1.435
   10    HG2  LYS   2           HG2      LYS   2  59.550   5.652   2.844
   11    HG3  LYS   2           HG1      LYS   2  60.452   4.543   1.786
   12    HD2  LYS   2           HD2      LYS   2  58.859   6.993   0.907
   13    HD3  LYS   2           HD1      LYS   2  60.632   6.835   0.927
   14    HE2  LYS   2           HE2      LYS   2  58.628   5.416  -0.862
   15    HE3  LYS   2           HE1      LYS   2  60.027   6.409  -1.332
   16    HZ1  LYS   2           HZ1      LYS   2  60.584   4.119  -1.622
   17    HZ2  LYS   2           HZ2      LYS   2  60.087   3.725  -0.045
   18    HZ3  LYS   2           HZ3      LYS   2  61.459   4.697  -0.289
   19    H    GLY   3           HN       GLY   3  56.246   3.737   1.016
   20    HA2  GLY   3           HA1      GLY   3  54.125   2.643   0.617
   21    HA3  GLY   3           HA2      GLY   3  55.178   1.143   0.778
   22    H    ARG   4           HN       ARG   4  53.883   3.789   1.852
   23    HA   ARG   4           HA       ARG   4  51.833   2.975   2.212
   24    HB2  ARG   4           HB2      ARG   4  53.081   2.136   4.789
   25    HB3  ARG   4           HB1      ARG   4  51.508   2.926   5.007
   26    HG2  ARG   4           HG2      ARG   4  51.223   0.937   2.874
   27    HG3  ARG   4           HG1      ARG   4  52.010   0.161   4.259
   28    HD2  ARG   4           HD2      ARG   4  49.487   1.836   4.559
   29    HD3  ARG   4           HD1      ARG   4  49.457   0.090   4.228
   30    HE   ARG   4           HE       ARG   4  51.152   0.764   6.504
   31   HH11  ARG   4          HH11      ARG   4  49.922   1.134   8.507
   32   HH12  ARG   4          HH12      ARG   4  48.471   0.205   8.689
   33   HH21  ARG   4          HH21      ARG   4  48.420  -0.861   5.391
   34   HH22  ARG   4          HH22      ARG   4  47.622  -0.924   6.927
   35    H    TRP   5           HN       TRP   5  54.185   4.994   2.987
   36    HA   TRP   5           HA       TRP   5  53.366   6.993   4.717
   37    HB2  TRP   5           HB2      TRP   5  55.442   6.980   3.242
   38    HB3  TRP   5           HB1      TRP   5  54.414   7.595   1.925
   39    HD1  TRP   5           HD1      TRP   5  53.328  10.032   2.255
   40    HE1  TRP   5           HE1      TRP   5  54.054  12.084   3.679
   41    HE3  TRP   5           HE3      TRP   5  56.580   7.692   5.443
   42    HZ2  TRP   5           HZ2      TRP   5  55.815  12.604   5.898
   43    HZ3  TRP   5           HZ3      TRP   5  57.771   8.986   7.205
   44    HH2  TRP   5           HH2      TRP   5  57.392  11.436   7.435
   45    H    LEU   6           HN       LEU   6  51.799   5.942   1.838
   46    HA   LEU   6           HA       LEU   6  49.980   8.334   1.822
   47    HB2  LEU   6           HB2      LEU   6  51.065   7.907  -0.324
   48    HB3  LEU   6           HB1      LEU   6  50.567   6.203  -0.278
   49    HG   LEU   6           HG       LEU   6  48.199   6.850  -0.436
   50   HD11  LEU   6          HD11      LEU   6  49.343   9.656  -0.164
   51   HD12  LEU   6          HD12      LEU   6  47.995   8.909   0.728
   52   HD13  LEU   6          HD13      LEU   6  47.781   9.383  -0.970
   53   HD21  LEU   6          HD21      LEU   6  49.844   8.405  -2.479
   54   HD22  LEU   6          HD22      LEU   6  48.225   7.700  -2.713
   55   HD23  LEU   6          HD23      LEU   6  49.638   6.637  -2.502
   56    H    GLU   7           HN       GLU   7  50.249   4.897   2.543
   57    HA   GLU   7           HA       GLU   7  47.234   4.711   2.724
   58    HB2  GLU   7           HB2      GLU   7  49.441   2.655   2.352
   59    HB3  GLU   7           HB1      GLU   7  47.815   2.190   2.909
   60    HG2  GLU   7           HG2      GLU   7  48.293   3.837   0.388
   61    HG3  GLU   7           HG1      GLU   7  48.209   2.059   0.379
   62    H    ARG   8           HN       ARG   8  49.547   5.813   4.544
   63    HA   ARG   8           HA       ARG   8  49.352   4.094   6.915
   64    HB2  ARG   8           HB2      ARG   8  51.346   5.541   6.288
   65    HB3  ARG   8           HB1      ARG   8  50.363   6.956   6.734
   66    HG2  ARG   8           HG2      ARG   8  50.013   5.934   9.005
   67    HG3  ARG   8           HG1      ARG   8  51.133   4.628   8.546
   68    HD2  ARG   8           HD2      ARG   8  52.939   6.248   8.194
   69    HD3  ARG   8           HD1      ARG   8  51.829   7.596   8.537
   70    HE   ARG   8           HE       ARG   8  52.109   7.142  10.836
   71   HH11  ARG   8          HH11      ARG   8  54.733   6.132  10.784
   72   HH12  ARG   8          HH12      ARG   8  54.609   4.479  11.284
   73   HH21  ARG   8          HH21      ARG   8  51.202   4.273  10.673
   74   HH22  ARG   8          HH22      ARG   8  52.610   3.426  11.222
   75    H    ILE   9           HN       ILE   9  48.585   7.581   6.481
   76    HA   ILE   9           HA       ILE   9  46.770   7.582   8.729
   77    HB   ILE   9           HB       ILE   9  46.123   9.849   7.918
   78   HG12  ILE   9          HG12      ILE   9  47.899   9.084   5.553
   79   HG13  ILE   9          HG11      ILE   9  46.155   9.426   5.500
   80   HG21  ILE   9          HG21      ILE   9  49.133   9.466   7.652
   81   HG22  ILE   9          HG22      ILE   9  48.288   9.337   9.214
   82   HG23  ILE   9          HG23      ILE   9  48.259  10.869   8.310
   83   HD11  ILE   9           HD1      ILE   9  48.444  11.353   6.007
   84   HD12  ILE   9           HD2      ILE   9  46.780  11.748   6.501
   85   HD13  ILE   9           HD3      ILE   9  47.155  11.454   4.787
   86    H    GLY  10           HN       GLY  10  46.395   7.130   5.241
   87    HA2  GLY  10           HA1      GLY  10  44.572   6.405   4.017
   88    HA3  GLY  10           HA2      GLY  10  43.875   5.818   5.540
   89    H    LYS  11           HN       LYS  11  44.637   9.039   4.135
   90    HA   LYS  11           HA       LYS  11  41.834   9.758   3.941
   91    HB2  LYS  11           HB2      LYS  11  42.242   9.841   6.453
   92    HB3  LYS  11           HB1      LYS  11  43.389  11.166   6.143
   93    HG2  LYS  11           HG2      LYS  11  41.546  12.405   4.952
   94    HG3  LYS  11           HG1      LYS  11  40.420  11.119   5.448
   95    HD2  LYS  11           HD2      LYS  11  41.009  11.561   7.836
   96    HD3  LYS  11           HD1      LYS  11  42.053  12.904   7.306
   97    HE2  LYS  11           HE2      LYS  11  39.052  12.673   6.807
   98    HE3  LYS  11           HE1      LYS  11  39.832  13.744   7.994
   99    HZ1  LYS  11           HZ1      LYS  11  39.420  14.171   5.236
  100    HZ2  LYS  11           HZ2      LYS  11  41.091  14.163   5.544
  101    HZ3  LYS  11           HZ3      LYS  11  40.073  15.230   6.388
  102    H    ALA  12           HN       ALA  12  43.210   9.967   1.869
  103    HA   ALA  12           HA       ALA  12  45.014  12.217   1.668
  104    HB1  ALA  12           HB1      ALA  12  44.858  10.225   0.100
  105    HB2  ALA  12           HB2      ALA  12  44.956  11.819  -0.687
  106    HB3  ALA  12           HB3      ALA  12  43.392  10.976  -0.574
  107    H    GLY  13           HN       GLY  13  43.691  13.784   2.870
  108    HA2  GLY  13           HA1      GLY  13  42.188  15.550   2.978
  109    HA3  GLY  13           HA2      GLY  13  42.625  15.786   1.275
  110    H    PHE  14           HN       PHE  14  40.599  13.565   3.254
  111    HA   PHE  14           HA       PHE  14  38.467  12.742   2.843
  112    HB2  PHE  14           HB2      PHE  14  38.039  15.316   1.278
  113    HB3  PHE  14           HB1      PHE  14  36.807  14.316   2.086
  114    HD1  PHE  14           HD1      PHE  14  36.673  14.227   4.564
  115    HD2  PHE  14           HD2      PHE  14  39.469  16.822   2.545
  116    HE1  PHE  14           HE1      PHE  14  37.019  15.500   6.678
  117    HE2  PHE  14           HE2      PHE  14  39.816  18.094   4.659
  118    HZ   PHE  14           HZ       PHE  14  38.654  17.378   6.745
  119    H    ILE  15           HN       ILE  15  40.601  12.052   1.026
  120    HA   ILE  15           HA       ILE  15  40.882  10.962  -0.990
  121    HB   ILE  15           HB       ILE  15  37.848  10.906  -1.225
  122   HG12  ILE  15          HG12      ILE  15  38.249  10.098   0.986
  123   HG13  ILE  15          HG11      ILE  15  38.086   8.642  -0.012
  124   HG21  ILE  15          HG21      ILE  15  40.126   9.247  -2.368
  125   HG22  ILE  15          HG22      ILE  15  38.824  10.095  -3.223
  126   HG23  ILE  15          HG23      ILE  15  38.462   8.625  -2.295
  127   HD11  ILE  15           HD1      ILE  15  40.633   9.887   1.094
  128   HD12  ILE  15           HD2      ILE  15  40.660   8.662  -0.196
  129   HD13  ILE  15           HD3      ILE  15  39.983   8.261   1.396
  130    H    ILE  16           HN       ILE  16  41.625  13.215  -1.577
  131    HA   ILE  16           HA       ILE  16  40.133  14.048  -4.034
  132    HB   ILE  16           HB       ILE  16  39.527  15.627  -2.175
  133   HG12  ILE  16          HG12      ILE  16  40.219  17.728  -3.407
  134   HG13  ILE  16          HG11      ILE  16  41.280  16.733  -4.427
  135   HG21  ILE  16          HG21      ILE  16  41.982  15.319  -1.163
  136   HG22  ILE  16          HG22      ILE  16  41.099  16.848  -0.955
  137   HG23  ILE  16          HG23      ILE  16  42.347  16.710  -2.208
  138   HD11  ILE  16           HD1      ILE  16  39.477  15.706  -5.534
  139   HD12  ILE  16           HD2      ILE  16  38.802  17.320  -5.226
  140   HD13  ILE  16           HD3      ILE  16  38.356  15.958  -4.173
  141    H    ILE  17           HN       ILE  17  43.107  13.914  -2.095
  142    HA   ILE  17           HA       ILE  17  44.744  14.675  -4.491
  143    HB   ILE  17           HB       ILE  17  45.640  13.875  -1.682
  144   HG12  ILE  17          HG12      ILE  17  44.418  15.941  -1.473
  145   HG13  ILE  17          HG11      ILE  17  46.138  16.358  -1.433
  146   HG21  ILE  17          HG21      ILE  17  47.769  15.170  -2.582
  147   HG22  ILE  17          HG22      ILE  17  47.088  14.802  -4.183
  148   HG23  ILE  17          HG23      ILE  17  47.492  13.483  -3.066
  149   HD11  ILE  17           HD1      ILE  17  45.182  17.965  -2.895
  150   HD12  ILE  17           HD2      ILE  17  44.149  16.764  -3.695
  151   HD13  ILE  17           HD3      ILE  17  45.899  16.771  -3.995
  152    H    GLY  18           HN       GLY  18  44.053  11.982  -2.275
  153    HA2  GLY  18           HA1      GLY  18  45.852  10.153  -3.681
  154    HA3  GLY  18           HA2      GLY  18  44.688   9.742  -2.403
  155    H    GLY  19           HN       GLY  19  42.314  10.669  -3.464
  156    HA2  GLY  19           HA1      GLY  19  41.720   8.536  -5.336
  157    HA3  GLY  19           HA2      GLY  19  40.604   9.793  -4.767
  158    H    ALA  20           HN       ALA  20  42.178  12.058  -5.566
  159    HA   ALA  20           HA       ALA  20  42.194  13.455  -7.427
  160    HB1  ALA  20           HB1      ALA  20  43.673  12.749  -9.188
  161    HB2  ALA  20           HB2      ALA  20  43.424  11.033  -8.781
  162    HB3  ALA  20           HB3      ALA  20  44.301  12.099  -7.655
  163    H    LEU  21           HN       LEU  21  39.683  12.556  -7.155
  164    HA   LEU  21           HA       LEU  21  38.629  11.069  -9.351
  165    HB2  LEU  21           HB2      LEU  21  37.288  11.429  -7.375
  166    HB3  LEU  21           HB1      LEU  21  37.403  13.193  -7.547
  167    HG   LEU  21           HG       LEU  21  36.029  13.164  -9.547
  168   HD11  LEU  21          HD11      LEU  21  35.052  10.869 -10.280
  169   HD12  LEU  21          HD12      LEU  21  36.393  10.148  -9.358
  170   HD13  LEU  21          HD13      LEU  21  36.734  11.221 -10.736
  171   HD21  LEU  21          HD21      LEU  21  34.926  12.961  -7.272
  172   HD22  LEU  21          HD22      LEU  21  34.793  11.209  -7.562
  173   HD23  LEU  21          HD23      LEU  21  33.940  12.356  -8.624
  174    H    ASP  22           HN       ASP  22  38.806  11.544 -11.441
  175    HA   ASP  22           HA       ASP  22  38.937  12.793 -13.394
  176    HB2  ASP  22           HB2      ASP  22  37.072  14.613 -11.819
  177    HB3  ASP  22           HB1      ASP  22  37.357  14.707 -13.573
  178    H    HIS  23           HN       HIS  23  40.636  13.487 -10.854
  179    HA   HIS  23           HA       HIS  23  42.304  15.013 -10.334
  180    HB2  HIS  23           HB2      HIS  23  43.007  14.307 -12.653
  181    HB3  HIS  23           HB1      HIS  23  42.165  15.743 -13.284
  182    HD1  HIS  23           HD1      HIS  23  43.892  15.993  -9.956
  183    HD2  HIS  23           HD2      HIS  23  44.651  16.996 -13.969
  184    HE1  HIS  23           HE1      HIS  23  45.957  17.498  -9.988
  185    H    LEU  24           HN       LEU  24  39.417  15.855 -10.327
  186    HA   LEU  24           HA       LEU  24  38.198  17.798 -10.014
  187    HB2  LEU  24           HB2      LEU  24  39.720  18.171  -8.184
  188    HB3  LEU  24           HB1      LEU  24  40.994  18.748  -9.279
  189    HG   LEU  24           HG       LEU  24  39.749  20.765  -9.788
  190   HD11  LEU  24          HD11      LEU  24  37.501  21.126  -8.544
  191   HD12  LEU  24          HD12      LEU  24  37.492  19.362  -8.304
  192   HD13  LEU  24          HD13      LEU  24  37.482  20.039  -9.951
  193   HD21  LEU  24          HD21      LEU  24  39.510  20.196  -6.800
  194   HD22  LEU  24          HD22      LEU  24  39.633  21.797  -7.569
  195   HD23  LEU  24          HD23      LEU  24  41.012  20.674  -7.625
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  61.048   7.237   9.130
    2    H2   GLY   1           HT2      GLY   1  59.872   6.264   8.383
    3    H3   GLY   1           HT3      GLY   1  59.547   7.004   9.878
    4    HA2  GLY   1           HA1      GLY   1  59.147   8.995   9.012
    5    HA3  GLY   1           HA2      GLY   1  60.305   8.734   7.692
    6    H    LYS   2           HN       LYS   2  59.554   6.571   6.388
    7    HA   LYS   2           HA       LYS   2  57.055   7.427   5.117
    8    HB2  LYS   2           HB2      LYS   2  58.648   4.896   4.577
    9    HB3  LYS   2           HB1      LYS   2  57.541   5.749   3.475
   10    HG2  LYS   2           HG2      LYS   2  59.087   7.759   3.629
   11    HG3  LYS   2           HG1      LYS   2  60.238   6.721   4.507
   12    HD2  LYS   2           HD2      LYS   2  60.103   5.101   2.536
   13    HD3  LYS   2           HD1      LYS   2  59.211   6.368   1.660
   14    HE2  LYS   2           HE2      LYS   2  61.981   6.721   2.888
   15    HE3  LYS   2           HE1      LYS   2  61.664   6.409   1.164
   16    HZ1  LYS   2           HZ1      LYS   2  61.894   8.747   1.473
   17    HZ2  LYS   2           HZ2      LYS   2  60.787   8.762   2.762
   18    HZ3  LYS   2           HZ3      LYS   2  60.252   8.439   1.183
   19    H    GLY   3           HN       GLY   3  56.175   6.986   7.541
   20    HA2  GLY   3           HA1      GLY   3  55.511   4.470   8.551
   21    HA3  GLY   3           HA2      GLY   3  54.284   5.817   8.497
   22    H    ARG   4           HN       ARG   4  53.769   6.567   6.730
   23    HA   ARG   4           HA       ARG   4  51.890   5.095   7.175
   24    HB2  ARG   4           HB2      ARG   4  51.924   7.010   4.794
   25    HB3  ARG   4           HB1      ARG   4  50.438   6.312   5.490
   26    HG2  ARG   4           HG2      ARG   4  50.906   7.319   7.656
   27    HG3  ARG   4           HG1      ARG   4  52.502   7.879   7.100
   28    HD2  ARG   4           HD2      ARG   4  49.857   8.740   5.850
   29    HD3  ARG   4           HD1      ARG   4  50.738   9.682   7.077
   30    HE   ARG   4           HE       ARG   4  52.477   9.032   4.863
   31   HH11  ARG   4          HH11      ARG   4  51.127  11.559   6.499
   32   HH12  ARG   4          HH12      ARG   4  50.948  12.612   5.135
   33   HH21  ARG   4          HH21      ARG   4  51.702  10.157   2.804
   34   HH22  ARG   4          HH22      ARG   4  51.273  11.819   3.044
   35    H    TRP   5           HN       TRP   5  54.205   4.447   5.097
   36    HA   TRP   5           HA       TRP   5  53.329   3.308   2.716
   37    HB2  TRP   5           HB2      TRP   5  55.676   3.238   3.396
   38    HB3  TRP   5           HB1      TRP   5  55.286   2.102   4.708
   39    HD1  TRP   5           HD1      TRP   5  54.145   1.977   0.991
   40    HE1  TRP   5           HE1      TRP   5  54.837  -0.311  -0.021
   41    HE3  TRP   5           HE3      TRP   5  56.705   0.061   4.993
   42    HZ2  TRP   5           HZ2      TRP   5  56.305  -2.640   0.814
   43    HZ3  TRP   5           HZ3      TRP   5  57.743  -2.199   4.859
   44    HH2  TRP   5           HH2      TRP   5  57.547  -3.548   2.775
   45    H    LEU   6           HN       LEU   6  52.595   2.288   5.952
   46    HA   LEU   6           HA       LEU   6  51.369  -0.280   5.032
   47    HB2  LEU   6           HB2      LEU   6  52.040   0.935   7.731
   48    HB3  LEU   6           HB1      LEU   6  50.917  -0.432   7.611
   49    HG   LEU   6           HG       LEU   6  53.363  -1.017   8.065
   50   HD11  LEU   6          HD11      LEU   6  53.273  -3.028   6.832
   51   HD12  LEU   6          HD12      LEU   6  52.442  -2.277   5.454
   52   HD13  LEU   6          HD13      LEU   6  51.565  -2.563   6.973
   53   HD21  LEU   6          HD21      LEU   6  53.741  -0.372   5.113
   54   HD22  LEU   6          HD22      LEU   6  54.972  -0.889   6.287
   55   HD23  LEU   6          HD23      LEU   6  54.232   0.724   6.424
   56    H    GLU   7           HN       GLU   7  50.595   2.985   6.200
   57    HA   GLU   7           HA       GLU   7  47.655   2.276   6.087
   58    HB2  GLU   7           HB2      GLU   7  49.163   4.447   7.593
   59    HB3  GLU   7           HB1      GLU   7  47.389   4.373   7.461
   60    HG2  GLU   7           HG2      GLU   7  47.326   2.222   8.576
   61    HG3  GLU   7           HG1      GLU   7  49.100   2.085   8.522
   62    H    ARG   8           HN       ARG   8  48.834   2.595   3.654
   63    HA   ARG   8           HA       ARG   8  48.999   5.279   2.699
   64    HB2  ARG   8           HB2      ARG   8  49.747   3.166   1.503
   65    HB3  ARG   8           HB1      ARG   8  48.037   2.870   1.112
   66    HG2  ARG   8           HG2      ARG   8  47.895   5.027  -0.055
   67    HG3  ARG   8           HG1      ARG   8  49.576   5.403   0.394
   68    HD2  ARG   8           HD2      ARG   8  50.343   3.392  -0.863
   69    HD3  ARG   8           HD1      ARG   8  48.660   3.075  -1.353
   70    HE   ARG   8           HE       ARG   8  49.394   5.763  -2.075
   71   HH11  ARG   8          HH11      ARG   8  48.755   5.732  -4.374
   72   HH12  ARG   8          HH12      ARG   8  49.603   4.605  -5.377
   73   HH21  ARG   8          HH21      ARG   8  51.008   2.884  -2.714
   74   HH22  ARG   8          HH22      ARG   8  50.879   2.992  -4.439
   75    H    ILE   9           HN       ILE   9  47.531   6.605   1.605
   76    HA   ILE   9           HA       ILE   9  44.679   5.807   1.504
   77    HB   ILE   9           HB       ILE   9  43.947   7.837   2.783
   78   HG12  ILE   9          HG12      ILE   9  46.920   7.964   3.479
   79   HG13  ILE   9          HG11      ILE   9  46.000   9.175   2.556
   80   HG21  ILE   9          HG21      ILE   9  44.213   5.487   3.798
   81   HG22  ILE   9          HG22      ILE   9  44.199   6.840   4.950
   82   HG23  ILE   9          HG23      ILE   9  45.740   6.071   4.501
   83   HD11  ILE   9           HD1      ILE   9  45.795   8.487   5.506
   84   HD12  ILE   9           HD2      ILE   9  44.464   9.317   4.661
   85   HD13  ILE   9           HD3      ILE   9  46.073  10.071   4.751
   86    H    GLY  10           HN       GLY  10  47.292   8.109   0.939
   87    HA2  GLY  10           HA1      GLY  10  47.648   9.472  -0.908
   88    HA3  GLY  10           HA2      GLY  10  46.208   8.766  -1.670
   89    H    LYS  11           HN       LYS  11  44.775   9.548   0.993
   90    HA   LYS  11           HA       LYS  11  43.678  12.013  -0.051
   91    HB2  LYS  11           HB2      LYS  11  43.403  10.673   2.666
   92    HB3  LYS  11           HB1      LYS  11  42.444  12.072   2.121
   93    HG2  LYS  11           HG2      LYS  11  41.557  10.768   0.237
   94    HG3  LYS  11           HG1      LYS  11  42.570   9.378   0.695
   95    HD2  LYS  11           HD2      LYS  11  41.404   9.411   2.963
   96    HD3  LYS  11           HD1      LYS  11  40.267  10.595   2.273
   97    HE2  LYS  11           HE2      LYS  11  39.241   8.438   1.999
   98    HE3  LYS  11           HE1      LYS  11  39.845   8.910   0.393
   99    HZ1  LYS  11           HZ1      LYS  11  41.786   7.507   1.996
  100    HZ2  LYS  11           HZ2      LYS  11  41.309   7.243   0.387
  101    HZ3  LYS  11           HZ3      LYS  11  40.406   6.580   1.664
  102    H    ALA  12           HN       ALA  12  44.928  13.793  -0.151
  103    HA   ALA  12           HA       ALA  12  46.980  14.351   1.828
  104    HB1  ALA  12           HB1      ALA  12  47.071  15.175  -0.507
  105    HB2  ALA  12           HB2      ALA  12  47.181  16.502   0.675
  106    HB3  ALA  12           HB3      ALA  12  45.653  16.201  -0.188
  107    H    GLY  13           HN       GLY  13  43.718  14.303   2.105
  108    HA2  GLY  13           HA1      GLY  13  42.260  15.177   3.663
  109    HA3  GLY  13           HA2      GLY  13  43.680  15.703   4.592
  110    H    PHE  14           HN       PHE  14  44.067  16.996   1.600
  111    HA   PHE  14           HA       PHE  14  42.883  19.620   2.470
  112    HB2  PHE  14           HB2      PHE  14  45.343  19.475   1.945
  113    HB3  PHE  14           HB1      PHE  14  44.913  19.041   0.273
  114    HD1  PHE  14           HD1      PHE  14  44.145  21.636   2.903
  115    HD2  PHE  14           HD2      PHE  14  44.620  20.785  -1.304
  116    HE1  PHE  14           HE1      PHE  14  43.837  24.051   2.378
  117    HE2  PHE  14           HE2      PHE  14  44.312  23.201  -1.826
  118    HZ   PHE  14           HZ       PHE  14  43.854  24.822   0.009
  119    H    ILE  15           HN       ILE  15  42.920  17.144  -0.023
  120    HA   ILE  15           HA       ILE  15  40.387  18.182  -1.115
  121    HB   ILE  15           HB       ILE  15  41.413  17.991  -3.526
  122   HG12  ILE  15          HG12      ILE  15  43.930  18.592  -1.897
  123   HG13  ILE  15          HG11      ILE  15  43.597  17.038  -2.687
  124   HG21  ILE  15          HG21      ILE  15  40.652  20.126  -2.346
  125   HG22  ILE  15          HG22      ILE  15  41.921  20.346  -3.568
  126   HG23  ILE  15          HG23      ILE  15  42.343  20.353  -1.840
  127   HD11  ILE  15           HD1      ILE  15  43.299  18.461  -4.869
  128   HD12  ILE  15           HD2      ILE  15  44.947  18.170  -4.266
  129   HD13  ILE  15           HD3      ILE  15  44.154  19.733  -3.964
  130    H    ILE  16           HN       ILE  16  42.077  16.318  -3.392
  131    HA   ILE  16           HA       ILE  16  41.653  14.156  -4.121
  132    HB   ILE  16           HB       ILE  16  42.057  13.469  -1.180
  133   HG12  ILE  16          HG12      ILE  16  43.900  14.880  -1.763
  134   HG13  ILE  16          HG11      ILE  16  44.514  13.224  -1.894
  135   HG21  ILE  16          HG21      ILE  16  41.391  11.491  -2.278
  136   HG22  ILE  16          HG22      ILE  16  43.163  11.398  -2.342
  137   HG23  ILE  16          HG23      ILE  16  42.247  11.904  -3.779
  138   HD11  ILE  16           HD1      ILE  16  43.887  13.406  -4.420
  139   HD12  ILE  16           HD2      ILE  16  45.315  14.296  -3.851
  140   HD13  ILE  16           HD3      ILE  16  43.782  15.155  -4.119
  141    H    ILE  17           HN       ILE  17  40.312  13.592  -0.842
  142    HA   ILE  17           HA       ILE  17  38.015  12.278  -2.008
  143    HB   ILE  17           HB       ILE  17  38.802  11.606   0.212
  144   HG12  ILE  17          HG12      ILE  17  36.703  11.621   1.450
  145   HG13  ILE  17          HG11      ILE  17  36.116  13.032   0.548
  146   HG21  ILE  17          HG21      ILE  17  37.958  14.357   1.210
  147   HG22  ILE  17          HG22      ILE  17  39.639  13.934   0.807
  148   HG23  ILE  17          HG23      ILE  17  38.795  13.078   2.119
  149   HD11  ILE  17           HD1      ILE  17  35.280  10.651  -0.165
  150   HD12  ILE  17           HD2      ILE  17  36.886  10.482  -0.913
  151   HD13  ILE  17           HD3      ILE  17  35.791  11.784  -1.438
  152    H    GLY  18           HN       GLY  18  38.594  15.474  -0.527
  153    HA2  GLY  18           HA1      GLY  18  35.806  16.292  -0.818
  154    HA3  GLY  18           HA2      GLY  18  37.178  17.314  -0.349
  155    H    GLY  19           HN       GLY  19  38.870  16.915  -2.547
  156    HA2  GLY  19           HA1      GLY  19  37.618  18.745  -4.432
  157    HA3  GLY  19           HA2      GLY  19  39.247  18.051  -4.540
  158    H    ALA  20           HN       ALA  20  38.580  15.308  -4.472
  159    HA   ALA  20           HA       ALA  20  38.156  13.650  -6.046
  160    HB1  ALA  20           HB1      ALA  20  35.869  13.494  -6.800
  161    HB2  ALA  20           HB2      ALA  20  35.611  15.234  -6.523
  162    HB3  ALA  20           HB3      ALA  20  35.869  14.141  -5.142
  163    H    LEU  21           HN       LEU  21  39.939  15.317  -7.107
  164    HA   LEU  21           HA       LEU  21  39.173  16.678  -9.501
  165    HB2  LEU  21           HB2      LEU  21  41.760  15.452  -8.495
  166    HB3  LEU  21           HB1      LEU  21  41.672  16.159 -10.125
  167    HG   LEU  21           HG       LEU  21  40.987  18.316  -9.209
  168   HD11  LEU  21          HD11      LEU  21  41.008  18.568  -6.650
  169   HD12  LEU  21          HD12      LEU  21  40.931  16.791  -6.575
  170   HD13  LEU  21          HD13      LEU  21  39.612  17.709  -7.342
  171   HD21  LEU  21          HD21      LEU  21  43.431  17.689  -9.267
  172   HD22  LEU  21          HD22      LEU  21  43.298  17.205  -7.559
  173   HD23  LEU  21          HD23      LEU  21  43.036  18.902  -8.026
  174    H    ASP  22           HN       ASP  22  37.677  15.419 -10.638
  175    HA   ASP  22           HA       ASP  22  36.988  13.768 -12.121
  176    HB2  ASP  22           HB2      ASP  22  38.781  14.985 -13.426
  177    HB3  ASP  22           HB1      ASP  22  39.918  13.707 -12.932
  178    H    HIS  23           HN       HIS  23  37.381  12.743  -9.596
  179    HA   HIS  23           HA       HIS  23  37.756  10.751  -8.468
  180    HB2  HIS  23           HB2      HIS  23  36.226   9.935 -10.248
  181    HB3  HIS  23           HB1      HIS  23  37.635   9.577 -11.276
  182    HD1  HIS  23           HD1      HIS  23  38.193   7.156 -11.209
  183    HD2  HIS  23           HD2      HIS  23  36.915   8.576  -7.462
  184    HE1  HIS  23           HE1      HIS  23  38.271   5.188  -9.581
  185    H    LEU  24           HN       LEU  24  40.051  12.122  -8.678
  186    HA   LEU  24           HA       LEU  24  42.168  10.687 -10.016
  187    HB2  LEU  24           HB2      LEU  24  42.498  13.005  -9.453
  188    HB3  LEU  24           HB1      LEU  24  42.138  12.707  -7.740
  189    HG   LEU  24           HG       LEU  24  44.192  11.456  -7.444
  190   HD11  LEU  24          HD11      LEU  24  45.787  11.277  -9.482
  191   HD12  LEU  24          HD12      LEU  24  44.352  11.619 -10.479
  192   HD13  LEU  24          HD13      LEU  24  44.395  10.170  -9.445
  193   HD21  LEU  24          HD21      LEU  24  44.314  13.972  -7.488
  194   HD22  LEU  24          HD22      LEU  24  44.807  13.876  -9.195
  195   HD23  LEU  24          HD23      LEU  24  45.845  13.181  -7.927
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  60.400  -0.284  -1.494
    2    H2   GLY   1           HT2      GLY   1  61.873  -0.095  -0.667
    3    H3   GLY   1           HT3      GLY   1  61.704   0.486  -2.256
    4    HA2  GLY   1           HA1      GLY   1  61.598   2.322  -0.843
    5    HA3  GLY   1           HA2      GLY   1  59.972   2.001  -1.475
    6    H    LYS   2           HN       LYS   2  58.460   0.809  -0.123
    7    HA   LYS   2           HA       LYS   2  57.321   0.660   1.895
    8    HB2  LYS   2           HB2      LYS   2  60.040   0.075   3.123
    9    HB3  LYS   2           HB1      LYS   2  58.444  -0.511   3.653
   10    HG2  LYS   2           HG2      LYS   2  58.213  -1.731   1.476
   11    HG3  LYS   2           HG1      LYS   2  59.863  -1.218   1.048
   12    HD2  LYS   2           HD2      LYS   2  60.735  -2.355   3.079
   13    HD3  LYS   2           HD1      LYS   2  59.085  -2.893   3.476
   14    HE2  LYS   2           HE2      LYS   2  58.964  -4.126   1.333
   15    HE3  LYS   2           HE1      LYS   2  60.610  -3.584   0.926
   16    HZ1  LYS   2           HZ1      LYS   2  60.650  -4.695   3.502
   17    HZ2  LYS   2           HZ2      LYS   2  61.407  -5.271   2.094
   18    HZ3  LYS   2           HZ3      LYS   2  59.835  -5.783   2.487
   19    H    GLY   3           HN       GLY   3  57.367   1.388   4.315
   20    HA2  GLY   3           HA1      GLY   3  58.600   3.295   5.681
   21    HA3  GLY   3           HA2      GLY   3  58.110   4.341   4.268
   22    H    ARG   4           HN       ARG   4  56.428   3.877   3.299
   23    HA   ARG   4           HA       ARG   4  55.684   5.736   4.669
   24    HB2  ARG   4           HB2      ARG   4  53.898   4.471   2.533
   25    HB3  ARG   4           HB1      ARG   4  53.662   6.116   3.180
   26    HG2  ARG   4           HG2      ARG   4  56.020   6.668   2.521
   27    HG3  ARG   4           HG1      ARG   4  56.157   5.057   1.775
   28    HD2  ARG   4           HD2      ARG   4  54.322   7.344   0.974
   29    HD3  ARG   4           HD1      ARG   4  55.568   6.539  -0.009
   30    HE   ARG   4           HE       ARG   4  53.745   4.522   0.687
   31   HH11  ARG   4          HH11      ARG   4  52.525   7.525   0.101
   32   HH12  ARG   4          HH12      ARG   4  51.738   7.142  -1.394
   33   HH21  ARG   4          HH21      ARG   4  53.238   4.029  -1.691
   34   HH22  ARG   4          HH22      ARG   4  52.142   5.163  -2.408
   35    H    TRP   5           HN       TRP   5  54.984   2.692   5.264
   36    HA   TRP   5           HA       TRP   5  52.376   2.235   6.117
   37    HB2  TRP   5           HB2      TRP   5  54.220   0.615   6.415
   38    HB3  TRP   5           HB1      TRP   5  54.881   1.612   7.734
   39    HD1  TRP   5           HD1      TRP   5  53.464   1.756   9.998
   40    HE1  TRP   5           HE1      TRP   5  51.686   0.181  11.056
   41    HE3  TRP   5           HE3      TRP   5  52.290  -1.028   5.865
   42    HZ2  TRP   5           HZ2      TRP   5  49.998  -1.987  10.194
   43    HZ3  TRP   5           HZ3      TRP   5  50.592  -2.843   6.006
   44    HH2  TRP   5           HH2      TRP   5  49.446  -3.325   8.165
   45    H    LEU   6           HN       LEU   6  54.573   4.619   7.328
   46    HA   LEU   6           HA       LEU   6  52.792   5.215   9.672
   47    HB2  LEU   6           HB2      LEU   6  55.212   4.861  10.141
   48    HB3  LEU   6           HB1      LEU   6  55.610   6.181   9.020
   49    HG   LEU   6           HG       LEU   6  54.285   7.762  10.443
   50   HD11  LEU   6          HD11      LEU   6  53.871   6.778  12.875
   51   HD12  LEU   6          HD12      LEU   6  53.816   5.213  12.030
   52   HD13  LEU   6          HD13      LEU   6  52.663   6.499  11.603
   53   HD21  LEU   6          HD21      LEU   6  56.729   7.470  10.752
   54   HD22  LEU   6          HD22      LEU   6  56.425   6.168  11.926
   55   HD23  LEU   6          HD23      LEU   6  55.923   7.835  12.296
   56    H    GLU   7           HN       GLU   7  54.002   6.392   6.557
   57    HA   GLU   7           HA       GLU   7  52.890   9.114   7.054
   58    HB2  GLU   7           HB2      GLU   7  54.340   7.839   4.701
   59    HB3  GLU   7           HB1      GLU   7  53.724   9.509   4.703
   60    HG2  GLU   7           HG2      GLU   7  55.118  10.057   6.649
   61    HG3  GLU   7           HG1      GLU   7  55.680   8.371   6.751
   62    H    ARG   8           HN       ARG   8  51.503   6.269   6.558
   63    HA   ARG   8           HA       ARG   8  49.930   6.589   4.185
   64    HB2  ARG   8           HB2      ARG   8  50.224   4.471   5.523
   65    HB3  ARG   8           HB1      ARG   8  49.137   5.161   6.750
   66    HG2  ARG   8           HG2      ARG   8  47.357   5.401   5.029
   67    HG3  ARG   8           HG1      ARG   8  48.445   4.680   3.817
   68    HD2  ARG   8           HD2      ARG   8  48.491   2.576   4.983
   69    HD3  ARG   8           HD1      ARG   8  47.696   3.276   6.413
   70    HE   ARG   8           HE       ARG   8  45.964   3.630   4.176
   71   HH11  ARG   8          HH11      ARG   8  45.417   2.275   6.889
   72   HH12  ARG   8          HH12      ARG   8  44.951   0.691   6.364
   73   HH21  ARG   8          HH21      ARG   8  46.200   1.099   3.154
   74   HH22  ARG   8          HH22      ARG   8  45.394   0.025   4.250
   75    H    ILE   9           HN       ILE   9  49.358   8.857   4.226
   76    HA   ILE   9           HA       ILE   9  47.738   9.965   6.332
   77    HB   ILE   9           HB       ILE   9  48.982  11.330   4.627
   78   HG12  ILE   9          HG12      ILE   9  45.966  11.817   4.695
   79   HG13  ILE   9          HG11      ILE   9  47.096  12.253   5.996
   80   HG21  ILE   9          HG21      ILE   9  46.687  10.696   2.731
   81   HG22  ILE   9          HG22      ILE   9  48.213   9.781   2.697
   82   HG23  ILE   9          HG23      ILE   9  48.220  11.530   2.381
   83   HD11  ILE   9           HD1      ILE   9  46.961  13.372   3.172
   84   HD12  ILE   9           HD2      ILE   9  48.393  13.590   4.207
   85   HD13  ILE   9           HD3      ILE   9  46.819  14.248   4.713
   86    H    GLY  10           HN       GLY  10  46.954   8.463   3.178
   87    HA2  GLY  10           HA1      GLY  10  44.887   7.851   2.296
   88    HA3  GLY  10           HA2      GLY  10  44.686   7.092   3.887
   89    H    LYS  11           HN       LYS  11  44.785  10.546   2.942
   90    HA   LYS  11           HA       LYS  11  41.905  10.862   3.289
   91    HB2  LYS  11           HB2      LYS  11  42.774  10.632   5.672
   92    HB3  LYS  11           HB1      LYS  11  43.676  12.143   5.403
   93    HG2  LYS  11           HG2      LYS  11  41.597  13.346   4.917
   94    HG3  LYS  11           HG1      LYS  11  40.661  11.839   5.055
   95    HD2  LYS  11           HD2      LYS  11  41.367  11.615   7.422
   96    HD3  LYS  11           HD1      LYS  11  42.288  13.133   7.287
   97    HE2  LYS  11           HE2      LYS  11  40.239  14.386   6.812
   98    HE3  LYS  11           HE1      LYS  11  39.288  12.881   6.799
   99    HZ1  LYS  11           HZ1      LYS  11  38.999  13.772   8.927
  100    HZ2  LYS  11           HZ2      LYS  11  40.639  14.187   9.093
  101    HZ3  LYS  11           HZ3      LYS  11  40.163  12.557   9.147
  102    H    ALA  12           HN       ALA  12  42.691  11.604   1.093
  103    HA   ALA  12           HA       ALA  12  44.199  14.090   0.963
  104    HB1  ALA  12           HB1      ALA  12  42.345  12.930  -1.140
  105    HB2  ALA  12           HB2      ALA  12  44.006  12.350  -0.867
  106    HB3  ALA  12           HB3      ALA  12  43.723  14.030  -1.384
  107    H    GLY  13           HN       GLY  13  42.813  15.109   2.710
  108    HA2  GLY  13           HA1      GLY  13  41.185  16.638   3.315
  109    HA3  GLY  13           HA2      GLY  13  41.269  17.183   1.628
  110    H    PHE  14           HN       PHE  14  39.941  14.447   3.542
  111    HA   PHE  14           HA       PHE  14  37.891  13.382   3.399
  112    HB2  PHE  14           HB2      PHE  14  37.149  15.752   3.936
  113    HB3  PHE  14           HB1      PHE  14  36.866  15.982   2.195
  114    HD1  PHE  14           HD1      PHE  14  34.842  15.211   1.192
  115    HD2  PHE  14           HD2      PHE  14  35.971  13.778   5.105
  116    HE1  PHE  14           HE1      PHE  14  32.628  14.093   1.421
  117    HE2  PHE  14           HE2      PHE  14  33.756  12.659   5.333
  118    HZ   PHE  14           HZ       PHE  14  32.102  12.780   3.472
  119    H    ILE  15           HN       ILE  15  39.784  13.345   1.100
  120    HA   ILE  15           HA       ILE  15  39.829  12.484  -1.025
  121    HB   ILE  15           HB       ILE  15  36.884  11.770  -0.715
  122   HG12  ILE  15          HG12      ILE  15  39.356  10.330   0.354
  123   HG13  ILE  15          HG11      ILE  15  38.041  11.035   1.321
  124   HG21  ILE  15          HG21      ILE  15  37.386  10.013  -2.270
  125   HG22  ILE  15          HG22      ILE  15  39.140  10.265  -2.100
  126   HG23  ILE  15          HG23      ILE  15  38.140  11.479  -2.932
  127   HD11  ILE  15           HD1      ILE  15  37.967   8.591  -0.477
  128   HD12  ILE  15           HD2      ILE  15  36.470   9.447  -0.028
  129   HD13  ILE  15           HD3      ILE  15  37.500   8.729   1.233
  130    H    ILE  16           HN       ILE  16  39.949  14.890  -1.276
  131    HA   ILE  16           HA       ILE  16  37.923  15.719  -3.335
  132    HB   ILE  16           HB       ILE  16  39.222  17.448  -1.193
  133   HG12  ILE  16          HG12      ILE  16  37.235  15.899  -0.522
  134   HG13  ILE  16          HG11      ILE  16  37.133  17.614  -0.096
  135   HG21  ILE  16          HG21      ILE  16  39.000  18.751  -3.207
  136   HG22  ILE  16          HG22      ILE  16  37.645  19.220  -2.156
  137   HG23  ILE  16          HG23      ILE  16  37.371  18.111  -3.521
  138   HD11  ILE  16           HD1      ILE  16  35.012  16.599  -1.088
  139   HD12  ILE  16           HD2      ILE  16  35.879  16.476  -2.632
  140   HD13  ILE  16           HD3      ILE  16  35.599  18.069  -1.896
  141    H    ILE  17           HN       ILE  17  41.120  16.338  -1.830
  142    HA   ILE  17           HA       ILE  17  42.196  17.614  -4.209
  143    HB   ILE  17           HB       ILE  17  43.484  16.423  -1.707
  144   HG12  ILE  17          HG12      ILE  17  43.983  18.780  -1.210
  145   HG13  ILE  17          HG11      ILE  17  43.292  19.282  -2.770
  146   HG21  ILE  17          HG21      ILE  17  45.165  16.098  -3.392
  147   HG22  ILE  17          HG22      ILE  17  45.594  17.623  -2.584
  148   HG23  ILE  17          HG23      ILE  17  44.788  17.653  -4.172
  149   HD11  ILE  17           HD1      ILE  17  41.631  17.712  -0.767
  150   HD12  ILE  17           HD2      ILE  17  41.083  18.760  -2.098
  151   HD13  ILE  17           HD3      ILE  17  41.796  19.479  -0.638
  152    H    GLY  18           HN       GLY  18  42.345  14.360  -2.753
  153    HA2  GLY  18           HA1      GLY  18  43.930  13.279  -4.967
  154    HA3  GLY  18           HA2      GLY  18  43.200  12.373  -3.625
  155    H    GLY  19           HN       GLY  19  40.537  13.142  -3.841
  156    HA2  GLY  19           HA1      GLY  19  39.607  11.335  -5.839
  157    HA3  GLY  19           HA2      GLY  19  38.617  12.529  -4.978
  158    H    ALA  20           HN       ALA  20  39.823  14.905  -5.810
  159    HA   ALA  20           HA       ALA  20  38.618  15.133  -8.465
  160    HB1  ALA  20           HB1      ALA  20  39.071  17.477  -8.253
  161    HB2  ALA  20           HB2      ALA  20  40.275  17.190  -6.973
  162    HB3  ALA  20           HB3      ALA  20  38.548  16.895  -6.656
  163    H    LEU  21           HN       LEU  21  40.744  13.269  -8.499
  164    HA   LEU  21           HA       LEU  21  43.254  14.270  -9.283
  165    HB2  LEU  21           HB2      LEU  21  42.557  11.838  -8.949
  166    HB3  LEU  21           HB1      LEU  21  41.845  11.908 -10.576
  167    HG   LEU  21           HG       LEU  21  44.235  12.799 -11.306
  168   HD11  LEU  21          HD11      LEU  21  46.051  11.720  -9.915
  169   HD12  LEU  21          HD12      LEU  21  44.837  11.401  -8.657
  170   HD13  LEU  21          HD13      LEU  21  45.240  13.075  -9.102
  171   HD21  LEU  21          HD21      LEU  21  44.993  10.467 -11.662
  172   HD22  LEU  21          HD22      LEU  21  43.254  10.635 -12.005
  173   HD23  LEU  21          HD23      LEU  21  43.793   9.894 -10.479
  174    H    ASP  22           HN       ASP  22  43.239  16.108 -10.527
  175    HA   ASP  22           HA       ASP  22  43.020  17.390 -12.451
  176    HB2  ASP  22           HB2      ASP  22  43.039  14.665 -13.811
  177    HB3  ASP  22           HB1      ASP  22  43.409  16.229 -14.576
  178    H    HIS  23           HN       HIS  23  40.661  17.238 -11.202
  179    HA   HIS  23           HA       HIS  23  38.369  17.374 -11.520
  180    HB2  HIS  23           HB2      HIS  23  39.081  19.083 -13.160
  181    HB3  HIS  23           HB1      HIS  23  39.201  17.827 -14.414
  182    HD1  HIS  23           HD1      HIS  23  37.307  18.845 -15.865
  183    HD2  HIS  23           HD2      HIS  23  36.115  17.951 -11.935
  184    HE1  HIS  23           HE1      HIS  23  34.755  18.945 -15.800
  185    H    LEU  24           HN       LEU  24  39.255  14.792 -11.336
  186    HA   LEU  24           HA       LEU  24  37.142  13.387 -12.785
  187    HB2  LEU  24           HB2      LEU  24  39.260  13.625 -14.361
  188    HB3  LEU  24           HB1      LEU  24  39.932  12.332 -13.345
  189    HG   LEU  24           HG       LEU  24  37.320  12.240 -14.926
  190   HD11  LEU  24          HD11      LEU  24  39.949  10.714 -15.194
  191   HD12  LEU  24          HD12      LEU  24  39.375  12.000 -16.283
  192   HD13  LEU  24          HD13      LEU  24  38.496  10.455 -16.187
  193   HD21  LEU  24          HD21      LEU  24  36.910  10.951 -12.958
  194   HD22  LEU  24          HD22      LEU  24  38.577  10.322 -12.920
  195   HD23  LEU  24          HD23      LEU  24  37.437   9.757 -14.165
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  62.113   4.836  11.939
    2    H2   GLY   1           HT2      GLY   1  63.529   5.281  11.111
    3    H3   GLY   1           HT3      GLY   1  63.628   4.404  12.563
    4    HA2  GLY   1           HA1      GLY   1  64.042   3.050  10.612
    5    HA3  GLY   1           HA2      GLY   1  62.666   2.508  11.593
    6    H    LYS   2           HN       LYS   2  61.585   1.457   9.959
    7    HA   LYS   2           HA       LYS   2  61.051   2.763   7.409
    8    HB2  LYS   2           HB2      LYS   2  59.855   0.297   8.734
    9    HB3  LYS   2           HB1      LYS   2  59.518   0.815   7.064
   10    HG2  LYS   2           HG2      LYS   2  61.785   0.480   6.384
   11    HG3  LYS   2           HG1      LYS   2  62.359   0.380   8.063
   12    HD2  LYS   2           HD2      LYS   2  62.312  -1.872   7.173
   13    HD3  LYS   2           HD1      LYS   2  60.980  -1.728   8.337
   14    HE2  LYS   2           HE2      LYS   2  60.353  -2.887   6.175
   15    HE3  LYS   2           HE1      LYS   2  59.356  -1.464   6.547
   16    HZ1  LYS   2           HZ1      LYS   2  60.417  -0.207   4.936
   17    HZ2  LYS   2           HZ2      LYS   2  60.334  -1.734   4.195
   18    HZ3  LYS   2           HZ3      LYS   2  61.791  -1.202   4.890
   19    H    GLY   3           HN       GLY   3  58.324   1.251   8.931
   20    HA2  GLY   3           HA1      GLY   3  56.431   2.341  10.038
   21    HA3  GLY   3           HA2      GLY   3  56.984   3.964   9.429
   22    H    ARG   4           HN       ARG   4  57.605   4.174   7.590
   23    HA   ARG   4           HA       ARG   4  55.328   4.963   7.361
   24    HB2  ARG   4           HB2      ARG   4  57.333   5.154   5.064
   25    HB3  ARG   4           HB1      ARG   4  55.873   6.165   5.199
   26    HG2  ARG   4           HG2      ARG   4  56.632   6.996   7.397
   27    HG3  ARG   4           HG1      ARG   4  58.080   5.967   7.297
   28    HD2  ARG   4           HD2      ARG   4  58.706   7.164   5.167
   29    HD3  ARG   4           HD1      ARG   4  57.342   8.272   5.444
   30    HE   ARG   4           HE       ARG   4  58.793   8.365   7.818
   31   HH11  ARG   4          HH11      ARG   4  61.302   7.888   6.479
   32   HH12  ARG   4          HH12      ARG   4  61.753   9.438   5.851
   33   HH21  ARG   4          HH21      ARG   4  58.568  10.777   6.139
   34   HH22  ARG   4          HH22      ARG   4  60.206  11.073   5.657
   35    H    TRP   5           HN       TRP   5  56.348   2.133   6.325
   36    HA   TRP   5           HA       TRP   5  55.300   1.349   3.868
   37    HB2  TRP   5           HB2      TRP   5  56.437  -0.146   5.525
   38    HB3  TRP   5           HB1      TRP   5  54.923  -0.205   6.457
   39    HD1  TRP   5           HD1      TRP   5  55.812  -0.663   2.697
   40    HE1  TRP   5           HE1      TRP   5  54.571  -2.763   1.796
   41    HE3  TRP   5           HE3      TRP   5  53.409  -2.084   6.988
   42    HZ2  TRP   5           HZ2      TRP   5  52.782  -4.771   2.829
   43    HZ3  TRP   5           HZ3      TRP   5  51.940  -4.095   7.007
   44    HH2  TRP   5           HH2      TRP   5  51.625  -5.438   4.933
   45    H    LEU   6           HN       LEU   6  53.543   2.607   6.552
   46    HA   LEU   6           HA       LEU   6  50.924   1.816   5.278
   47    HB2  LEU   6           HB2      LEU   6  51.392   2.622   8.171
   48    HB3  LEU   6           HB1      LEU   6  49.917   1.935   7.456
   49    HG   LEU   6           HG       LEU   6  52.608   0.500   7.622
   50   HD11  LEU   6          HD11      LEU   6  50.051   0.048   9.222
   51   HD12  LEU   6          HD12      LEU   6  51.487   0.903   9.837
   52   HD13  LEU   6          HD13      LEU   6  51.593  -0.821   9.405
   53   HD21  LEU   6          HD21      LEU   6  51.418  -0.420   5.771
   54   HD22  LEU   6          HD22      LEU   6  49.846  -0.269   6.591
   55   HD23  LEU   6          HD23      LEU   6  51.014  -1.501   7.121
   56    H    GLU   7           HN       GLU   7  53.084   4.432   6.115
   57    HA   GLU   7           HA       GLU   7  51.337   6.545   6.654
   58    HB2  GLU   7           HB2      GLU   7  53.880   6.610   6.443
   59    HB3  GLU   7           HB1      GLU   7  53.643   6.753   4.684
   60    HG2  GLU   7           HG2      GLU   7  52.177   8.761   5.108
   61    HG3  GLU   7           HG1      GLU   7  52.609   8.656   6.831
   62    H    ARG   8           HN       ARG   8  51.743   4.748   3.677
   63    HA   ARG   8           HA       ARG   8  50.762   6.525   1.751
   64    HB2  ARG   8           HB2      ARG   8  49.831   4.475   0.622
   65    HB3  ARG   8           HB1      ARG   8  51.525   4.307   1.145
   66    HG2  ARG   8           HG2      ARG   8  50.762   3.157   3.215
   67    HG3  ARG   8           HG1      ARG   8  49.077   3.296   2.659
   68    HD2  ARG   8           HD2      ARG   8  49.564   1.928   0.692
   69    HD3  ARG   8           HD1      ARG   8  51.292   1.874   1.119
   70    HE   ARG   8           HE       ARG   8  49.840   0.864   3.340
   71   HH11  ARG   8          HH11      ARG   8  49.482   0.132   0.053
   72   HH12  ARG   8          HH12      ARG   8  49.759  -1.568   0.234
   73   HH21  ARG   8          HH21      ARG   8  50.628  -1.337   3.583
   74   HH22  ARG   8          HH22      ARG   8  50.410  -2.400   2.233
   75    H    ILE   9           HN       ILE   9  48.727   7.058   0.924
   76    HA   ILE   9           HA       ILE   9  46.282   6.096   2.152
   77    HB   ILE   9           HB       ILE   9  47.128   7.624   3.973
   78   HG12  ILE   9          HG12      ILE   9  44.631   8.589   2.505
   79   HG13  ILE   9          HG11      ILE   9  44.698   7.170   3.574
   80   HG21  ILE   9          HG21      ILE   9  48.204   9.232   2.273
   81   HG22  ILE   9          HG22      ILE   9  47.310   9.984   3.615
   82   HG23  ILE   9          HG23      ILE   9  46.567   9.874   2.001
   83   HD11  ILE   9           HD1      ILE   9  45.617   8.796   5.377
   84   HD12  ILE   9           HD2      ILE   9  43.891   8.922   4.966
   85   HD13  ILE   9           HD3      ILE   9  45.050  10.097   4.304
   86    H    GLY  10           HN       GLY  10  47.933   8.712   0.377
   87    HA2  GLY  10           HA1      GLY  10  47.438   9.542  -1.739
   88    HA3  GLY  10           HA2      GLY  10  46.111   8.373  -1.875
   89    H    LYS  11           HN       LYS  11  44.319   8.921  -0.056
   90    HA   LYS  11           HA       LYS  11  42.981  11.211  -0.981
   91    HB2  LYS  11           HB2      LYS  11  42.772   9.822   1.719
   92    HB3  LYS  11           HB1      LYS  11  41.598  11.003   1.091
   93    HG2  LYS  11           HG2      LYS  11  41.076   9.567  -0.801
   94    HG3  LYS  11           HG1      LYS  11  42.376   8.434  -0.355
   95    HD2  LYS  11           HD2      LYS  11  41.220   7.958   1.790
   96    HD3  LYS  11           HD1      LYS  11  39.911   9.073   1.327
   97    HE2  LYS  11           HE2      LYS  11  39.412   7.684  -0.654
   98    HE3  LYS  11           HE1      LYS  11  40.734   6.575  -0.218
   99    HZ1  LYS  11           HZ1      LYS  11  38.298   7.151   1.395
  100    HZ2  LYS  11           HZ2      LYS  11  39.588   6.171   1.905
  101    HZ3  LYS  11           HZ3      LYS  11  38.645   5.710   0.569
  102    H    ALA  12           HN       ALA  12  43.972  13.156  -1.033
  103    HA   ALA  12           HA       ALA  12  45.710  14.118   1.050
  104    HB1  ALA  12           HB1      ALA  12  45.763  14.998  -1.244
  105    HB2  ALA  12           HB2      ALA  12  45.452  16.302  -0.073
  106    HB3  ALA  12           HB3      ALA  12  44.116  15.639  -1.045
  107    H    GLY  13           HN       GLY  13  42.497  13.418   1.150
  108    HA2  GLY  13           HA1      GLY  13  40.710  14.154   2.435
  109    HA3  GLY  13           HA2      GLY  13  41.959  14.406   3.670
  110    H    PHE  14           HN       PHE  14  41.686  16.169   0.592
  111    HA   PHE  14           HA       PHE  14  40.327  18.438   1.765
  112    HB2  PHE  14           HB2      PHE  14  42.465  18.690   2.955
  113    HB3  PHE  14           HB1      PHE  14  43.341  18.672   1.408
  114    HD1  PHE  14           HD1      PHE  14  40.375  20.446   2.966
  115    HD2  PHE  14           HD2      PHE  14  43.925  20.781   0.523
  116    HE1  PHE  14           HE1      PHE  14  39.992  22.894   2.738
  117    HE2  PHE  14           HE2      PHE  14  43.533  23.229   0.297
  118    HZ   PHE  14           HZ       PHE  14  41.594  24.292   1.442
  119    H    ILE  15           HN       ILE  15  41.957  16.790  -0.799
  120    HA   ILE  15           HA       ILE  15  40.540  18.474  -2.758
  121    HB   ILE  15           HB       ILE  15  42.667  18.839  -4.130
  122   HG12  ILE  15          HG12      ILE  15  43.956  18.183  -1.438
  123   HG13  ILE  15          HG11      ILE  15  44.053  17.177  -2.901
  124   HG21  ILE  15          HG21      ILE  15  42.730  20.257  -1.439
  125   HG22  ILE  15          HG22      ILE  15  41.498  20.601  -2.673
  126   HG23  ILE  15          HG23      ILE  15  43.215  20.896  -3.025
  127   HD11  ILE  15           HD1      ILE  15  46.071  18.422  -2.942
  128   HD12  ILE  15           HD2      ILE  15  45.268  19.914  -2.400
  129   HD13  ILE  15           HD3      ILE  15  45.010  19.315  -4.057
  130    H    ILE  16           HN       ILE  16  39.971  15.933  -2.169
  131    HA   ILE  16           HA       ILE  16  40.761  14.551  -4.688
  132    HB   ILE  16           HB       ILE  16  41.334  13.616  -1.874
  133   HG12  ILE  16          HG12      ILE  16  43.072  14.422  -3.640
  134   HG13  ILE  16          HG11      ILE  16  43.427  12.939  -2.740
  135   HG21  ILE  16          HG21      ILE  16  39.841  11.852  -2.447
  136   HG22  ILE  16          HG22      ILE  16  41.458  11.206  -2.799
  137   HG23  ILE  16          HG23      ILE  16  40.422  11.784  -4.126
  138   HD11  ILE  16           HD1      ILE  16  42.934  11.545  -4.600
  139   HD12  ILE  16           HD2      ILE  16  43.821  12.913  -5.306
  140   HD13  ILE  16           HD3      ILE  16  42.055  12.830  -5.455
  141    H    ILE  17           HN       ILE  17  38.841  14.458  -1.662
  142    HA   ILE  17           HA       ILE  17  36.694  12.934  -3.019
  143    HB   ILE  17           HB       ILE  17  35.530  13.411  -0.683
  144   HG12  ILE  17          HG12      ILE  17  37.095  13.867   1.140
  145   HG13  ILE  17          HG11      ILE  17  38.456  13.960   0.004
  146   HG21  ILE  17          HG21      ILE  17  36.432  11.216  -1.401
  147   HG22  ILE  17          HG22      ILE  17  36.764  11.520   0.321
  148   HG23  ILE  17          HG23      ILE  17  38.060  11.716  -0.883
  149   HD11  ILE  17           HD1      ILE  17  36.043  15.795  -0.229
  150   HD12  ILE  17           HD2      ILE  17  37.658  15.996  -0.953
  151   HD13  ILE  17           HD3      ILE  17  37.437  16.195   0.800
  152    H    GLY  18           HN       GLY  18  37.516  15.716  -3.864
  153    HA2  GLY  18           HA1      GLY  18  34.887  16.681  -4.438
  154    HA3  GLY  18           HA2      GLY  18  35.554  17.609  -3.080
  155    H    GLY  19           HN       GLY  19  38.235  17.740  -3.738
  156    HA2  GLY  19           HA1      GLY  19  38.251  19.924  -5.563
  157    HA3  GLY  19           HA2      GLY  19  39.679  19.044  -4.985
  158    H    ALA  20           HN       ALA  20  39.037  16.474  -6.000
  159    HA   ALA  20           HA       ALA  20  39.891  16.879  -8.775
  160    HB1  ALA  20           HB1      ALA  20  40.094  14.466  -8.832
  161    HB2  ALA  20           HB2      ALA  20  39.152  14.313  -7.330
  162    HB3  ALA  20           HB3      ALA  20  40.766  15.065  -7.298
  163    H    LEU  21           HN       LEU  21  37.493  18.107  -8.623
  164    HA   LEU  21           HA       LEU  21  35.203  16.489  -9.108
  165    HB2  LEU  21           HB2      LEU  21  34.275  18.537 -10.226
  166    HB3  LEU  21           HB1      LEU  21  34.941  18.822  -8.607
  167    HG   LEU  21           HG       LEU  21  37.194  19.355 -10.067
  168   HD11  LEU  21          HD11      LEU  21  34.858  20.061 -11.903
  169   HD12  LEU  21          HD12      LEU  21  36.221  18.979 -12.272
  170   HD13  LEU  21          HD13      LEU  21  36.501  20.720 -12.067
  171   HD21  LEU  21          HD21      LEU  21  34.889  21.312  -9.649
  172   HD22  LEU  21          HD22      LEU  21  36.593  21.751  -9.915
  173   HD23  LEU  21          HD23      LEU  21  36.119  20.880  -8.438
  174    H    ASP  22           HN       ASP  22  38.016  16.646 -10.889
  175    HA   ASP  22           HA       ASP  22  37.206  16.762 -13.580
  176    HB2  ASP  22           HB2      ASP  22  39.255  14.855 -12.383
  177    HB3  ASP  22           HB1      ASP  22  39.173  15.398 -14.076
  178    H    HIS  23           HN       HIS  23  37.030  14.062 -11.266
  179    HA   HIS  23           HA       HIS  23  34.837  12.853 -12.732
  180    HB2  HIS  23           HB2      HIS  23  36.021  10.712 -13.273
  181    HB3  HIS  23           HB1      HIS  23  36.586  12.094 -14.241
  182    HD1  HIS  23           HD1      HIS  23  38.702  10.175 -14.303
  183    HD2  HIS  23           HD2      HIS  23  38.184  12.552 -10.872
  184    HE1  HIS  23           HE1      HIS  23  40.908  10.144 -13.015
  185    H    LEU  24           HN       LEU  24  36.302  13.626 -10.013
  186    HA   LEU  24           HA       LEU  24  34.808  11.696  -8.442
  187    HB2  LEU  24           HB2      LEU  24  37.077  10.557  -9.193
  188    HB3  LEU  24           HB1      LEU  24  37.797  11.591  -7.951
  189    HG   LEU  24           HG       LEU  24  37.330   9.501  -6.889
  190   HD11  LEU  24          HD11      LEU  24  34.969  11.271  -6.131
  191   HD12  LEU  24          HD12      LEU  24  36.651  11.602  -5.651
  192   HD13  LEU  24          HD13      LEU  24  35.846  10.115  -5.103
  193   HD21  LEU  24          HD21      LEU  24  35.571   8.855  -8.736
  194   HD22  LEU  24          HD22      LEU  24  34.381   9.583  -7.635
  195   HD23  LEU  24          HD23      LEU  24  35.368   8.211  -7.095
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  61.875   5.604   0.270
    2    H2   GLY   1           HT2      GLY   1  61.248   4.745   1.595
    3    H3   GLY   1           HT3      GLY   1  62.348   6.017   1.844
    4    HA2  GLY   1           HA1      GLY   1  60.491   7.119   2.310
    5    HA3  GLY   1           HA2      GLY   1  60.556   7.357   0.552
    6    H    LYS   2           HN       LYS   2  60.039   4.111   1.181
    7    HA   LYS   2           HA       LYS   2  57.263   4.301   0.270
    8    HB2  LYS   2           HB2      LYS   2  58.796   1.869   1.266
    9    HB3  LYS   2           HB1      LYS   2  57.322   1.876   0.267
   10    HG2  LYS   2           HG2      LYS   2  58.613   3.167  -1.487
   11    HG3  LYS   2           HG1      LYS   2  60.081   2.905  -0.516
   12    HD2  LYS   2           HD2      LYS   2  59.769   0.460  -0.676
   13    HD3  LYS   2           HD1      LYS   2  58.281   0.705  -1.622
   14    HE2  LYS   2           HE2      LYS   2  60.216   0.225  -3.101
   15    HE3  LYS   2           HE1      LYS   2  59.578   1.863  -3.381
   16    HZ1  LYS   2           HZ1      LYS   2  61.897   1.205  -1.633
   17    HZ2  LYS   2           HZ2      LYS   2  61.311   2.760  -1.984
   18    HZ3  LYS   2           HZ3      LYS   2  62.010   1.815  -3.211
   19    H    GLY   3           HN       GLY   3  58.124   5.407   2.978
   20    HA2  GLY   3           HA1      GLY   3  57.233   3.968   5.203
   21    HA3  GLY   3           HA2      GLY   3  56.807   5.727   4.976
   22    H    ARG   4           HN       ARG   4  55.752   6.245   3.372
   23    HA   ARG   4           HA       ARG   4  54.031   6.255   5.076
   24    HB2  ARG   4           HB2      ARG   4  53.469   7.197   2.222
   25    HB3  ARG   4           HB1      ARG   4  52.514   7.684   3.644
   26    HG2  ARG   4           HG2      ARG   4  54.567   8.575   4.717
   27    HG3  ARG   4           HG1      ARG   4  55.516   8.104   3.286
   28    HD2  ARG   4           HD2      ARG   4  53.964   9.555   1.893
   29    HD3  ARG   4           HD1      ARG   4  53.266  10.152   3.418
   30    HE   ARG   4           HE       ARG   4  55.812  10.959   2.296
   31   HH11  ARG   4          HH11      ARG   4  57.541  11.138   3.989
   32   HH12  ARG   4          HH12      ARG   4  57.012  11.804   5.498
   33   HH21  ARG   4          HH21      ARG   4  53.640  11.447   4.775
   34   HH22  ARG   4          HH22      ARG   4  54.803  11.979   5.942
   35    H    TRP   5           HN       TRP   5  54.352   3.980   2.864
   36    HA   TRP   5           HA       TRP   5  51.937   3.044   1.832
   37    HB2  TRP   5           HB2      TRP   5  54.214   1.924   1.692
   38    HB3  TRP   5           HB1      TRP   5  53.894   1.239   3.303
   39    HD1  TRP   5           HD1      TRP   5  52.620  -0.963   3.348
   40    HE1  TRP   5           HE1      TRP   5  51.202  -2.359   1.674
   41    HE3  TRP   5           HE3      TRP   5  52.490   2.345  -0.557
   42    HZ2  TRP   5           HZ2      TRP   5  50.167  -2.051  -0.996
   43    HZ3  TRP   5           HZ3      TRP   5  51.282   1.774  -2.658
   44    HH2  TRP   5           HH2      TRP   5  50.121  -0.420  -2.881
   45    H    LEU   6           HN       LEU   6  52.753   3.467   5.152
   46    HA   LEU   6           HA       LEU   6  50.314   1.923   6.020
   47    HB2  LEU   6           HB2      LEU   6  52.627   2.775   7.797
   48    HB3  LEU   6           HB1      LEU   6  51.369   1.561   8.120
   49    HG   LEU   6           HG       LEU   6  53.534   1.347   5.977
   50   HD11  LEU   6          HD11      LEU   6  54.404   1.117   8.280
   51   HD12  LEU   6          HD12      LEU   6  54.425  -0.449   7.436
   52   HD13  LEU   6          HD13      LEU   6  53.157  -0.100   8.635
   53   HD21  LEU   6          HD21      LEU   6  51.234  -0.463   6.832
   54   HD22  LEU   6          HD22      LEU   6  52.655  -1.085   5.958
   55   HD23  LEU   6          HD23      LEU   6  51.612   0.138   5.200
   56    H    GLU   7           HN       GLU   7  51.809   5.080   5.735
   57    HA   GLU   7           HA       GLU   7  50.745   6.477   7.905
   58    HB2  GLU   7           HB2      GLU   7  52.142   7.381   5.968
   59    HB3  GLU   7           HB1      GLU   7  50.623   7.512   5.050
   60    HG2  GLU   7           HG2      GLU   7  49.674   8.983   6.783
   61    HG3  GLU   7           HG1      GLU   7  51.154   8.814   7.759
   62    H    ARG   8           HN       ARG   8  49.036   4.878   5.351
   63    HA   ARG   8           HA       ARG   8  46.777   4.722   4.862
   64    HB2  ARG   8           HB2      ARG   8  46.867   4.044   7.338
   65    HB3  ARG   8           HB1      ARG   8  46.283   5.685   7.703
   66    HG2  ARG   8           HG2      ARG   8  44.341   5.270   6.145
   67    HG3  ARG   8           HG1      ARG   8  44.892   3.584   5.985
   68    HD2  ARG   8           HD2      ARG   8  43.125   3.806   7.722
   69    HD3  ARG   8           HD1      ARG   8  44.669   3.263   8.422
   70    HE   ARG   8           HE       ARG   8  44.587   6.107   8.573
   71   HH11  ARG   8          HH11      ARG   8  41.768   4.781   9.269
   72   HH12  ARG   8          HH12      ARG   8  41.860   4.871  10.996
   73   HH21  ARG   8          HH21      ARG   8  45.251   5.593  11.043
   74   HH22  ARG   8          HH22      ARG   8  43.832   5.330  12.001
   75    H    ILE   9           HN       ILE   9  47.547   6.844   3.638
   76    HA   ILE   9           HA       ILE   9  46.680   9.382   4.511
   77    HB   ILE   9           HB       ILE   9  48.056   9.189   2.518
   78   HG12  ILE   9          HG12      ILE   9  46.880  10.659   0.970
   79   HG13  ILE   9          HG11      ILE   9  45.302  10.174   1.624
   80   HG21  ILE   9          HG21      ILE   9  46.968   6.951   1.828
   81   HG22  ILE   9          HG22      ILE   9  47.426   8.065   0.521
   82   HG23  ILE   9          HG23      ILE   9  45.726   7.934   1.020
   83   HD11  ILE   9           HD1      ILE   9  45.655  11.329   3.663
   84   HD12  ILE   9           HD2      ILE   9  46.344  12.427   2.445
   85   HD13  ILE   9           HD3      ILE   9  47.419  11.402   3.427
   86    H    GLY  10           HN       GLY  10  44.757   9.964   5.228
   87    HA2  GLY  10           HA1      GLY  10  42.354   9.283   3.600
   88    HA3  GLY  10           HA2      GLY  10  42.375   8.772   5.301
   89    H    LYS  11           HN       LYS  11  43.876  11.724   4.063
   90    HA   LYS  11           HA       LYS  11  41.610  13.394   5.009
   91    HB2  LYS  11           HB2      LYS  11  44.375  13.449   6.287
   92    HB3  LYS  11           HB1      LYS  11  43.172  14.747   6.465
   93    HG2  LYS  11           HG2      LYS  11  41.547  12.978   7.330
   94    HG3  LYS  11           HG1      LYS  11  42.923  11.850   7.372
   95    HD2  LYS  11           HD2      LYS  11  44.138  13.327   8.904
   96    HD3  LYS  11           HD1      LYS  11  42.835  14.536   8.811
   97    HE2  LYS  11           HE2      LYS  11  42.672  13.122  10.867
   98    HE3  LYS  11           HE1      LYS  11  41.249  12.951   9.811
   99    HZ1  LYS  11           HZ1      LYS  11  41.708  10.814   9.457
  100    HZ2  LYS  11           HZ2      LYS  11  42.804  10.917  10.752
  101    HZ3  LYS  11           HZ3      LYS  11  43.351  11.110   9.155
  102    H    ALA  12           HN       ALA  12  42.721  12.886   2.429
  103    HA   ALA  12           HA       ALA  12  44.519  15.112   1.768
  104    HB1  ALA  12           HB1      ALA  12  42.899  13.379  -0.122
  105    HB2  ALA  12           HB2      ALA  12  44.448  12.869   0.591
  106    HB3  ALA  12           HB3      ALA  12  44.385  14.293  -0.476
  107    H    GLY  13           HN       GLY  13  42.616  16.399   3.036
  108    HA2  GLY  13           HA1      GLY  13  41.019  18.060   2.834
  109    HA3  GLY  13           HA2      GLY  13  41.631  18.277   1.183
  110    H    PHE  14           HN       PHE  14  39.561  16.046   3.087
  111    HA   PHE  14           HA       PHE  14  37.587  14.980   2.502
  112    HB2  PHE  14           HB2      PHE  14  37.238  17.438   0.738
  113    HB3  PHE  14           HB1      PHE  14  35.949  16.318   1.240
  114    HD1  PHE  14           HD1      PHE  14  38.282  18.970   2.352
  115    HD2  PHE  14           HD2      PHE  14  35.142  16.265   3.556
  116    HE1  PHE  14           HE1      PHE  14  38.000  20.243   4.476
  117    HE2  PHE  14           HE2      PHE  14  34.861  17.537   5.681
  118    HZ   PHE  14           HZ       PHE  14  36.236  19.572   6.102
  119    H    ILE  15           HN       ILE  15  40.031  14.419   0.934
  120    HA   ILE  15           HA       ILE  15  40.609  13.177  -0.905
  121    HB   ILE  15           HB       ILE  15  37.645  12.690  -1.411
  122   HG12  ILE  15          HG12      ILE  15  39.513  11.302   0.568
  123   HG13  ILE  15          HG11      ILE  15  38.101  12.298   0.985
  124   HG21  ILE  15          HG21      ILE  15  40.026  10.827  -1.764
  125   HG22  ILE  15          HG22      ILE  15  39.466  11.922  -3.049
  126   HG23  ILE  15          HG23      ILE  15  38.385  10.654  -2.433
  127   HD11  ILE  15           HD1      ILE  15  37.282  10.077   1.109
  128   HD12  ILE  15           HD2      ILE  15  38.166   9.573  -0.349
  129   HD13  ILE  15           HD3      ILE  15  36.741  10.632  -0.493
  130    H    ILE  16           HN       ILE  16  41.063  15.478  -1.512
  131    HA   ILE  16           HA       ILE  16  39.828  15.987  -4.203
  132    HB   ILE  16           HB       ILE  16  40.568  18.040  -2.082
  133   HG12  ILE  16          HG12      ILE  16  38.319  16.741  -1.861
  134   HG13  ILE  16          HG11      ILE  16  38.267  18.508  -1.786
  135   HG21  ILE  16          HG21      ILE  16  41.132  18.951  -4.240
  136   HG22  ILE  16          HG22      ILE  16  39.568  19.665  -3.792
  137   HG23  ILE  16          HG23      ILE  16  39.634  18.331  -4.969
  138   HD11  ILE  16           HD1      ILE  16  36.481  17.406  -3.246
  139   HD12  ILE  16           HD2      ILE  16  37.780  16.967  -4.373
  140   HD13  ILE  16           HD3      ILE  16  37.438  18.676  -4.037
  141    H    ILE  17           HN       ILE  17  42.476  16.828  -1.922
  142    HA   ILE  17           HA       ILE  17  44.326  17.547  -4.029
  143    HB   ILE  17           HB       ILE  17  45.036  16.496  -1.252
  144   HG12  ILE  17          HG12      ILE  17  43.472  18.235  -0.794
  145   HG13  ILE  17          HG11      ILE  17  45.057  19.013  -0.646
  146   HG21  ILE  17          HG21      ILE  17  46.471  18.189  -3.335
  147   HG22  ILE  17          HG22      ILE  17  46.996  16.671  -2.579
  148   HG23  ILE  17          HG23      ILE  17  46.973  18.171  -1.628
  149   HD11  ILE  17           HD1      ILE  17  43.704  20.523  -1.917
  150   HD12  ILE  17           HD2      ILE  17  43.074  19.215  -2.942
  151   HD13  ILE  17           HD3      ILE  17  44.764  19.735  -3.105
  152    H    GLY  18           HN       GLY  18  43.663  14.610  -2.142
  153    HA2  GLY  18           HA1      GLY  18  45.708  13.061  -3.581
  154    HA3  GLY  18           HA2      GLY  18  44.558  12.460  -2.368
  155    H    GLY  19           HN       GLY  19  42.150  13.366  -3.472
  156    HA2  GLY  19           HA1      GLY  19  41.569  11.255  -5.293
  157    HA3  GLY  19           HA2      GLY  19  40.548  12.674  -4.991
  158    H    ALA  20           HN       ALA  20  42.375  14.686  -5.844
  159    HA   ALA  20           HA       ALA  20  41.712  15.021  -8.507
  160    HB1  ALA  20           HB1      ALA  20  43.793  16.441  -8.681
  161    HB2  ALA  20           HB2      ALA  20  44.247  15.849  -7.063
  162    HB3  ALA  20           HB3      ALA  20  42.755  16.797  -7.280
  163    H    LEU  21           HN       LEU  21  44.274  12.970  -7.208
  164    HA   LEU  21           HA       LEU  21  45.568  12.547  -9.789
  165    HB2  LEU  21           HB2      LEU  21  45.706  11.184  -7.078
  166    HB3  LEU  21           HB1      LEU  21  46.580  10.539  -8.486
  167    HG   LEU  21           HG       LEU  21  47.781  12.660  -8.762
  168   HD11  LEU  21          HD11      LEU  21  46.236  14.334  -8.081
  169   HD12  LEU  21          HD12      LEU  21  47.495  14.376  -6.827
  170   HD13  LEU  21          HD13      LEU  21  45.946  13.557  -6.506
  171   HD21  LEU  21          HD21      LEU  21  47.801  11.734  -5.853
  172   HD22  LEU  21          HD22      LEU  21  49.117  12.590  -6.693
  173   HD23  LEU  21          HD23      LEU  21  48.669  10.938  -7.187
  174    H    ASP  22           HN       ASP  22  43.309  10.658  -7.737
  175    HA   ASP  22           HA       ASP  22  43.095   8.354  -9.319
  176    HB2  ASP  22           HB2      ASP  22  41.985   8.798  -7.087
  177    HB3  ASP  22           HB1      ASP  22  40.752   9.739  -7.961
  178    H    HIS  23           HN       HIS  23  40.594  10.924  -9.385
  179    HA   HIS  23           HA       HIS  23  40.716  11.246 -12.257
  180    HB2  HIS  23           HB2      HIS  23  39.747   8.974 -12.223
  181    HB3  HIS  23           HB1      HIS  23  38.436   9.548 -11.165
  182    HD1  HIS  23           HD1      HIS  23  39.981  10.973 -14.398
  183    HD2  HIS  23           HD2      HIS  23  36.233  10.020 -12.745
  184    HE1  HIS  23           HE1      HIS  23  38.206  11.575 -16.136
  185    H    LEU  24           HN       LEU  24  40.851  13.271 -10.742
  186    HA   LEU  24           HA       LEU  24  38.291  14.653 -11.066
  187    HB2  LEU  24           HB2      LEU  24  38.091  13.410  -8.837
  188    HB3  LEU  24           HB1      LEU  24  39.419  14.435  -8.253
  189    HG   LEU  24           HG       LEU  24  37.905  16.438  -9.133
  190   HD11  LEU  24          HD11      LEU  24  35.881  14.179  -8.768
  191   HD12  LEU  24          HD12      LEU  24  36.167  15.132 -10.244
  192   HD13  LEU  24          HD13      LEU  24  35.459  15.904  -8.809
  193   HD21  LEU  24          HD21      LEU  24  36.779  16.540  -6.921
  194   HD22  LEU  24          HD22      LEU  24  38.482  16.051  -6.762
  195   HD23  LEU  24          HD23      LEU  24  37.190  14.832  -6.637
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  52.790  -3.924   9.393
    2    H2   GLY   1           HT2      GLY   1  54.062  -4.886   9.980
    3    H3   GLY   1           HT3      GLY   1  52.824  -5.583   9.047
    4    HA2  GLY   1           HA1      GLY   1  55.104  -5.025   8.019
    5    HA3  GLY   1           HA2      GLY   1  53.592  -4.801   7.116
    6    H    LYS   2           HN       LYS   2  54.566  -3.217   5.801
    7    HA   LYS   2           HA       LYS   2  55.714  -0.811   6.997
    8    HB2  LYS   2           HB2      LYS   2  54.784  -1.440   4.168
    9    HB3  LYS   2           HB1      LYS   2  55.658   0.035   4.646
   10    HG2  LYS   2           HG2      LYS   2  57.518  -1.402   5.524
   11    HG3  LYS   2           HG1      LYS   2  56.659  -2.834   4.903
   12    HD2  LYS   2           HD2      LYS   2  56.837  -2.051   2.624
   13    HD3  LYS   2           HD1      LYS   2  57.442  -0.463   3.157
   14    HE2  LYS   2           HE2      LYS   2  59.477  -1.508   4.057
   15    HE3  LYS   2           HE1      LYS   2  58.868  -3.121   3.614
   16    HZ1  LYS   2           HZ1      LYS   2  60.152  -1.152   1.983
   17    HZ2  LYS   2           HZ2      LYS   2  58.669  -1.643   1.316
   18    HZ3  LYS   2           HZ3      LYS   2  59.867  -2.794   1.670
   19    H    GLY   3           HN       GLY   3  53.681  -0.681   8.448
   20    HA2  GLY   3           HA1      GLY   3  51.123   0.127   7.625
   21    HA3  GLY   3           HA2      GLY   3  51.965   0.903   9.043
   22    H    ARG   4           HN       ARG   4  53.693   1.830   8.728
   23    HA   ARG   4           HA       ARG   4  52.176   3.716   8.844
   24    HB2  ARG   4           HB2      ARG   4  55.210   4.034   8.682
   25    HB3  ARG   4           HB1      ARG   4  54.124   5.333   9.237
   26    HG2  ARG   4           HG2      ARG   4  53.267   3.919  11.035
   27    HG3  ARG   4           HG1      ARG   4  54.203   2.528  10.435
   28    HD2  ARG   4           HD2      ARG   4  56.297   3.606  10.962
   29    HD3  ARG   4           HD1      ARG   4  55.482   5.150  11.308
   30    HE   ARG   4           HE       ARG   4  55.195   4.322  13.489
   31   HH11  ARG   4          HH11      ARG   4  56.885   1.866  12.435
   32   HH12  ARG   4          HH12      ARG   4  55.918   0.576  13.068
   33   HH21  ARG   4          HH21      ARG   4  53.201   2.610  13.783
   34   HH22  ARG   4          HH22      ARG   4  53.832   0.997  13.831
   35    H    TRP   5           HN       TRP   5  53.452   2.606   6.141
   36    HA   TRP   5           HA       TRP   5  54.209   4.600   4.342
   37    HB2  TRP   5           HB2      TRP   5  53.879   2.141   3.832
   38    HB3  TRP   5           HB1      TRP   5  52.139   2.474   3.668
   39    HD1  TRP   5           HD1      TRP   5  51.379   3.123   1.334
   40    HE1  TRP   5           HE1      TRP   5  52.483   4.040  -0.835
   41    HE3  TRP   5           HE3      TRP   5  56.143   3.798   3.081
   42    HZ2  TRP   5           HZ2      TRP   5  55.093   4.937  -1.664
   43    HZ3  TRP   5           HZ3      TRP   5  57.924   4.684   1.584
   44    HH2  TRP   5           HH2      TRP   5  57.403   5.254  -0.785
   45    H    LEU   6           HN       LEU   6  51.206   4.337   6.006
   46    HA   LEU   6           HA       LEU   6  49.984   6.476   4.265
   47    HB2  LEU   6           HB2      LEU   6  48.501   4.600   6.140
   48    HB3  LEU   6           HB1      LEU   6  47.829   5.647   4.870
   49    HG   LEU   6           HG       LEU   6  49.663   3.249   4.415
   50   HD11  LEU   6          HD11      LEU   6  47.651   2.201   3.455
   51   HD12  LEU   6          HD12      LEU   6  46.698   3.658   3.821
   52   HD13  LEU   6          HD13      LEU   6  47.354   2.666   5.146
   53   HD21  LEU   6          HD21      LEU   6  50.088   4.786   2.637
   54   HD22  LEU   6          HD22      LEU   6  48.384   5.299   2.559
   55   HD23  LEU   6          HD23      LEU   6  48.857   3.684   1.979
   56    H    GLU   7           HN       GLU   7  51.267   5.672   7.413
   57    HA   GLU   7           HA       GLU   7  49.766   7.197   9.181
   58    HB2  GLU   7           HB2      GLU   7  51.872   5.911   9.694
   59    HB3  GLU   7           HB1      GLU   7  52.801   7.278   9.030
   60    HG2  GLU   7           HG2      GLU   7  51.852   8.793  10.695
   61    HG3  GLU   7           HG1      GLU   7  50.780   7.508  11.304
   62    H    ARG   8           HN       ARG   8  51.771   8.334   6.534
   63    HA   ARG   8           HA       ARG   8  51.925  11.088   7.441
   64    HB2  ARG   8           HB2      ARG   8  52.120  10.066   4.584
   65    HB3  ARG   8           HB1      ARG   8  52.827  11.553   5.262
   66    HG2  ARG   8           HG2      ARG   8  54.187  10.110   6.827
   67    HG3  ARG   8           HG1      ARG   8  53.582   8.681   5.953
   68    HD2  ARG   8           HD2      ARG   8  55.716   9.236   4.978
   69    HD3  ARG   8           HD1      ARG   8  54.472   9.752   3.814
   70    HE   ARG   8           HE       ARG   8  55.041  11.963   5.513
   71   HH11  ARG   8          HH11      ARG   8  57.689  12.038   5.536
   72   HH12  ARG   8          HH12      ARG   8  58.266  12.350   3.933
   73   HH21  ARG   8          HH21      ARG   8  55.283  11.468   2.401
   74   HH22  ARG   8          HH22      ARG   8  56.905  12.027   2.159
   75    H    ILE   9           HN       ILE   9  51.086  11.881   4.537
   76    HA   ILE   9           HA       ILE   9  48.555  12.982   5.254
   77    HB   ILE   9           HB       ILE   9  48.314  13.327   2.706
   78   HG12  ILE   9          HG12      ILE   9  51.233  12.454   2.574
   79   HG13  ILE   9          HG11      ILE   9  49.954  11.245   2.349
   80   HG21  ILE   9          HG21      ILE   9  49.280  15.008   4.264
   81   HG22  ILE   9          HG22      ILE   9  50.090  15.045   2.681
   82   HG23  ILE   9          HG23      ILE   9  50.884  14.261   4.068
   83   HD11  ILE   9           HD1      ILE   9  50.607  12.115   0.168
   84   HD12  ILE   9           HD2      ILE   9  50.353  13.788   0.713
   85   HD13  ILE   9           HD3      ILE   9  48.965  12.686   0.540
   86    H    GLY  10           HN       GLY  10  48.062  11.585   2.214
   87    HA2  GLY  10           HA1      GLY  10  46.680   9.880   1.470
   88    HA3  GLY  10           HA2      GLY  10  46.955   9.043   3.011
   89    H    LYS  11           HN       LYS  11  45.606  12.292   2.498
   90    HA   LYS  11           HA       LYS  11  43.479  11.934   4.337
   91    HB2  LYS  11           HB2      LYS  11  44.356  14.117   3.371
   92    HB3  LYS  11           HB1      LYS  11  43.419  13.755   1.903
   93    HG2  LYS  11           HG2      LYS  11  41.352  13.570   3.318
   94    HG3  LYS  11           HG1      LYS  11  42.317  14.070   4.729
   95    HD2  LYS  11           HD2      LYS  11  42.897  16.190   3.586
   96    HD3  LYS  11           HD1      LYS  11  41.933  15.692   2.173
   97    HE2  LYS  11           HE2      LYS  11  39.933  15.489   3.726
   98    HE3  LYS  11           HE1      LYS  11  40.929  16.242   4.995
   99    HZ1  LYS  11           HZ1      LYS  11  40.925  18.239   3.940
  100    HZ2  LYS  11           HZ2      LYS  11  39.430  17.662   3.377
  101    HZ3  LYS  11           HZ3      LYS  11  40.806  17.570   2.386
  102    H    ALA  12           HN       ALA  12  43.751  11.147   0.897
  103    HA   ALA  12           HA       ALA  12  41.194   9.629   1.095
  104    HB1  ALA  12           HB1      ALA  12  40.224  10.682  -0.831
  105    HB2  ALA  12           HB2      ALA  12  41.690  11.660  -1.106
  106    HB3  ALA  12           HB3      ALA  12  40.660  11.970   0.315
  107    H    GLY  13           HN       GLY  13  44.230  10.447  -0.406
  108    HA2  GLY  13           HA1      GLY  13  45.185   8.040  -1.133
  109    HA3  GLY  13           HA2      GLY  13  44.008   8.304  -2.443
  110    H    PHE  14           HN       PHE  14  46.314  10.342  -0.629
  111    HA   PHE  14           HA       PHE  14  48.087  11.625  -1.383
  112    HB2  PHE  14           HB2      PHE  14  47.699  10.737  -4.255
  113    HB3  PHE  14           HB1      PHE  14  49.197  11.161  -3.397
  114    HD1  PHE  14           HD1      PHE  14  47.648   8.443  -4.822
  115    HD2  PHE  14           HD2      PHE  14  49.321   9.632  -1.022
  116    HE1  PHE  14           HE1      PHE  14  48.031   6.053  -4.240
  117    HE2  PHE  14           HE2      PHE  14  49.701   7.239  -0.444
  118    HZ   PHE  14           HZ       PHE  14  49.125   5.455  -2.084
  119    H    ILE  15           HN       ILE  15  45.029  12.128  -1.641
  120    HA   ILE  15           HA       ILE  15  43.723  13.917  -2.255
  121    HB   ILE  15           HB       ILE  15  46.266  15.428  -2.990
  122   HG12  ILE  15          HG12      ILE  15  45.036  14.983  -0.228
  123   HG13  ILE  15          HG11      ILE  15  46.607  14.361  -0.781
  124   HG21  ILE  15          HG21      ILE  15  43.898  16.356  -3.419
  125   HG22  ILE  15          HG22      ILE  15  44.990  17.379  -2.464
  126   HG23  ILE  15          HG23      ILE  15  43.720  16.429  -1.653
  127   HD11  ILE  15           HD1      ILE  15  45.795  17.237  -0.248
  128   HD12  ILE  15           HD2      ILE  15  47.203  16.849  -1.267
  129   HD13  ILE  15           HD3      ILE  15  47.160  16.324   0.433
  130    H    ILE  16           HN       ILE  16  43.544  12.113  -4.007
  131    HA   ILE  16           HA       ILE  16  43.902  13.489  -6.666
  132    HB   ILE  16           HB       ILE  16  45.509  11.561  -6.290
  133   HG12  ILE  16          HG12      ILE  16  44.896  10.407  -8.484
  134   HG13  ILE  16          HG11      ILE  16  43.392  11.352  -8.486
  135   HG21  ILE  16          HG21      ILE  16  44.731   9.320  -6.154
  136   HG22  ILE  16          HG22      ILE  16  43.061   9.781  -6.553
  137   HG23  ILE  16          HG23      ILE  16  43.753  10.218  -4.973
  138   HD11  ILE  16           HD1      ILE  16  46.027  12.824  -8.174
  139   HD12  ILE  16           HD2      ILE  16  44.504  13.376  -8.911
  140   HD13  ILE  16           HD3      ILE  16  45.552  12.239  -9.784
  141    H    ILE  17           HN       ILE  17  42.095  10.930  -4.870
  142    HA   ILE  17           HA       ILE  17  39.953  10.874  -6.806
  143    HB   ILE  17           HB       ILE  17  40.237   9.012  -5.213
  144   HG12  ILE  17          HG12      ILE  17  37.939   8.773  -4.415
  145   HG13  ILE  17          HG11      ILE  17  37.669  10.525  -4.524
  146   HG21  ILE  17          HG21      ILE  17  41.137  10.486  -3.369
  147   HG22  ILE  17          HG22      ILE  17  39.926   9.299  -2.825
  148   HG23  ILE  17          HG23      ILE  17  39.465  11.004  -3.044
  149   HD11  ILE  17           HD1      ILE  17  38.503   8.950  -6.985
  150   HD12  ILE  17           HD2      ILE  17  37.632  10.500  -6.888
  151   HD13  ILE  17           HD3      ILE  17  36.800   8.986  -6.469
  152    H    GLY  18           HN       GLY  18  40.717  12.705  -3.902
  153    HA2  GLY  18           HA1      GLY  18  38.163  14.216  -4.023
  154    HA3  GLY  18           HA2      GLY  18  39.439  14.356  -2.793
  155    H    GLY  19           HN       GLY  19  41.701  14.694  -4.354
  156    HA2  GLY  19           HA1      GLY  19  41.690  17.473  -4.841
  157    HA3  GLY  19           HA2      GLY  19  42.865  16.326  -5.516
  158    H    ALA  20           HN       ALA  20  40.878  14.778  -6.973
  159    HA   ALA  20           HA       ALA  20  41.028  15.978  -9.487
  160    HB1  ALA  20           HB1      ALA  20  39.073  14.512 -10.087
  161    HB2  ALA  20           HB2      ALA  20  38.915  14.115  -8.359
  162    HB3  ALA  20           HB3      ALA  20  40.394  13.668  -9.243
  163    H    LEU  21           HN       LEU  21  38.332  16.205  -7.127
  164    HA   LEU  21           HA       LEU  21  36.523  17.664  -7.060
  165    HB2  LEU  21           HB2      LEU  21  38.526  19.521  -8.405
  166    HB3  LEU  21           HB1      LEU  21  37.022  20.032  -7.610
  167    HG   LEU  21           HG       LEU  21  39.174  18.431  -6.158
  168   HD11  LEU  21          HD11      LEU  21  39.977  20.583  -5.234
  169   HD12  LEU  21          HD12      LEU  21  38.830  21.461  -6.275
  170   HD13  LEU  21          HD13      LEU  21  40.167  20.538  -7.003
  171   HD21  LEU  21          HD21      LEU  21  38.048  19.681  -4.173
  172   HD22  LEU  21          HD22      LEU  21  37.125  18.367  -4.929
  173   HD23  LEU  21          HD23      LEU  21  36.737  20.060  -5.312
  174    H    ASP  22           HN       ASP  22  37.151  16.023  -9.574
  175    HA   ASP  22           HA       ASP  22  36.036  17.599 -11.769
  176    HB2  ASP  22           HB2      ASP  22  36.428  14.596 -11.439
  177    HB3  ASP  22           HB1      ASP  22  36.010  15.425 -12.960
  178    H    HIS  23           HN       HIS  23  34.398  17.685  -9.421
  179    HA   HIS  23           HA       HIS  23  32.173  17.456  -8.822
  180    HB2  HIS  23           HB2      HIS  23  31.678  16.681 -11.718
  181    HB3  HIS  23           HB1      HIS  23  30.533  17.426 -10.576
  182    HD1  HIS  23           HD1      HIS  23  33.297  18.198 -12.966
  183    HD2  HIS  23           HD2      HIS  23  31.088  20.209 -10.006
  184    HE1  HIS  23           HE1      HIS  23  33.768  20.697 -13.230
  185    H    LEU  24           HN       LEU  24  34.113  14.973  -9.513
  186    HA   LEU  24           HA       LEU  24  33.964  12.670  -9.331
  187    HB2  LEU  24           HB2      LEU  24  33.131  13.705  -7.045
  188    HB3  LEU  24           HB1      LEU  24  31.556  13.061  -7.534
  189    HG   LEU  24           HG       LEU  24  32.575  11.378  -6.174
  190   HD11  LEU  24          HD11      LEU  24  31.503  10.629  -8.343
  191   HD12  LEU  24          HD12      LEU  24  32.665   9.480  -7.642
  192   HD13  LEU  24          HD13      LEU  24  33.139  10.482  -9.030
  193   HD21  LEU  24          HD21      LEU  24  34.978  12.381  -6.587
  194   HD22  LEU  24          HD22      LEU  24  35.060  11.213  -7.924
  195   HD23  LEU  24          HD23      LEU  24  34.813  10.644  -6.262
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1  61.122   1.227  11.660
    2    H2   GLY   1           HT2      GLY   1  61.580   2.839  11.375
    3    H3   GLY   1           HT3      GLY   1  62.672   1.754  12.097
    4    HA2  GLY   1           HA1      GLY   1  62.943   2.326   9.657
    5    HA3  GLY   1           HA2      GLY   1  63.092   0.640  10.190
    6    H    LYS   2           HN       LYS   2  61.770   2.617   7.899
    7    HA   LYS   2           HA       LYS   2  60.043   2.369   6.363
    8    HB2  LYS   2           HB2      LYS   2  60.282  -0.595   6.990
    9    HB3  LYS   2           HB1      LYS   2  59.745   0.158   5.469
   10    HG2  LYS   2           HG2      LYS   2  62.017   1.201   5.237
   11    HG3  LYS   2           HG1      LYS   2  62.537   0.308   6.686
   12    HD2  LYS   2           HD2      LYS   2  62.068  -1.831   5.588
   13    HD3  LYS   2           HD1      LYS   2  61.420  -0.986   4.161
   14    HE2  LYS   2           HE2      LYS   2  63.583  -0.047   3.635
   15    HE3  LYS   2           HE1      LYS   2  64.265  -0.607   5.182
   16    HZ1  LYS   2           HZ1      LYS   2  64.519  -2.683   4.407
   17    HZ2  LYS   2           HZ2      LYS   2  64.442  -1.959   2.872
   18    HZ3  LYS   2           HZ3      LYS   2  63.057  -2.675   3.547
   19    H    GLY   3           HN       GLY   3  57.920   0.711   6.041
   20    HA2  GLY   3           HA1      GLY   3  56.097  -0.265   7.589
   21    HA3  GLY   3           HA2      GLY   3  56.262   1.268   8.563
   22    H    ARG   4           HN       ARG   4  56.678   2.957   7.635
   23    HA   ARG   4           HA       ARG   4  54.288   3.198   7.950
   24    HB2  ARG   4           HB2      ARG   4  55.998   5.470   6.829
   25    HB3  ARG   4           HB1      ARG   4  54.414   5.704   7.611
   26    HG2  ARG   4           HG2      ARG   4  55.220   4.718   9.684
   27    HG3  ARG   4           HG1      ARG   4  56.759   4.255   8.917
   28    HD2  ARG   4           HD2      ARG   4  55.763   7.118   9.260
   29    HD3  ARG   4           HD1      ARG   4  56.985   6.328  10.284
   30    HE   ARG   4           HE       ARG   4  57.803   6.115   7.550
   31   HH11  ARG   4          HH11      ARG   4  58.403   8.161   6.453
   32   HH12  ARG   4          HH12      ARG   4  59.146   9.358   7.460
   33   HH21  ARG   4          HH21      ARG   4  58.299   7.769  10.425
   34   HH22  ARG   4          HH22      ARG   4  59.087   9.136   9.710
   35    H    TRP   5           HN       TRP   5  55.663   2.511   5.162
   36    HA   TRP   5           HA       TRP   5  54.559   3.779   2.956
   37    HB2  TRP   5           HB2      TRP   5  56.027   1.760   2.877
   38    HB3  TRP   5           HB1      TRP   5  54.622   0.755   3.309
   39    HD1  TRP   5           HD1      TRP   5  53.064   0.039   1.409
   40    HE1  TRP   5           HE1      TRP   5  52.855   0.547  -1.133
   41    HE3  TRP   5           HE3      TRP   5  56.475   3.840   1.066
   42    HZ2  TRP   5           HZ2      TRP   5  54.030   2.368  -3.030
   43    HZ3  TRP   5           HZ3      TRP   5  56.916   4.948  -1.120
   44    HH2  TRP   5           HH2      TRP   5  55.698   4.216  -3.166
   45    H    LEU   6           HN       LEU   6  52.821   2.130   5.445
   46    HA   LEU   6           HA       LEU   6  50.262   2.391   3.868
   47    HB2  LEU   6           HB2      LEU   6  50.811   0.417   6.113
   48    HB3  LEU   6           HB1      LEU   6  49.392   0.482   5.046
   49    HG   LEU   6           HG       LEU   6  52.248  -0.050   4.100
   50   HD11  LEU   6          HD11      LEU   6  51.578  -2.382   3.898
   51   HD12  LEU   6          HD12      LEU   6  49.921  -1.993   4.420
   52   HD13  LEU   6          HD13      LEU   6  51.273  -1.851   5.568
   53   HD21  LEU   6          HD21      LEU   6  51.006   0.857   2.268
   54   HD22  LEU   6          HD22      LEU   6  49.521  -0.003   2.738
   55   HD23  LEU   6          HD23      LEU   6  50.894  -0.902   2.051
   56    H    GLU   7           HN       GLU   7  52.112   3.379   6.641
   57    HA   GLU   7           HA       GLU   7  49.680   4.072   8.209
   58    HB2  GLU   7           HB2      GLU   7  52.613   4.680   8.745
   59    HB3  GLU   7           HB1      GLU   7  51.263   4.861   9.888
   60    HG2  GLU   7           HG2      GLU   7  50.805   2.413   9.696
   61    HG3  GLU   7           HG1      GLU   7  52.210   2.254   8.614
   62    H    ARG   8           HN       ARG   8  51.544   5.380   5.695
   63    HA   ARG   8           HA       ARG   8  51.214   8.204   6.478
   64    HB2  ARG   8           HB2      ARG   8  53.153   7.316   5.111
   65    HB3  ARG   8           HB1      ARG   8  52.005   7.026   3.787
   66    HG2  ARG   8           HG2      ARG   8  53.071   9.179   3.410
   67    HG3  ARG   8           HG1      ARG   8  51.377   9.465   3.857
   68    HD2  ARG   8           HD2      ARG   8  53.397   9.434   6.100
   69    HD3  ARG   8           HD1      ARG   8  53.398  10.837   5.009
   70    HE   ARG   8           HE       ARG   8  50.709  10.431   5.707
   71   HH11  ARG   8          HH11      ARG   8  50.858  12.875   6.531
   72   HH12  ARG   8          HH12      ARG   8  51.410  12.938   8.172
   73   HH21  ARG   8          HH21      ARG   8  52.659   9.703   8.152
   74   HH22  ARG   8          HH22      ARG   8  52.431  11.141   9.089
   75    H    ILE   9           HN       ILE   9  49.162   8.953   6.515
   76    HA   ILE   9           HA       ILE   9  47.067   7.929   4.847
   77    HB   ILE   9           HB       ILE   9  46.561   9.127   6.920
   78   HG12  ILE   9          HG12      ILE   9  45.554  10.756   4.537
   79   HG13  ILE   9          HG11      ILE   9  44.940   9.146   4.975
   80   HG21  ILE   9          HG21      ILE   9  48.557  10.787   6.529
   81   HG22  ILE   9          HG22      ILE   9  47.095  11.387   7.344
   82   HG23  ILE   9          HG23      ILE   9  47.370  11.758   5.628
   83   HD11  ILE   9           HD1      ILE   9  44.417  10.060   7.280
   84   HD12  ILE   9           HD2      ILE   9  43.467  10.793   5.967
   85   HD13  ILE   9           HD3      ILE   9  44.843  11.677   6.668
   86    H    GLY  10           HN       GLY  10  47.036   8.002   2.713
   87    HA2  GLY  10           HA1      GLY  10  48.507  10.024   1.226
   88    HA3  GLY  10           HA2      GLY  10  47.456   8.760   0.557
   89    H    LYS  11           HN       LYS  11  45.308   9.799   2.533
   90    HA   LYS  11           HA       LYS  11  44.001  11.500   0.587
   91    HB2  LYS  11           HB2      LYS  11  43.351  10.846   3.485
   92    HB3  LYS  11           HB1      LYS  11  42.291  11.791   2.410
   93    HG2  LYS  11           HG2      LYS  11  42.283   9.867   0.799
   94    HG3  LYS  11           HG1      LYS  11  43.227   8.920   1.975
   95    HD2  LYS  11           HD2      LYS  11  41.443   9.068   3.620
   96    HD3  LYS  11           HD1      LYS  11  40.525  10.190   2.587
   97    HE2  LYS  11           HE2      LYS  11  40.350   8.415   0.846
   98    HE3  LYS  11           HE1      LYS  11  41.213   7.293   1.925
   99    HZ1  LYS  11           HZ1      LYS  11  39.171   6.792   2.650
  100    HZ2  LYS  11           HZ2      LYS  11  38.470   8.203   2.014
  101    HZ3  LYS  11           HZ3      LYS  11  39.258   8.246   3.518
  102    H    ALA  12           HN       ALA  12  45.033  13.393   0.160
  103    HA   ALA  12           HA       ALA  12  46.291  15.037   2.140
  104    HB1  ALA  12           HB1      ALA  12  46.598  15.152  -0.370
  105    HB2  ALA  12           HB2      ALA  12  46.367  16.725   0.433
  106    HB3  ALA  12           HB3      ALA  12  45.020  15.971  -0.455
  107    H    GLY  13           HN       GLY  13  43.094  14.196   1.855
  108    HA2  GLY  13           HA1      GLY  13  41.156  15.060   2.770
  109    HA3  GLY  13           HA2      GLY  13  42.199  16.043   3.817
  110    H    PHE  14           HN       PHE  14  43.013  16.634   0.639
  111    HA   PHE  14           HA       PHE  14  41.648  19.258   0.727
  112    HB2  PHE  14           HB2      PHE  14  44.132  18.463  -0.131
  113    HB3  PHE  14           HB1      PHE  14  43.270  18.460  -1.681
  114    HD1  PHE  14           HD1      PHE  14  41.289  20.711  -1.109
  115    HD2  PHE  14           HD2      PHE  14  45.530  20.390  -0.373
  116    HE1  PHE  14           HE1      PHE  14  41.494  23.189  -1.219
  117    HE2  PHE  14           HE2      PHE  14  45.735  22.870  -0.481
  118    HZ   PHE  14           HZ       PHE  14  43.717  24.270  -0.902
  119    H    ILE  15           HN       ILE  15  42.114  16.906  -1.963
  120    HA   ILE  15           HA       ILE  15  39.225  16.702  -2.401
  121    HB   ILE  15           HB       ILE  15  39.400  17.540  -4.813
  122   HG12  ILE  15          HG12      ILE  15  41.946  18.830  -3.724
  123   HG13  ILE  15          HG11      ILE  15  41.902  17.491  -4.894
  124   HG21  ILE  15          HG21      ILE  15  38.901  19.797  -4.239
  125   HG22  ILE  15          HG22      ILE  15  39.960  19.761  -2.812
  126   HG23  ILE  15          HG23      ILE  15  38.429  18.858  -2.807
  127   HD11  ILE  15           HD1      ILE  15  40.958  20.354  -5.267
  128   HD12  ILE  15           HD2      ILE  15  40.412  19.045  -6.344
  129   HD13  ILE  15           HD3      ILE  15  42.142  19.444  -6.232
  130    H    ILE  16           HN       ILE  16  40.774  14.736  -1.725
  131    HA   ILE  16           HA       ILE  16  41.707  13.324  -4.193
  132    HB   ILE  16           HB       ILE  16  41.821  12.585  -1.244
  133   HG12  ILE  16          HG12      ILE  16  43.230  14.517  -1.650
  134   HG13  ILE  16          HG11      ILE  16  44.279  13.097  -1.474
  135   HG21  ILE  16          HG21      ILE  16  41.986  10.505  -2.299
  136   HG22  ILE  16          HG22      ILE  16  43.696  10.985  -2.316
  137   HG23  ILE  16          HG23      ILE  16  42.704  11.178  -3.779
  138   HD11  ILE  16           HD1      ILE  16  43.607  14.676  -3.974
  139   HD12  ILE  16           HD2      ILE  16  44.116  12.978  -4.110
  140   HD13  ILE  16           HD3      ILE  16  45.195  14.171  -3.359
  141    H    ILE  17           HN       ILE  17  39.847  12.475  -1.235
  142    HA   ILE  17           HA       ILE  17  38.504  10.298  -2.594
  143    HB   ILE  17           HB       ILE  17  38.801  10.223  -0.159
  144   HG12  ILE  17          HG12      ILE  17  36.533   9.664   0.547
  145   HG13  ILE  17          HG11      ILE  17  35.830  10.641  -0.759
  146   HG21  ILE  17          HG21      ILE  17  37.682  11.820   1.324
  147   HG22  ILE  17          HG22      ILE  17  36.968  12.659  -0.073
  148   HG23  ILE  17          HG23      ILE  17  38.728  12.698   0.185
  149   HD11  ILE  17           HD1      ILE  17  36.487   9.099  -2.432
  150   HD12  ILE  17           HD2      ILE  17  36.010   8.041  -1.084
  151   HD13  ILE  17           HD3      ILE  17  37.732   8.358  -1.397
  152    H    GLY  18           HN       GLY  18  37.798  13.693  -1.905
  153    HA2  GLY  18           HA1      GLY  18  35.030  13.526  -2.825
  154    HA3  GLY  18           HA2      GLY  18  35.951  15.000  -2.461
  155    H    GLY  19           HN       GLY  19  38.084  14.889  -4.131
  156    HA2  GLY  19           HA1      GLY  19  36.909  15.691  -6.629
  157    HA3  GLY  19           HA2      GLY  19  38.640  15.478  -6.301
  158    H    ALA  20           HN       ALA  20  38.788  12.804  -5.646
  159    HA   ALA  20           HA       ALA  20  39.113  10.787  -6.751
  160    HB1  ALA  20           HB1      ALA  20  37.083   9.795  -7.740
  161    HB2  ALA  20           HB2      ALA  20  36.287  11.388  -7.693
  162    HB3  ALA  20           HB3      ALA  20  36.738  10.572  -6.177
  163    H    LEU  21           HN       LEU  21  39.452  13.516  -8.256
  164    HA   LEU  21           HA       LEU  21  40.122  14.168 -10.379
  165    HB2  LEU  21           HB2      LEU  21  40.658  11.235 -10.956
  166    HB3  LEU  21           HB1      LEU  21  41.522  12.665 -11.570
  167    HG   LEU  21           HG       LEU  21  41.497  11.648  -8.694
  168   HD11  LEU  21          HD11      LEU  21  43.716  11.883 -10.777
  169   HD12  LEU  21          HD12      LEU  21  42.928  10.371 -10.269
  170   HD13  LEU  21          HD13      LEU  21  43.912  11.294  -9.109
  171   HD21  LEU  21          HD21      LEU  21  42.623  14.177  -9.968
  172   HD22  LEU  21          HD22      LEU  21  43.278  13.514  -8.450
  173   HD23  LEU  21          HD23      LEU  21  41.579  14.034  -8.533
  174    H    ASP  22           HN       ASP  22  37.343  12.726  -9.826
  175    HA   ASP  22           HA       ASP  22  36.588  11.847 -12.521
  176    HB2  ASP  22           HB2      ASP  22  35.550  10.953 -10.423
  177    HB3  ASP  22           HB1      ASP  22  34.817  12.552 -10.148
  178    H    HIS  23           HN       HIS  23  37.722  14.302 -12.840
  179    HA   HIS  23           HA       HIS  23  37.324  16.435 -13.664
  180    HB2  HIS  23           HB2      HIS  23  34.638  15.227 -14.439
  181    HB3  HIS  23           HB1      HIS  23  35.403  16.664 -15.159
  182    HD1  HIS  23           HD1      HIS  23  37.987  16.134 -16.121
  183    HD2  HIS  23           HD2      HIS  23  35.243  12.956 -15.876
  184    HE1  HIS  23           HE1      HIS  23  38.858  14.259 -17.621
  185    H    LEU  24           HN       LEU  24  36.325  15.624 -10.880
  186    HA   LEU  24           HA       LEU  24  35.146  18.201 -10.260
  187    HB2  LEU  24           HB2      LEU  24  33.097  17.250 -11.096
  188    HB3  LEU  24           HB1      LEU  24  33.374  15.728 -10.224
  189    HG   LEU  24           HG       LEU  24  33.009  16.797  -8.079
  190   HD11  LEU  24          HD11      LEU  24  33.100  19.367  -9.707
  191   HD12  LEU  24          HD12      LEU  24  34.078  18.921  -8.288
  192   HD13  LEU  24          HD13      LEU  24  32.353  19.306  -8.093
  193   HD21  LEU  24          HD21      LEU  24  30.688  17.590  -8.349
  194   HD22  LEU  24          HD22      LEU  24  30.991  16.184  -9.396
  195   HD23  LEU  24          HD23      LEU  24  30.958  17.821 -10.093
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  62.052   0.012  10.212
    2    H2   GLY   1           HT2      GLY   1  61.710   0.428   8.599
    3    H3   GLY   1           HT3      GLY   1  61.243  -1.088   9.209
    4    HA2  GLY   1           HA1      GLY   1  59.673  -0.140  10.646
    5    HA3  GLY   1           HA2      GLY   1  60.255   1.485  10.236
    6    H    LYS   2           HN       LYS   2  59.564   2.503   8.406
    7    HA   LYS   2           HA       LYS   2  57.992   2.967   6.749
    8    HB2  LYS   2           HB2      LYS   2  58.562   0.099   5.899
    9    HB3  LYS   2           HB1      LYS   2  57.985   1.433   4.870
   10    HG2  LYS   2           HG2      LYS   2  60.136   2.681   5.534
   11    HG3  LYS   2           HG1      LYS   2  60.707   1.132   6.198
   12    HD2  LYS   2           HD2      LYS   2  59.845   1.642   3.316
   13    HD3  LYS   2           HD1      LYS   2  61.515   1.419   3.886
   14    HE2  LYS   2           HE2      LYS   2  60.677  -0.864   4.825
   15    HE3  LYS   2           HE1      LYS   2  59.268  -0.620   3.763
   16    HZ1  LYS   2           HZ1      LYS   2  60.504  -1.389   2.110
   17    HZ2  LYS   2           HZ2      LYS   2  61.892  -1.455   3.089
   18    HZ3  LYS   2           HZ3      LYS   2  61.510  -0.030   2.247
   19    H    GLY   3           HN       GLY   3  56.531   0.446   5.527
   20    HA2  GLY   3           HA1      GLY   3  54.155  -0.028   5.664
   21    HA3  GLY   3           HA2      GLY   3  54.698  -0.707   7.298
   22    H    ARG   4           HN       ARG   4  54.278   1.544   5.210
   23    HA   ARG   4           HA       ARG   4  52.165   1.927   5.349
   24    HB2  ARG   4           HB2      ARG   4  52.894   3.469   7.793
   25    HB3  ARG   4           HB1      ARG   4  51.748   4.322   6.732
   26    HG2  ARG   4           HG2      ARG   4  50.004   2.837   7.131
   27    HG3  ARG   4           HG1      ARG   4  51.065   1.437   7.333
   28    HD2  ARG   4           HD2      ARG   4  49.839   2.329   9.437
   29    HD3  ARG   4           HD1      ARG   4  51.584   2.027   9.590
   30    HE   ARG   4           HE       ARG   4  51.326   4.716   8.791
   31   HH11  ARG   4          HH11      ARG   4  52.791   4.347  11.200
   32   HH12  ARG   4          HH12      ARG   4  51.725   4.868  12.460
   33   HH21  ARG   4          HH21      ARG   4  48.875   4.674  10.495
   34   HH22  ARG   4          HH22      ARG   4  49.508   5.054  12.061
   35    H    TRP   5           HN       TRP   5  55.119   3.127   5.051
   36    HA   TRP   5           HA       TRP   5  55.138   5.736   4.111
   37    HB2  TRP   5           HB2      TRP   5  57.095   4.163   4.138
   38    HB3  TRP   5           HB1      TRP   5  56.431   3.389   2.678
   39    HD1  TRP   5           HD1      TRP   5  57.293   4.344   0.491
   40    HE1  TRP   5           HE1      TRP   5  58.358   6.571  -0.321
   41    HE3  TRP   5           HE3      TRP   5  57.036   7.004   4.859
   42    HZ2  TRP   5           HZ2      TRP   5  59.001   9.144   0.799
   43    HZ3  TRP   5           HZ3      TRP   5  57.882   9.342   4.963
   44    HH2  TRP   5           HH2      TRP   5  58.864  10.415   2.940
   45    H    LEU   6           HN       LEU   6  53.424   3.033   2.854
   46    HA   LEU   6           HA       LEU   6  52.795   4.434   0.276
   47    HB2  LEU   6           HB2      LEU   6  52.055   1.599   1.082
   48    HB3  LEU   6           HB1      LEU   6  52.112   2.306  -0.551
   49    HG   LEU   6           HG       LEU   6  54.495   1.806   1.290
   50   HD11  LEU   6          HD11      LEU   6  53.648   0.544  -1.357
   51   HD12  LEU   6          HD12      LEU   6  53.552  -0.231   0.243
   52   HD13  LEU   6          HD13      LEU   6  55.138   0.171  -0.459
   53   HD21  LEU   6          HD21      LEU   6  54.223   3.163  -1.425
   54   HD22  LEU   6          HD22      LEU   6  55.760   2.440  -0.888
   55   HD23  LEU   6          HD23      LEU   6  55.032   3.770   0.039
   56    H    GLU   7           HN       GLU   7  51.490   3.555   3.435
   57    HA   GLU   7           HA       GLU   7  48.708   3.562   2.622
   58    HB2  GLU   7           HB2      GLU   7  49.721   2.656   4.794
   59    HB3  GLU   7           HB1      GLU   7  49.800   4.347   5.346
   60    HG2  GLU   7           HG2      GLU   7  47.716   3.466   6.168
   61    HG3  GLU   7           HG1      GLU   7  47.306   4.514   4.790
   62    H    ARG   8           HN       ARG   8  51.079   6.041   3.286
   63    HA   ARG   8           HA       ARG   8  50.953   8.337   3.046
   64    HB2  ARG   8           HB2      ARG   8  49.398   7.526   1.058
   65    HB3  ARG   8           HB1      ARG   8  48.085   8.166   2.070
   66    HG2  ARG   8           HG2      ARG   8  49.312  10.354   2.197
   67    HG3  ARG   8           HG1      ARG   8  50.532   9.698   1.083
   68    HD2  ARG   8           HD2      ARG   8  47.555  10.015   0.501
   69    HD3  ARG   8           HD1      ARG   8  48.868  11.012  -0.169
   70    HE   ARG   8           HE       ARG   8  49.455   8.303  -0.791
   71   HH11  ARG   8          HH11      ARG   8  49.403   8.056  -3.092
   72   HH12  ARG   8          HH12      ARG   8  47.997   8.617  -3.934
   73   HH21  ARG   8          HH21      ARG   8  46.631  10.183  -1.159
   74   HH22  ARG   8          HH22      ARG   8  46.429   9.820  -2.840
   75    H    ILE   9           HN       ILE   9  49.840  10.296   3.949
   76    HA   ILE   9           HA       ILE   9  49.218   9.912   6.670
   77    HB   ILE   9           HB       ILE   9  48.422  12.224   6.703
   78   HG12  ILE   9          HG12      ILE   9  48.302  11.889   3.669
   79   HG13  ILE   9          HG11      ILE   9  46.946  12.239   4.762
   80   HG21  ILE   9          HG21      ILE   9  50.407  13.284   5.873
   81   HG22  ILE   9          HG22      ILE   9  50.626  12.049   4.610
   82   HG23  ILE   9          HG23      ILE   9  50.897  11.633   6.319
   83   HD11  ILE   9           HD1      ILE   9  49.243  14.056   3.963
   84   HD12  ILE   9           HD2      ILE   9  48.270  14.373   5.422
   85   HD13  ILE   9           HD3      ILE   9  47.494  14.348   3.820
   86    H    GLY  10           HN       GLY  10  47.325   9.081   4.002
   87    HA2  GLY  10           HA1      GLY  10  45.111   8.441   3.795
   88    HA3  GLY  10           HA2      GLY  10  45.190   8.068   5.528
   89    H    LYS  11           HN       LYS  11  45.115  11.004   3.456
   90    HA   LYS  11           HA       LYS  11  42.579  11.861   4.583
   91    HB2  LYS  11           HB2      LYS  11  44.238  12.319   6.467
   92    HB3  LYS  11           HB1      LYS  11  45.000  13.514   5.390
   93    HG2  LYS  11           HG2      LYS  11  42.644  14.541   5.125
   94    HG3  LYS  11           HG1      LYS  11  42.168  13.524   6.506
   95    HD2  LYS  11           HD2      LYS  11  44.380  15.627   6.474
   96    HD3  LYS  11           HD1      LYS  11  42.817  15.747   7.315
   97    HE2  LYS  11           HE2      LYS  11  43.527  13.567   8.545
   98    HE3  LYS  11           HE1      LYS  11  45.163  13.921   7.937
   99    HZ1  LYS  11           HZ1      LYS  11  45.191  15.972   9.069
  100    HZ2  LYS  11           HZ2      LYS  11  44.599  14.842  10.192
  101    HZ3  LYS  11           HZ3      LYS  11  43.532  15.912   9.417
  102    H    ALA  12           HN       ALA  12  42.488  11.731   2.163
  103    HA   ALA  12           HA       ALA  12  43.870  13.928   0.727
  104    HB1  ALA  12           HB1      ALA  12  43.467  11.570  -0.183
  105    HB2  ALA  12           HB2      ALA  12  43.018  12.922  -1.246
  106    HB3  ALA  12           HB3      ALA  12  41.759  12.036  -0.351
  107    H    GLY  13           HN       GLY  13  42.446  15.130   2.633
  108    HA2  GLY  13           HA1      GLY  13  40.854  16.787   2.912
  109    HA3  GLY  13           HA2      GLY  13  40.634  16.784   1.149
  110    H    PHE  14           HN       PHE  14  40.212  13.965   3.226
  111    HA   PHE  14           HA       PHE  14  38.340  12.720   3.751
  112    HB2  PHE  14           HB2      PHE  14  36.562  15.083   3.068
  113    HB3  PHE  14           HB1      PHE  14  36.302  13.797   4.267
  114    HD1  PHE  14           HD1      PHE  14  37.386  17.164   3.847
  115    HD2  PHE  14           HD2      PHE  14  38.212  13.582   6.114
  116    HE1  PHE  14           HE1      PHE  14  38.498  18.532   5.605
  117    HE2  PHE  14           HE2      PHE  14  39.322  14.953   7.872
  118    HZ   PHE  14           HZ       PHE  14  39.458  17.429   7.622
  119    H    ILE  15           HN       ILE  15  39.068  11.668   1.715
  120    HA   ILE  15           HA       ILE  15  38.731  10.962  -0.484
  121    HB   ILE  15           HB       ILE  15  36.452   9.889  -0.761
  122   HG12  ILE  15          HG12      ILE  15  35.999  10.937   2.075
  123   HG13  ILE  15          HG11      ILE  15  35.244  11.644   0.630
  124   HG21  ILE  15          HG21      ILE  15  38.442   8.813   0.395
  125   HG22  ILE  15          HG22      ILE  15  36.863   8.200   0.927
  126   HG23  ILE  15          HG23      ILE  15  37.756   9.355   1.943
  127   HD11  ILE  15           HD1      ILE  15  33.608  10.137   1.441
  128   HD12  ILE  15           HD2      ILE  15  34.814   8.895   1.842
  129   HD13  ILE  15           HD3      ILE  15  34.399   9.219   0.141
  130    H    ILE  16           HN       ILE  16  38.943  13.507  -0.887
  131    HA   ILE  16           HA       ILE  16  36.749  14.074  -2.850
  132    HB   ILE  16           HB       ILE  16  36.484  15.427  -0.655
  133   HG12  ILE  16          HG12      ILE  16  36.257  17.662  -2.088
  134   HG13  ILE  16          HG11      ILE  16  36.679  16.608  -3.456
  135   HG21  ILE  16          HG21      ILE  16  37.959  17.246  -0.230
  136   HG22  ILE  16          HG22      ILE  16  38.759  17.067  -1.805
  137   HG23  ILE  16          HG23      ILE  16  39.020  15.849  -0.533
  138   HD11  ILE  16           HD1      ILE  16  34.401  16.003  -1.510
  139   HD12  ILE  16           HD2      ILE  16  34.736  15.208  -3.065
  140   HD13  ILE  16           HD3      ILE  16  34.185  16.895  -3.031
  141    H    ILE  17           HN       ILE  17  40.053  14.817  -1.671
  142    HA   ILE  17           HA       ILE  17  40.827  15.879  -4.328
  143    HB   ILE  17           HB       ILE  17  42.527  15.146  -1.895
  144   HG12  ILE  17          HG12      ILE  17  41.051  16.999  -1.346
  145   HG13  ILE  17          HG11      ILE  17  42.686  17.638  -1.578
  146   HG21  ILE  17          HG21      ILE  17  44.131  16.833  -3.235
  147   HG22  ILE  17          HG22      ILE  17  43.194  16.254  -4.632
  148   HG23  ILE  17          HG23      ILE  17  44.091  15.100  -3.625
  149   HD11  ILE  17           HD1      ILE  17  41.901  18.075  -4.054
  150   HD12  ILE  17           HD2      ILE  17  41.354  19.174  -2.773
  151   HD13  ILE  17           HD3      ILE  17  40.263  17.913  -3.385
  152    H    GLY  18           HN       GLY  18  41.393  13.015  -2.288
  153    HA2  GLY  18           HA1      GLY  18  42.876  11.647  -4.431
  154    HA3  GLY  18           HA2      GLY  18  42.431  10.990  -2.842
  155    H    GLY  19           HN       GLY  19  39.613  11.955  -3.248
  156    HA2  GLY  19           HA1      GLY  19  38.647   9.509  -4.542
  157    HA3  GLY  19           HA2      GLY  19  37.670  10.774  -3.773
  158    H    ALA  20           HN       ALA  20  38.725  13.006  -5.268
  159    HA   ALA  20           HA       ALA  20  36.942  12.954  -7.484
  160    HB1  ALA  20           HB1      ALA  20  39.344  14.682  -6.836
  161    HB2  ALA  20           HB2      ALA  20  37.619  15.063  -6.618
  162    HB3  ALA  20           HB3      ALA  20  38.310  14.970  -8.256
  163    H    LEU  21           HN       LEU  21  40.504  13.266  -7.817
  164    HA   LEU  21           HA       LEU  21  41.928  12.436  -9.449
  165    HB2  LEU  21           HB2      LEU  21  39.951  10.149  -9.765
  166    HB3  LEU  21           HB1      LEU  21  41.697  10.137 -10.098
  167    HG   LEU  21           HG       LEU  21  40.441  10.556  -7.347
  168   HD11  LEU  21          HD11      LEU  21  40.108   8.261  -8.193
  169   HD12  LEU  21          HD12      LEU  21  41.311   8.275  -6.882
  170   HD13  LEU  21          HD13      LEU  21  41.841   8.139  -8.576
  171   HD21  LEU  21          HD21      LEU  21  42.565  11.644  -7.332
  172   HD22  LEU  21          HD22      LEU  21  43.306  10.409  -8.379
  173   HD23  LEU  21          HD23      LEU  21  42.911  10.024  -6.687
  174    H    ASP  22           HN       ASP  22  39.528  14.136 -10.135
  175    HA   ASP  22           HA       ASP  22  38.603  13.279 -12.738
  176    HB2  ASP  22           HB2      ASP  22  37.325  14.870 -11.389
  177    HB3  ASP  22           HB1      ASP  22  38.671  16.033 -11.438
  178    H    HIS  23           HN       HIS  23  39.827  16.505 -12.759
  179    HA   HIS  23           HA       HIS  23  41.427  15.954 -15.114
  180    HB2  HIS  23           HB2      HIS  23  41.361  18.436 -13.353
  181    HB3  HIS  23           HB1      HIS  23  41.997  18.333 -15.012
  182    HD1  HIS  23           HD1      HIS  23  39.658  16.430 -16.094
  183    HD2  HIS  23           HD2      HIS  23  39.102  20.006 -13.955
  184    HE1  HIS  23           HE1      HIS  23  37.342  17.324 -16.694
  185    H    LEU  24           HN       LEU  24  42.002  15.378 -11.875
  186    HA   LEU  24           HA       LEU  24  44.651  16.280 -11.459
  187    HB2  LEU  24           HB2      LEU  24  42.928  14.987  -9.908
  188    HB3  LEU  24           HB1      LEU  24  43.777  13.541 -10.493
  189    HG   LEU  24           HG       LEU  24  45.018  15.940  -9.068
  190   HD11  LEU  24          HD11      LEU  24  45.525  14.268  -7.317
  191   HD12  LEU  24          HD12      LEU  24  44.728  13.006  -8.285
  192   HD13  LEU  24          HD13      LEU  24  43.774  14.353  -7.620
  193   HD21  LEU  24          HD21      LEU  24  46.666  15.221 -10.641
  194   HD22  LEU  24          HD22      LEU  24  46.248  13.503 -10.420
  195   HD23  LEU  24          HD23      LEU  24  47.095  14.390  -9.130
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1  57.800   5.068  11.101
    2    H2   GLY   1           HT2      GLY   1  58.531   6.163  12.175
    3    H3   GLY   1           HT3      GLY   1  59.437   4.894  11.501
    4    HA2  GLY   1           HA1      GLY   1  58.709   7.451  10.420
    5    HA3  GLY   1           HA2      GLY   1  60.123   6.428  10.098
    6    H    LYS   2           HN       LYS   2  58.810   4.033   9.397
    7    HA   LYS   2           HA       LYS   2  58.123   4.692   6.629
    8    HB2  LYS   2           HB2      LYS   2  57.911   2.250   6.365
    9    HB3  LYS   2           HB1      LYS   2  59.427   2.675   7.197
   10    HG2  LYS   2           HG2      LYS   2  58.145   2.320   9.403
   11    HG3  LYS   2           HG1      LYS   2  56.864   1.574   8.418
   12    HD2  LYS   2           HD2      LYS   2  59.779   0.684   8.574
   13    HD3  LYS   2           HD1      LYS   2  58.380  -0.162   9.274
   14    HE2  LYS   2           HE2      LYS   2  59.094   0.209   6.346
   15    HE3  LYS   2           HE1      LYS   2  58.783  -1.302   7.231
   16    HZ1  LYS   2           HZ1      LYS   2  56.867  -0.814   5.945
   17    HZ2  LYS   2           HZ2      LYS   2  56.811   0.796   6.484
   18    HZ3  LYS   2           HZ3      LYS   2  56.465  -0.474   7.558
   19    H    GLY   3           HN       GLY   3  56.332   5.753   8.711
   20    HA2  GLY   3           HA1      GLY   3  53.904   4.439   9.139
   21    HA3  GLY   3           HA2      GLY   3  53.956   6.191   8.633
   22    H    ARG   4           HN       ARG   4  54.794   6.640   6.882
   23    HA   ARG   4           HA       ARG   4  52.439   6.754   6.315
   24    HB2  ARG   4           HB2      ARG   4  54.554   7.568   4.258
   25    HB3  ARG   4           HB1      ARG   4  52.890   8.204   4.340
   26    HG2  ARG   4           HG2      ARG   4  53.343   8.961   6.691
   27    HG3  ARG   4           HG1      ARG   4  55.031   8.427   6.505
   28    HD2  ARG   4           HD2      ARG   4  53.640  10.495   4.745
   29    HD3  ARG   4           HD1      ARG   4  54.777  10.867   6.062
   30    HE   ARG   4           HE       ARG   4  56.159   9.096   4.397
   31   HH11  ARG   4          HH11      ARG   4  57.909  10.869   4.024
   32   HH12  ARG   4          HH12      ARG   4  57.455  11.993   2.786
   33   HH21  ARG   4          HH21      ARG   4  54.108  11.087   2.822
   34   HH22  ARG   4          HH22      ARG   4  55.303  12.117   2.106
   35    H    TRP   5           HN       TRP   5  54.365   4.364   5.472
   36    HA   TRP   5           HA       TRP   5  53.984   3.409   2.890
   37    HB2  TRP   5           HB2      TRP   5  55.198   2.163   4.646
   38    HB3  TRP   5           HB1      TRP   5  53.652   1.754   5.426
   39    HD1  TRP   5           HD1      TRP   5  55.837   0.904   2.436
   40    HE1  TRP   5           HE1      TRP   5  54.901  -1.196   1.218
   41    HE3  TRP   5           HE3      TRP   5  51.393   0.436   4.935
   42    HZ2  TRP   5           HZ2      TRP   5  52.536  -2.833   1.340
   43    HZ3  TRP   5           HZ3      TRP   5  49.813  -1.401   4.368
   44    HH2  TRP   5           HH2      TRP   5  50.379  -3.035   2.574
   45    H    LEU   6           HN       LEU   6  51.533   4.005   5.247
   46    HA   LEU   6           HA       LEU   6  49.473   2.583   3.575
   47    HB2  LEU   6           HB2      LEU   6  49.775   1.989   6.063
   48    HB3  LEU   6           HB1      LEU   6  49.152   3.614   6.414
   49    HG   LEU   6           HG       LEU   6  47.158   2.926   4.811
   50   HD11  LEU   6          HD11      LEU   6  46.662   0.444   5.034
   51   HD12  LEU   6          HD12      LEU   6  48.334   0.217   5.593
   52   HD13  LEU   6          HD13      LEU   6  48.018   0.822   3.952
   53   HD21  LEU   6          HD21      LEU   6  47.490   1.675   7.576
   54   HD22  LEU   6          HD22      LEU   6  45.943   1.951   6.741
   55   HD23  LEU   6          HD23      LEU   6  46.943   3.335   7.245
   56    H    GLU   7           HN       GLU   7  50.627   5.685   4.803
   57    HA   GLU   7           HA       GLU   7  48.104   7.039   3.915
   58    HB2  GLU   7           HB2      GLU   7  50.593   8.059   5.342
   59    HB3  GLU   7           HB1      GLU   7  49.183   9.056   4.913
   60    HG2  GLU   7           HG2      GLU   7  48.983   6.524   6.600
   61    HG3  GLU   7           HG1      GLU   7  49.194   8.146   7.302
   62    H    ARG   8           HN       ARG   8  49.858   5.733   1.977
   63    HA   ARG   8           HA       ARG   8  51.578   7.652   0.715
   64    HB2  ARG   8           HB2      ARG   8  51.506   5.130   0.334
   65    HB3  ARG   8           HB1      ARG   8  50.070   5.411  -0.681
   66    HG2  ARG   8           HG2      ARG   8  51.448   7.065  -2.023
   67    HG3  ARG   8           HG1      ARG   8  52.873   6.531  -1.100
   68    HD2  ARG   8           HD2      ARG   8  51.071   4.720  -2.768
   69    HD3  ARG   8           HD1      ARG   8  52.675   5.313  -3.260
   70    HE   ARG   8           HE       ARG   8  52.955   4.023  -0.735
   71   HH11  ARG   8          HH11      ARG   8  51.956   3.304  -3.952
   72   HH12  ARG   8          HH12      ARG   8  52.625   1.706  -3.947
   73   HH21  ARG   8          HH21      ARG   8  53.911   1.971  -0.738
   74   HH22  ARG   8          HH22      ARG   8  53.733   0.952  -2.127
   75    H    ILE   9           HN       ILE   9  48.544   6.396  -0.736
   76    HA   ILE   9           HA       ILE   9  48.236   8.783  -2.334
   77    HB   ILE   9           HB       ILE   9  45.924   7.841  -2.827
   78   HG12  ILE   9          HG12      ILE   9  45.597   5.431  -2.075
   79   HG13  ILE   9          HG11      ILE   9  46.936   5.660  -0.932
   80   HG21  ILE   9          HG21      ILE   9  48.320   5.977  -3.105
   81   HG22  ILE   9          HG22      ILE   9  47.889   7.306  -4.208
   82   HG23  ILE   9          HG23      ILE   9  46.825   5.885  -4.065
   83   HD11  ILE   9           HD1      ILE   9  44.662   7.663  -0.868
   84   HD12  ILE   9           HD2      ILE   9  45.686   7.067   0.461
   85   HD13  ILE   9           HD3      ILE   9  44.383   6.046  -0.181
   86    H    GLY  10           HN       GLY  10  47.843   8.343   0.923
   87    HA2  GLY  10           HA1      GLY  10  45.401   9.982   1.229
   88    HA3  GLY  10           HA2      GLY  10  46.406   9.299   2.521
   89    H    LYS  11           HN       LYS  11  46.505  11.752  -0.097
   90    HA   LYS  11           HA       LYS  11  48.679  13.266   0.836
   91    HB2  LYS  11           HB2      LYS  11  47.349  13.656  -1.277
   92    HB3  LYS  11           HB1      LYS  11  46.092  14.420  -0.273
   93    HG2  LYS  11           HG2      LYS  11  47.697  16.093   0.528
   94    HG3  LYS  11           HG1      LYS  11  49.009  15.301  -0.378
   95    HD2  LYS  11           HD2      LYS  11  47.706  15.702  -2.498
   96    HD3  LYS  11           HD1      LYS  11  46.528  16.634  -1.543
   97    HE2  LYS  11           HE2      LYS  11  48.375  18.144  -0.794
   98    HE3  LYS  11           HE1      LYS  11  49.502  17.245  -1.837
   99    HZ1  LYS  11           HZ1      LYS  11  47.499  19.201  -2.542
  100    HZ2  LYS  11           HZ2      LYS  11  47.459  17.808  -3.512
  101    HZ3  LYS  11           HZ3      LYS  11  48.889  18.715  -3.385
  102    H    ALA  12           HN       ALA  12  45.368  13.062   2.023
  103    HA   ALA  12           HA       ALA  12  46.152  14.270   4.560
  104    HB1  ALA  12           HB1      ALA  12  45.875  16.339   3.371
  105    HB2  ALA  12           HB2      ALA  12  44.437  16.114   4.395
  106    HB3  ALA  12           HB3      ALA  12  44.350  15.782   2.647
  107    H    GLY  13           HN       GLY  13  44.384  12.245   2.645
  108    HA2  GLY  13           HA1      GLY  13  42.464  10.983   2.965
  109    HA3  GLY  13           HA2      GLY  13  42.977  10.972   4.665
  110    H    PHE  14           HN       PHE  14  42.052  13.878   2.883
  111    HA   PHE  14           HA       PHE  14  39.346  13.884   4.114
  112    HB2  PHE  14           HB2      PHE  14  41.078  14.872   5.774
  113    HB3  PHE  14           HB1      PHE  14  41.218  16.229   4.632
  114    HD1  PHE  14           HD1      PHE  14  38.700  14.221   6.578
  115    HD2  PHE  14           HD2      PHE  14  39.614  17.991   4.684
  116    HE1  PHE  14           HE1      PHE  14  36.618  15.204   7.529
  117    HE2  PHE  14           HE2      PHE  14  37.529  18.971   5.633
  118    HZ   PHE  14           HZ       PHE  14  36.000  17.559   7.001
  119    H    ILE  15           HN       ILE  15  41.613  14.681   1.720
  120    HA   ILE  15           HA       ILE  15  39.508  15.929   0.082
  121    HB   ILE  15           HB       ILE  15  40.998  17.876  -0.550
  122   HG12  ILE  15          HG12      ILE  15  42.463  17.064   2.005
  123   HG13  ILE  15          HG11      ILE  15  43.105  16.867   0.359
  124   HG21  ILE  15          HG21      ILE  15  39.050  17.981   1.120
  125   HG22  ILE  15          HG22      ILE  15  40.269  19.265   1.273
  126   HG23  ILE  15          HG23      ILE  15  40.272  17.896   2.409
  127   HD11  ILE  15           HD1      ILE  15  44.053  18.912   1.097
  128   HD12  ILE  15           HD2      ILE  15  42.544  19.434   1.880
  129   HD13  ILE  15           HD3      ILE  15  42.670  19.428   0.103
  130    H    ILE  16           HN       ILE  16  40.824  13.457  -0.030
  131    HA   ILE  16           HA       ILE  16  42.023  13.713  -2.726
  132    HB   ILE  16           HB       ILE  16  43.931  13.901  -1.075
  133   HG12  ILE  16          HG12      ILE  16  45.294  12.036  -2.130
  134   HG13  ILE  16          HG11      ILE  16  43.795  11.419  -2.856
  135   HG21  ILE  16          HG21      ILE  16  44.538  12.038   0.308
  136   HG22  ILE  16          HG22      ILE  16  43.316  10.987  -0.447
  137   HG23  ILE  16          HG23      ILE  16  42.809  12.334   0.602
  138   HD11  ILE  16           HD1      ILE  16  43.617  13.218  -4.354
  139   HD12  ILE  16           HD2      ILE  16  45.383  13.081  -4.222
  140   HD13  ILE  16           HD3      ILE  16  44.519  14.331  -3.299
  141    H    ILE  17           HN       ILE  17  40.593  11.931  -0.096
  142    HA   ILE  17           HA       ILE  17  40.487   9.392  -1.597
  143    HB   ILE  17           HB       ILE  17  38.792   8.856   0.387
  144   HG12  ILE  17          HG12      ILE  17  39.129  10.227   2.378
  145   HG13  ILE  17          HG11      ILE  17  40.300  11.258   1.527
  146   HG21  ILE  17          HG21      ILE  17  41.756   9.396   0.874
  147   HG22  ILE  17          HG22      ILE  17  41.062   7.908   0.187
  148   HG23  ILE  17          HG23      ILE  17  40.716   8.356   1.875
  149   HD11  ILE  17           HD1      ILE  17  37.901  12.172   1.758
  150   HD12  ILE  17           HD2      ILE  17  37.430  10.936   0.569
  151   HD13  ILE  17           HD3      ILE  17  38.605  12.200   0.126
  152    H    GLY  18           HN       GLY  18  39.093  12.260  -2.106
  153    HA2  GLY  18           HA1      GLY  18  37.005  11.208  -3.748
  154    HA3  GLY  18           HA2      GLY  18  36.302  11.777  -2.220
  155    H    GLY  19           HN       GLY  19  38.783  13.737  -2.273
  156    HA2  GLY  19           HA1      GLY  19  37.241  15.942  -3.414
  157    HA3  GLY  19           HA2      GLY  19  38.843  16.034  -2.656
  158    H    ALA  20           HN       ALA  20  39.378  13.639  -4.698
  159    HA   ALA  20           HA       ALA  20  39.903  15.418  -7.081
  160    HB1  ALA  20           HB1      ALA  20  42.063  14.289  -7.351
  161    HB2  ALA  20           HB2      ALA  20  41.764  13.338  -5.876
  162    HB3  ALA  20           HB3      ALA  20  41.971  15.104  -5.773
  163    H    LEU  21           HN       LEU  21  37.628  14.030  -7.130
  164    HA   LEU  21           HA       LEU  21  37.750  11.309  -7.921
  165    HB2  LEU  21           HB2      LEU  21  35.860  13.573  -8.646
  166    HB3  LEU  21           HB1      LEU  21  35.595  11.908  -9.209
  167    HG   LEU  21           HG       LEU  21  36.076  12.423  -6.248
  168   HD11  LEU  21          HD11      LEU  21  33.427  12.754  -7.724
  169   HD12  LEU  21          HD12      LEU  21  34.308  14.012  -6.824
  170   HD13  LEU  21          HD13      LEU  21  33.596  12.631  -5.957
  171   HD21  LEU  21          HD21      LEU  21  34.532  10.448  -6.065
  172   HD22  LEU  21          HD22      LEU  21  35.995  10.082  -7.005
  173   HD23  LEU  21          HD23      LEU  21  34.452  10.376  -7.839
  174    H    ASP  22           HN       ASP  22  39.035  10.493  -9.440
  175    HA   ASP  22           HA       ASP  22  40.140  10.262 -11.469
  176    HB2  ASP  22           HB2      ASP  22  37.734  11.781 -12.550
  177    HB3  ASP  22           HB1      ASP  22  38.826  10.720 -13.472
  178    H    HIS  23           HN       HIS  23  40.420  12.829  -9.823
  179    HA   HIS  23           HA       HIS  23  41.535  14.856 -10.024
  180    HB2  HIS  23           HB2      HIS  23  43.301  13.313 -10.865
  181    HB3  HIS  23           HB1      HIS  23  42.695  13.558 -12.522
  182    HD1  HIS  23           HD1      HIS  23  43.065  16.225  -9.798
  183    HD2  HIS  23           HD2      HIS  23  44.753  15.177 -13.505
  184    HE1  HIS  23           HE1      HIS  23  44.618  18.131 -10.495
  185    H    LEU  24           HN       LEU  24  38.943  14.974 -10.941
  186    HA   LEU  24           HA       LEU  24  38.579  15.903 -13.589
  187    HB2  LEU  24           HB2      LEU  24  36.797  15.374 -11.839
  188    HB3  LEU  24           HB1      LEU  24  37.138  16.968 -11.135
  189    HG   LEU  24           HG       LEU  24  36.741  17.865 -13.597
  190   HD11  LEU  24          HD11      LEU  24  34.977  16.480 -14.775
  191   HD12  LEU  24          HD12      LEU  24  35.347  15.148 -13.657
  192   HD13  LEU  24          HD13      LEU  24  36.592  15.741 -14.780
  193   HD21  LEU  24          HD21      LEU  24  35.281  18.383 -11.679
  194   HD22  LEU  24          HD22      LEU  24  34.457  16.816 -11.865
  195   HD23  LEU  24          HD23      LEU  24  34.304  18.059 -13.131
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  57.103   0.668  12.918
    2    H2   GLY   1           HT2      GLY   1  57.303   1.947  14.019
    3    H3   GLY   1           HT3      GLY   1  58.436   1.705  12.776
    4    HA2  GLY   1           HA1      GLY   1  55.601   2.273  12.262
    5    HA3  GLY   1           HA2      GLY   1  56.814   3.553  12.467
    6    H    LYS   2           HN       LYS   2  58.767   1.408  11.266
    7    HA   LYS   2           HA       LYS   2  58.836   2.521   8.645
    8    HB2  LYS   2           HB2      LYS   2  60.771   1.426   9.721
    9    HB3  LYS   2           HB1      LYS   2  59.936  -0.144   9.630
   10    HG2  LYS   2           HG2      LYS   2  60.020  -0.175   7.242
   11    HG3  LYS   2           HG1      LYS   2  60.440   1.551   7.152
   12    HD2  LYS   2           HD2      LYS   2  62.410   0.065   6.736
   13    HD3  LYS   2           HD1      LYS   2  62.632   1.112   8.157
   14    HE2  LYS   2           HE2      LYS   2  63.274  -1.384   8.413
   15    HE3  LYS   2           HE1      LYS   2  62.243  -0.676   9.677
   16    HZ1  LYS   2           HZ1      LYS   2  61.013  -1.962   7.323
   17    HZ2  LYS   2           HZ2      LYS   2  60.388  -1.762   8.891
   18    HZ3  LYS   2           HZ3      LYS   2  61.592  -2.923   8.595
   19    H    GLY   3           HN       GLY   3  58.533   1.421   6.579
   20    HA2  GLY   3           HA1      GLY   3  57.415  -0.530   5.396
   21    HA3  GLY   3           HA2      GLY   3  56.097  -0.453   6.659
   22    H    ARG   4           HN       ARG   4  55.609   1.358   7.369
   23    HA   ARG   4           HA       ARG   4  53.780   0.936   5.826
   24    HB2  ARG   4           HB2      ARG   4  53.831   3.345   7.705
   25    HB3  ARG   4           HB1      ARG   4  52.345   2.711   6.951
   26    HG2  ARG   4           HG2      ARG   4  52.828   0.469   7.947
   27    HG3  ARG   4           HG1      ARG   4  54.256   1.158   8.756
   28    HD2  ARG   4           HD2      ARG   4  51.374   2.080   9.142
   29    HD3  ARG   4           HD1      ARG   4  52.312   1.098  10.291
   30    HE   ARG   4           HE       ARG   4  53.880   3.362   9.888
   31   HH11  ARG   4          HH11      ARG   4  51.302   2.310  11.755
   32   HH12  ARG   4          HH12      ARG   4  50.854   3.877  12.341
   33   HH21  ARG   4          HH21      ARG   4  53.021   5.576  10.233
   34   HH22  ARG   4          HH22      ARG   4  51.827   5.725  11.480
   35    H    TRP   5           HN       TRP   5  56.181   2.926   5.232
   36    HA   TRP   5           HA       TRP   5  55.440   5.310   3.991
   37    HB2  TRP   5           HB2      TRP   5  57.355   3.198   2.941
   38    HB3  TRP   5           HB1      TRP   5  57.283   4.873   2.341
   39    HD1  TRP   5           HD1      TRP   5  58.449   2.775   5.277
   40    HE1  TRP   5           HE1      TRP   5  59.818   4.238   6.934
   41    HE3  TRP   5           HE3      TRP   5  57.515   7.383   3.250
   42    HZ2  TRP   5           HZ2      TRP   5  60.409   7.032   7.302
   43    HZ3  TRP   5           HZ3      TRP   5  58.493   9.433   4.271
   44    HH2  TRP   5           HH2      TRP   5  59.936   9.262   6.293
   45    H    LEU   6           HN       LEU   6  54.642   2.066   3.033
   46    HA   LEU   6           HA       LEU   6  53.610   2.937   0.367
   47    HB2  LEU   6           HB2      LEU   6  54.092   0.259   1.717
   48    HB3  LEU   6           HB1      LEU   6  53.080   0.382   0.260
   49    HG   LEU   6           HG       LEU   6  54.971   1.494  -0.935
   50   HD11  LEU   6          HD11      LEU   6  57.272   1.205   0.228
   51   HD12  LEU   6          HD12      LEU   6  56.348   1.024   1.740
   52   HD13  LEU   6          HD13      LEU   6  56.235   2.531   0.799
   53   HD21  LEU   6          HD21      LEU   6  54.602  -1.003  -0.969
   54   HD22  LEU   6          HD22      LEU   6  55.777  -1.149   0.361
   55   HD23  LEU   6          HD23      LEU   6  56.299  -0.532  -1.224
   56    H    GLU   7           HN       GLU   7  52.549   1.999   3.629
   57    HA   GLU   7           HA       GLU   7  49.907   1.209   3.150
   58    HB2  GLU   7           HB2      GLU   7  51.083   1.440   5.390
   59    HB3  GLU   7           HB1      GLU   7  50.708   3.180   5.320
   60    HG2  GLU   7           HG2      GLU   7  48.299   2.670   5.145
   61    HG3  GLU   7           HG1      GLU   7  48.656   0.926   5.170
   62    H    ARG   8           HN       ARG   8  51.346   4.393   2.796
   63    HA   ARG   8           HA       ARG   8  50.489   6.368   1.955
   64    HB2  ARG   8           HB2      ARG   8  49.736   4.725   0.133
   65    HB3  ARG   8           HB1      ARG   8  48.141   4.742   0.916
   66    HG2  ARG   8           HG2      ARG   8  47.841   6.464  -0.640
   67    HG3  ARG   8           HG1      ARG   8  48.438   7.405   0.744
   68    HD2  ARG   8           HD2      ARG   8  49.736   8.168  -1.093
   69    HD3  ARG   8           HD1      ARG   8  50.808   7.014  -0.268
   70    HE   ARG   8           HE       ARG   8  49.463   5.468  -2.151
   71   HH11  ARG   8          HH11      ARG   8  49.177   7.498  -4.094
   72   HH12  ARG   8          HH12      ARG   8  50.731   7.640  -4.845
   73   HH21  ARG   8          HH21      ARG   8  52.412   6.016  -2.282
   74   HH22  ARG   8          HH22      ARG   8  52.563   6.801  -3.820
   75    H    ILE   9           HN       ILE   9  49.529   8.007   2.960
   76    HA   ILE   9           HA       ILE   9  47.973   7.652   5.287
   77    HB   ILE   9           HB       ILE   9  49.151   9.772   4.654
   78   HG12  ILE   9          HG12      ILE   9  46.157  10.127   5.153
   79   HG13  ILE   9          HG11      ILE   9  47.342   9.682   6.402
   80   HG21  ILE   9          HG21      ILE   9  46.746  10.312   2.865
   81   HG22  ILE   9          HG22      ILE   9  48.282   9.669   2.235
   82   HG23  ILE   9          HG23      ILE   9  48.240  11.266   3.017
   83   HD11  ILE   9           HD1      ILE   9  47.106  12.043   6.602
   84   HD12  ILE   9           HD2      ILE   9  47.136  12.281   4.841
   85   HD13  ILE   9           HD3      ILE   9  48.624  11.822   5.702
   86    H    GLY  10           HN       GLY  10  46.986   8.070   1.898
   87    HA2  GLY  10           HA1      GLY  10  44.918   7.837   0.889
   88    HA3  GLY  10           HA2      GLY  10  44.561   6.666   2.173
   89    H    LYS  11           HN       LYS  11  44.947  10.232   1.897
   90    HA   LYS  11           HA       LYS  11  42.179  10.707   2.606
   91    HB2  LYS  11           HB2      LYS  11  43.178   9.950   4.825
   92    HB3  LYS  11           HB1      LYS  11  44.196  11.410   4.770
   93    HG2  LYS  11           HG2      LYS  11  42.186  12.833   4.650
   94    HG3  LYS  11           HG1      LYS  11  41.147  11.386   4.646
   95    HD2  LYS  11           HD2      LYS  11  42.219  10.744   6.870
   96    HD3  LYS  11           HD1      LYS  11  42.968  12.359   6.885
   97    HE2  LYS  11           HE2      LYS  11  40.743  13.414   6.762
   98    HE3  LYS  11           HE1      LYS  11  39.973  11.809   6.695
   99    HZ1  LYS  11           HZ1      LYS  11  41.039  13.247   8.955
  100    HZ2  LYS  11           HZ2      LYS  11  41.575  11.636   8.875
  101    HZ3  LYS  11           HZ3      LYS  11  39.911  11.981   8.907
  102    H    ALA  12           HN       ALA  12  42.975  11.763   0.511
  103    HA   ALA  12           HA       ALA  12  44.641  14.140   0.789
  104    HB1  ALA  12           HB1      ALA  12  42.720  13.417  -1.448
  105    HB2  ALA  12           HB2      ALA  12  44.381  12.790  -1.314
  106    HB3  ALA  12           HB3      ALA  12  44.100  14.535  -1.528
  107    H    GLY  13           HN       GLY  13  43.258  14.832   2.736
  108    HA2  GLY  13           HA1      GLY  13  41.758  16.352   3.617
  109    HA3  GLY  13           HA2      GLY  13  41.848  17.175   2.047
  110    H    PHE  14           HN       PHE  14  40.622  13.907   2.800
  111    HA   PHE  14           HA       PHE  14  38.496  13.018   2.586
  112    HB2  PHE  14           HB2      PHE  14  38.032  15.442   3.767
  113    HB3  PHE  14           HB1      PHE  14  37.117  15.678   2.265
  114    HD1  PHE  14           HD1      PHE  14  36.216  12.818   1.773
  115    HD2  PHE  14           HD2      PHE  14  36.301  15.181   5.386
  116    HE1  PHE  14           HE1      PHE  14  34.356  11.456   2.708
  117    HE2  PHE  14           HE2      PHE  14  34.440  13.816   6.320
  118    HZ   PHE  14           HZ       PHE  14  33.529  11.899   5.016
  119    H    ILE  15           HN       ILE  15  40.141  13.272   0.367
  120    HA   ILE  15           HA       ILE  15  40.099  13.230  -1.939
  121    HB   ILE  15           HB       ILE  15  37.081  12.881  -1.743
  122   HG12  ILE  15          HG12      ILE  15  39.286  10.811  -1.313
  123   HG13  ILE  15          HG11      ILE  15  38.144  11.396  -0.080
  124   HG21  ILE  15          HG21      ILE  15  39.085  11.564  -3.620
  125   HG22  ILE  15          HG22      ILE  15  38.312  13.124  -3.991
  126   HG23  ILE  15          HG23      ILE  15  37.317  11.663  -3.792
  127   HD11  ILE  15           HD1      ILE  15  36.278  10.591  -1.711
  128   HD12  ILE  15           HD2      ILE  15  37.194   9.351  -0.822
  129   HD13  ILE  15           HD3      ILE  15  37.578   9.687  -2.526
  130    H    ILE  16           HN       ILE  16  40.497  15.619  -1.341
  131    HA   ILE  16           HA       ILE  16  38.594  17.266  -2.995
  132    HB   ILE  16           HB       ILE  16  40.012  17.989  -0.399
  133   HG12  ILE  16          HG12      ILE  16  37.935  16.733  -0.051
  134   HG13  ILE  16          HG11      ILE  16  37.719  18.421   0.452
  135   HG21  ILE  16          HG21      ILE  16  38.519  20.206  -0.895
  136   HG22  ILE  16          HG22      ILE  16  38.832  19.715  -2.576
  137   HG23  ILE  16          HG23      ILE  16  40.188  20.041  -1.478
  138   HD11  ILE  16           HD1      ILE  16  36.533  16.965  -1.922
  139   HD12  ILE  16           HD2      ILE  16  36.796  18.717  -2.043
  140   HD13  ILE  16           HD3      ILE  16  35.750  18.062  -0.768
  141    H    ILE  17           HN       ILE  17  41.861  16.822  -1.625
  142    HA   ILE  17           HA       ILE  17  43.031  18.640  -3.670
  143    HB   ILE  17           HB       ILE  17  44.394  16.891  -1.570
  144   HG12  ILE  17          HG12      ILE  17  42.960  18.515  -0.456
  145   HG13  ILE  17          HG11      ILE  17  44.648  19.039  -0.289
  146   HG21  ILE  17          HG21      ILE  17  46.114  17.375  -3.066
  147   HG22  ILE  17          HG22      ILE  17  46.208  18.818  -2.035
  148   HG23  ILE  17          HG23      ILE  17  45.383  18.899  -3.609
  149   HD11  ILE  17           HD1      ILE  17  44.173  20.478  -2.430
  150   HD12  ILE  17           HD2      ILE  17  43.508  21.027  -0.880
  151   HD13  ILE  17           HD3      ILE  17  42.462  20.196  -2.049
  152    H    GLY  18           HN       GLY  18  42.799  15.206  -2.820
  153    HA2  GLY  18           HA1      GLY  18  44.591  14.347  -4.948
  154    HA3  GLY  18           HA2      GLY  18  43.522  13.319  -3.971
  155    H    GLY  19           HN       GLY  19  41.039  14.321  -4.439
  156    HA2  GLY  19           HA1      GLY  19  40.534  13.311  -7.122
  157    HA3  GLY  19           HA2      GLY  19  39.334  13.931  -5.972
  158    H    ALA  20           HN       ALA  20  40.547  16.508  -5.544
  159    HA   ALA  20           HA       ALA  20  40.408  18.631  -6.464
  160    HB1  ALA  20           HB1      ALA  20  42.362  17.668  -7.763
  161    HB2  ALA  20           HB2      ALA  20  41.500  19.010  -8.555
  162    HB3  ALA  20           HB3      ALA  20  41.216  17.335  -9.082
  163    H    LEU  21           HN       LEU  21  38.296  16.265  -7.115
  164    HA   LEU  21           HA       LEU  21  36.263  16.134  -8.235
  165    HB2  LEU  21           HB2      LEU  21  35.977  18.014  -6.512
  166    HB3  LEU  21           HB1      LEU  21  36.198  19.147  -7.861
  167    HG   LEU  21           HG       LEU  21  34.297  17.706  -9.035
  168   HD11  LEU  21          HD11      LEU  21  32.627  16.888  -7.325
  169   HD12  LEU  21          HD12      LEU  21  33.872  17.088  -6.072
  170   HD13  LEU  21          HD13      LEU  21  34.110  15.914  -7.387
  171   HD21  LEU  21          HD21      LEU  21  34.065  20.080  -8.375
  172   HD22  LEU  21          HD22      LEU  21  33.697  19.585  -6.705
  173   HD23  LEU  21          HD23      LEU  21  32.573  19.176  -8.023
  174    H    ASP  22           HN       ASP  22  37.869  15.771 -10.167
  175    HA   ASP  22           HA       ASP  22  36.731  17.297 -12.411
  176    HB2  ASP  22           HB2      ASP  22  39.686  17.483 -11.714
  177    HB3  ASP  22           HB1      ASP  22  39.016  17.898 -13.311
  178    H    HIS  23           HN       HIS  23  36.388  14.655 -11.767
  179    HA   HIS  23           HA       HIS  23  36.661  12.505 -12.605
  180    HB2  HIS  23           HB2      HIS  23  35.915  13.730 -14.657
  181    HB3  HIS  23           HB1      HIS  23  37.624  13.978 -15.089
  182    HD1  HIS  23           HD1      HIS  23  37.028  10.751 -13.402
  183    HD2  HIS  23           HD2      HIS  23  36.846  12.182 -17.352
  184    HE1  HIS  23           HE1      HIS  23  37.084   8.720 -14.952
  185    H    LEU  24           HN       LEU  24  39.036  14.023 -11.394
  186    HA   LEU  24           HA       LEU  24  40.947  11.879 -11.754
  187    HB2  LEU  24           HB2      LEU  24  41.259  13.242 -13.884
  188    HB3  LEU  24           HB1      LEU  24  41.784  14.587 -12.851
  189    HG   LEU  24           HG       LEU  24  43.484  12.836 -11.838
  190   HD11  LEU  24          HD11      LEU  24  42.724  11.530 -14.491
  191   HD12  LEU  24          HD12      LEU  24  42.667  10.797 -12.871
  192   HD13  LEU  24          HD13      LEU  24  44.231  11.184 -13.618
  193   HD21  LEU  24          HD21      LEU  24  45.130  13.398 -13.603
  194   HD22  LEU  24          HD22      LEU  24  44.126  14.809 -13.193
  195   HD23  LEU  24          HD23      LEU  24  43.806  13.891 -14.684
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  54.097   4.760  -4.652
    2    H2   GLY   1           HT2      GLY   1  55.276   5.267  -5.765
    3    H3   GLY   1           HT3      GLY   1  53.852   6.172  -5.558
    4    HA2  GLY   1           HA1      GLY   1  56.285   6.385  -4.227
    5    HA3  GLY   1           HA2      GLY   1  54.827   7.384  -4.066
    6    H    LYS   2           HN       LYS   2  56.246   4.256  -3.062
    7    HA   LYS   2           HA       LYS   2  54.422   3.758  -0.922
    8    HB2  LYS   2           HB2      LYS   2  57.371   3.008  -1.047
    9    HB3  LYS   2           HB1      LYS   2  56.100   2.197  -0.101
   10    HG2  LYS   2           HG2      LYS   2  54.893   1.742  -2.293
   11    HG3  LYS   2           HG1      LYS   2  56.346   2.334  -3.135
   12    HD2  LYS   2           HD2      LYS   2  56.283   0.025  -1.139
   13    HD3  LYS   2           HD1      LYS   2  56.353  -0.147  -2.908
   14    HE2  LYS   2           HE2      LYS   2  58.484   1.382  -2.738
   15    HE3  LYS   2           HE1      LYS   2  58.472   0.919  -1.018
   16    HZ1  LYS   2           HZ1      LYS   2  58.058  -1.329  -2.731
   17    HZ2  LYS   2           HZ2      LYS   2  59.227  -1.091  -1.522
   18    HZ3  LYS   2           HZ3      LYS   2  59.510  -0.535  -3.101
   19    H    GLY   3           HN       GLY   3  56.175   3.379   1.309
   20    HA2  GLY   3           HA1      GLY   3  56.503   4.668   3.341
   21    HA3  GLY   3           HA2      GLY   3  57.585   5.646   2.220
   22    H    ARG   4           HN       ARG   4  54.833   4.461   3.178
   23    HA   ARG   4           HA       ARG   4  54.469   5.960   4.795
   24    HB2  ARG   4           HB2      ARG   4  53.502   7.575   2.522
   25    HB3  ARG   4           HB1      ARG   4  52.289   7.503   3.810
   26    HG2  ARG   4           HG2      ARG   4  53.517   8.791   5.291
   27    HG3  ARG   4           HG1      ARG   4  55.077   8.143   4.764
   28    HD2  ARG   4           HD2      ARG   4  54.875   9.507   2.656
   29    HD3  ARG   4           HD1      ARG   4  53.378  10.213   3.307
   30    HE   ARG   4           HE       ARG   4  56.070  10.953   4.082
   31   HH11  ARG   4          HH11      ARG   4  53.626  12.710   4.260
   32   HH12  ARG   4          HH12      ARG   4  53.423  12.859   5.975
   33   HH21  ARG   4          HH21      ARG   4  55.481  10.169   6.720
   34   HH22  ARG   4          HH22      ARG   4  54.471  11.420   7.366
   35    H    TRP   5           HN       TRP   5  53.314   3.979   2.590
   36    HA   TRP   5           HA       TRP   5  50.584   3.553   2.827
   37    HB2  TRP   5           HB2      TRP   5  52.872   1.553   2.840
   38    HB3  TRP   5           HB1      TRP   5  51.176   1.017   2.845
   39    HD1  TRP   5           HD1      TRP   5  53.851   1.787   0.513
   40    HE1  TRP   5           HE1      TRP   5  52.969   2.266  -1.886
   41    HE3  TRP   5           HE3      TRP   5  48.890   2.439   1.594
   42    HZ2  TRP   5           HZ2      TRP   5  50.439   2.851  -3.133
   43    HZ3  TRP   5           HZ3      TRP   5  47.259   2.957  -0.215
   44    HH2  TRP   5           HH2      TRP   5  48.028   3.162  -2.575
   45    H    LEU   6           HN       LEU   6  52.945   3.459   5.335
   46    HA   LEU   6           HA       LEU   6  51.002   2.230   7.269
   47    HB2  LEU   6           HB2      LEU   6  53.158   1.090   7.191
   48    HB3  LEU   6           HB1      LEU   6  54.022   2.630   7.384
   49    HG   LEU   6           HG       LEU   6  53.094   2.912   9.646
   50   HD11  LEU   6          HD11      LEU   6  50.920   1.958   9.590
   51   HD12  LEU   6          HD12      LEU   6  51.837   0.814  10.592
   52   HD13  LEU   6          HD13      LEU   6  51.503   0.432   8.885
   53   HD21  LEU   6          HD21      LEU   6  55.163   1.554   9.305
   54   HD22  LEU   6          HD22      LEU   6  54.162   0.084   9.231
   55   HD23  LEU   6          HD23      LEU   6  54.238   1.034  10.734
   56    H    GLU   7           HN       GLU   7  52.645   5.183   6.271
   57    HA   GLU   7           HA       GLU   7  51.670   6.542   8.797
   58    HB2  GLU   7           HB2      GLU   7  54.001   7.156   6.938
   59    HB3  GLU   7           HB1      GLU   7  53.394   8.296   8.163
   60    HG2  GLU   7           HG2      GLU   7  53.768   6.557   9.921
   61    HG3  GLU   7           HG1      GLU   7  54.454   5.482   8.679
   62    H    ARG   8           HN       ARG   8  50.152   5.844   6.361
   63    HA   ARG   8           HA       ARG   8  49.854   7.931   4.522
   64    HB2  ARG   8           HB2      ARG   8  47.526   7.169   4.267
   65    HB3  ARG   8           HB1      ARG   8  48.633   5.782   4.417
   66    HG2  ARG   8           HG2      ARG   8  48.110   5.770   6.911
   67    HG3  ARG   8           HG1      ARG   8  46.830   6.958   6.572
   68    HD2  ARG   8           HD2      ARG   8  45.752   5.386   5.012
   69    HD3  ARG   8           HD1      ARG   8  47.053   4.202   5.284
   70    HE   ARG   8           HE       ARG   8  45.926   3.581   7.254
   71   HH11  ARG   8          HH11      ARG   8  46.236   5.982   8.843
   72   HH12  ARG   8          HH12      ARG   8  44.619   6.573   9.030
   73   HH21  ARG   8          HH21      ARG   8  43.346   4.689   6.411
   74   HH22  ARG   8          HH22      ARG   8  42.982   5.841   7.652
   75    H    ILE   9           HN       ILE   9  48.744   9.840   4.396
   76    HA   ILE   9           HA       ILE   9  48.502  11.363   6.823
   77    HB   ILE   9           HB       ILE   9  47.345  13.057   5.339
   78   HG12  ILE   9          HG12      ILE   9  47.769  10.861   3.255
   79   HG13  ILE   9          HG11      ILE   9  46.201  11.458   3.842
   80   HG21  ILE   9          HG21      ILE   9  49.330  13.603   4.101
   81   HG22  ILE   9          HG22      ILE   9  49.836  11.899   4.020
   82   HG23  ILE   9          HG23      ILE   9  49.891  12.773   5.568
   83   HD11  ILE   9           HD1      ILE   9  46.525  12.631   1.808
   84   HD12  ILE   9           HD2      ILE   9  48.255  12.892   2.127
   85   HD13  ILE   9           HD3      ILE   9  47.031  13.803   3.047
   86    H    GLY  10           HN       GLY  10  46.338   9.253   5.091
   87    HA2  GLY  10           HA1      GLY  10  44.152   8.630   5.500
   88    HA3  GLY  10           HA2      GLY  10  44.464   9.084   7.187
   89    H    LYS  11           HN       LYS  11  45.008  11.724   5.176
   90    HA   LYS  11           HA       LYS  11  42.162  12.633   5.202
   91    HB2  LYS  11           HB2      LYS  11  44.448  14.109   6.574
   92    HB3  LYS  11           HB1      LYS  11  42.823  14.777   6.282
   93    HG2  LYS  11           HG2      LYS  11  41.889  12.776   7.557
   94    HG3  LYS  11           HG1      LYS  11  43.563  12.386   8.018
   95    HD2  LYS  11           HD2      LYS  11  43.779  14.713   8.965
   96    HD3  LYS  11           HD1      LYS  11  42.047  14.957   8.637
   97    HE2  LYS  11           HE2      LYS  11  42.411  14.245  10.982
   98    HE3  LYS  11           HE1      LYS  11  41.499  13.014  10.077
   99    HZ1  LYS  11           HZ1      LYS  11  43.400  12.180  11.474
  100    HZ2  LYS  11           HZ2      LYS  11  44.453  12.931  10.374
  101    HZ3  LYS  11           HZ3      LYS  11  43.417  11.690   9.851
  102    H    ALA  12           HN       ALA  12  42.646  12.210   2.896
  103    HA   ALA  12           HA       ALA  12  44.570  13.959   1.556
  104    HB1  ALA  12           HB1      ALA  12  42.265  12.432   0.310
  105    HB2  ALA  12           HB2      ALA  12  43.805  11.667   0.773
  106    HB3  ALA  12           HB3      ALA  12  43.784  12.952  -0.458
  107    H    GLY  13           HN       GLY  13  43.449  15.824   2.877
  108    HA2  GLY  13           HA1      GLY  13  42.178  17.754   2.794
  109    HA3  GLY  13           HA2      GLY  13  42.320  17.603   1.032
  110    H    PHE  14           HN       PHE  14  40.487  16.253   3.806
  111    HA   PHE  14           HA       PHE  14  38.256  15.641   3.965
  112    HB2  PHE  14           HB2      PHE  14  38.032  18.103   3.484
  113    HB3  PHE  14           HB1      PHE  14  37.830  17.697   1.762
  114    HD1  PHE  14           HD1      PHE  14  36.445  16.908   5.174
  115    HD2  PHE  14           HD2      PHE  14  35.676  17.131   0.932
  116    HE1  PHE  14           HE1      PHE  14  34.035  16.435   5.586
  117    HE2  PHE  14           HE2      PHE  14  33.266  16.656   1.345
  118    HZ   PHE  14           HZ       PHE  14  32.462  16.229   3.666
  119    H    ILE  15           HN       ILE  15  40.037  14.284   1.986
  120    HA   ILE  15           HA       ILE  15  39.831  12.654   0.380
  121    HB   ILE  15           HB       ILE  15  36.816  12.726   0.814
  122   HG12  ILE  15          HG12      ILE  15  38.975  11.356   2.485
  123   HG13  ILE  15          HG11      ILE  15  37.899  12.665   3.023
  124   HG21  ILE  15          HG21      ILE  15  37.914  11.320  -1.035
  125   HG22  ILE  15          HG22      ILE  15  36.891  10.435   0.117
  126   HG23  ILE  15          HG23      ILE  15  38.664  10.369   0.268
  127   HD11  ILE  15           HD1      ILE  15  36.864  10.700   3.854
  128   HD12  ILE  15           HD2      ILE  15  37.197   9.787   2.366
  129   HD13  ILE  15           HD3      ILE  15  35.950  11.059   2.370
  130    H    ILE  16           HN       ILE  16  40.396  14.723  -0.788
  131    HA   ILE  16           HA       ILE  16  38.494  15.027  -3.097
  132    HB   ILE  16           HB       ILE  16  40.172  17.174  -1.740
  133   HG12  ILE  16          HG12      ILE  16  37.929  16.417  -0.640
  134   HG13  ILE  16          HG11      ILE  16  38.188  18.149  -0.904
  135   HG21  ILE  16          HG21      ILE  16  40.168  17.605  -4.111
  136   HG22  ILE  16          HG22      ILE  16  38.960  18.698  -3.401
  137   HG23  ILE  16          HG23      ILE  16  38.437  17.220  -4.245
  138   HD11  ILE  16           HD1      ILE  16  36.735  18.172  -2.823
  139   HD12  ILE  16           HD2      ILE  16  35.882  17.266  -1.555
  140   HD13  ILE  16           HD3      ILE  16  36.669  16.398  -2.887
  141    H    ILE  17           HN       ILE  17  41.806  15.529  -1.823
  142    HA   ILE  17           HA       ILE  17  43.022  15.551  -4.461
  143    HB   ILE  17           HB       ILE  17  44.140  15.175  -1.642
  144   HG12  ILE  17          HG12      ILE  17  45.127  17.389  -2.067
  145   HG13  ILE  17          HG11      ILE  17  44.483  17.385  -3.724
  146   HG21  ILE  17          HG21      ILE  17  46.412  15.498  -2.826
  147   HG22  ILE  17          HG22      ILE  17  45.565  15.076  -4.334
  148   HG23  ILE  17          HG23      ILE  17  45.652  13.900  -3.002
  149   HD11  ILE  17           HD1      ILE  17  43.152  18.679  -1.885
  150   HD12  ILE  17           HD2      ILE  17  42.628  17.069  -1.338
  151   HD13  ILE  17           HD3      ILE  17  42.246  17.619  -2.988
  152    H    GLY  18           HN       GLY  18  42.610  13.152  -1.849
  153    HA2  GLY  18           HA1      GLY  18  43.828  11.007  -3.424
  154    HA3  GLY  18           HA2      GLY  18  43.006  10.854  -1.856
  155    H    GLY  19           HN       GLY  19  40.542  12.016  -2.444
  156    HA2  GLY  19           HA1      GLY  19  39.155   9.810  -3.586
  157    HA3  GLY  19           HA2      GLY  19  38.482  11.430  -3.319
  158    H    ALA  20           HN       ALA  20  40.086  12.971  -4.981
  159    HA   ALA  20           HA       ALA  20  38.780  12.594  -7.494
  160    HB1  ALA  20           HB1      ALA  20  41.283  14.156  -6.769
  161    HB2  ALA  20           HB2      ALA  20  39.611  14.767  -6.808
  162    HB3  ALA  20           HB3      ALA  20  40.422  14.288  -8.319
  163    H    LEU  21           HN       LEU  21  41.968  11.602  -6.280
  164    HA   LEU  21           HA       LEU  21  43.564  10.199  -7.198
  165    HB2  LEU  21           HB2      LEU  21  41.451   8.715  -7.145
  166    HB3  LEU  21           HB1      LEU  21  41.324   9.034  -8.888
  167    HG   LEU  21           HG       LEU  21  43.875   8.273  -8.936
  168   HD11  LEU  21          HD11      LEU  21  44.284   6.453  -7.237
  169   HD12  LEU  21          HD12      LEU  21  42.842   7.003  -6.356
  170   HD13  LEU  21          HD13      LEU  21  44.246   8.081  -6.527
  171   HD21  LEU  21          HD21      LEU  21  43.141   5.908  -9.247
  172   HD22  LEU  21          HD22      LEU  21  42.051   7.061 -10.057
  173   HD23  LEU  21          HD23      LEU  21  41.571   6.316  -8.513
  174    H    ASP  22           HN       ASP  22  43.881  12.541  -8.278
  175    HA   ASP  22           HA       ASP  22  44.674  13.666 -10.140
  176    HB2  ASP  22           HB2      ASP  22  46.108  11.578 -10.236
  177    HB3  ASP  22           HB1      ASP  22  44.949  10.920 -11.417
  178    H    HIS  23           HN       HIS  23  41.926  13.593  -9.936
  179    HA   HIS  23           HA       HIS  23  39.977  13.807 -11.183
  180    HB2  HIS  23           HB2      HIS  23  41.889  14.498 -13.445
  181    HB3  HIS  23           HB1      HIS  23  40.199  15.025 -13.258
  182    HD1  HIS  23           HD1      HIS  23  39.710  16.488 -10.979
  183    HD2  HIS  23           HD2      HIS  23  43.682  16.287 -12.342
  184    HE1  HIS  23           HE1      HIS  23  41.004  18.374  -9.839
  185    H    LEU  24           HN       LEU  24  40.525  11.195 -10.949
  186    HA   LEU  24           HA       LEU  24  39.282  10.097 -13.308
  187    HB2  LEU  24           HB2      LEU  24  41.463  10.269 -14.334
  188    HB3  LEU  24           HB1      LEU  24  42.252   9.570 -12.906
  189    HG   LEU  24           HG       LEU  24  41.248   7.400 -13.317
  190   HD11  LEU  24          HD11      LEU  24  39.611   8.916 -15.387
  191   HD12  LEU  24          HD12      LEU  24  39.035   7.882 -14.057
  192   HD13  LEU  24          HD13      LEU  24  39.818   7.151 -15.476
  193   HD21  LEU  24          HD21      LEU  24  42.248   6.856 -15.479
  194   HD22  LEU  24          HD22      LEU  24  43.264   8.070 -14.664
  195   HD23  LEU  24          HD23      LEU  24  42.171   8.562 -15.982
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1  60.873   2.908  11.842
    2    H2   GLY   1           HT2      GLY   1  62.055   1.809  12.372
    3    H3   GLY   1           HT3      GLY   1  60.647   1.246  11.605
    4    HA2  GLY   1           HA1      GLY   1  63.008   2.532  10.491
    5    HA3  GLY   1           HA2      GLY   1  62.122   1.101   9.929
    6    H    LYS   2           HN       LYS   2  61.151   1.412   8.058
    7    HA   LYS   2           HA       LYS   2  59.557   3.903   7.649
    8    HB2  LYS   2           HB2      LYS   2  61.670   2.938   5.677
    9    HB3  LYS   2           HB1      LYS   2  60.551   4.301   5.442
   10    HG2  LYS   2           HG2      LYS   2  61.527   5.338   7.550
   11    HG3  LYS   2           HG1      LYS   2  62.770   4.065   7.514
   12    HD2  LYS   2           HD2      LYS   2  63.311   4.786   5.140
   13    HD3  LYS   2           HD1      LYS   2  62.231   6.179   5.388
   14    HE2  LYS   2           HE2      LYS   2  64.630   5.505   7.147
   15    HE3  LYS   2           HE1      LYS   2  64.631   6.728   5.853
   16    HZ1  LYS   2           HZ1      LYS   2  62.395   7.194   7.459
   17    HZ2  LYS   2           HZ2      LYS   2  63.784   8.160   7.294
   18    HZ3  LYS   2           HZ3      LYS   2  63.710   6.973   8.507
   19    H    GLY   3           HN       GLY   3  58.522   3.689   5.303
   20    HA2  GLY   3           HA1      GLY   3  57.917   1.498   3.837
   21    HA3  GLY   3           HA2      GLY   3  57.052   1.056   5.381
   22    H    ARG   4           HN       ARG   4  56.362   2.527   6.528
   23    HA   ARG   4           HA       ARG   4  54.327   1.807   5.427
   24    HB2  ARG   4           HB2      ARG   4  54.402   3.854   7.687
   25    HB3  ARG   4           HB1      ARG   4  52.893   3.062   7.175
   26    HG2  ARG   4           HG2      ARG   4  53.889   0.843   7.588
   27    HG3  ARG   4           HG1      ARG   4  55.432   1.605   8.043
   28    HD2  ARG   4           HD2      ARG   4  54.378   2.709   9.953
   29    HD3  ARG   4           HD1      ARG   4  52.780   2.097   9.464
   30    HE   ARG   4           HE       ARG   4  53.351   0.041  10.472
   31   HH11  ARG   4          HH11      ARG   4  56.131   1.991   9.871
   32   HH12  ARG   4          HH12      ARG   4  57.238   0.865  10.584
   33   HH21  ARG   4          HH21      ARG   4  54.788  -1.466  11.352
   34   HH22  ARG   4          HH22      ARG   4  56.479  -1.092  11.421
   35    H    TRP   5           HN       TRP   5  55.898   4.487   4.713
   36    HA   TRP   5           HA       TRP   5  54.267   6.671   4.163
   37    HB2  TRP   5           HB2      TRP   5  56.698   6.455   3.573
   38    HB3  TRP   5           HB1      TRP   5  56.223   5.490   2.155
   39    HD1  TRP   5           HD1      TRP   5  55.156   8.905   3.680
   40    HE1  TRP   5           HE1      TRP   5  54.867  10.627   1.753
   41    HE3  TRP   5           HE3      TRP   5  56.276   5.872  -0.291
   42    HZ2  TRP   5           HZ2      TRP   5  55.101  10.653  -1.115
   43    HZ3  TRP   5           HZ3      TRP   5  56.236   6.767  -2.614
   44    HH2  TRP   5           HH2      TRP   5  55.651   9.152  -3.029
   45    H    LEU   6           HN       LEU   6  53.892   3.488   2.912
   46    HA   LEU   6           HA       LEU   6  51.813   4.468   0.969
   47    HB2  LEU   6           HB2      LEU   6  53.751   3.592  -0.241
   48    HB3  LEU   6           HB1      LEU   6  53.731   2.111   0.736
   49    HG   LEU   6           HG       LEU   6  51.576   1.452  -0.218
   50   HD11  LEU   6          HD11      LEU   6  50.734   2.931  -2.216
   51   HD12  LEU   6          HD12      LEU   6  51.690   4.227  -1.459
   52   HD13  LEU   6          HD13      LEU   6  50.357   3.463  -0.564
   53   HD21  LEU   6          HD21      LEU   6  53.642   0.890  -1.460
   54   HD22  LEU   6          HD22      LEU   6  53.517   2.420  -2.361
   55   HD23  LEU   6          HD23      LEU   6  52.279   1.159  -2.572
   56    H    GLU   7           HN       GLU   7  52.510   2.587   3.825
   57    HA   GLU   7           HA       GLU   7  50.388   0.612   3.357
   58    HB2  GLU   7           HB2      GLU   7  51.889   1.453   5.856
   59    HB3  GLU   7           HB1      GLU   7  50.704   0.133   5.804
   60    HG2  GLU   7           HG2      GLU   7  53.118   0.274   3.947
   61    HG3  GLU   7           HG1      GLU   7  53.153  -0.564   5.518
   62    H    ARG   8           HN       ARG   8  50.592   3.870   4.626
   63    HA   ARG   8           HA       ARG   8  48.043   3.748   6.056
   64    HB2  ARG   8           HB2      ARG   8  49.470   6.226   5.027
   65    HB3  ARG   8           HB1      ARG   8  48.336   6.107   6.390
   66    HG2  ARG   8           HG2      ARG   8  51.123   4.877   6.228
   67    HG3  ARG   8           HG1      ARG   8  50.618   6.233   7.262
   68    HD2  ARG   8           HD2      ARG   8  49.877   3.299   7.482
   69    HD3  ARG   8           HD1      ARG   8  50.543   4.379   8.730
   70    HE   ARG   8           HE       ARG   8  48.068   5.495   8.085
   71   HH11  ARG   8          HH11      ARG   8  48.766   4.271  10.763
   72   HH12  ARG   8          HH12      ARG   8  47.553   3.043  10.908
   73   HH21  ARG   8          HH21      ARG   8  46.700   3.112   7.547
   74   HH22  ARG   8          HH22      ARG   8  46.384   2.386   9.088
   75    H    ILE   9           HN       ILE   9  47.506   6.533   4.719
   76    HA   ILE   9           HA       ILE   9  46.346   5.602   2.131
   77    HB   ILE   9           HB       ILE   9  44.151   6.817   2.825
   78   HG12  ILE   9          HG12      ILE   9  45.112   6.083   5.630
   79   HG13  ILE   9          HG11      ILE   9  45.299   7.720   4.976
   80   HG21  ILE   9          HG21      ILE   9  44.403   4.339   2.512
   81   HG22  ILE   9          HG22      ILE   9  43.222   4.755   3.771
   82   HG23  ILE   9          HG23      ILE   9  44.848   4.195   4.228
   83   HD11  ILE   9           HD1      ILE   9  42.726   6.208   5.537
   84   HD12  ILE   9           HD2      ILE   9  42.760   7.639   4.479
   85   HD13  ILE   9           HD3      ILE   9  43.251   7.778   6.181
   86    H    GLY  10           HN       GLY  10  46.629   7.043   0.611
   87    HA2  GLY  10           HA1      GLY  10  47.886   9.583   1.223
   88    HA3  GLY  10           HA2      GLY  10  47.380   9.008  -0.378
   89    H    LYS  11           HN       LYS  11  44.646   8.552   1.192
   90    HA   LYS  11           HA       LYS  11  43.341  10.837   0.097
   91    HB2  LYS  11           HB2      LYS  11  42.507   8.924   2.314
   92    HB3  LYS  11           HB1      LYS  11  41.423  10.131   1.580
   93    HG2  LYS  11           HG2      LYS  11  42.020   9.066  -0.693
   94    HG3  LYS  11           HG1      LYS  11  42.750   7.738   0.240
   95    HD2  LYS  11           HD2      LYS  11  39.857   8.686   0.468
   96    HD3  LYS  11           HD1      LYS  11  40.402   7.225  -0.389
   97    HE2  LYS  11           HE2      LYS  11  41.486   6.538   1.878
   98    HE3  LYS  11           HE1      LYS  11  40.449   7.797   2.592
   99    HZ1  LYS  11           HZ1      LYS  11  38.886   6.289   0.834
  100    HZ2  LYS  11           HZ2      LYS  11  38.773   6.376   2.527
  101    HZ3  LYS  11           HZ3      LYS  11  39.749   5.192   1.798
  102    H    ALA  12           HN       ALA  12  43.719  12.875   0.669
  103    HA   ALA  12           HA       ALA  12  44.663  13.551   3.350
  104    HB1  ALA  12           HB1      ALA  12  45.432  14.887   1.520
  105    HB2  ALA  12           HB2      ALA  12  44.338  15.913   2.480
  106    HB3  ALA  12           HB3      ALA  12  43.771  15.184   0.957
  107    H    GLY  13           HN       GLY  13  41.779  12.479   2.363
  108    HA2  GLY  13           HA1      GLY  13  39.563  12.861   2.979
  109    HA3  GLY  13           HA2      GLY  13  40.291  12.976   4.593
  110    H    PHE  14           HN       PHE  14  40.698  15.250   1.878
  111    HA   PHE  14           HA       PHE  14  38.745  17.133   2.902
  112    HB2  PHE  14           HB2      PHE  14  40.677  17.228   4.616
  113    HB3  PHE  14           HB1      PHE  14  41.632  17.989   3.324
  114    HD1  PHE  14           HD1      PHE  14  38.283  18.254   5.038
  115    HD2  PHE  14           HD2      PHE  14  41.491  20.343   3.041
  116    HE1  PHE  14           HE1      PHE  14  37.182  20.431   5.545
  117    HE2  PHE  14           HE2      PHE  14  40.388  22.517   3.548
  118    HZ   PHE  14           HZ       PHE  14  38.254  22.563   4.832
  119    H    ILE  15           HN       ILE  15  41.192  16.078   0.744
  120    HA   ILE  15           HA       ILE  15  40.212  17.966  -1.306
  121    HB   ILE  15           HB       ILE  15  42.561  18.616  -1.977
  122   HG12  ILE  15          HG12      ILE  15  43.209  17.480   0.784
  123   HG13  ILE  15          HG11      ILE  15  43.740  16.800  -0.771
  124   HG21  ILE  15          HG21      ILE  15  40.976  20.057  -0.562
  125   HG22  ILE  15          HG22      ILE  15  42.705  20.446  -0.429
  126   HG23  ILE  15          HG23      ILE  15  41.900  19.515   0.857
  127   HD11  ILE  15           HD1      ILE  15  45.603  18.077  -0.056
  128   HD12  ILE  15           HD2      ILE  15  44.582  19.402   0.546
  129   HD13  ILE  15           HD3      ILE  15  44.781  19.155  -1.207
  130    H    ILE  16           HN       ILE  16  39.727  15.310  -1.104
  131    HA   ILE  16           HA       ILE  16  41.188  14.297  -3.493
  132    HB   ILE  16           HB       ILE  16  42.350  13.444  -1.408
  133   HG12  ILE  16          HG12      ILE  16  42.219  10.997  -2.106
  134   HG13  ILE  16          HG11      ILE  16  40.903  11.442  -3.212
  135   HG21  ILE  16          HG21      ILE  16  41.241  11.931   0.071
  136   HG22  ILE  16          HG22      ILE  16  39.817  11.815  -0.987
  137   HG23  ILE  16          HG23      ILE  16  40.150  13.322  -0.100
  138   HD11  ILE  16           HD1      ILE  16  43.519  12.973  -3.372
  139   HD12  ILE  16           HD2      ILE  16  42.332  12.629  -4.653
  140   HD13  ILE  16           HD3      ILE  16  43.423  11.347  -4.085
  141    H    ILE  17           HN       ILE  17  38.599  13.879  -1.075
  142    HA   ILE  17           HA       ILE  17  37.075  12.031  -2.703
  143    HB   ILE  17           HB       ILE  17  35.127  12.799  -1.146
  144   HG12  ILE  17          HG12      ILE  17  35.867  13.949   0.931
  145   HG13  ILE  17          HG11      ILE  17  37.484  14.175   0.239
  146   HG21  ILE  17          HG21      ILE  17  36.062  11.520   0.756
  147   HG22  ILE  17          HG22      ILE  17  37.694  11.679   0.062
  148   HG23  ILE  17          HG23      ILE  17  36.449  10.741  -0.796
  149   HD11  ILE  17           HD1      ILE  17  35.030  15.200  -1.231
  150   HD12  ILE  17           HD2      ILE  17  36.721  15.751  -1.352
  151   HD13  ILE  17           HD3      ILE  17  35.758  16.146   0.088
  152    H    GLY  18           HN       GLY  18  37.925  15.103  -3.363
  153    HA2  GLY  18           HA1      GLY  18  35.909  15.399  -5.401
  154    HA3  GLY  18           HA2      GLY  18  35.583  16.494  -4.042
  155    H    GLY  19           HN       GLY  19  38.462  16.756  -3.390
  156    HA2  GLY  19           HA1      GLY  19  39.032  19.120  -4.788
  157    HA3  GLY  19           HA2      GLY  19  40.243  18.113  -3.971
  158    H    ALA  20           HN       ALA  20  39.877  15.765  -5.590
  159    HA   ALA  20           HA       ALA  20  41.615  16.527  -7.803
  160    HB1  ALA  20           HB1      ALA  20  40.237  13.889  -7.192
  161    HB2  ALA  20           HB2      ALA  20  41.840  14.383  -6.597
  162    HB3  ALA  20           HB3      ALA  20  41.573  14.136  -8.340
  163    H    LEU  21           HN       LEU  21  38.187  16.005  -7.341
  164    HA   LEU  21           HA       LEU  21  36.408  16.158  -8.814
  165    HB2  LEU  21           HB2      LEU  21  37.606  18.380  -9.237
  166    HB3  LEU  21           HB1      LEU  21  38.328  17.613 -10.666
  167    HG   LEU  21           HG       LEU  21  35.814  16.984 -11.268
  168   HD11  LEU  21          HD11      LEU  21  34.743  17.735  -9.203
  169   HD12  LEU  21          HD12      LEU  21  34.242  18.811 -10.524
  170   HD13  LEU  21          HD13      LEU  21  35.475  19.349  -9.363
  171   HD21  LEU  21          HD21      LEU  21  37.228  18.500 -12.603
  172   HD22  LEU  21          HD22      LEU  21  36.885  19.835 -11.477
  173   HD23  LEU  21          HD23      LEU  21  35.576  19.150 -12.471
  174    H    ASP  22           HN       ASP  22  37.123  13.727  -8.939
  175    HA   ASP  22           HA       ASP  22  37.364  11.833 -10.260
  176    HB2  ASP  22           HB2      ASP  22  36.258  13.634 -12.450
  177    HB3  ASP  22           HB1      ASP  22  36.197  11.856 -12.393
  178    H    HIS  23           HN       HIS  23  39.735  13.192  -9.947
  179    HA   HIS  23           HA       HIS  23  41.832  13.476 -10.904
  180    HB2  HIS  23           HB2      HIS  23  40.813  11.404 -12.888
  181    HB3  HIS  23           HB1      HIS  23  42.514  11.778 -12.516
  182    HD1  HIS  23           HD1      HIS  23  41.712  12.131  -9.320
  183    HD2  HIS  23           HD2      HIS  23  41.281   8.750 -11.782
  184    HE1  HIS  23           HE1      HIS  23  41.579  10.089  -7.791
  185    H    LEU  24           HN       LEU  24  40.548  15.610 -11.539
  186    HA   LEU  24           HA       LEU  24  41.565  16.334 -14.139
  187    HB2  LEU  24           HB2      LEU  24  39.670  15.159 -15.049
  188    HB3  LEU  24           HB1      LEU  24  38.567  15.888 -13.864
  189    HG   LEU  24           HG       LEU  24  38.786  18.074 -14.886
  190   HD11  LEU  24          HD11      LEU  24  41.098  18.227 -15.461
  191   HD12  LEU  24          HD12      LEU  24  40.247  18.256 -17.021
  192   HD13  LEU  24          HD13      LEU  24  41.033  16.758 -16.464
  193   HD21  LEU  24          HD21      LEU  24  37.271  16.393 -15.984
  194   HD22  LEU  24          HD22      LEU  24  38.590  15.997 -17.111
  195   HD23  LEU  24          HD23      LEU  24  37.879  17.629 -17.110
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1  63.309  -2.211   3.670
    2    H2   GLY   1           HT2      GLY   1  63.262  -0.961   2.520
    3    H3   GLY   1           HT3      GLY   1  61.827  -1.736   3.000
    4    HA2  GLY   1           HA1      GLY   1  63.300  -0.650   5.180
    5    HA3  GLY   1           HA2      GLY   1  62.800   0.565   3.986
    6    H    LYS   2           HN       LYS   2  60.502   0.564   3.323
    7    HA   LYS   2           HA       LYS   2  58.278   0.784   3.956
    8    HB2  LYS   2           HB2      LYS   2  58.674  -1.760   5.572
    9    HB3  LYS   2           HB1      LYS   2  57.187  -1.172   4.788
   10    HG2  LYS   2           HG2      LYS   2  58.456  -1.351   2.560
   11    HG3  LYS   2           HG1      LYS   2  59.705  -2.246   3.457
   12    HD2  LYS   2           HD2      LYS   2  56.758  -3.005   3.236
   13    HD3  LYS   2           HD1      LYS   2  58.114  -3.816   2.421
   14    HE2  LYS   2           HE2      LYS   2  59.086  -4.154   4.819
   15    HE3  LYS   2           HE1      LYS   2  57.440  -3.766   5.380
   16    HZ1  LYS   2           HZ1      LYS   2  58.432  -6.156   4.156
   17    HZ2  LYS   2           HZ2      LYS   2  57.068  -5.551   3.343
   18    HZ3  LYS   2           HZ3      LYS   2  56.987  -5.894   5.004
   19    H    GLY   3           HN       GLY   3  57.111  -0.289   6.466
   20    HA2  GLY   3           HA1      GLY   3  56.471   0.882   8.487
   21    HA3  GLY   3           HA2      GLY   3  58.272   0.673   8.843
   22    H    ARG   4           HN       ARG   4  55.842   1.741   7.208
   23    HA   ARG   4           HA       ARG   4  55.216   3.395   8.501
   24    HB2  ARG   4           HB2      ARG   4  57.443   4.829   7.159
   25    HB3  ARG   4           HB1      ARG   4  55.940   5.778   7.183
   26    HG2  ARG   4           HG2      ARG   4  55.987   6.123   9.475
   27    HG3  ARG   4           HG1      ARG   4  56.687   4.539   9.833
   28    HD2  ARG   4           HD2      ARG   4  58.323   6.247  10.381
   29    HD3  ARG   4           HD1      ARG   4  58.897   5.396   8.929
   30    HE   ARG   4           HE       ARG   4  57.374   7.618   8.045
   31   HH11  ARG   4          HH11      ARG   4  60.173   7.158   7.173
   32   HH12  ARG   4          HH12      ARG   4  61.016   8.497   7.879
   33   HH21  ARG   4          HH21      ARG   4  58.479   9.254  10.119
   34   HH22  ARG   4          HH22      ARG   4  60.057   9.684   9.546
   35    H    TRP   5           HN       TRP   5  55.596   2.225   5.567
   36    HA   TRP   5           HA       TRP   5  54.238   3.662   3.627
   37    HB2  TRP   5           HB2      TRP   5  55.098   1.372   3.285
   38    HB3  TRP   5           HB1      TRP   5  53.805   0.740   4.334
   39    HD1  TRP   5           HD1      TRP   5  53.722   3.254   1.362
   40    HE1  TRP   5           HE1      TRP   5  51.879   2.508  -0.312
   41    HE3  TRP   5           HE3      TRP   5  52.175  -1.023   3.714
   42    HZ2  TRP   5           HZ2      TRP   5  50.004   0.340  -0.569
   43    HZ3  TRP   5           HZ3      TRP   5  50.357  -2.416   2.734
   44    HH2  TRP   5           HH2      TRP   5  49.272  -1.739   0.598
   45    H    LEU   6           HN       LEU   6  53.040   2.465   6.633
   46    HA   LEU   6           HA       LEU   6  50.180   2.896   5.887
   47    HB2  LEU   6           HB2      LEU   6  51.281   1.983   8.568
   48    HB3  LEU   6           HB1      LEU   6  49.650   1.742   7.897
   49    HG   LEU   6           HG       LEU   6  52.240   0.496   6.870
   50   HD11  LEU   6          HD11      LEU   6  51.159  -1.620   7.585
   51   HD12  LEU   6          HD12      LEU   6  49.762  -0.699   8.194
   52   HD13  LEU   6          HD13      LEU   6  51.358  -0.505   8.957
   53   HD21  LEU   6          HD21      LEU   6  49.380   0.476   5.819
   54   HD22  LEU   6          HD22      LEU   6  50.536  -0.817   5.419
   55   HD23  LEU   6          HD23      LEU   6  50.879   0.859   4.938
   56    H    GLU   7           HN       GLU   7  52.883   4.384   7.634
   57    HA   GLU   7           HA       GLU   7  51.232   6.062   9.327
   58    HB2  GLU   7           HB2      GLU   7  53.697   5.569   9.631
   59    HB3  GLU   7           HB1      GLU   7  54.021   6.654   8.260
   60    HG2  GLU   7           HG2      GLU   7  52.405   7.555  10.684
   61    HG3  GLU   7           HG1      GLU   7  54.178   7.677  10.633
   62    H    ARG   8           HN       ARG   8  52.296   6.215   5.984
   63    HA   ARG   8           HA       ARG   8  51.947   8.995   5.500
   64    HB2  ARG   8           HB2      ARG   8  52.895   7.179   3.940
   65    HB3  ARG   8           HB1      ARG   8  51.204   6.797   3.534
   66    HG2  ARG   8           HG2      ARG   8  50.841   9.146   2.829
   67    HG3  ARG   8           HG1      ARG   8  52.532   9.529   3.234
   68    HD2  ARG   8           HD2      ARG   8  53.229   7.698   1.607
   69    HD3  ARG   8           HD1      ARG   8  51.528   7.614   1.089
   70    HE   ARG   8           HE       ARG   8  52.477  10.337   0.975
   71   HH11  ARG   8          HH11      ARG   8  54.740   9.469  -0.465
   72   HH12  ARG   8          HH12      ARG   8  54.173   9.142  -2.069
   73   HH21  ARG   8          HH21      ARG   8  50.838   8.962  -1.140
   74   HH22  ARG   8          HH22      ARG   8  51.964   8.855  -2.450
   75    H    ILE   9           HN       ILE   9  50.217  10.300   5.406
   76    HA   ILE   9           HA       ILE   9  47.584   9.182   6.014
   77    HB   ILE   9           HB       ILE   9  46.850  11.635   5.584
   78   HG12  ILE   9          HG12      ILE   9  49.783  12.363   5.896
   79   HG13  ILE   9          HG11      ILE   9  49.215  11.941   4.269
   80   HG21  ILE   9          HG21      ILE   9  48.907  10.890   7.707
   81   HG22  ILE   9          HG22      ILE   9  47.134  10.797   7.832
   82   HG23  ILE   9          HG23      ILE   9  47.938  12.382   7.750
   83   HD11  ILE   9           HD1      ILE   9  47.422  13.629   4.434
   84   HD12  ILE   9           HD2      ILE   9  49.024  14.371   4.670
   85   HD13  ILE   9           HD3      ILE   9  47.971  14.058   6.072
   86    H    GLY  10           HN       GLY  10  46.352   8.226   4.595
   87    HA2  GLY  10           HA1      GLY  10  46.735   8.579   1.724
   88    HA3  GLY  10           HA2      GLY  10  45.518   7.564   2.522
   89    H    LYS  11           HN       LYS  11  45.236  10.468   4.007
   90    HA   LYS  11           HA       LYS  11  42.782  11.102   2.558
   91    HB2  LYS  11           HB2      LYS  11  44.284  12.506   4.801
   92    HB3  LYS  11           HB1      LYS  11  42.713  13.048   4.160
   93    HG2  LYS  11           HG2      LYS  11  41.767  10.783   4.684
   94    HG3  LYS  11           HG1      LYS  11  43.322  10.343   5.432
   95    HD2  LYS  11           HD2      LYS  11  43.092  12.072   7.108
   96    HD3  LYS  11           HD1      LYS  11  41.674  12.760   6.281
   97    HE2  LYS  11           HE2      LYS  11  41.042  11.349   8.249
   98    HE3  LYS  11           HE1      LYS  11  40.382  10.723   6.720
   99    HZ1  LYS  11           HZ1      LYS  11  41.411   8.998   8.136
  100    HZ2  LYS  11           HZ2      LYS  11  42.912   9.780   7.977
  101    HZ3  LYS  11           HZ3      LYS  11  42.144   9.121   6.612
  102    H    ALA  12           HN       ALA  12  43.158  11.753   0.480
  103    HA   ALA  12           HA       ALA  12  45.255  13.703  -0.142
  104    HB1  ALA  12           HB1      ALA  12  44.457  13.540  -2.399
  105    HB2  ALA  12           HB2      ALA  12  42.910  12.839  -1.864
  106    HB3  ALA  12           HB3      ALA  12  44.416  11.903  -1.703
  107    H    GLY  13           HN       GLY  13  43.452  14.597   1.901
  108    HA2  GLY  13           HA1      GLY  13  42.483  16.638   2.434
  109    HA3  GLY  13           HA2      GLY  13  42.792  17.188   0.776
  110    H    PHE  14           HN       PHE  14  40.738  14.785   2.487
  111    HA   PHE  14           HA       PHE  14  38.503  14.249   2.185
  112    HB2  PHE  14           HB2      PHE  14  38.281  16.639   2.920
  113    HB3  PHE  14           HB1      PHE  14  38.244  17.119   1.207
  114    HD1  PHE  14           HD1      PHE  14  36.164  17.156   0.067
  115    HD2  PHE  14           HD2      PHE  14  36.582  14.764   3.637
  116    HE1  PHE  14           HE1      PHE  14  33.733  16.617  -0.008
  117    HE2  PHE  14           HE2      PHE  14  34.150  14.227   3.561
  118    HZ   PHE  14           HZ       PHE  14  32.722  15.172   1.751
  119    H    ILE  15           HN       ILE  15  40.379  13.787  -0.023
  120    HA   ILE  15           HA       ILE  15  40.294  13.099  -2.213
  121    HB   ILE  15           HB       ILE  15  37.257  13.261  -2.052
  122   HG12  ILE  15          HG12      ILE  15  39.111  11.050  -1.049
  123   HG13  ILE  15          HG11      ILE  15  38.100  12.102  -0.033
  124   HG21  ILE  15          HG21      ILE  15  38.486  12.745  -4.238
  125   HG22  ILE  15          HG22      ILE  15  37.305  11.528  -3.709
  126   HG23  ILE  15          HG23      ILE  15  39.047  11.245  -3.467
  127   HD11  ILE  15           HD1      ILE  15  36.806  10.129  -0.255
  128   HD12  ILE  15           HD2      ILE  15  37.228   9.935  -1.972
  129   HD13  ILE  15           HD3      ILE  15  36.103  11.221  -1.469
  130    H    ILE  16           HN       ILE  16  41.089  15.409  -2.232
  131    HA   ILE  16           HA       ILE  16  39.504  16.902  -4.304
  132    HB   ILE  16           HB       ILE  16  41.061  18.037  -1.950
  133   HG12  ILE  16          HG12      ILE  16  38.683  17.057  -1.534
  134   HG13  ILE  16          HG11      ILE  16  39.017  18.698  -0.957
  135   HG21  ILE  16          HG21      ILE  16  40.102  20.248  -2.821
  136   HG22  ILE  16          HG22      ILE  16  39.648  19.367  -4.300
  137   HG23  ILE  16          HG23      ILE  16  41.358  19.506  -3.837
  138   HD11  ILE  16           HD1      ILE  16  36.784  18.381  -2.157
  139   HD12  ILE  16           HD2      ILE  16  37.706  18.148  -3.656
  140   HD13  ILE  16           HD3      ILE  16  37.807  19.692  -2.782
  141    H    ILE  17           HN       ILE  17  42.653  16.607  -2.603
  142    HA   ILE  17           HA       ILE  17  44.164  17.670  -4.841
  143    HB   ILE  17           HB       ILE  17  45.171  15.812  -2.639
  144   HG12  ILE  17          HG12      ILE  17  44.041  17.593  -1.493
  145   HG13  ILE  17          HG11      ILE  17  45.769  17.992  -1.439
  146   HG21  ILE  17          HG21      ILE  17  47.283  17.325  -3.066
  147   HG22  ILE  17          HG22      ILE  17  46.491  17.715  -4.609
  148   HG23  ILE  17          HG23      ILE  17  46.900  16.033  -4.221
  149   HD11  ILE  17           HD1      ILE  17  43.598  19.222  -3.172
  150   HD12  ILE  17           HD2      ILE  17  45.319  19.411  -3.567
  151   HD13  ILE  17           HD3      ILE  17  44.688  20.030  -2.027
  152    H    GLY  18           HN       GLY  18  43.297  14.438  -3.653
  153    HA2  GLY  18           HA1      GLY  18  44.769  13.082  -5.797
  154    HA3  GLY  18           HA2      GLY  18  43.695  12.338  -4.594
  155    H    GLY  19           HN       GLY  19  41.326  13.643  -4.933
  156    HA2  GLY  19           HA1      GLY  19  40.310  12.352  -7.298
  157    HA3  GLY  19           HA2      GLY  19  39.427  13.480  -6.254
  158    H    ALA  20           HN       ALA  20  41.390  15.640  -6.593
  159    HA   ALA  20           HA       ALA  20  41.709  17.452  -7.994
  160    HB1  ALA  20           HB1      ALA  20  42.335  17.064 -10.246
  161    HB2  ALA  20           HB2      ALA  20  41.352  15.584 -10.354
  162    HB3  ALA  20           HB3      ALA  20  42.834  15.600  -9.369
  163    H    LEU  21           HN       LEU  21  38.894  15.811  -7.699
  164    HA   LEU  21           HA       LEU  21  36.694  16.356  -8.143
  165    HB2  LEU  21           HB2      LEU  21  37.727  18.663  -7.408
  166    HB3  LEU  21           HB1      LEU  21  37.583  19.085  -9.126
  167    HG   LEU  21           HG       LEU  21  35.081  18.186  -8.839
  168   HD11  LEU  21          HD11      LEU  21  35.867  18.935  -5.984
  169   HD12  LEU  21          HD12      LEU  21  35.316  17.339  -6.543
  170   HD13  LEU  21          HD13      LEU  21  34.198  18.720  -6.557
  171   HD21  LEU  21          HD21      LEU  21  35.685  20.518  -9.390
  172   HD22  LEU  21          HD22      LEU  21  36.021  20.845  -7.673
  173   HD23  LEU  21          HD23      LEU  21  34.362  20.477  -8.201
  174    H    ASP  22           HN       ASP  22  38.946  15.876 -10.414
  175    HA   ASP  22           HA       ASP  22  37.760  16.853 -12.830
  176    HB2  ASP  22           HB2      ASP  22  39.504  14.421 -12.283
  177    HB3  ASP  22           HB1      ASP  22  39.077  14.998 -13.911
  178    H    HIS  23           HN       HIS  23  38.045  13.381 -12.663
  179    HA   HIS  23           HA       HIS  23  35.207  13.126 -13.514
  180    HB2  HIS  23           HB2      HIS  23  37.057  11.919 -14.699
  181    HB3  HIS  23           HB1      HIS  23  37.361  10.995 -13.208
  182    HD1  HIS  23           HD1      HIS  23  33.795  11.764 -13.609
  183    HD2  HIS  23           HD2      HIS  23  36.409   8.745 -14.932
  184    HE1  HIS  23           HE1      HIS  23  32.358   9.798 -14.384
  185    H    LEU  24           HN       LEU  24  37.376  12.232 -10.844
  186    HA   LEU  24           HA       LEU  24  35.200  10.770  -9.449
  187    HB2  LEU  24           HB2      LEU  24  37.932  11.454  -8.315
  188    HB3  LEU  24           HB1      LEU  24  36.870  10.081  -7.921
  189    HG   LEU  24           HG       LEU  24  38.359  10.538 -10.545
  190   HD11  LEU  24          HD11      LEU  24  39.778   9.734  -8.699
  191   HD12  LEU  24          HD12      LEU  24  39.517   8.431  -9.883
  192   HD13  LEU  24          HD13      LEU  24  38.614   8.435  -8.348
  193   HD21  LEU  24          HD21      LEU  24  36.273   9.504 -11.126
  194   HD22  LEU  24          HD22      LEU  24  36.304   8.457  -9.687
  195   HD23  LEU  24          HD23      LEU  24  37.447   8.172 -11.022
  Start of MODEL   21
    1    H1   GLY   1           HT1      GLY   1  61.545  -1.069   3.106
    2    H2   GLY   1           HT2      GLY   1  59.994  -0.563   2.634
    3    H3   GLY   1           HT3      GLY   1  60.418  -2.206   2.552
    4    HA2  GLY   1           HA1      GLY   1  59.645  -2.517   4.539
    5    HA3  GLY   1           HA2      GLY   1  60.901  -1.413   5.134
    6    H    LYS   2           HN       LYS   2  59.419   0.571   3.142
    7    HA   LYS   2           HA       LYS   2  57.009   1.159   4.799
    8    HB2  LYS   2           HB2      LYS   2  59.241   3.197   4.389
    9    HB3  LYS   2           HB1      LYS   2  57.706   3.454   5.251
   10    HG2  LYS   2           HG2      LYS   2  58.389   1.545   6.804
   11    HG3  LYS   2           HG1      LYS   2  59.999   1.614   6.046
   12    HD2  LYS   2           HD2      LYS   2  60.193   4.006   6.680
   13    HD3  LYS   2           HD1      LYS   2  58.589   3.929   7.450
   14    HE2  LYS   2           HE2      LYS   2  60.167   3.630   9.225
   15    HE3  LYS   2           HE1      LYS   2  59.530   2.005   8.879
   16    HZ1  LYS   2           HZ1      LYS   2  61.850   1.778   8.988
   17    HZ2  LYS   2           HZ2      LYS   2  62.134   3.171   8.058
   18    HZ3  LYS   2           HZ3      LYS   2  61.498   1.774   7.329
   19    H    GLY   3           HN       GLY   3  57.627   4.011   3.439
   20    HA2  GLY   3           HA1      GLY   3  56.363   5.049   1.645
   21    HA3  GLY   3           HA2      GLY   3  57.394   3.885   0.652
   22    H    ARG   4           HN       ARG   4  55.235   4.586   2.797
   23    HA   ARG   4           HA       ARG   4  53.559   5.087   1.469
   24    HB2  ARG   4           HB2      ARG   4  53.254   2.147   1.301
   25    HB3  ARG   4           HB1      ARG   4  51.720   2.941   1.699
   26    HG2  ARG   4           HG2      ARG   4  51.514   3.990  -0.364
   27    HG3  ARG   4           HG1      ARG   4  53.261   4.157  -0.601
   28    HD2  ARG   4           HD2      ARG   4  53.491   1.887  -1.306
   29    HD3  ARG   4           HD1      ARG   4  51.882   1.448  -0.683
   30    HE   ARG   4           HE       ARG   4  51.047   2.120  -2.774
   31   HH11  ARG   4          HH11      ARG   4  53.423   2.143  -4.346
   32   HH12  ARG   4          HH12      ARG   4  53.657   3.804  -4.779
   33   HH21  ARG   4          HH21      ARG   4  51.548   5.020  -2.309
   34   HH22  ARG   4          HH22      ARG   4  52.596   5.433  -3.624
   35    H    TRP   5           HN       TRP   5  54.585   3.793   4.191
   36    HA   TRP   5           HA       TRP   5  52.551   3.426   6.045
   37    HB2  TRP   5           HB2      TRP   5  54.993   3.401   6.578
   38    HB3  TRP   5           HB1      TRP   5  55.003   5.178   6.503
   39    HD1  TRP   5           HD1      TRP   5  52.749   2.542   8.266
   40    HE1  TRP   5           HE1      TRP   5  52.335   3.306  10.718
   41    HE3  TRP   5           HE3      TRP   5  55.454   6.888   8.226
   42    HZ2  TRP   5           HZ2      TRP   5  53.092   5.515  12.404
   43    HZ3  TRP   5           HZ3      TRP   5  55.595   8.309  10.266
   44    HH2  TRP   5           HH2      TRP   5  54.417   7.627  12.354
   45    H    LEU   6           HN       LEU   6  53.222   6.218   4.168
   46    HA   LEU   6           HA       LEU   6  51.296   7.888   5.770
   47    HB2  LEU   6           HB2      LEU   6  53.361   8.854   3.759
   48    HB3  LEU   6           HB1      LEU   6  52.417   9.827   4.914
   49    HG   LEU   6           HG       LEU   6  54.529   7.741   5.625
   50   HD11  LEU   6          HD11      LEU   6  55.845   9.658   6.378
   51   HD12  LEU   6          HD12      LEU   6  54.515  10.772   5.981
   52   HD13  LEU   6          HD13      LEU   6  55.375   9.911   4.682
   53   HD21  LEU   6          HD21      LEU   6  52.958   7.674   7.407
   54   HD22  LEU   6          HD22      LEU   6  52.607   9.415   7.291
   55   HD23  LEU   6          HD23      LEU   6  54.159   8.860   7.963
   56    H    GLU   7           HN       GLU   7  51.861   6.167   2.771
   57    HA   GLU   7           HA       GLU   7  49.530   7.644   1.523
   58    HB2  GLU   7           HB2      GLU   7  51.913   6.258   0.229
   59    HB3  GLU   7           HB1      GLU   7  50.492   6.860  -0.655
   60    HG2  GLU   7           HG2      GLU   7  50.927   9.144   0.152
   61    HG3  GLU   7           HG1      GLU   7  52.305   8.561   1.115
   62    H    ARG   8           HN       ARG   8  49.499   5.423   3.455
   63    HA   ARG   8           HA       ARG   8  49.166   2.888   2.296
   64    HB2  ARG   8           HB2      ARG   8  49.049   3.530   4.756
   65    HB3  ARG   8           HB1      ARG   8  47.368   4.033   4.462
   66    HG2  ARG   8           HG2      ARG   8  46.780   1.775   3.712
   67    HG3  ARG   8           HG1      ARG   8  48.475   1.253   3.870
   68    HD2  ARG   8           HD2      ARG   8  46.661   2.211   6.126
   69    HD3  ARG   8           HD1      ARG   8  47.206   0.539   5.847
   70    HE   ARG   8           HE       ARG   8  49.580   1.927   6.050
   71   HH11  ARG   8          HH11      ARG   8  47.189   0.704   8.071
   72   HH12  ARG   8          HH12      ARG   8  47.768   1.471   9.512
   73   HH21  ARG   8          HH21      ARG   8  50.135   3.390   7.854
   74   HH22  ARG   8          HH22      ARG   8  49.436   2.992   9.388
   75    H    ILE   9           HN       ILE   9  47.275   5.742   1.816
   76    HA   ILE   9           HA       ILE   9  45.492   4.250  -0.015
   77    HB   ILE   9           HB       ILE   9  43.417   5.247   1.001
   78   HG12  ILE   9          HG12      ILE   9  45.333   5.874   3.298
   79   HG13  ILE   9          HG11      ILE   9  44.510   7.068   2.267
   80   HG21  ILE   9          HG21      ILE   9  44.884   3.504   3.023
   81   HG22  ILE   9          HG22      ILE   9  44.295   2.869   1.469
   82   HG23  ILE   9          HG23      ILE   9  43.145   3.531   2.651
   83   HD11  ILE   9           HD1      ILE   9  43.301   5.190   4.324
   84   HD12  ILE   9           HD2      ILE   9  42.302   5.920   3.043
   85   HD13  ILE   9           HD3      ILE   9  43.153   6.958   4.211
   86    H    GLY  10           HN       GLY  10  46.849   7.175   1.324
   87    HA2  GLY  10           HA1      GLY  10  47.267   9.194   0.245
   88    HA3  GLY  10           HA2      GLY  10  46.558   8.523  -1.238
   89    H    LYS  11           HN       LYS  11  44.013   7.800  -0.029
   90    HA   LYS  11           HA       LYS  11  42.562  10.168  -0.528
   91    HB2  LYS  11           HB2      LYS  11  41.871   7.719   1.142
   92    HB3  LYS  11           HB1      LYS  11  40.701   9.008   0.761
   93    HG2  LYS  11           HG2      LYS  11  41.104   8.639  -1.667
   94    HG3  LYS  11           HG1      LYS  11  42.238   7.324  -1.270
   95    HD2  LYS  11           HD2      LYS  11  40.349   6.197  -0.006
   96    HD3  LYS  11           HD1      LYS  11  39.253   7.432  -0.671
   97    HE2  LYS  11           HE2      LYS  11  39.175   5.447  -2.097
   98    HE3  LYS  11           HE1      LYS  11  39.975   6.768  -2.981
   99    HZ1  LYS  11           HZ1      LYS  11  41.970   5.734  -2.894
  100    HZ2  LYS  11           HZ2      LYS  11  41.007   4.339  -2.778
  101    HZ3  LYS  11           HZ3      LYS  11  41.687   5.026  -1.379
  102    H    ALA  12           HN       ALA  12  42.880  12.044   0.499
  103    HA   ALA  12           HA       ALA  12  43.756  12.171   3.258
  104    HB1  ALA  12           HB1      ALA  12  42.630  14.234   1.343
  105    HB2  ALA  12           HB2      ALA  12  44.338  13.952   1.760
  106    HB3  ALA  12           HB3      ALA  12  43.221  14.623   2.976
  107    H    GLY  13           HN       GLY  13  40.920  11.134   2.049
  108    HA2  GLY  13           HA1      GLY  13  38.705  11.160   2.780
  109    HA3  GLY  13           HA2      GLY  13  39.477  10.950   4.363
  110    H    PHE  14           HN       PHE  14  39.733  13.846   2.332
  111    HA   PHE  14           HA       PHE  14  37.632  15.278   3.745
  112    HB2  PHE  14           HB2      PHE  14  39.497  15.092   5.484
  113    HB3  PHE  14           HB1      PHE  14  40.470  16.133   4.420
  114    HD1  PHE  14           HD1      PHE  14  37.000  15.978   5.914
  115    HD2  PHE  14           HD2      PHE  14  40.336  18.472   4.767
  116    HE1  PHE  14           HE1      PHE  14  35.827  17.975   6.830
  117    HE2  PHE  14           HE2      PHE  14  39.160  20.464   5.685
  118    HZ   PHE  14           HZ       PHE  14  36.873  20.228   6.644
  119    H    ILE  15           HN       ILE  15  40.192  14.985   1.461
  120    HA   ILE  15           HA       ILE  15  39.054  17.225  -0.097
  121    HB   ILE  15           HB       ILE  15  41.348  18.214  -0.521
  122   HG12  ILE  15          HG12      ILE  15  42.036  16.465   1.887
  123   HG13  ILE  15          HG11      ILE  15  42.714  16.327   0.250
  124   HG21  ILE  15          HG21      ILE  15  41.294  19.632   1.421
  125   HG22  ILE  15          HG22      ILE  15  40.543  18.360   2.412
  126   HG23  ILE  15          HG23      ILE  15  39.611  19.147   1.119
  127   HD11  ILE  15           HD1      ILE  15  43.166  18.507   2.311
  128   HD12  ILE  15           HD2      ILE  15  43.463  18.812   0.581
  129   HD13  ILE  15           HD3      ILE  15  44.370  17.539   1.432
  130    H    ILE  16           HN       ILE  16  38.751  14.630  -0.629
  131    HA   ILE  16           HA       ILE  16  40.374  14.332  -3.107
  132    HB   ILE  16           HB       ILE  16  41.495  13.015  -1.250
  133   HG12  ILE  16          HG12      ILE  16  41.550  10.844  -2.571
  134   HG13  ILE  16          HG11      ILE  16  40.239  11.487  -3.585
  135   HG21  ILE  16          HG21      ILE  16  39.048  11.220  -1.415
  136   HG22  ILE  16          HG22      ILE  16  39.247  12.455  -0.150
  137   HG23  ILE  16          HG23      ILE  16  40.412  11.119  -0.280
  138   HD11  ILE  16           HD1      ILE  16  42.800  11.770  -4.319
  139   HD12  ILE  16           HD2      ILE  16  42.736  13.171  -3.227
  140   HD13  ILE  16           HD3      ILE  16  41.629  13.072  -4.616
  141    H    ILE  17           HN       ILE  17  37.695  13.244  -1.027
  142    HA   ILE  17           HA       ILE  17  36.321  11.912  -3.261
  143    HB   ILE  17           HB       ILE  17  34.343  12.009  -1.470
  144   HG12  ILE  17          HG12      ILE  17  35.113  12.223   0.836
  145   HG13  ILE  17          HG11      ILE  17  36.785  12.495   0.302
  146   HG21  ILE  17          HG21      ILE  17  36.883  10.406  -0.942
  147   HG22  ILE  17          HG22      ILE  17  35.613   9.968  -2.108
  148   HG23  ILE  17          HG23      ILE  17  35.249  10.005  -0.366
  149   HD11  ILE  17           HD1      ILE  17  36.245  14.635  -0.628
  150   HD12  ILE  17           HD2      ILE  17  35.418  14.584   0.946
  151   HD13  ILE  17           HD3      ILE  17  34.495  14.312  -0.549
  152    H    GLY  18           HN       GLY  18  37.006  15.025  -2.740
  153    HA2  GLY  18           HA1      GLY  18  34.726  15.937  -4.354
  154    HA3  GLY  18           HA2      GLY  18  34.780  16.610  -2.711
  155    H    GLY  19           HN       GLY  19  37.729  16.540  -2.603
  156    HA2  GLY  19           HA1      GLY  19  38.289  19.165  -3.424
  157    HA3  GLY  19           HA2      GLY  19  39.514  17.907  -3.159
  158    H    ALA  20           HN       ALA  20  38.573  16.121  -5.217
  159    HA   ALA  20           HA       ALA  20  39.074  15.716  -7.444
  160    HB1  ALA  20           HB1      ALA  20  38.124  17.280  -9.063
  161    HB2  ALA  20           HB2      ALA  20  37.976  18.525  -7.799
  162    HB3  ALA  20           HB3      ALA  20  37.000  17.039  -7.705
  163    H    LEU  21           HN       LEU  21  41.302  16.434  -6.010
  164    HA   LEU  21           HA       LEU  21  42.764  18.651  -7.067
  165    HB2  LEU  21           HB2      LEU  21  43.553  16.017  -5.779
  166    HB3  LEU  21           HB1      LEU  21  44.796  17.137  -6.382
  167    HG   LEU  21           HG       LEU  21  43.893  18.937  -4.955
  168   HD11  LEU  21          HD11      LEU  21  42.168  18.198  -3.179
  169   HD12  LEU  21          HD12      LEU  21  41.852  16.797  -4.229
  170   HD13  LEU  21          HD13      LEU  21  41.555  18.447  -4.829
  171   HD21  LEU  21          HD21      LEU  21  44.274  16.369  -3.353
  172   HD22  LEU  21          HD22      LEU  21  44.616  18.029  -2.814
  173   HD23  LEU  21          HD23      LEU  21  45.605  17.286  -4.095
  174    H    ASP  22           HN       ASP  22  43.250  19.030  -9.115
  175    HA   ASP  22           HA       ASP  22  43.892  18.676 -11.308
  176    HB2  ASP  22           HB2      ASP  22  45.931  17.785 -10.139
  177    HB3  ASP  22           HB1      ASP  22  45.227  16.154 -10.247
  178    H    HIS  23           HN       HIS  23  43.688  15.220 -10.394
  179    HA   HIS  23           HA       HIS  23  41.076  14.865 -11.616
  180    HB2  HIS  23           HB2      HIS  23  42.497  15.211 -13.652
  181    HB3  HIS  23           HB1      HIS  23  43.469  13.802 -13.167
  182    HD1  HIS  23           HD1      HIS  23  42.536  11.480 -13.616
  183    HD2  HIS  23           HD2      HIS  23  39.781  14.553 -14.414
  184    HE1  HIS  23           HE1      HIS  23  40.512  10.412 -14.747
  185    H    LEU  24           HN       LEU  24  42.597  14.221  -9.172
  186    HA   LEU  24           HA       LEU  24  41.726  11.466  -8.930
  187    HB2  LEU  24           HB2      LEU  24  44.063  11.448 -10.163
  188    HB3  LEU  24           HB1      LEU  24  44.719  11.790  -8.548
  189    HG   LEU  24           HG       LEU  24  42.909   9.435  -9.270
  190   HD11  LEU  24          HD11      LEU  24  45.190   9.263 -10.223
  191   HD12  LEU  24          HD12      LEU  24  44.953   8.083  -8.911
  192   HD13  LEU  24          HD13      LEU  24  45.886   9.570  -8.614
  193   HD21  LEU  24          HD21      LEU  24  44.184  10.395  -6.677
  194   HD22  LEU  24          HD22      LEU  24  43.773   8.679  -6.921
  195   HD23  LEU  24          HD23      LEU  24  42.496   9.913  -6.977
  Start of MODEL   22
    1    H1   GLY   1           HT1      GLY   1  62.262   2.207  -1.665
    2    H2   GLY   1           HT2      GLY   1  62.827   2.280  -0.063
    3    H3   GLY   1           HT3      GLY   1  61.466   3.183  -0.531
    4    HA2  GLY   1           HA1      GLY   1  60.772   0.691  -1.225
    5    HA3  GLY   1           HA2      GLY   1  61.694   0.458   0.273
    6    H    LYS   2           HN       LYS   2  60.449   0.364   2.001
    7    HA   LYS   2           HA       LYS   2  57.719   1.261   2.008
    8    HB2  LYS   2           HB2      LYS   2  57.884   0.845   4.492
    9    HB3  LYS   2           HB1      LYS   2  58.416  -0.518   3.489
   10    HG2  LYS   2           HG2      LYS   2  60.726  -0.051   3.858
   11    HG3  LYS   2           HG1      LYS   2  60.386   1.557   4.530
   12    HD2  LYS   2           HD2      LYS   2  59.209  -0.883   5.905
   13    HD3  LYS   2           HD1      LYS   2  60.928  -0.504   6.147
   14    HE2  LYS   2           HE2      LYS   2  58.700   1.533   6.577
   15    HE3  LYS   2           HE1      LYS   2  59.361   0.509   7.872
   16    HZ1  LYS   2           HZ1      LYS   2  61.018   2.283   6.153
   17    HZ2  LYS   2           HZ2      LYS   2  61.511   1.441   7.543
   18    HZ3  LYS   2           HZ3      LYS   2  60.418   2.735   7.673
   19    H    GLY   3           HN       GLY   3  58.460   2.430   4.927
   20    HA2  GLY   3           HA1      GLY   3  57.992   4.713   5.646
   21    HA3  GLY   3           HA2      GLY   3  59.623   4.945   4.805
   22    H    ARG   4           HN       ARG   4  56.610   4.238   4.909
   23    HA   ARG   4           HA       ARG   4  55.686   6.184   5.014
   24    HB2  ARG   4           HB2      ARG   4  56.177   6.253   2.070
   25    HB3  ARG   4           HB1      ARG   4  54.545   6.791   2.534
   26    HG2  ARG   4           HG2      ARG   4  55.293   8.744   3.536
   27    HG3  ARG   4           HG1      ARG   4  56.793   8.022   4.129
   28    HD2  ARG   4           HD2      ARG   4  57.892   8.338   2.044
   29    HD3  ARG   4           HD1      ARG   4  56.357   8.517   1.162
   30    HE   ARG   4           HE       ARG   4  56.744  10.596   3.174
   31   HH11  ARG   4          HH11      ARG   4  59.217  10.633   1.431
   32   HH12  ARG   4          HH12      ARG   4  58.742  11.729   0.177
   33   HH21  ARG   4          HH21      ARG   4  55.362  11.539   0.929
   34   HH22  ARG   4          HH22      ARG   4  56.559  12.241  -0.107
   35    H    TRP   5           HN       TRP   5  55.637   3.208   3.801
   36    HA   TRP   5           HA       TRP   5  53.146   2.522   2.785
   37    HB2  TRP   5           HB2      TRP   5  55.019   0.933   3.298
   38    HB3  TRP   5           HB1      TRP   5  54.572   1.031   5.018
   39    HD1  TRP   5           HD1      TRP   5  52.536   0.482   1.746
   40    HE1  TRP   5           HE1      TRP   5  50.903  -1.509   2.103
   41    HE3  TRP   5           HE3      TRP   5  53.790  -0.741   6.559
   42    HZ2  TRP   5           HZ2      TRP   5  50.254  -3.363   4.206
   43    HZ3  TRP   5           HZ3      TRP   5  52.651  -2.626   7.719
   44    HH2  TRP   5           HH2      TRP   5  50.886  -3.937   6.549
   45    H    LEU   6           HN       LEU   6  53.865   3.951   5.815
   46    HA   LEU   6           HA       LEU   6  51.093   3.386   6.850
   47    HB2  LEU   6           HB2      LEU   6  53.516   4.319   8.432
   48    HB3  LEU   6           HB1      LEU   6  51.968   3.703   9.061
   49    HG   LEU   6           HG       LEU   6  53.990   2.100   7.427
   50   HD11  LEU   6          HD11      LEU   6  53.208   1.913  10.370
   51   HD12  LEU   6          HD12      LEU   6  54.707   2.655   9.760
   52   HD13  LEU   6          HD13      LEU   6  54.418   0.914   9.530
   53   HD21  LEU   6          HD21      LEU   6  51.849   1.168   6.949
   54   HD22  LEU   6          HD22      LEU   6  51.255   1.458   8.603
   55   HD23  LEU   6          HD23      LEU   6  52.454   0.179   8.298
   56    H    GLU   7           HN       GLU   7  53.189   5.813   5.491
   57    HA   GLU   7           HA       GLU   7  52.230   8.072   6.990
   58    HB2  GLU   7           HB2      GLU   7  54.216   8.089   5.518
   59    HB3  GLU   7           HB1      GLU   7  53.159   7.918   4.097
   60    HG2  GLU   7           HG2      GLU   7  52.749  10.196   6.080
   61    HG3  GLU   7           HG1      GLU   7  53.966  10.324   4.789
   62    H    ARG   8           HN       ARG   8  50.768   6.082   4.540
   63    HA   ARG   8           HA       ARG   8  48.985   7.729   3.219
   64    HB2  ARG   8           HB2      ARG   8  48.392   5.030   4.495
   65    HB3  ARG   8           HB1      ARG   8  47.387   5.815   3.253
   66    HG2  ARG   8           HG2      ARG   8  49.245   5.789   1.664
   67    HG3  ARG   8           HG1      ARG   8  50.340   5.136   2.909
   68    HD2  ARG   8           HD2      ARG   8  48.792   3.139   3.103
   69    HD3  ARG   8           HD1      ARG   8  47.902   3.767   1.696
   70    HE   ARG   8           HE       ARG   8  50.462   2.403   1.612
   71   HH11  ARG   8          HH11      ARG   8  51.538   4.725   0.412
   72   HH12  ARG   8          HH12      ARG   8  50.980   4.697  -1.229
   73   HH21  ARG   8          HH21      ARG   8  48.438   2.422  -0.603
   74   HH22  ARG   8          HH22      ARG   8  49.224   3.394  -1.803
   75    H    ILE   9           HN       ILE   9  48.240   9.536   4.274
   76    HA   ILE   9           HA       ILE   9  47.084   9.499   6.905
   77    HB   ILE   9           HB       ILE   9  46.088  11.713   6.238
   78   HG12  ILE   9          HG12      ILE   9  47.362  10.998   3.555
   79   HG13  ILE   9          HG11      ILE   9  45.623  11.179   3.875
   80   HG21  ILE   9          HG21      ILE   9  48.982  11.482   5.316
   81   HG22  ILE   9          HG22      ILE   9  48.511  11.365   7.028
   82   HG23  ILE   9          HG23      ILE   9  48.192  12.860   6.119
   83   HD11  ILE   9           HD1      ILE   9  46.229  13.583   4.690
   84   HD12  ILE   9           HD2      ILE   9  46.243  13.268   2.939
   85   HD13  ILE   9           HD3      ILE   9  47.774  13.322   3.844
   86    H    GLY  10           HN       GLY  10  45.924   8.456   3.836
   87    HA2  GLY  10           HA1      GLY  10  43.921   7.385   3.334
   88    HA3  GLY  10           HA2      GLY  10  43.412   7.587   5.023
   89    H    LYS  11           HN       LYS  11  43.740  10.438   5.133
   90    HA   LYS  11           HA       LYS  11  41.163  11.199   4.033
   91    HB2  LYS  11           HB2      LYS  11  43.402  12.744   5.395
   92    HB3  LYS  11           HB1      LYS  11  41.878  13.502   4.865
   93    HG2  LYS  11           HG2      LYS  11  40.570  12.116   6.328
   94    HG3  LYS  11           HG1      LYS  11  41.956  11.053   6.674
   95    HD2  LYS  11           HD2      LYS  11  41.513  12.641   8.543
   96    HD3  LYS  11           HD1      LYS  11  43.118  12.896   7.820
   97    HE2  LYS  11           HE2      LYS  11  40.730  14.486   6.827
   98    HE3  LYS  11           HE1      LYS  11  41.599  14.987   8.295
   99    HZ1  LYS  11           HZ1      LYS  11  43.600  14.458   6.545
  100    HZ2  LYS  11           HZ2      LYS  11  42.975  16.001   6.884
  101    HZ3  LYS  11           HZ3      LYS  11  42.417  15.132   5.535
  102    H    ALA  12           HN       ALA  12  40.916  11.380   1.893
  103    HA   ALA  12           HA       ALA  12  43.107  12.285   0.172
  104    HB1  ALA  12           HB1      ALA  12  41.285  10.608  -0.432
  105    HB2  ALA  12           HB2      ALA  12  41.609  11.884  -1.630
  106    HB3  ALA  12           HB3      ALA  12  40.182  11.997  -0.570
  107    H    GLY  13           HN       GLY  13  42.701  14.226   2.091
  108    HA2  GLY  13           HA1      GLY  13  42.488  16.524   2.219
  109    HA3  GLY  13           HA2      GLY  13  42.336  16.546   0.452
  110    H    PHE  14           HN       PHE  14  40.452  15.636   3.371
  111    HA   PHE  14           HA       PHE  14  38.198  15.923   3.839
  112    HB2  PHE  14           HB2      PHE  14  38.976  18.319   3.677
  113    HB3  PHE  14           HB1      PHE  14  38.412  18.329   1.989
  114    HD1  PHE  14           HD1      PHE  14  36.141  18.848   1.523
  115    HD2  PHE  14           HD2      PHE  14  37.252  17.543   5.486
  116    HE1  PHE  14           HE1      PHE  14  33.826  19.303   2.323
  117    HE2  PHE  14           HE2      PHE  14  34.937  17.998   6.284
  118    HZ   PHE  14           HZ       PHE  14  33.252  18.966   4.724
  119    H    ILE  15           HN       ILE  15  38.966  14.281   1.508
  120    HA   ILE  15           HA       ILE  15  37.909  13.155  -0.191
  121    HB   ILE  15           HB       ILE  15  35.300  14.476   0.667
  122   HG12  ILE  15          HG12      ILE  15  36.759  12.088   1.892
  123   HG13  ILE  15          HG11      ILE  15  36.401  13.635   2.693
  124   HG21  ILE  15          HG21      ILE  15  35.836  11.655  -0.351
  125   HG22  ILE  15          HG22      ILE  15  35.477  13.017  -1.437
  126   HG23  ILE  15          HG23      ILE  15  34.275  12.501  -0.235
  127   HD11  ILE  15           HD1      ILE  15  34.473  11.440   1.865
  128   HD12  ILE  15           HD2      ILE  15  33.904  13.104   2.151
  129   HD13  ILE  15           HD3      ILE  15  34.685  12.191   3.464
  130    H    ILE  16           HN       ILE  16  39.242  14.870  -1.272
  131    HA   ILE  16           HA       ILE  16  37.486  16.316  -3.240
  132    HB   ILE  16           HB       ILE  16  40.083  17.288  -1.987
  133   HG12  ILE  16          HG12      ILE  16  37.869  17.464  -0.619
  134   HG13  ILE  16          HG11      ILE  16  38.861  18.921  -0.791
  135   HG21  ILE  16          HG21      ILE  16  38.319  18.440  -4.189
  136   HG22  ILE  16          HG22      ILE  16  40.037  17.995  -4.290
  137   HG23  ILE  16          HG23      ILE  16  39.542  19.402  -3.325
  138   HD11  ILE  16           HD1      ILE  16  36.353  19.245  -1.148
  139   HD12  ILE  16           HD2      ILE  16  36.517  18.306  -2.645
  140   HD13  ILE  16           HD3      ILE  16  37.391  19.842  -2.459
  141    H    ILE  17           HN       ILE  17  40.760  15.107  -2.432
  142    HA   ILE  17           HA       ILE  17  41.583  14.947  -5.219
  143    HB   ILE  17           HB       ILE  17  42.696  13.743  -2.640
  144   HG12  ILE  17          HG12      ILE  17  44.523  15.347  -3.035
  145   HG13  ILE  17          HG11      ILE  17  43.773  15.857  -4.564
  146   HG21  ILE  17          HG21      ILE  17  43.640  13.421  -5.518
  147   HG22  ILE  17          HG22      ILE  17  43.326  12.145  -4.317
  148   HG23  ILE  17          HG23      ILE  17  44.736  13.214  -4.130
  149   HD11  ILE  17           HD1      ILE  17  42.232  16.038  -1.953
  150   HD12  ILE  17           HD2      ILE  17  41.976  16.935  -3.468
  151   HD13  ILE  17           HD3      ILE  17  43.367  17.320  -2.433
  152    H    GLY  18           HN       GLY  18  40.396  12.664  -2.748
  153    HA2  GLY  18           HA1      GLY  18  40.345  10.420  -4.625
  154    HA3  GLY  18           HA2      GLY  18  39.698  10.451  -2.970
  155    H    GLY  19           HN       GLY  19  38.006  12.664  -3.127
  156    HA2  GLY  19           HA1      GLY  19  35.649  11.481  -4.188
  157    HA3  GLY  19           HA2      GLY  19  35.841  13.191  -3.750
  158    H    ALA  20           HN       ALA  20  37.749  14.073  -5.508
  159    HA   ALA  20           HA       ALA  20  36.187  14.534  -7.858
  160    HB1  ALA  20           HB1      ALA  20  38.288  15.496  -8.777
  161    HB2  ALA  20           HB2      ALA  20  39.175  14.826  -7.386
  162    HB3  ALA  20           HB3      ALA  20  37.930  16.074  -7.133
  163    H    LEU  21           HN       LEU  21  39.027  12.418  -7.290
  164    HA   LEU  21           HA       LEU  21  39.761  10.558  -8.450
  165    HB2  LEU  21           HB2      LEU  21  37.211  10.027  -8.083
  166    HB3  LEU  21           HB1      LEU  21  37.058  10.368  -9.817
  167    HG   LEU  21           HG       LEU  21  39.111   8.679 -10.042
  168   HD11  LEU  21          HD11      LEU  21  38.952   6.853  -8.320
  169   HD12  LEU  21          HD12      LEU  21  37.884   7.896  -7.356
  170   HD13  LEU  21          HD13      LEU  21  39.569   8.380  -7.653
  171   HD21  LEU  21          HD21      LEU  21  36.291   7.732  -9.355
  172   HD22  LEU  21          HD22      LEU  21  37.511   6.794 -10.250
  173   HD23  LEU  21          HD23      LEU  21  36.842   8.285 -10.954
  174    H    ASP  22           HN       ASP  22  39.023  13.432  -9.820
  175    HA   ASP  22           HA       ASP  22  39.423  12.674 -12.654
  176    HB2  ASP  22           HB2      ASP  22  39.281  15.394 -11.290
  177    HB3  ASP  22           HB1      ASP  22  39.292  15.108 -13.049
  178    H    HIS  23           HN       HIS  23  41.511  11.855 -10.861
  179    HA   HIS  23           HA       HIS  23  43.820  11.947 -10.671
  180    HB2  HIS  23           HB2      HIS  23  43.540  11.687 -13.175
  181    HB3  HIS  23           HB1      HIS  23  43.713  13.454 -13.314
  182    HD1  HIS  23           HD1      HIS  23  45.775  12.599 -10.542
  183    HD2  HIS  23           HD2      HIS  23  46.190  12.080 -14.693
  184    HE1  HIS  23           HE1      HIS  23  48.267  12.303 -11.027
  185    H    LEU  24           HN       LEU  24  42.104  14.249  -9.722
  186    HA   LEU  24           HA       LEU  24  43.697  16.650 -10.095
  187    HB2  LEU  24           HB2      LEU  24  41.173  16.333  -9.373
  188    HB3  LEU  24           HB1      LEU  24  41.843  16.210  -7.732
  189    HG   LEU  24           HG       LEU  24  42.243  18.530  -9.680
  190   HD11  LEU  24          HD11      LEU  24  40.710  18.298  -7.051
  191   HD12  LEU  24          HD12      LEU  24  39.988  18.425  -8.673
  192   HD13  LEU  24          HD13      LEU  24  40.913  19.789  -8.000
  193   HD21  LEU  24          HD21      LEU  24  43.391  17.911  -6.928
  194   HD22  LEU  24          HD22      LEU  24  43.231  19.587  -7.507
  195   HD23  LEU  24          HD23      LEU  24  44.246  18.433  -8.399
  Start of MODEL   23
    1    H1   GLY   1           HT1      GLY   1  56.747  11.413  -1.560
    2    H2   GLY   1           HT2      GLY   1  57.323  12.475  -2.755
    3    H3   GLY   1           HT3      GLY   1  58.400  11.453  -1.929
    4    HA2  GLY   1           HA1      GLY   1  56.735  10.956  -4.189
    5    HA3  GLY   1           HA2      GLY   1  58.214  10.135  -3.651
    6    H    LYS   2           HN       LYS   2  57.627   8.036  -3.767
    7    HA   LYS   2           HA       LYS   2  55.052   7.019  -3.073
    8    HB2  LYS   2           HB2      LYS   2  56.198   4.815  -2.968
    9    HB3  LYS   2           HB1      LYS   2  56.654   5.741  -4.418
   10    HG2  LYS   2           HG2      LYS   2  58.686   6.570  -3.160
   11    HG3  LYS   2           HG1      LYS   2  58.262   5.449  -1.845
   12    HD2  LYS   2           HD2      LYS   2  58.322   3.561  -3.513
   13    HD3  LYS   2           HD1      LYS   2  58.912   4.716  -4.732
   14    HE2  LYS   2           HE2      LYS   2  60.829   3.572  -3.747
   15    HE3  LYS   2           HE1      LYS   2  60.833   5.267  -3.204
   16    HZ1  LYS   2           HZ1      LYS   2  61.230   3.815  -1.345
   17    HZ2  LYS   2           HZ2      LYS   2  59.828   2.914  -1.678
   18    HZ3  LYS   2           HZ3      LYS   2  59.701   4.528  -1.163
   19    H    GLY   3           HN       GLY   3  55.291   4.986  -1.316
   20    HA2  GLY   3           HA1      GLY   3  56.093   4.597   1.049
   21    HA3  GLY   3           HA2      GLY   3  55.944   6.389   1.344
   22    H    ARG   4           HN       ARG   4  54.460   7.385   0.498
   23    HA   ARG   4           HA       ARG   4  53.589   7.093   2.743
   24    HB2  ARG   4           HB2      ARG   4  52.169   8.823   0.662
   25    HB3  ARG   4           HB1      ARG   4  51.917   8.976   2.420
   26    HG2  ARG   4           HG2      ARG   4  54.227   9.538   2.795
   27    HG3  ARG   4           HG1      ARG   4  54.674   9.092   1.130
   28    HD2  ARG   4           HD2      ARG   4  52.750  11.347   1.846
   29    HD3  ARG   4           HD1      ARG   4  54.477  11.578   1.477
   30    HE   ARG   4           HE       ARG   4  53.200  10.098  -0.643
   31   HH11  ARG   4          HH11      ARG   4  53.086  13.188   0.861
   32   HH12  ARG   4          HH12      ARG   4  52.931  14.059  -0.628
   33   HH21  ARG   4          HH21      ARG   4  53.165  11.226  -2.616
   34   HH22  ARG   4          HH22      ARG   4  52.977  12.949  -2.598
   35    H    TRP   5           HN       TRP   5  52.588   5.445   0.216
   36    HA   TRP   5           HA       TRP   5  49.849   5.017   0.084
   37    HB2  TRP   5           HB2      TRP   5  51.558   3.714  -1.174
   38    HB3  TRP   5           HB1      TRP   5  51.918   2.796   0.308
   39    HD1  TRP   5           HD1      TRP   5  50.237   0.953   1.049
   40    HE1  TRP   5           HE1      TRP   5  48.140  -0.143  -0.028
   41    HE3  TRP   5           HE3      TRP   5  49.463   4.273  -2.770
   42    HZ2  TRP   5           HZ2      TRP   5  46.386   0.377  -2.252
   43    HZ3  TRP   5           HZ3      TRP   5  47.572   3.954  -4.357
   44    HH2  TRP   5           HH2      TRP   5  46.034   2.010  -4.102
   45    H    LEU   6           HN       LEU   6  51.897   4.499   2.827
   46    HA   LEU   6           HA       LEU   6  49.719   3.040   4.295
   47    HB2  LEU   6           HB2      LEU   6  52.108   2.092   4.145
   48    HB3  LEU   6           HB1      LEU   6  52.596   3.453   5.177
   49    HG   LEU   6           HG       LEU   6  50.588   2.631   6.730
   50   HD11  LEU   6          HD11      LEU   6  51.273   0.124   5.123
   51   HD12  LEU   6          HD12      LEU   6  49.682   0.913   5.232
   52   HD13  LEU   6          HD13      LEU   6  50.383   0.125   6.662
   53   HD21  LEU   6          HD21      LEU   6  53.242   1.146   6.476
   54   HD22  LEU   6          HD22      LEU   6  52.171   1.078   7.898
   55   HD23  LEU   6          HD23      LEU   6  52.935   2.618   7.431
   56    H    GLU   7           HN       GLU   7  51.603   6.034   4.105
   57    HA   GLU   7           HA       GLU   7  50.603   6.925   6.770
   58    HB2  GLU   7           HB2      GLU   7  52.960   7.391   5.797
   59    HB3  GLU   7           HB1      GLU   7  52.160   8.570   4.737
   60    HG2  GLU   7           HG2      GLU   7  51.322   9.813   6.665
   61    HG3  GLU   7           HG1      GLU   7  51.935   8.572   7.782
   62    H    ARG   8           HN       ARG   8  49.355   6.613   3.746
   63    HA   ARG   8           HA       ARG   8  48.231   9.020   2.945
   64    HB2  ARG   8           HB2      ARG   8  46.277   7.650   2.158
   65    HB3  ARG   8           HB1      ARG   8  47.859   6.964   1.714
   66    HG2  ARG   8           HG2      ARG   8  47.748   5.458   3.693
   67    HG3  ARG   8           HG1      ARG   8  46.145   6.120   4.094
   68    HD2  ARG   8           HD2      ARG   8  45.228   5.309   1.981
   69    HD3  ARG   8           HD1      ARG   8  46.839   4.763   1.453
   70    HE   ARG   8           HE       ARG   8  46.391   2.793   2.656
   71   HH11  ARG   8          HH11      ARG   8  43.588   2.961   3.087
   72   HH12  ARG   8          HH12      ARG   8  43.404   3.149   4.798
   73   HH21  ARG   8          HH21      ARG   8  46.691   4.130   5.312
   74   HH22  ARG   8          HH22      ARG   8  45.161   3.810   6.059
   75    H    ILE   9           HN       ILE   9  46.373  10.209   3.379
   76    HA   ILE   9           HA       ILE   9  45.560  10.183   6.205
   77    HB   ILE   9           HB       ILE   9  44.364  11.871   3.964
   78   HG12  ILE   9          HG12      ILE   9  46.909  12.317   5.594
   79   HG13  ILE   9          HG11      ILE   9  46.804  12.087   3.834
   80   HG21  ILE   9          HG21      ILE   9  44.834  12.550   6.896
   81   HG22  ILE   9          HG22      ILE   9  43.345  11.760   6.328
   82   HG23  ILE   9          HG23      ILE   9  43.774  13.378   5.729
   83   HD11  ILE   9           HD1      ILE   9  45.236  14.167   3.851
   84   HD12  ILE   9           HD2      ILE   9  46.976  14.442   4.102
   85   HD13  ILE   9           HD3      ILE   9  45.867  14.453   5.492
   86    H    GLY  10           HN       GLY  10  43.684  10.180   3.130
   87    HA2  GLY  10           HA1      GLY  10  41.873   8.846   2.527
   88    HA3  GLY  10           HA2      GLY  10  42.071   7.914   4.021
   89    H    LYS  11           HN       LYS  11  42.022  10.801   5.342
   90    HA   LYS  11           HA       LYS  11  39.229  10.594   6.091
   91    HB2  LYS  11           HB2      LYS  11  41.276  11.543   7.423
   92    HB3  LYS  11           HB1      LYS  11  40.933  13.064   6.566
   93    HG2  LYS  11           HG2      LYS  11  38.526  12.853   7.396
   94    HG3  LYS  11           HG1      LYS  11  39.070  11.506   8.414
   95    HD2  LYS  11           HD2      LYS  11  40.288  14.303   8.480
   96    HD3  LYS  11           HD1      LYS  11  39.025  13.741   9.597
   97    HE2  LYS  11           HE2      LYS  11  41.004  13.341  10.818
   98    HE3  LYS  11           HE1      LYS  11  40.695  11.751  10.082
   99    HZ1  LYS  11           HZ1      LYS  11  42.675  11.904   9.129
  100    HZ2  LYS  11           HZ2      LYS  11  42.909  13.474   9.735
  101    HZ3  LYS  11           HZ3      LYS  11  42.146  13.244   8.235
  102    H    ALA  12           HN       ALA  12  40.406  11.436   3.209
  103    HA   ALA  12           HA       ALA  12  39.402  12.493   1.423
  104    HB1  ALA  12           HB1      ALA  12  37.265  13.749   3.151
  105    HB2  ALA  12           HB2      ALA  12  37.238  11.996   2.855
  106    HB3  ALA  12           HB3      ALA  12  37.161  13.130   1.486
  107    H    GLY  13           HN       GLY  13  40.205  14.081   4.394
  108    HA2  GLY  13           HA1      GLY  13  40.745  16.317   4.861
  109    HA3  GLY  13           HA2      GLY  13  41.820  16.049   3.474
  110    H    PHE  14           HN       PHE  14  38.383  16.829   4.172
  111    HA   PHE  14           HA       PHE  14  36.950  18.306   3.103
  112    HB2  PHE  14           HB2      PHE  14  39.518  19.800   2.420
  113    HB3  PHE  14           HB1      PHE  14  37.868  20.467   2.403
  114    HD1  PHE  14           HD1      PHE  14  36.609  20.791   4.510
  115    HD2  PHE  14           HD2      PHE  14  40.689  19.385   4.516
  116    HE1  PHE  14           HE1      PHE  14  36.781  21.300   6.944
  117    HE2  PHE  14           HE2      PHE  14  40.862  19.895   6.949
  118    HZ   PHE  14           HZ       PHE  14  38.925  20.902   8.150
  119    H    ILE  15           HN       ILE  15  37.879  16.006   1.710
  120    HA   ILE  15           HA       ILE  15  37.741  15.086  -0.392
  121    HB   ILE  15           HB       ILE  15  36.801  17.787  -1.433
  122   HG12  ILE  15          HG12      ILE  15  35.430  17.392   0.500
  123   HG13  ILE  15          HG11      ILE  15  34.459  16.898  -0.898
  124   HG21  ILE  15          HG21      ILE  15  36.568  14.910  -2.375
  125   HG22  ILE  15          HG22      ILE  15  37.091  16.351  -3.268
  126   HG23  ILE  15          HG23      ILE  15  35.375  16.127  -2.880
  127   HD11  ILE  15           HD1      ILE  15  35.327  14.506  -0.457
  128   HD12  ILE  15           HD2      ILE  15  34.180  15.166   0.726
  129   HD13  ILE  15           HD3      ILE  15  35.918  15.128   1.101
  130    H    ILE  16           HN       ILE  16  40.092  14.971  -0.316
  131    HA   ILE  16           HA       ILE  16  41.239  16.492  -2.608
  132    HB   ILE  16           HB       ILE  16  41.835  17.866  -0.607
  133   HG12  ILE  16          HG12      ILE  16  44.310  17.861  -0.947
  134   HG13  ILE  16          HG11      ILE  16  44.181  16.324  -1.826
  135   HG21  ILE  16          HG21      ILE  16  41.849  15.750   0.926
  136   HG22  ILE  16          HG22      ILE  16  43.046  17.025   1.238
  137   HG23  ILE  16          HG23      ILE  16  43.528  15.544   0.380
  138   HD11  ILE  16           HD1      ILE  16  43.142  17.320  -3.686
  139   HD12  ILE  16           HD2      ILE  16  44.224  18.629  -3.159
  140   HD13  ILE  16           HD3      ILE  16  42.498  18.680  -2.732
  141    H    ILE  17           HN       ILE  17  42.023  14.166   0.035
  142    HA   ILE  17           HA       ILE  17  43.847  12.708  -1.723
  143    HB   ILE  17           HB       ILE  17  44.220  12.644   0.710
  144   HG12  ILE  17          HG12      ILE  17  44.448  10.241   1.044
  145   HG13  ILE  17          HG11      ILE  17  43.221   9.899  -0.193
  146   HG21  ILE  17          HG21      ILE  17  41.812  12.919   1.340
  147   HG22  ILE  17          HG22      ILE  17  42.609  11.598   2.228
  148   HG23  ILE  17          HG23      ILE  17  41.524  11.228   0.866
  149   HD11  ILE  17           HD1      ILE  17  45.715  11.480  -0.908
  150   HD12  ILE  17           HD2      ILE  17  44.658  10.516  -1.969
  151   HD13  ILE  17           HD3      ILE  17  45.764   9.702  -0.838
  152    H    GLY  18           HN       GLY  18  40.480  12.555  -0.715
  153    HA2  GLY  18           HA1      GLY  18  40.016   9.979  -2.091
  154    HA3  GLY  18           HA2      GLY  18  38.822  10.968  -1.224
  155    H    GLY  19           HN       GLY  19  39.041  13.425  -2.412
  156    HA2  GLY  19           HA1      GLY  19  37.481  13.091  -4.759
  157    HA3  GLY  19           HA2      GLY  19  38.294  14.586  -4.261
  158    H    ALA  20           HN       ALA  20  40.984  13.699  -4.348
  159    HA   ALA  20           HA       ALA  20  41.694  14.261  -6.991
  160    HB1  ALA  20           HB1      ALA  20  43.106  12.586  -4.895
  161    HB2  ALA  20           HB2      ALA  20  43.365  14.302  -5.285
  162    HB3  ALA  20           HB3      ALA  20  43.858  13.044  -6.441
  163    H    LEU  21           HN       LEU  21  41.844  10.959  -5.568
  164    HA   LEU  21           HA       LEU  21  41.634   8.891  -6.589
  165    HB2  LEU  21           HB2      LEU  21  39.293   9.887  -6.891
  166    HB3  LEU  21           HB1      LEU  21  39.783  10.290  -8.550
  167    HG   LEU  21           HG       LEU  21  40.484   7.735  -8.693
  168   HD11  LEU  21          HD11      LEU  21  40.168   7.105  -6.359
  169   HD12  LEU  21          HD12      LEU  21  38.905   6.307  -7.317
  170   HD13  LEU  21          HD13      LEU  21  38.511   7.751  -6.359
  171   HD21  LEU  21          HD21      LEU  21  38.171   7.150  -9.416
  172   HD22  LEU  21          HD22      LEU  21  38.667   8.752 -10.014
  173   HD23  LEU  21          HD23      LEU  21  37.563   8.624  -8.623
  174    H    ASP  22           HN       ASP  22  43.920   9.259  -7.259
  175    HA   ASP  22           HA       ASP  22  44.177   8.637 -10.095
  176    HB2  ASP  22           HB2      ASP  22  43.956  11.146 -10.139
  177    HB3  ASP  22           HB1      ASP  22  45.426  11.242  -9.140
  178    H    HIS  23           HN       HIS  23  44.808   7.279  -7.718
  179    HA   HIS  23           HA       HIS  23  46.574   6.186  -6.681
  180    HB2  HIS  23           HB2      HIS  23  48.077   6.898  -9.229
  181    HB3  HIS  23           HB1      HIS  23  48.455   5.577  -8.099
  182    HD1  HIS  23           HD1      HIS  23  45.181   6.704  -9.796
  183    HD2  HIS  23           HD2      HIS  23  47.516   3.251  -9.232
  184    HE1  HIS  23           HE1      HIS  23  43.950   4.763 -10.912
  185    H    LEU  24           HN       LEU  24  46.279   8.718  -5.734
  186    HA   LEU  24           HA       LEU  24  48.952   9.276  -4.766
  187    HB2  LEU  24           HB2      LEU  24  48.952  10.367  -7.072
  188    HB3  LEU  24           HB1      LEU  24  47.679  11.448  -6.466
  189    HG   LEU  24           HG       LEU  24  49.358  11.936  -4.488
  190   HD11  LEU  24          HD11      LEU  24  51.204  10.762  -6.620
  191   HD12  LEU  24          HD12      LEU  24  51.049  10.253  -4.921
  192   HD13  LEU  24          HD13      LEU  24  51.763  11.830  -5.315
  193   HD21  LEU  24          HD21      LEU  24  48.691  13.584  -6.213
  194   HD22  LEU  24          HD22      LEU  24  49.918  12.925  -7.321
  195   HD23  LEU  24          HD23      LEU  24  50.420  13.738  -5.820
  Start of MODEL   24
    1    H1   GLY   1           HT1      GLY   1  62.882   1.527   3.005
    2    H2   GLY   1           HT2      GLY   1  61.963   0.327   3.781
    3    H3   GLY   1           HT3      GLY   1  62.161   1.853   4.504
    4    HA2  GLY   1           HA1      GLY   1  61.101   2.728   2.369
    5    HA3  GLY   1           HA2      GLY   1  60.519   1.058   2.226
    6    H    LYS   2           HN       LYS   2  61.059   2.103   5.446
    7    HA   LYS   2           HA       LYS   2  58.378   1.701   6.253
    8    HB2  LYS   2           HB2      LYS   2  60.570   3.404   7.501
    9    HB3  LYS   2           HB1      LYS   2  59.041   2.983   8.310
   10    HG2  LYS   2           HG2      LYS   2  59.554   0.600   8.149
   11    HG3  LYS   2           HG1      LYS   2  61.018   0.946   7.197
   12    HD2  LYS   2           HD2      LYS   2  62.041   2.104   9.081
   13    HD3  LYS   2           HD1      LYS   2  60.542   1.962  10.033
   14    HE2  LYS   2           HE2      LYS   2  62.352   0.240  10.573
   15    HE3  LYS   2           HE1      LYS   2  60.753  -0.430  10.176
   16    HZ1  LYS   2           HZ1      LYS   2  62.900  -1.346   9.037
   17    HZ2  LYS   2           HZ2      LYS   2  62.702  -0.006   8.011
   18    HZ3  LYS   2           HZ3      LYS   2  61.469  -1.166   8.146
   19    H    GLY   3           HN       GLY   3  57.447   3.766   7.702
   20    HA2  GLY   3           HA1      GLY   3  56.775   6.147   7.479
   21    HA3  GLY   3           HA2      GLY   3  57.016   6.037   5.674
   22    H    ARG   4           HN       ARG   4  56.469   4.388   4.739
   23    HA   ARG   4           HA       ARG   4  54.591   5.835   4.231
   24    HB2  ARG   4           HB2      ARG   4  54.637   3.061   2.943
   25    HB3  ARG   4           HB1      ARG   4  54.009   4.561   2.220
   26    HG2  ARG   4           HG2      ARG   4  56.910   4.029   3.029
   27    HG3  ARG   4           HG1      ARG   4  56.280   4.072   1.370
   28    HD2  ARG   4           HD2      ARG   4  55.449   6.498   2.035
   29    HD3  ARG   4           HD1      ARG   4  56.690   6.361   3.306
   30    HE   ARG   4           HE       ARG   4  57.872   5.599   0.826
   31   HH11  ARG   4          HH11      ARG   4  59.717   7.252   1.521
   32   HH12  ARG   4          HH12      ARG   4  59.293   8.875   1.090
   33   HH21  ARG   4          HH21      ARG   4  55.927   8.162   0.656
   34   HH22  ARG   4          HH22      ARG   4  57.147   9.390   0.601
   35    H    TRP   5           HN       TRP   5  54.492   3.464   6.346
   36    HA   TRP   5           HA       TRP   5  52.140   1.990   6.358
   37    HB2  TRP   5           HB2      TRP   5  53.750   1.942   8.207
   38    HB3  TRP   5           HB1      TRP   5  53.275   3.586   8.691
   39    HD1  TRP   5           HD1      TRP   5  51.263   0.352   7.900
   40    HE1  TRP   5           HE1      TRP   5  49.504  -0.018   9.781
   41    HE3  TRP   5           HE3      TRP   5  52.373   4.388  10.843
   42    HZ2  TRP   5           HZ2      TRP   5  48.713   1.287  12.223
   43    HZ3  TRP   5           HZ3      TRP   5  51.105   4.807  12.944
   44    HH2  TRP   5           HH2      TRP   5  49.278   3.263  13.637
   45    H    LEU   6           HN       LEU   6  52.421   5.435   6.374
   46    HA   LEU   6           HA       LEU   6  49.487   5.757   6.986
   47    HB2  LEU   6           HB2      LEU   6  51.611   7.932   6.912
   48    HB3  LEU   6           HB1      LEU   6  49.971   8.019   7.596
   49    HG   LEU   6           HG       LEU   6  52.216   6.224   8.629
   50   HD11  LEU   6          HD11      LEU   6  52.500   8.722   8.981
   51   HD12  LEU   6          HD12      LEU   6  52.380   7.770  10.480
   52   HD13  LEU   6          HD13      LEU   6  50.976   8.700   9.901
   53   HD21  LEU   6          HD21      LEU   6  49.327   6.701   9.470
   54   HD22  LEU   6          HD22      LEU   6  50.541   6.088  10.617
   55   HD23  LEU   6          HD23      LEU   6  50.148   5.153   9.157
   56    H    GLU   7           HN       GLU   7  52.034   6.109   4.557
   57    HA   GLU   7           HA       GLU   7  50.137   7.613   2.772
   58    HB2  GLU   7           HB2      GLU   7  52.638   8.279   3.237
   59    HB3  GLU   7           HB1      GLU   7  53.032   6.950   2.126
   60    HG2  GLU   7           HG2      GLU   7  51.617   7.992   0.374
   61    HG3  GLU   7           HG1      GLU   7  51.196   9.311   1.492
   62    H    ARG   8           HN       ARG   8  50.356   4.580   3.611
   63    HA   ARG   8           HA       ARG   8  50.972   3.215   1.124
   64    HB2  ARG   8           HB2      ARG   8  51.069   2.157   3.394
   65    HB3  ARG   8           HB1      ARG   8  49.293   2.242   3.467
   66    HG2  ARG   8           HG2      ARG   8  49.082   0.813   1.510
   67    HG3  ARG   8           HG1      ARG   8  50.842   0.849   1.241
   68    HD2  ARG   8           HD2      ARG   8  49.969  -1.247   2.403
   69    HD3  ARG   8           HD1      ARG   8  51.262  -0.385   3.270
   70    HE   ARG   8           HE       ARG   8  49.712  -0.043   5.006
   71   HH11  ARG   8          HH11      ARG   8  47.649   0.717   5.692
   72   HH12  ARG   8          HH12      ARG   8  46.262   0.283   4.749
   73   HH21  ARG   8          HH21      ARG   8  48.118  -1.123   2.180
   74   HH22  ARG   8          HH22      ARG   8  46.528  -0.757   2.760
   75    H    ILE   9           HN       ILE   9  47.905   4.039   2.810
   76    HA   ILE   9           HA       ILE   9  46.197   2.967   0.779
   77    HB   ILE   9           HB       ILE   9  44.442   4.461   1.768
   78   HG12  ILE   9          HG12      ILE   9  46.797   5.464   3.439
   79   HG13  ILE   9          HG11      ILE   9  45.890   6.414   2.240
   80   HG21  ILE   9          HG21      ILE   9  46.135   3.185   3.955
   81   HG22  ILE   9          HG22      ILE   9  45.203   2.223   2.783
   82   HG23  ILE   9          HG23      ILE   9  44.364   3.337   3.886
   83   HD11  ILE   9           HD1      ILE   9  44.912   7.034   4.308
   84   HD12  ILE   9           HD2      ILE   9  44.950   5.369   4.930
   85   HD13  ILE   9           HD3      ILE   9  43.784   5.820   3.661
   86    H    GLY  10           HN       GLY  10  48.065   5.900   0.961
   87    HA2  GLY  10           HA1      GLY  10  48.469   7.455  -0.722
   88    HA3  GLY  10           HA2      GLY  10  47.396   6.541  -1.800
   89    H    LYS  11           HN       LYS  11  45.135   6.608   0.085
   90    HA   LYS  11           HA       LYS  11  44.036   9.159  -0.781
   91    HB2  LYS  11           HB2      LYS  11  42.995   6.975   1.063
   92    HB3  LYS  11           HB1      LYS  11  42.053   8.411   0.590
   93    HG2  LYS  11           HG2      LYS  11  42.401   7.785  -1.819
   94    HG3  LYS  11           HG1      LYS  11  43.211   6.295  -1.278
   95    HD2  LYS  11           HD2      LYS  11  41.199   5.506  -0.191
   96    HD3  LYS  11           HD1      LYS  11  40.384   7.069  -0.446
   97    HE2  LYS  11           HE2      LYS  11  40.387   6.744  -2.858
   98    HE3  LYS  11           HE1      LYS  11  41.375   5.271  -2.700
   99    HZ1  LYS  11           HZ1      LYS  11  39.579   4.068  -2.237
  100    HZ2  LYS  11           HZ2      LYS  11  38.639   5.400  -2.718
  101    HZ3  LYS  11           HZ3      LYS  11  39.018   5.173  -1.079
  102    H    ALA  12           HN       ALA  12  44.699  11.004   0.120
  103    HA   ALA  12           HA       ALA  12  45.614  11.085   2.905
  104    HB1  ALA  12           HB1      ALA  12  45.069  13.297   0.895
  105    HB2  ALA  12           HB2      ALA  12  46.635  12.499   1.181
  106    HB3  ALA  12           HB3      ALA  12  45.895  13.496   2.458
  107    H    GLY  13           HN       GLY  13  42.656  10.608   1.774
  108    HA2  GLY  13           HA1      GLY  13  40.508  11.207   2.433
  109    HA3  GLY  13           HA2      GLY  13  41.225  11.204   4.055
  110    H    PHE  14           HN       PHE  14  42.191  13.448   1.519
  111    HA   PHE  14           HA       PHE  14  40.465  15.607   2.554
  112    HB2  PHE  14           HB2      PHE  14  42.372  15.519   4.182
  113    HB3  PHE  14           HB1      PHE  14  43.490  15.822   2.832
  114    HD1  PHE  14           HD1      PHE  14  43.982  18.063   2.230
  115    HD2  PHE  14           HD2      PHE  14  40.362  17.201   4.420
  116    HE1  PHE  14           HE1      PHE  14  43.517  20.502   2.421
  117    HE2  PHE  14           HE2      PHE  14  39.898  19.642   4.609
  118    HZ   PHE  14           HZ       PHE  14  41.488  21.292   3.633
  119    H    ILE  15           HN       ILE  15  43.711  15.671   1.030
  120    HA   ILE  15           HA       ILE  15  42.524  17.172  -1.243
  121    HB   ILE  15           HB       ILE  15  44.639  17.917  -0.046
  122   HG12  ILE  15          HG12      ILE  15  44.950  17.401  -3.042
  123   HG13  ILE  15          HG11      ILE  15  43.946  18.688  -2.338
  124   HG21  ILE  15          HG21      ILE  15  46.644  16.742  -0.181
  125   HG22  ILE  15          HG22      ILE  15  46.210  15.928  -1.698
  126   HG23  ILE  15          HG23      ILE  15  45.510  15.374  -0.160
  127   HD11  ILE  15           HD1      ILE  15  46.176  19.553  -2.960
  128   HD12  ILE  15           HD2      ILE  15  46.944  18.339  -1.910
  129   HD13  ILE  15           HD3      ILE  15  45.937  19.622  -1.199
  130    H    ILE  16           HN       ILE  16  41.565  14.675  -1.187
  131    HA   ILE  16           HA       ILE  16  42.758  13.550  -3.675
  132    HB   ILE  16           HB       ILE  16  43.663  12.315  -1.619
  133   HG12  ILE  16          HG12      ILE  16  42.825   9.979  -2.639
  134   HG13  ILE  16          HG11      ILE  16  42.095  11.014  -3.883
  135   HG21  ILE  16          HG21      ILE  16  41.430  12.492  -0.389
  136   HG22  ILE  16          HG22      ILE  16  42.208  10.892  -0.353
  137   HG23  ILE  16          HG23      ILE  16  40.840  11.189  -1.451
  138   HD11  ILE  16           HD1      ILE  16  44.280  11.964  -4.442
  139   HD12  ILE  16           HD2      ILE  16  44.405  10.193  -4.466
  140   HD13  ILE  16           HD3      ILE  16  45.043  11.108  -3.082
  141    H    ILE  17           HN       ILE  17  40.141  13.462  -1.240
  142    HA   ILE  17           HA       ILE  17  38.242  12.437  -3.257
  143    HB   ILE  17           HB       ILE  17  37.893  11.723  -0.935
  144   HG12  ILE  17          HG12      ILE  17  35.560  12.341  -0.630
  145   HG13  ILE  17          HG11      ILE  17  35.762  13.809  -1.607
  146   HG21  ILE  17          HG21      ILE  17  37.508  14.666  -0.246
  147   HG22  ILE  17          HG22      ILE  17  38.994  13.750   0.092
  148   HG23  ILE  17          HG23      ILE  17  37.467  13.285   0.872
  149   HD11  ILE  17           HD1      ILE  17  36.353  11.075  -2.794
  150   HD12  ILE  17           HD2      ILE  17  35.931  12.589  -3.631
  151   HD13  ILE  17           HD3      ILE  17  34.688  11.696  -2.726
  152    H    GLY  18           HN       GLY  18  39.093  15.425  -1.559
  153    HA2  GLY  18           HA1      GLY  18  37.031  16.976  -3.022
  154    HA3  GLY  18           HA2      GLY  18  38.154  17.579  -1.784
  155    H    GLY  19           HN       GLY  19  40.595  16.725  -2.737
  156    HA2  GLY  19           HA1      GLY  19  41.237  18.754  -4.606
  157    HA3  GLY  19           HA2      GLY  19  42.253  17.352  -4.213
  158    H    ALA  20           HN       ALA  20  40.361  15.326  -5.092
  159    HA   ALA  20           HA       ALA  20  41.048  15.401  -7.938
  160    HB1  ALA  20           HB1      ALA  20  39.296  13.456  -6.396
  161    HB2  ALA  20           HB2      ALA  20  41.058  13.313  -6.610
  162    HB3  ALA  20           HB3      ALA  20  39.978  13.207  -8.020
  163    H    LEU  21           HN       LEU  21  39.406  17.606  -7.228
  164    HA   LEU  21           HA       LEU  21  36.642  17.085  -7.874
  165    HB2  LEU  21           HB2      LEU  21  37.242  19.090  -6.657
  166    HB3  LEU  21           HB1      LEU  21  38.341  19.611  -7.950
  167    HG   LEU  21           HG       LEU  21  36.482  19.991  -9.473
  168   HD11  LEU  21          HD11      LEU  21  34.861  18.619  -7.293
  169   HD12  LEU  21          HD12      LEU  21  34.944  18.229  -9.028
  170   HD13  LEU  21          HD13      LEU  21  34.088  19.690  -8.487
  171   HD21  LEU  21          HD21      LEU  21  35.326  21.787  -8.285
  172   HD22  LEU  21          HD22      LEU  21  37.023  21.739  -7.751
  173   HD23  LEU  21          HD23      LEU  21  35.744  21.063  -6.715
  174    H    ASP  22           HN       ASP  22  39.373  18.455  -9.769
  175    HA   ASP  22           HA       ASP  22  37.997  18.779 -12.214
  176    HB2  ASP  22           HB2      ASP  22  40.892  17.947 -11.776
  177    HB3  ASP  22           HB1      ASP  22  40.219  18.621 -13.280
  178    H    HIS  23           HN       HIS  23  39.734  15.916 -10.932
  179    HA   HIS  23           HA       HIS  23  39.555  14.216 -13.143
  180    HB2  HIS  23           HB2      HIS  23  39.115  13.517 -10.213
  181    HB3  HIS  23           HB1      HIS  23  39.477  12.348 -11.504
  182    HD1  HIS  23           HD1      HIS  23  41.158  15.652 -11.828
  183    HD2  HIS  23           HD2      HIS  23  42.005  11.942 -10.038
  184    HE1  HIS  23           HE1      HIS  23  43.664  15.597 -11.340
  185    H    LEU  24           HN       LEU  24  37.039  15.122 -10.817
  186    HA   LEU  24           HA       LEU  24  34.776  14.619 -10.755
  187    HB2  LEU  24           HB2      LEU  24  34.748  16.166 -12.604
  188    HB3  LEU  24           HB1      LEU  24  35.294  14.914 -13.738
  189    HG   LEU  24           HG       LEU  24  33.187  13.726 -13.566
  190   HD11  LEU  24          HD11      LEU  24  32.601  13.876 -11.259
  191   HD12  LEU  24          HD12      LEU  24  31.333  14.797 -12.097
  192   HD13  LEU  24          HD13      LEU  24  32.657  15.655 -11.273
  193   HD21  LEU  24          HD21      LEU  24  33.228  15.685 -15.075
  194   HD22  LEU  24          HD22      LEU  24  32.700  16.734 -13.736
  195   HD23  LEU  24          HD23      LEU  24  31.611  15.471 -14.364
  Start of MODEL   25
    1    H1   GLY   1           HT1      GLY   1  54.915   2.528  -5.432
    2    H2   GLY   1           HT2      GLY   1  55.820   3.610  -6.379
    3    H3   GLY   1           HT3      GLY   1  54.956   4.173  -5.029
    4    HA2  GLY   1           HA1      GLY   1  57.193   2.261  -4.932
    5    HA3  GLY   1           HA2      GLY   1  57.337   4.006  -4.643
    6    H    LYS   2           HN       LYS   2  58.106   2.106  -2.750
    7    HA   LYS   2           HA       LYS   2  55.942   1.725  -0.815
    8    HB2  LYS   2           HB2      LYS   2  58.909   1.549  -0.195
    9    HB3  LYS   2           HB1      LYS   2  57.560   0.628   0.515
   10    HG2  LYS   2           HG2      LYS   2  58.628   0.392  -2.333
   11    HG3  LYS   2           HG1      LYS   2  58.795  -0.809  -1.032
   12    HD2  LYS   2           HD2      LYS   2  56.225  -0.856  -0.935
   13    HD3  LYS   2           HD1      LYS   2  56.251   0.061  -2.461
   14    HE2  LYS   2           HE2      LYS   2  57.756  -1.765  -3.408
   15    HE3  LYS   2           HE1      LYS   2  57.401  -2.709  -1.942
   16    HZ1  LYS   2           HZ1      LYS   2  54.997  -2.385  -2.492
   17    HZ2  LYS   2           HZ2      LYS   2  55.852  -3.352  -3.598
   18    HZ3  LYS   2           HZ3      LYS   2  55.472  -1.742  -3.988
   19    H    GLY   3           HN       GLY   3  56.394   2.443   1.535
   20    HA2  GLY   3           HA1      GLY   3  57.582   4.422   2.763
   21    HA3  GLY   3           HA2      GLY   3  56.849   5.468   1.461
   22    H    ARG   4           HN       ARG   4  55.103   4.953   0.697
   23    HA   ARG   4           HA       ARG   4  54.423   6.703   2.228
   24    HB2  ARG   4           HB2      ARG   4  52.476   5.388   0.278
   25    HB3  ARG   4           HB1      ARG   4  52.203   6.979   1.025
   26    HG2  ARG   4           HG2      ARG   4  54.384   7.767   0.102
   27    HG3  ARG   4           HG1      ARG   4  54.597   6.190  -0.695
   28    HD2  ARG   4           HD2      ARG   4  53.648   7.950  -2.222
   29    HD3  ARG   4           HD1      ARG   4  52.582   6.536  -2.031
   30    HE   ARG   4           HE       ARG   4  51.957   8.623  -0.106
   31   HH11  ARG   4          HH11      ARG   4  50.397   6.718  -2.168
   32   HH12  ARG   4          HH12      ARG   4  49.448   7.933  -2.959
   33   HH21  ARG   4          HH21      ARG   4  51.257  10.582  -1.641
   34   HH22  ARG   4          HH22      ARG   4  49.934  10.120  -2.660
   35    H    TRP   5           HN       TRP   5  53.960   3.596   2.745
   36    HA   TRP   5           HA       TRP   5  51.523   2.927   3.875
   37    HB2  TRP   5           HB2      TRP   5  53.534   1.464   3.861
   38    HB3  TRP   5           HB1      TRP   5  54.211   2.425   5.198
   39    HD1  TRP   5           HD1      TRP   5  53.562   1.704   7.554
   40    HE1  TRP   5           HE1      TRP   5  51.803   0.115   8.622
   41    HE3  TRP   5           HE3      TRP   5  50.907   0.498   3.347
   42    HZ2  TRP   5           HZ2      TRP   5  49.554  -1.454   7.737
   43    HZ3  TRP   5           HZ3      TRP   5  48.959  -1.047   3.482
   44    HH2  TRP   5           HH2      TRP   5  48.280  -2.023   5.671
   45    H    LEU   6           HN       LEU   6  53.669   5.419   4.969
   46    HA   LEU   6           HA       LEU   6  52.081   5.745   7.505
   47    HB2  LEU   6           HB2      LEU   6  54.466   5.375   7.893
   48    HB3  LEU   6           HB1      LEU   6  54.884   6.670   6.753
   49    HG   LEU   6           HG       LEU   6  53.850   8.351   8.218
   50   HD11  LEU   6          HD11      LEU   6  53.159   7.466  10.595
   51   HD12  LEU   6          HD12      LEU   6  52.971   5.895   9.782
   52   HD13  LEU   6          HD13      LEU   6  52.000   7.292   9.259
   53   HD21  LEU   6          HD21      LEU   6  55.609   6.457   9.836
   54   HD22  LEU   6          HD22      LEU   6  55.421   8.209  10.083
   55   HD23  LEU   6          HD23      LEU   6  56.215   7.597   8.612
   56    H    GLU   7           HN       GLU   7  52.842   7.161   4.365
   57    HA   GLU   7           HA       GLU   7  52.432   9.907   5.068
   58    HB2  GLU   7           HB2      GLU   7  53.243   8.900   2.825
   59    HB3  GLU   7           HB1      GLU   7  51.518   8.676   2.448
   60    HG2  GLU   7           HG2      GLU   7  52.125  10.806   1.522
   61    HG3  GLU   7           HG1      GLU   7  51.199  11.155   3.002
   62    H    ARG   8           HN       ARG   8  50.223   7.222   4.650
   63    HA   ARG   8           HA       ARG   8  47.813   8.644   4.169
   64    HB2  ARG   8           HB2      ARG   8  48.178   6.122   4.142
   65    HB3  ARG   8           HB1      ARG   8  48.074   6.171   5.918
   66    HG2  ARG   8           HG2      ARG   8  45.824   7.143   5.795
   67    HG3  ARG   8           HG1      ARG   8  45.927   7.215   4.019
   68    HD2  ARG   8           HD2      ARG   8  46.170   4.737   3.949
   69    HD3  ARG   8           HD1      ARG   8  46.008   4.685   5.720
   70    HE   ARG   8           HE       ARG   8  43.768   6.081   4.558
   71   HH11  ARG   8          HH11      ARG   8  43.708   3.779   2.757
   72   HH12  ARG   8          HH12      ARG   8  42.854   2.577   3.665
   73   HH21  ARG   8          HH21      ARG   8  43.294   4.184   6.706
   74   HH22  ARG   8          HH22      ARG   8  42.619   2.806   5.902
   75    H    ILE   9           HN       ILE   9  46.105   9.275   5.564
   76    HA   ILE   9           HA       ILE   9  46.638   9.496   8.458
   77    HB   ILE   9           HB       ILE   9  46.256  12.013   8.424
   78   HG12  ILE   9          HG12      ILE   9  46.939  11.651   5.468
   79   HG13  ILE   9          HG11      ILE   9  45.335  12.087   6.101
   80   HG21  ILE   9          HG21      ILE   9  48.540  10.845   8.644
   81   HG22  ILE   9          HG22      ILE   9  48.572  12.534   8.091
   82   HG23  ILE   9          HG23      ILE   9  48.781  11.211   6.919
   83   HD11  ILE   9           HD1      ILE   9  46.553  14.070   7.272
   84   HD12  ILE   9           HD2      ILE   9  46.308  14.171   5.512
   85   HD13  ILE   9           HD3      ILE   9  47.899  13.713   6.162
   86    H    GLY  10           HN       GLY  10  44.677   8.754   6.031
   87    HA2  GLY  10           HA1      GLY  10  42.379   8.720   5.716
   88    HA3  GLY  10           HA2      GLY  10  42.320   8.578   7.484
   89    H    LYS  11           HN       LYS  11  43.651  11.400   5.858
   90    HA   LYS  11           HA       LYS  11  41.157  12.925   6.004
   91    HB2  LYS  11           HB2      LYS  11  42.019  12.760   8.428
   92    HB3  LYS  11           HB1      LYS  11  43.373  13.787   7.899
   93    HG2  LYS  11           HG2      LYS  11  41.678  15.461   7.050
   94    HG3  LYS  11           HG1      LYS  11  40.402  14.464   7.786
   95    HD2  LYS  11           HD2      LYS  11  41.414  14.737  10.002
   96    HD3  LYS  11           HD1      LYS  11  42.773  15.644   9.297
   97    HE2  LYS  11           HE2      LYS  11  41.120  17.201  10.256
   98    HE3  LYS  11           HE1      LYS  11  41.176  17.375   8.485
   99    HZ1  LYS  11           HZ1      LYS  11  39.033  16.874   8.405
  100    HZ2  LYS  11           HZ2      LYS  11  38.978  16.727  10.097
  101    HZ3  LYS  11           HZ3      LYS  11  39.320  15.370   9.134
  102    H    ALA  12           HN       ALA  12  42.525  12.526   3.795
  103    HA   ALA  12           HA       ALA  12  44.633  14.532   3.388
  104    HB1  ALA  12           HB1      ALA  12  44.492  12.338   2.168
  105    HB2  ALA  12           HB2      ALA  12  44.612  13.757   1.098
  106    HB3  ALA  12           HB3      ALA  12  43.040  12.952   1.339
  107    H    GLY  13           HN       GLY  13  41.393  14.736   3.857
  108    HA2  GLY  13           HA1      GLY  13  40.505  17.079   3.695
  109    HA3  GLY  13           HA2      GLY  13  41.080  17.101   2.013
  110    H    PHE  14           HN       PHE  14  39.295  14.781   4.076
  111    HA   PHE  14           HA       PHE  14  37.294  13.684   3.733
  112    HB2  PHE  14           HB2      PHE  14  36.479  16.092   3.427
  113    HB3  PHE  14           HB1      PHE  14  36.598  15.814   1.674
  114    HD1  PHE  14           HD1      PHE  14  34.898  14.603   0.505
  115    HD2  PHE  14           HD2      PHE  14  35.017  14.521   4.820
  116    HE1  PHE  14           HE1      PHE  14  32.688  13.457   0.544
  117    HE2  PHE  14           HE2      PHE  14  32.805  13.376   4.857
  118    HZ   PHE  14           HZ       PHE  14  31.676  12.779   2.718
  119    H    ILE  15           HN       ILE  15  39.716  13.157   2.079
  120    HA   ILE  15           HA       ILE  15  40.282  11.811   0.306
  121    HB   ILE  15           HB       ILE  15  37.344  11.043   0.044
  122   HG12  ILE  15          HG12      ILE  15  39.420   9.961   2.008
  123   HG13  ILE  15          HG11      ILE  15  37.992  10.928   2.441
  124   HG21  ILE  15          HG21      ILE  15  39.842   9.330  -0.273
  125   HG22  ILE  15          HG22      ILE  15  39.159  10.271  -1.618
  126   HG23  ILE  15          HG23      ILE  15  38.191   8.994  -0.851
  127   HD11  ILE  15           HD1      ILE  15  36.613   9.082   1.230
  128   HD12  ILE  15           HD2      ILE  15  37.310   8.684   2.818
  129   HD13  ILE  15           HD3      ILE  15  38.097   8.102   1.334
  130    H    ILE  16           HN       ILE  16  40.372  14.183  -0.404
  131    HA   ILE  16           HA       ILE  16  38.901  14.407  -3.024
  132    HB   ILE  16           HB       ILE  16  39.735  16.589  -1.072
  133   HG12  ILE  16          HG12      ILE  16  37.608  15.139  -0.598
  134   HG13  ILE  16          HG11      ILE  16  37.460  16.905  -0.528
  135   HG21  ILE  16          HG21      ILE  16  38.472  18.088  -2.715
  136   HG22  ILE  16          HG22      ILE  16  38.498  16.720  -3.853
  137   HG23  ILE  16          HG23      ILE  16  40.024  17.449  -3.300
  138   HD11  ILE  16           HD1      ILE  16  36.390  16.993  -2.686
  139   HD12  ILE  16           HD2      ILE  16  35.594  15.689  -1.779
  140   HD13  ILE  16           HD3      ILE  16  36.786  15.296  -3.033
  141    H    ILE  17           HN       ILE  17  41.748  15.400  -1.086
  142    HA   ILE  17           HA       ILE  17  43.294  16.210  -3.394
  143    HB   ILE  17           HB       ILE  17  44.048  15.455  -0.532
  144   HG12  ILE  17          HG12      ILE  17  44.527  17.844  -0.332
  145   HG13  ILE  17          HG11      ILE  17  44.244  18.086  -2.070
  146   HG21  ILE  17          HG21      ILE  17  45.991  14.807  -1.791
  147   HG22  ILE  17          HG22      ILE  17  46.339  16.442  -1.180
  148   HG23  ILE  17          HG23      ILE  17  45.843  16.211  -2.874
  149   HD11  ILE  17           HD1      ILE  17  42.317  18.705  -0.443
  150   HD12  ILE  17           HD2      ILE  17  42.081  16.952  -0.261
  151   HD13  ILE  17           HD3      ILE  17  41.907  17.714  -1.861
  152    H    GLY  18           HN       GLY  18  42.857  13.236  -1.529
  153    HA2  GLY  18           HA1      GLY  18  44.762  11.746  -3.246
  154    HA3  GLY  18           HA2      GLY  18  43.866  11.125  -1.843
  155    H    GLY  19           HN       GLY  19  41.277  12.005  -2.532
  156    HA2  GLY  19           HA1      GLY  19  40.421   9.845  -4.188
  157    HA3  GLY  19           HA2      GLY  19  39.444  11.253  -3.727
  158    H    ALA  20           HN       ALA  20  41.293  13.192  -4.930
  159    HA   ALA  20           HA       ALA  20  40.084  13.402  -7.485
  160    HB1  ALA  20           HB1      ALA  20  41.059  15.336  -6.472
  161    HB2  ALA  20           HB2      ALA  20  41.982  15.014  -7.958
  162    HB3  ALA  20           HB3      ALA  20  42.657  14.561  -6.374
  163    H    LEU  21           HN       LEU  21  43.174  11.926  -6.489
  164    HA   LEU  21           HA       LEU  21  44.689  10.644  -7.700
  165    HB2  LEU  21           HB2      LEU  21  42.181   9.860  -9.235
  166    HB3  LEU  21           HB1      LEU  21  43.705   8.947  -9.188
  167    HG   LEU  21           HG       LEU  21  42.123   9.626  -6.671
  168   HD11  LEU  21          HD11      LEU  21  41.188   7.338  -6.796
  169   HD12  LEU  21          HD12      LEU  21  41.990   7.092  -8.367
  170   HD13  LEU  21          HD13      LEU  21  40.694   8.303  -8.209
  171   HD21  LEU  21          HD21      LEU  21  43.392   7.503  -5.894
  172   HD22  LEU  21          HD22      LEU  21  44.360   8.975  -6.112
  173   HD23  LEU  21          HD23      LEU  21  44.389   7.702  -7.353
  174    H    ASP  22           HN       ASP  22  45.462  12.816  -8.488
  175    HA   ASP  22           HA       ASP  22  46.185  14.177 -10.225
  176    HB2  ASP  22           HB2      ASP  22  45.926  11.602 -11.829
  177    HB3  ASP  22           HB1      ASP  22  46.928  13.014 -12.246
  178    H    HIS  23           HN       HIS  23  43.367  14.202  -9.733
  179    HA   HIS  23           HA       HIS  23  41.396  14.914 -10.726
  180    HB2  HIS  23           HB2      HIS  23  43.353  15.928 -12.826
  181    HB3  HIS  23           HB1      HIS  23  41.649  16.421 -12.689
  182    HD1  HIS  23           HD1      HIS  23  44.805  17.716 -11.882
  183    HD2  HIS  23           HD2      HIS  23  41.255  17.256  -9.677
  184    HE1  HIS  23           HE1      HIS  23  44.938  19.304  -9.886
  185    H    LEU  24           HN       LEU  24  41.373  12.365 -11.024
  186    HA   LEU  24           HA       LEU  24  40.205  11.954 -13.683
  187    HB2  LEU  24           HB2      LEU  24  42.732  11.584 -13.972
  188    HB3  LEU  24           HB1      LEU  24  42.543  10.181 -12.896
  189    HG   LEU  24           HG       LEU  24  40.572   9.523 -14.579
  190   HD11  LEU  24          HD11      LEU  24  40.636  11.571 -15.942
  191   HD12  LEU  24          HD12      LEU  24  41.152  10.184 -16.926
  192   HD13  LEU  24          HD13      LEU  24  42.363  11.318 -16.286
  193   HD21  LEU  24          HD21      LEU  24  42.221   8.263 -15.961
  194   HD22  LEU  24          HD22      LEU  24  42.603   8.176 -14.225
  195   HD23  LEU  24          HD23      LEU  24  43.531   9.262 -15.288
  Start of MODEL   26
    1    H1   GLY   1           HT1      GLY   1  60.578   1.962  -2.155
    2    H2   GLY   1           HT2      GLY   1  60.745   1.201  -0.644
    3    H3   GLY   1           HT3      GLY   1  61.963   2.237  -1.219
    4    HA2  GLY   1           HA1      GLY   1  61.031   3.942  -0.290
    5    HA3  GLY   1           HA2      GLY   1  59.567   3.630  -1.243
    6    H    LYS   2           HN       LYS   2  61.186   1.742   1.339
    7    HA   LYS   2           HA       LYS   2  58.728   0.980   2.577
    8    HB2  LYS   2           HB2      LYS   2  60.895  -0.186   2.920
    9    HB3  LYS   2           HB1      LYS   2  61.495   1.222   3.829
   10    HG2  LYS   2           HG2      LYS   2  59.825   0.926   5.547
   11    HG3  LYS   2           HG1      LYS   2  58.968  -0.301   4.584
   12    HD2  LYS   2           HD2      LYS   2  60.811  -1.859   4.795
   13    HD3  LYS   2           HD1      LYS   2  61.843  -0.615   5.542
   14    HE2  LYS   2           HE2      LYS   2  60.845  -2.204   7.215
   15    HE3  LYS   2           HE1      LYS   2  60.382  -0.509   7.497
   16    HZ1  LYS   2           HZ1      LYS   2  58.276  -0.881   6.520
   17    HZ2  LYS   2           HZ2      LYS   2  58.526  -2.170   7.596
   18    HZ3  LYS   2           HZ3      LYS   2  58.721  -2.405   5.925
   19    H    GLY   3           HN       GLY   3  57.830   1.603   4.613
   20    HA2  GLY   3           HA1      GLY   3  58.005   3.377   6.494
   21    HA3  GLY   3           HA2      GLY   3  58.175   4.602   5.149
   22    H    ARG   4           HN       ARG   4  57.225   4.230   3.436
   23    HA   ARG   4           HA       ARG   4  55.761   5.886   4.433
   24    HB2  ARG   4           HB2      ARG   4  55.433   4.822   1.591
   25    HB3  ARG   4           HB1      ARG   4  54.642   6.318   2.153
   26    HG2  ARG   4           HG2      ARG   4  56.792   7.318   2.710
   27    HG3  ARG   4           HG1      ARG   4  57.641   5.791   2.369
   28    HD2  ARG   4           HD2      ARG   4  56.061   7.416   0.326
   29    HD3  ARG   4           HD1      ARG   4  57.836   7.399   0.476
   30    HE   ARG   4           HE       ARG   4  57.028   4.707   0.200
   31   HH11  ARG   4          HH11      ARG   4  56.492   3.767  -1.820
   32   HH12  ARG   4          HH12      ARG   4  56.692   4.719  -3.255
   33   HH21  ARG   4          HH21      ARG   4  57.456   7.631  -1.533
   34   HH22  ARG   4          HH22      ARG   4  57.238   6.908  -3.091
   35    H    TRP   5           HN       TRP   5  55.105   2.770   4.282
   36    HA   TRP   5           HA       TRP   5  52.439   2.192   3.705
   37    HB2  TRP   5           HB2      TRP   5  53.928   1.314   6.211
   38    HB3  TRP   5           HB1      TRP   5  52.513   0.502   5.498
   39    HD1  TRP   5           HD1      TRP   5  56.177   0.428   5.436
   40    HE1  TRP   5           HE1      TRP   5  57.087  -0.932   3.416
   41    HE3  TRP   5           HE3      TRP   5  51.871   0.084   2.688
   42    HZ2  TRP   5           HZ2      TRP   5  56.056  -2.009   0.952
   43    HZ3  TRP   5           HZ3      TRP   5  51.857  -1.112   0.505
   44    HH2  TRP   5           HH2      TRP   5  53.944  -2.159  -0.365
   45    H    LEU   6           HN       LEU   6  53.624   4.417   6.046
   46    HA   LEU   6           HA       LEU   6  50.893   4.680   7.289
   47    HB2  LEU   6           HB2      LEU   6  52.661   4.062   8.881
   48    HB3  LEU   6           HB1      LEU   6  53.640   5.449   8.363
   49    HG   LEU   6           HG       LEU   6  50.837   6.158   9.194
   50   HD11  LEU   6          HD11      LEU   6  52.861   5.104  11.219
   51   HD12  LEU   6          HD12      LEU   6  51.252   4.427  10.869
   52   HD13  LEU   6          HD13      LEU   6  51.397   6.028  11.632
   53   HD21  LEU   6          HD21      LEU   6  53.546   7.227  10.118
   54   HD22  LEU   6          HD22      LEU   6  51.965   8.026  10.274
   55   HD23  LEU   6          HD23      LEU   6  52.697   7.809   8.669
   56    H    GLU   7           HN       GLU   7  53.370   6.201   5.310
   57    HA   GLU   7           HA       GLU   7  52.392   8.927   5.878
   58    HB2  GLU   7           HB2      GLU   7  54.795   8.120   5.127
   59    HB3  GLU   7           HB1      GLU   7  54.107   8.180   3.492
   60    HG2  GLU   7           HG2      GLU   7  55.079  10.337   3.853
   61    HG3  GLU   7           HG1      GLU   7  53.327  10.568   4.063
   62    H    ARG   8           HN       ARG   8  50.695   6.606   4.683
   63    HA   ARG   8           HA       ARG   8  50.016   7.473   2.003
   64    HB2  ARG   8           HB2      ARG   8  48.338   5.879   3.981
   65    HB3  ARG   8           HB1      ARG   8  48.122   5.952   2.215
   66    HG2  ARG   8           HG2      ARG   8  50.505   5.067   1.996
   67    HG3  ARG   8           HG1      ARG   8  50.472   4.770   3.751
   68    HD2  ARG   8           HD2      ARG   8  48.726   3.520   1.599
   69    HD3  ARG   8           HD1      ARG   8  49.809   2.703   2.753
   70    HE   ARG   8           HE       ARG   8  47.947   4.026   4.355
   71   HH11  ARG   8          HH11      ARG   8  48.048   1.598   1.916
   72   HH12  ARG   8          HH12      ARG   8  46.525   0.902   2.356
   73   HH21  ARG   8          HH21      ARG   8  45.893   3.207   4.867
   74   HH22  ARG   8          HH22      ARG   8  45.305   1.812   4.027
   75    H    ILE   9           HN       ILE   9  47.519   7.921   1.613
   76    HA   ILE   9           HA       ILE   9  46.181   9.580   3.561
   77    HB   ILE   9           HB       ILE   9  48.043  11.146   2.938
   78   HG12  ILE   9          HG12      ILE   9  45.289  11.994   1.923
   79   HG13  ILE   9          HG11      ILE   9  45.769  11.944   3.635
   80   HG21  ILE   9          HG21      ILE   9  46.739  11.274   0.190
   81   HG22  ILE   9          HG22      ILE   9  48.138  10.226   0.524
   82   HG23  ILE   9          HG23      ILE   9  48.281  11.988   0.717
   83   HD11  ILE   9           HD1      ILE   9  46.100  14.211   2.968
   84   HD12  ILE   9           HD2      ILE   9  46.850  13.733   1.427
   85   HD13  ILE   9           HD3      ILE   9  47.728  13.494   2.958
   86    H    GLY  10           HN       GLY  10  44.084   9.603   3.085
   87    HA2  GLY  10           HA1      GLY  10  43.058   9.909   0.417
   88    HA3  GLY  10           HA2      GLY  10  43.025   8.198   0.887
   89    H    LYS  11           HN       LYS  11  42.792  10.457   3.467
   90    HA   LYS  11           HA       LYS  11  40.185   9.499   4.227
   91    HB2  LYS  11           HB2      LYS  11  41.822  11.902   5.121
   92    HB3  LYS  11           HB1      LYS  11  40.292  11.409   5.886
   93    HG2  LYS  11           HG2      LYS  11  41.296   9.131   6.288
   94    HG3  LYS  11           HG1      LYS  11  42.845   9.752   5.668
   95    HD2  LYS  11           HD2      LYS  11  42.951  11.421   7.436
   96    HD3  LYS  11           HD1      LYS  11  41.317  10.990   7.997
   97    HE2  LYS  11           HE2      LYS  11  42.113   8.700   8.537
   98    HE3  LYS  11           HE1      LYS  11  43.749   9.148   7.998
   99    HZ1  LYS  11           HZ1      LYS  11  42.479   9.652  10.491
  100    HZ2  LYS  11           HZ2      LYS  11  42.956  11.116   9.772
  101    HZ3  LYS  11           HZ3      LYS  11  44.098   9.889  10.047
  102    H    ALA  12           HN       ALA  12  41.024  11.546   1.715
  103    HA   ALA  12           HA       ALA  12  39.798  13.052   0.465
  104    HB1  ALA  12           HB1      ALA  12  37.471  12.678   0.269
  105    HB2  ALA  12           HB2      ALA  12  37.324  12.122   1.952
  106    HB3  ALA  12           HB3      ALA  12  38.127  11.096   0.742
  107    H    GLY  13           HN       GLY  13  41.105  14.392   2.164
  108    HA2  GLY  13           HA1      GLY  13  39.969  15.641   4.370
  109    HA3  GLY  13           HA2      GLY  13  41.117  16.430   3.270
  110    H    PHE  14           HN       PHE  14  37.725  15.859   4.027
  111    HA   PHE  14           HA       PHE  14  35.843  17.127   3.563
  112    HB2  PHE  14           HB2      PHE  14  37.456  19.014   4.286
  113    HB3  PHE  14           HB1      PHE  14  37.654  19.355   2.552
  114    HD1  PHE  14           HD1      PHE  14  35.975  20.562   1.342
  115    HD2  PHE  14           HD2      PHE  14  35.104  19.037   5.285
  116    HE1  PHE  14           HE1      PHE  14  33.833  21.834   1.361
  117    HE2  PHE  14           HE2      PHE  14  32.963  20.310   5.304
  118    HZ   PHE  14           HZ       PHE  14  32.359  21.758   3.368
  119    H    ILE  15           HN       ILE  15  36.860  15.307   1.647
  120    HA   ILE  15           HA       ILE  15  36.508  14.676  -0.530
  121    HB   ILE  15           HB       ILE  15  34.714  17.120  -0.785
  122   HG12  ILE  15          HG12      ILE  15  34.043  15.962   1.235
  123   HG13  ILE  15          HG11      ILE  15  32.866  15.558  -0.032
  124   HG21  ILE  15          HG21      ILE  15  33.462  15.256  -2.264
  125   HG22  ILE  15          HG22      ILE  15  35.099  14.573  -2.373
  126   HG23  ILE  15          HG23      ILE  15  34.788  16.229  -2.932
  127   HD11  ILE  15           HD1      ILE  15  34.372  13.462  -0.458
  128   HD12  ILE  15           HD2      ILE  15  33.339  13.471   0.988
  129   HD13  ILE  15           HD3      ILE  15  35.075  13.831   1.134
  130    H    ILE  16           HN       ILE  16  38.784  15.293  -0.726
  131    HA   ILE  16           HA       ILE  16  39.052  17.358  -2.901
  132    HB   ILE  16           HB       ILE  16  40.976  16.926  -0.579
  133   HG12  ILE  16          HG12      ILE  16  38.781  18.290  -0.173
  134   HG13  ILE  16          HG11      ILE  16  40.320  19.018   0.312
  135   HG21  ILE  16          HG21      ILE  16  42.239  17.430  -2.577
  136   HG22  ILE  16          HG22      ILE  16  42.148  18.936  -1.640
  137   HG23  ILE  16          HG23      ILE  16  41.096  18.702  -3.056
  138   HD11  ILE  16           HD1      ILE  16  39.001  19.592  -2.379
  139   HD12  ILE  16           HD2      ILE  16  40.347  20.465  -1.616
  140   HD13  ILE  16           HD3      ILE  16  38.713  20.566  -0.923
  141    H    ILE  17           HN       ILE  17  40.733  14.725  -1.099
  142    HA   ILE  17           HA       ILE  17  42.352  14.019  -3.412
  143    HB   ILE  17           HB       ILE  17  41.709  12.530  -0.820
  144   HG12  ILE  17          HG12      ILE  17  44.092  13.018  -0.326
  145   HG13  ILE  17          HG11      ILE  17  44.247  13.853  -1.889
  146   HG21  ILE  17          HG21      ILE  17  42.129  10.780  -2.405
  147   HG22  ILE  17          HG22      ILE  17  43.681  11.042  -1.576
  148   HG23  ILE  17          HG23      ILE  17  43.417  11.712  -3.204
  149   HD11  ILE  17           HD1      ILE  17  42.882  15.651  -1.207
  150   HD12  ILE  17           HD2      ILE  17  43.789  15.278   0.274
  151   HD13  ILE  17           HD3      ILE  17  42.111  14.712   0.092
  152    H    GLY  18           HN       GLY  18  39.495  12.591  -1.789
  153    HA2  GLY  18           HA1      GLY  18  39.085  10.616  -3.874
  154    HA3  GLY  18           HA2      GLY  18  37.949  11.049  -2.578
  155    H    GLY  19           HN       GLY  19  37.687  13.798  -3.050
  156    HA2  GLY  19           HA1      GLY  19  35.672  13.797  -5.067
  157    HA3  GLY  19           HA2      GLY  19  36.400  15.232  -4.323
  158    H    ALA  20           HN       ALA  20  39.054  15.005  -5.108
  159    HA   ALA  20           HA       ALA  20  38.840  15.986  -7.832
  160    HB1  ALA  20           HB1      ALA  20  41.254  16.249  -7.705
  161    HB2  ALA  20           HB2      ALA  20  41.320  15.214  -6.260
  162    HB3  ALA  20           HB3      ALA  20  40.514  16.800  -6.185
  163    H    LEU  21           HN       LEU  21  39.171  12.853  -6.461
  164    HA   LEU  21           HA       LEU  21  39.661  10.785  -7.407
  165    HB2  LEU  21           HB2      LEU  21  38.772  12.191  -9.957
  166    HB3  LEU  21           HB1      LEU  21  38.842  10.434  -9.705
  167    HG   LEU  21           HG       LEU  21  37.185  12.227  -7.880
  168   HD11  LEU  21          HD11      LEU  21  36.284  10.886 -10.468
  169   HD12  LEU  21          HD12      LEU  21  36.444  12.639 -10.206
  170   HD13  LEU  21          HD13      LEU  21  35.225  11.710  -9.301
  171   HD21  LEU  21          HD21      LEU  21  37.513   9.972  -7.034
  172   HD22  LEU  21          HD22      LEU  21  37.138   9.263  -8.622
  173   HD23  LEU  21          HD23      LEU  21  35.861  10.063  -7.680
  174    H    ASP  22           HN       ASP  22  41.937  11.172  -6.937
  175    HA   ASP  22           HA       ASP  22  44.179  11.414  -7.534
  176    HB2  ASP  22           HB2      ASP  22  44.871   9.910  -9.315
  177    HB3  ASP  22           HB1      ASP  22  43.545   9.156  -8.400
  178    H    HIS  23           HN       HIS  23  42.481  13.644  -8.366
  179    HA   HIS  23           HA       HIS  23  42.662  15.550  -9.670
  180    HB2  HIS  23           HB2      HIS  23  45.411  14.578 -10.517
  181    HB3  HIS  23           HB1      HIS  23  44.838  16.252 -10.310
  182    HD1  HIS  23           HD1      HIS  23  46.433  13.431  -8.521
  183    HD2  HIS  23           HD2      HIS  23  44.273  16.878  -7.455
  184    HE1  HIS  23           HE1      HIS  23  46.877  13.873  -6.044
  185    H    LEU  24           HN       LEU  24  41.054  13.994 -10.910
  186    HA   LEU  24           HA       LEU  24  41.539  14.487 -13.709
  187    HB2  LEU  24           HB2      LEU  24  43.029  12.592 -13.634
  188    HB3  LEU  24           HB1      LEU  24  41.860  11.633 -12.703
  189    HG   LEU  24           HG       LEU  24  40.360  11.475 -14.601
  190   HD11  LEU  24          HD11      LEU  24  42.219  13.546 -15.835
  191   HD12  LEU  24          HD12      LEU  24  40.454  13.633 -15.615
  192   HD13  LEU  24          HD13      LEU  24  41.144  12.539 -16.834
  193   HD21  LEU  24          HD21      LEU  24  41.817  10.325 -16.244
  194   HD22  LEU  24          HD22      LEU  24  42.287   9.919 -14.577
  195   HD23  LEU  24          HD23      LEU  24  43.247  11.091 -15.512
  Start of MODEL   27
    1    H1   GLY   1           HT1      GLY   1  56.996   1.110  13.083
    2    H2   GLY   1           HT2      GLY   1  56.450   0.646  14.625
    3    H3   GLY   1           HT3      GLY   1  57.618   1.871  14.464
    4    HA2  GLY   1           HA1      GLY   1  54.757   1.957  14.167
    5    HA3  GLY   1           HA2      GLY   1  55.892   3.202  14.725
    6    H    LYS   2           HN       LYS   2  57.677   2.956  12.435
    7    HA   LYS   2           HA       LYS   2  56.214   4.751  10.636
    8    HB2  LYS   2           HB2      LYS   2  59.009   3.556  10.469
    9    HB3  LYS   2           HB1      LYS   2  58.371   4.837   9.409
   10    HG2  LYS   2           HG2      LYS   2  57.881   6.171  11.553
   11    HG3  LYS   2           HG1      LYS   2  58.870   4.967  12.411
   12    HD2  LYS   2           HD2      LYS   2  59.768   6.740  10.096
   13    HD3  LYS   2           HD1      LYS   2  60.268   6.885  11.797
   14    HE2  LYS   2           HE2      LYS   2  60.960   4.709   9.796
   15    HE3  LYS   2           HE1      LYS   2  62.056   5.702  10.784
   16    HZ1  LYS   2           HZ1      LYS   2  62.052   3.806  12.008
   17    HZ2  LYS   2           HZ2      LYS   2  60.488   3.341  11.530
   18    HZ3  LYS   2           HZ3      LYS   2  60.697   4.546  12.710
   19    H    GLY   3           HN       GLY   3  54.802   2.441  10.607
   20    HA2  GLY   3           HA1      GLY   3  55.463   0.399   8.757
   21    HA3  GLY   3           HA2      GLY   3  53.771   1.051   8.944
   22    H    ARG   4           HN       ARG   4  53.457   2.982   8.620
   23    HA   ARG   4           HA       ARG   4  52.660   2.035   6.537
   24    HB2  ARG   4           HB2      ARG   4  52.356   4.996   7.225
   25    HB3  ARG   4           HB1      ARG   4  51.379   4.175   5.981
   26    HG2  ARG   4           HG2      ARG   4  50.522   2.588   7.625
   27    HG3  ARG   4           HG1      ARG   4  51.601   3.244   8.878
   28    HD2  ARG   4           HD2      ARG   4  49.462   4.874   7.443
   29    HD3  ARG   4           HD1      ARG   4  49.232   4.102   9.030
   30    HE   ARG   4           HE       ARG   4  50.655   6.567   8.560
   31   HH11  ARG   4          HH11      ARG   4  49.507   6.083  11.181
   32   HH12  ARG   4          HH12      ARG   4  50.876   5.685  12.167
   33   HH21  ARG   4          HH21      ARG   4  52.950   4.997   9.475
   34   HH22  ARG   4          HH22      ARG   4  52.825   5.070  11.201
   35    H    TRP   5           HN       TRP   5  55.428   3.591   6.861
   36    HA   TRP   5           HA       TRP   5  56.069   5.259   4.729
   37    HB2  TRP   5           HB2      TRP   5  57.651   4.371   6.501
   38    HB3  TRP   5           HB1      TRP   5  57.807   2.889   5.527
   39    HD1  TRP   5           HD1      TRP   5  59.555   2.927   3.673
   40    HE1  TRP   5           HE1      TRP   5  61.020   4.725   2.501
   41    HE3  TRP   5           HE3      TRP   5  57.529   7.124   5.792
   42    HZ2  TRP   5           HZ2      TRP   5  61.255   7.596   2.503
   43    HZ3  TRP   5           HZ3      TRP   5  58.388   9.382   5.192
   44    HH2  TRP   5           HH2      TRP   5  60.248   9.622   3.551
   45    H    LEU   6           HN       LEU   6  55.017   1.979   4.557
   46    HA   LEU   6           HA       LEU   6  55.612   1.892   1.601
   47    HB2  LEU   6           HB2      LEU   6  55.143  -0.511   3.406
   48    HB3  LEU   6           HB1      LEU   6  55.791  -0.484   1.749
   49    HG   LEU   6           HG       LEU   6  57.165   0.737   4.189
   50   HD11  LEU   6          HD11      LEU   6  58.689  -1.158   4.051
   51   HD12  LEU   6          HD12      LEU   6  57.858  -1.772   2.601
   52   HD13  LEU   6          HD13      LEU   6  57.025  -1.778   4.175
   53   HD21  LEU   6          HD21      LEU   6  57.876   1.940   2.242
   54   HD22  LEU   6          HD22      LEU   6  57.909   0.467   1.246
   55   HD23  LEU   6          HD23      LEU   6  59.136   0.716   2.510
   56    H    GLU   7           HN       GLU   7  53.185   1.968   4.109
   57    HA   GLU   7           HA       GLU   7  51.134   0.688   2.379
   58    HB2  GLU   7           HB2      GLU   7  51.309   0.501   4.958
   59    HB3  GLU   7           HB1      GLU   7  50.663   2.156   4.999
   60    HG2  GLU   7           HG2      GLU   7  48.664   1.439   3.755
   61    HG3  GLU   7           HG1      GLU   7  49.322  -0.208   3.607
   62    H    ARG   8           HN       ARG   8  52.623   3.682   2.604
   63    HA   ARG   8           HA       ARG   8  52.097   5.751   1.719
   64    HB2  ARG   8           HB2      ARG   8  51.312   4.148  -0.184
   65    HB3  ARG   8           HB1      ARG   8  49.669   4.502   0.386
   66    HG2  ARG   8           HG2      ARG   8  49.927   6.183  -1.228
   67    HG3  ARG   8           HG1      ARG   8  50.483   7.045   0.223
   68    HD2  ARG   8           HD2      ARG   8  52.832   6.549  -0.356
   69    HD3  ARG   8           HD1      ARG   8  52.301   5.600  -1.765
   70    HE   ARG   8           HE       ARG   8  51.180   8.206  -1.997
   71   HH11  ARG   8          HH11      ARG   8  52.378   9.946  -2.886
   72   HH12  ARG   8          HH12      ARG   8  53.957   9.625  -3.519
   73   HH21  ARG   8          HH21      ARG   8  54.022   6.337  -2.422
   74   HH22  ARG   8          HH22      ARG   8  54.888   7.582  -3.257
   75    H    ILE   9           HN       ILE   9  48.996   6.102   1.025
   76    HA   ILE   9           HA       ILE   9  47.793   6.221   3.679
   77    HB   ILE   9           HB       ILE   9  49.356   8.207   3.736
   78   HG12  ILE   9          HG12      ILE   9  46.372   8.852   3.707
   79   HG13  ILE   9          HG11      ILE   9  47.246   8.095   5.059
   80   HG21  ILE   9          HG21      ILE   9  47.491   9.495   1.707
   81   HG22  ILE   9          HG22      ILE   9  48.972   8.652   1.191
   82   HG23  ILE   9          HG23      ILE   9  49.081  10.055   2.278
   83   HD11  ILE   9           HD1      ILE   9  47.141  10.430   5.584
   84   HD12  ILE   9           HD2      ILE   9  47.605  10.898   3.931
   85   HD13  ILE   9           HD3      ILE   9  48.801  10.143   5.013
   86    H    GLY  10           HN       GLY  10  45.713   5.848   3.377
   87    HA2  GLY  10           HA1      GLY  10  44.558   6.153   0.686
   88    HA3  GLY  10           HA2      GLY  10  43.786   5.431   2.111
   89    H    LYS  11           HN       LYS  11  45.301   8.592   2.261
   90    HA   LYS  11           HA       LYS  11  42.585   9.793   2.712
   91    HB2  LYS  11           HB2      LYS  11  44.425   9.985   4.457
   92    HB3  LYS  11           HB1      LYS  11  45.310  11.009   3.300
   93    HG2  LYS  11           HG2      LYS  11  43.292  12.511   3.167
   94    HG3  LYS  11           HG1      LYS  11  42.526  11.538   4.440
   95    HD2  LYS  11           HD2      LYS  11  45.279  12.770   4.864
   96    HD3  LYS  11           HD1      LYS  11  43.804  13.723   5.130
   97    HE2  LYS  11           HE2      LYS  11  44.520  11.095   6.511
   98    HE3  LYS  11           HE1      LYS  11  44.533  12.713   7.245
   99    HZ1  LYS  11           HZ1      LYS  11  42.356  10.940   6.899
  100    HZ2  LYS  11           HZ2      LYS  11  42.039  12.388   6.068
  101    HZ3  LYS  11           HZ3      LYS  11  42.405  12.420   7.727
  102    H    ALA  12           HN       ALA  12  41.789  10.337   0.741
  103    HA   ALA  12           HA       ALA  12  43.519  11.578  -1.292
  104    HB1  ALA  12           HB1      ALA  12  41.774  10.151  -2.086
  105    HB2  ALA  12           HB2      ALA  12  41.292  11.815  -2.492
  106    HB3  ALA  12           HB3      ALA  12  40.550  10.987  -1.103
  107    H    GLY  13           HN       GLY  13  43.950  13.161   0.744
  108    HA2  GLY  13           HA1      GLY  13  43.737  15.324   1.544
  109    HA3  GLY  13           HA2      GLY  13  43.157  15.721  -0.087
  110    H    PHE  14           HN       PHE  14  41.794  13.721   2.556
  111    HA   PHE  14           HA       PHE  14  39.721  13.810   3.581
  112    HB2  PHE  14           HB2      PHE  14  40.647  16.079   4.263
  113    HB3  PHE  14           HB1      PHE  14  39.722  16.778   2.913
  114    HD1  PHE  14           HD1      PHE  14  37.422  17.312   3.198
  115    HD2  PHE  14           HD2      PHE  14  39.344  14.616   5.969
  116    HE1  PHE  14           HE1      PHE  14  35.376  17.313   4.620
  117    HE2  PHE  14           HE2      PHE  14  37.298  14.617   7.390
  118    HZ   PHE  14           HZ       PHE  14  35.283  15.891   6.664
  119    H    ILE  15           HN       ILE  15  39.700  12.957   0.952
  120    HA   ILE  15           HA       ILE  15  38.226  12.555  -0.766
  121    HB   ILE  15           HB       ILE  15  36.109  14.081   0.797
  122   HG12  ILE  15          HG12      ILE  15  37.101  11.215   1.149
  123   HG13  ILE  15          HG11      ILE  15  37.190  12.520   2.353
  124   HG21  ILE  15          HG21      ILE  15  34.563  12.660  -0.368
  125   HG22  ILE  15          HG22      ILE  15  35.872  11.609  -0.961
  126   HG23  ILE  15          HG23      ILE  15  35.703  13.265  -1.589
  127   HD11  ILE  15           HD1      ILE  15  34.590  12.642   2.099
  128   HD12  ILE  15           HD2      ILE  15  35.282  11.282   3.015
  129   HD13  ILE  15           HD3      ILE  15  34.742  11.040   1.338
  130    H    ILE  16           HN       ILE  16  39.751  14.180  -1.727
  131    HA   ILE  16           HA       ILE  16  38.115  16.398  -2.918
  132    HB   ILE  16           HB       ILE  16  40.986  16.573  -1.891
  133   HG12  ILE  16          HG12      ILE  16  38.937  16.944  -0.304
  134   HG13  ILE  16          HG11      ILE  16  40.228  18.159  -0.314
  135   HG21  ILE  16          HG21      ILE  16  39.406  18.461  -3.682
  136   HG22  ILE  16          HG22      ILE  16  40.983  17.704  -4.008
  137   HG23  ILE  16          HG23      ILE  16  40.846  18.971  -2.770
  138   HD11  ILE  16           HD1      ILE  16  37.837  19.071  -0.365
  139   HD12  ILE  16           HD2      ILE  16  37.716  18.445  -2.021
  140   HD13  ILE  16           HD3      ILE  16  38.923  19.687  -1.627
  141    H    ILE  17           HN       ILE  17  41.419  14.980  -3.167
  142    HA   ILE  17           HA       ILE  17  41.326  15.145  -6.067
  143    HB   ILE  17           HB       ILE  17  43.496  15.200  -4.895
  144   HG12  ILE  17          HG12      ILE  17  44.720  13.530  -6.200
  145   HG13  ILE  17          HG11      ILE  17  43.248  12.568  -6.438
  146   HG21  ILE  17          HG21      ILE  17  44.329  13.337  -3.613
  147   HG22  ILE  17          HG22      ILE  17  42.961  12.310  -4.101
  148   HG23  ILE  17          HG23      ILE  17  42.693  13.689  -3.010
  149   HD11  ILE  17           HD1      ILE  17  43.341  15.464  -7.351
  150   HD12  ILE  17           HD2      ILE  17  42.315  14.134  -7.943
  151   HD13  ILE  17           HD3      ILE  17  44.043  14.178  -8.361
  152    H    GLY  18           HN       GLY  18  40.257  12.931  -3.648
  153    HA2  GLY  18           HA1      GLY  18  40.075  10.628  -5.497
  154    HA3  GLY  18           HA2      GLY  18  39.607  10.673  -3.786
  155    H    GLY  19           HN       GLY  19  37.891  12.853  -3.711
  156    HA2  GLY  19           HA1      GLY  19  35.509  11.623  -4.861
  157    HA3  GLY  19           HA2      GLY  19  35.588  13.132  -3.934
  158    H    ALA  20           HN       ALA  20  37.460  14.530  -5.559
  159    HA   ALA  20           HA       ALA  20  35.720  15.777  -7.393
  160    HB1  ALA  20           HB1      ALA  20  37.760  16.837  -6.601
  161    HB2  ALA  20           HB2      ALA  20  37.772  16.766  -8.379
  162    HB3  ALA  20           HB3      ALA  20  38.751  15.618  -7.436
  163    H    LEU  21           HN       LEU  21  38.641  14.032  -8.511
  164    HA   LEU  21           HA       LEU  21  38.979  12.749 -10.415
  165    HB2  LEU  21           HB2      LEU  21  36.019  12.064 -10.305
  166    HB3  LEU  21           HB1      LEU  21  37.344  11.099 -10.995
  167    HG   LEU  21           HG       LEU  21  37.031  11.805  -8.045
  168   HD11  LEU  21          HD11      LEU  21  36.664   9.139  -9.479
  169   HD12  LEU  21          HD12      LEU  21  35.330  10.191  -8.948
  170   HD13  LEU  21          HD13      LEU  21  36.419   9.460  -7.746
  171   HD21  LEU  21          HD21      LEU  21  39.091  10.227  -9.640
  172   HD22  LEU  21          HD22      LEU  21  38.827   9.912  -7.909
  173   HD23  LEU  21          HD23      LEU  21  39.363  11.519  -8.447
  174    H    ASP  22           HN       ASP  22  37.606  15.571 -10.407
  175    HA   ASP  22           HA       ASP  22  36.169  15.632 -12.940
  176    HB2  ASP  22           HB2      ASP  22  37.400  17.810 -11.209
  177    HB3  ASP  22           HB1      ASP  22  36.436  18.125 -12.673
  178    H    HIS  23           HN       HIS  23  38.966  17.697 -12.213
  179    HA   HIS  23           HA       HIS  23  40.575  16.510 -14.384
  180    HB2  HIS  23           HB2      HIS  23  39.487  19.345 -14.634
  181    HB3  HIS  23           HB1      HIS  23  40.680  18.582 -15.713
  182    HD1  HIS  23           HD1      HIS  23  39.771  16.171 -16.801
  183    HD2  HIS  23           HD2      HIS  23  36.901  18.964 -15.512
  184    HE1  HIS  23           HE1      HIS  23  37.560  15.569 -17.934
  185    H    LEU  24           HN       LEU  24  41.345  16.461 -11.874
  186    HA   LEU  24           HA       LEU  24  43.683  18.186 -11.874
  187    HB2  LEU  24           HB2      LEU  24  41.629  19.588 -10.956
  188    HB3  LEU  24           HB1      LEU  24  41.882  18.642  -9.475
  189    HG   LEU  24           HG       LEU  24  43.942  20.397 -10.890
  190   HD11  LEU  24          HD11      LEU  24  42.638  20.622  -8.141
  191   HD12  LEU  24          HD12      LEU  24  42.167  21.575  -9.569
  192   HD13  LEU  24          HD13      LEU  24  43.790  21.769  -8.864
  193   HD21  LEU  24          HD21      LEU  24  45.276  19.841  -8.730
  194   HD22  LEU  24          HD22      LEU  24  45.187  18.576  -9.977
  195   HD23  LEU  24          HD23      LEU  24  44.148  18.478  -8.533
  Start of MODEL   28
    1    H1   GLY   1           HT1      GLY   1  56.928  -3.698  11.410
    2    H2   GLY   1           HT2      GLY   1  57.808  -2.333  11.912
    3    H3   GLY   1           HT3      GLY   1  58.602  -3.813  11.649
    4    HA2  GLY   1           HA1      GLY   1  59.074  -2.454   9.831
    5    HA3  GLY   1           HA2      GLY   1  57.932  -3.711   9.315
    6    H    LYS   2           HN       LYS   2  58.145  -0.343  10.485
    7    HA   LYS   2           HA       LYS   2  55.434   0.285   9.576
    8    HB2  LYS   2           HB2      LYS   2  57.636   2.281  10.196
    9    HB3  LYS   2           HB1      LYS   2  55.875   2.488  10.349
   10    HG2  LYS   2           HG2      LYS   2  57.627   0.629  12.020
   11    HG3  LYS   2           HG1      LYS   2  56.872   2.144  12.568
   12    HD2  LYS   2           HD2      LYS   2  54.616   1.065  11.881
   13    HD3  LYS   2           HD1      LYS   2  55.516  -0.470  11.800
   14    HE2  LYS   2           HE2      LYS   2  54.529  -0.279  14.016
   15    HE3  LYS   2           HE1      LYS   2  56.291  -0.070  14.166
   16    HZ1  LYS   2           HZ1      LYS   2  55.423   2.450  13.712
   17    HZ2  LYS   2           HZ2      LYS   2  55.754   1.795  15.245
   18    HZ3  LYS   2           HZ3      LYS   2  54.161   1.818  14.654
   19    H    GLY   3           HN       GLY   3  56.142  -0.795   7.399
   20    HA2  GLY   3           HA1      GLY   3  57.773   0.374   5.448
   21    HA3  GLY   3           HA2      GLY   3  56.109  -0.263   5.052
   22    H    ARG   4           HN       ARG   4  54.549   0.570   5.999
   23    HA   ARG   4           HA       ARG   4  54.404   1.626   3.823
   24    HB2  ARG   4           HB2      ARG   4  52.259   2.013   5.968
   25    HB3  ARG   4           HB1      ARG   4  51.981   2.288   4.231
   26    HG2  ARG   4           HG2      ARG   4  52.687  -0.045   3.752
   27    HG3  ARG   4           HG1      ARG   4  52.946  -0.320   5.492
   28    HD2  ARG   4           HD2      ARG   4  50.527   0.275   5.884
   29    HD3  ARG   4           HD1      ARG   4  50.308   0.354   4.120
   30    HE   ARG   4           HE       ARG   4  51.478  -2.171   4.783
   31   HH11  ARG   4          HH11      ARG   4  49.787  -2.813   6.822
   32   HH12  ARG   4          HH12      ARG   4  48.229  -3.120   6.132
   33   HH21  ARG   4          HH21      ARG   4  48.938  -1.500   3.148
   34   HH22  ARG   4          HH22      ARG   4  47.747  -2.377   4.052
   35    H    TRP   5           HN       TRP   5  55.465   3.081   6.449
   36    HA   TRP   5           HA       TRP   5  54.640   5.723   6.724
   37    HB2  TRP   5           HB2      TRP   5  56.579   4.605   7.913
   38    HB3  TRP   5           HB1      TRP   5  57.577   4.959   6.483
   39    HD1  TRP   5           HD1      TRP   5  58.692   7.249   6.432
   40    HE1  TRP   5           HE1      TRP   5  58.459   9.493   7.727
   41    HE3  TRP   5           HE3      TRP   5  54.561   6.132   9.244
   42    HZ2  TRP   5           HZ2      TRP   5  56.702  10.617   9.713
   43    HZ3  TRP   5           HZ3      TRP   5  53.625   7.805  10.833
   44    HH2  TRP   5           HH2      TRP   5  54.690  10.045  11.069
   45    H    LEU   6           HN       LEU   6  55.978   4.267   3.899
   46    HA   LEU   6           HA       LEU   6  56.231   6.963   2.567
   47    HB2  LEU   6           HB2      LEU   6  57.544   4.364   1.692
   48    HB3  LEU   6           HB1      LEU   6  57.864   6.007   1.094
   49    HG   LEU   6           HG       LEU   6  58.384   5.052   3.947
   50   HD11  LEU   6          HD11      LEU   6  60.369   5.688   1.725
   51   HD12  LEU   6          HD12      LEU   6  59.856   4.038   2.156
   52   HD13  LEU   6          HD13      LEU   6  60.733   5.037   3.341
   53   HD21  LEU   6          HD21      LEU   6  58.823   7.683   2.474
   54   HD22  LEU   6          HD22      LEU   6  59.773   7.253   3.917
   55   HD23  LEU   6          HD23      LEU   6  58.007   7.409   4.031
   56    H    GLU   7           HN       GLU   7  54.569   3.883   2.684
   57    HA   GLU   7           HA       GLU   7  53.604   4.150  -0.121
   58    HB2  GLU   7           HB2      GLU   7  52.898   2.148   2.062
   59    HB3  GLU   7           HB1      GLU   7  52.410   2.053   0.354
   60    HG2  GLU   7           HG2      GLU   7  55.319   2.191   1.254
   61    HG3  GLU   7           HG1      GLU   7  54.455   0.659   0.975
   62    H    ARG   8           HN       ARG   8  53.019   6.054   2.254
   63    HA   ARG   8           HA       ARG   8  50.310   5.832   3.026
   64    HB2  ARG   8           HB2      ARG   8  50.436   8.397   3.169
   65    HB3  ARG   8           HB1      ARG   8  51.654   7.485   4.094
   66    HG2  ARG   8           HG2      ARG   8  53.335   7.854   2.392
   67    HG3  ARG   8           HG1      ARG   8  52.131   8.548   1.281
   68    HD2  ARG   8           HD2      ARG   8  52.958   9.723   3.972
   69    HD3  ARG   8           HD1      ARG   8  53.444  10.337   2.373
   70    HE   ARG   8           HE       ARG   8  50.633  10.283   2.348
   71   HH11  ARG   8          HH11      ARG   8  49.331  11.702   3.671
   72   HH12  ARG   8          HH12      ARG   8  50.099  13.117   4.309
   73   HH21  ARG   8          HH21      ARG   8  53.291  12.122   3.394
   74   HH22  ARG   8          HH22      ARG   8  52.342  13.355   4.153
   75    H    ILE   9           HN       ILE   9  48.830   7.911   2.296
   76    HA   ILE   9           HA       ILE   9  48.717   8.094  -0.662
   77    HB   ILE   9           HB       ILE   9  46.179   7.466  -0.513
   78   HG12  ILE   9          HG12      ILE   9  47.098   5.714   1.810
   79   HG13  ILE   9          HG11      ILE   9  46.459   7.338   2.129
   80   HG21  ILE   9          HG21      ILE   9  48.278   5.269  -0.190
   81   HG22  ILE   9          HG22      ILE   9  47.928   6.136  -1.703
   82   HG23  ILE   9          HG23      ILE   9  46.687   5.102  -0.966
   83   HD11  ILE   9           HD1      ILE   9  44.394   6.734   0.825
   84   HD12  ILE   9           HD2      ILE   9  44.633   5.739   2.279
   85   HD13  ILE   9           HD3      ILE   9  45.021   5.076   0.677
   86    H    GLY  10           HN       GLY  10  48.269  10.098  -1.180
   87    HA2  GLY  10           HA1      GLY  10  47.546  12.044   0.814
   88    HA3  GLY  10           HA2      GLY  10  47.639  12.314  -0.937
   89    H    LYS  11           HN       LYS  11  45.670   9.723  -0.659
   90    HA   LYS  11           HA       LYS  11  43.280  11.328  -1.158
   91    HB2  LYS  11           HB2      LYS  11  43.568   8.321  -0.766
   92    HB3  LYS  11           HB1      LYS  11  42.183   9.171  -1.491
   93    HG2  LYS  11           HG2      LYS  11  43.538   9.932  -3.356
   94    HG3  LYS  11           HG1      LYS  11  45.023   9.313  -2.592
   95    HD2  LYS  11           HD2      LYS  11  44.269   7.021  -2.812
   96    HD3  LYS  11           HD1      LYS  11  42.657   7.551  -3.352
   97    HE2  LYS  11           HE2      LYS  11  44.195   6.806  -5.227
   98    HE3  LYS  11           HE1      LYS  11  43.567   8.462  -5.406
   99    HZ1  LYS  11           HZ1      LYS  11  46.067   8.177  -3.935
  100    HZ2  LYS  11           HZ2      LYS  11  45.590   9.361  -5.057
  101    HZ3  LYS  11           HZ3      LYS  11  46.145   7.848  -5.596
  102    H    ALA  12           HN       ALA  12  42.703  12.459   0.673
  103    HA   ALA  12           HA       ALA  12  42.740  11.422   3.319
  104    HB1  ALA  12           HB1      ALA  12  42.452  13.814   2.741
  105    HB2  ALA  12           HB2      ALA  12  41.189  13.234   3.853
  106    HB3  ALA  12           HB3      ALA  12  40.821  13.455   2.126
  107    H    GLY  13           HN       GLY  13  40.903  10.468   0.657
  108    HA2  GLY  13           HA1      GLY  13  39.104   9.028   0.454
  109    HA3  GLY  13           HA2      GLY  13  39.467   8.491   2.105
  110    H    PHE  14           HN       PHE  14  38.597  11.803   1.173
  111    HA   PHE  14           HA       PHE  14  35.839  11.415   2.270
  112    HB2  PHE  14           HB2      PHE  14  37.866  13.436   3.316
  113    HB3  PHE  14           HB1      PHE  14  36.122  13.502   3.652
  114    HD1  PHE  14           HD1      PHE  14  39.210  12.353   4.925
  115    HD2  PHE  14           HD2      PHE  14  35.091  11.127   4.473
  116    HE1  PHE  14           HE1      PHE  14  39.484  10.730   6.793
  117    HE2  PHE  14           HE2      PHE  14  35.373   9.504   6.338
  118    HZ   PHE  14           HZ       PHE  14  37.578   9.280   7.475
  119    H    ILE  15           HN       ILE  15  38.185  13.855   1.036
  120    HA   ILE  15           HA       ILE  15  36.289  14.564  -1.111
  121    HB   ILE  15           HB       ILE  15  36.463  17.056  -0.461
  122   HG12  ILE  15          HG12      ILE  15  37.147  15.808   2.242
  123   HG13  ILE  15          HG11      ILE  15  38.304  16.683   1.214
  124   HG21  ILE  15          HG21      ILE  15  34.504  16.953   0.937
  125   HG22  ILE  15          HG22      ILE  15  34.933  15.334   1.532
  126   HG23  ILE  15          HG23      ILE  15  34.410  15.554  -0.153
  127   HD11  ILE  15           HD1      ILE  15  35.872  17.765   2.675
  128   HD12  ILE  15           HD2      ILE  15  36.571  18.639   1.290
  129   HD13  ILE  15           HD3      ILE  15  37.555  18.333   2.740
  130    H    ILE  16           HN       ILE  16  38.433  13.379  -1.760
  131    HA   ILE  16           HA       ILE  16  40.274  15.541  -2.728
  132    HB   ILE  16           HB       ILE  16  41.001  12.907  -1.386
  133   HG12  ILE  16          HG12      ILE  16  40.697  15.162  -0.087
  134   HG13  ILE  16          HG11      ILE  16  42.146  14.191   0.226
  135   HG21  ILE  16          HG21      ILE  16  42.696  14.643  -3.224
  136   HG22  ILE  16          HG22      ILE  16  42.393  12.892  -3.323
  137   HG23  ILE  16          HG23      ILE  16  43.416  13.541  -2.024
  138   HD11  ILE  16           HD1      ILE  16  43.542  15.660  -1.038
  139   HD12  ILE  16           HD2      ILE  16  42.483  16.731  -0.098
  140   HD13  ILE  16           HD3      ILE  16  42.157  16.452  -1.819
  141    H    ILE  17           HN       ILE  17  39.016  12.218  -2.993
  142    HA   ILE  17           HA       ILE  17  39.925  12.097  -5.845
  143    HB   ILE  17           HB       ILE  17  38.860   9.681  -5.573
  144   HG12  ILE  17          HG12      ILE  17  38.892   8.855  -3.254
  145   HG13  ILE  17          HG11      ILE  17  39.343  10.468  -2.658
  146   HG21  ILE  17          HG21      ILE  17  41.395  10.587  -4.141
  147   HG22  ILE  17          HG22      ILE  17  41.255  10.030  -5.826
  148   HG23  ILE  17          HG23      ILE  17  40.991   8.889  -4.485
  149   HD11  ILE  17           HD1      ILE  17  36.808  10.028  -4.279
  150   HD12  ILE  17           HD2      ILE  17  37.220  11.390  -3.205
  151   HD13  ILE  17           HD3      ILE  17  36.842   9.796  -2.515
  152    H    GLY  18           HN       GLY  18  37.551  13.663  -4.496
  153    HA2  GLY  18           HA1      GLY  18  35.764  13.291  -6.774
  154    HA3  GLY  18           HA2      GLY  18  35.077  12.689  -5.253
  155    H    GLY  19           HN       GLY  19  35.963  14.499  -3.397
  156    HA2  GLY  19           HA1      GLY  19  34.114  16.615  -3.698
  157    HA3  GLY  19           HA2      GLY  19  35.465  16.591  -2.549
  158    H    ALA  20           HN       ALA  20  37.634  16.533  -4.313
  159    HA   ALA  20           HA       ALA  20  37.883  19.325  -4.914
  160    HB1  ALA  20           HB1      ALA  20  40.006  18.732  -5.900
  161    HB2  ALA  20           HB2      ALA  20  39.506  17.030  -6.063
  162    HB3  ALA  20           HB3      ALA  20  39.765  17.734  -4.449
  163    H    LEU  21           HN       LEU  21  37.548  16.475  -7.081
  164    HA   LEU  21           HA       LEU  21  36.707  16.327  -9.229
  165    HB2  LEU  21           HB2      LEU  21  34.817  17.670  -7.991
  166    HB3  LEU  21           HB1      LEU  21  35.429  19.060  -8.910
  167    HG   LEU  21           HG       LEU  21  35.232  17.387 -10.992
  168   HD11  LEU  21          HD11      LEU  21  33.234  16.233  -8.992
  169   HD12  LEU  21          HD12      LEU  21  34.625  15.381  -9.701
  170   HD13  LEU  21          HD13      LEU  21  33.262  15.870 -10.732
  171   HD21  LEU  21          HD21      LEU  21  33.945  19.472 -10.768
  172   HD22  LEU  21          HD22      LEU  21  32.819  18.680  -9.639
  173   HD23  LEU  21          HD23      LEU  21  32.883  18.163 -11.340
  174    H    ASP  22           HN       ASP  22  38.953  18.499  -8.244
  175    HA   ASP  22           HA       ASP  22  39.216  20.088 -10.693
  176    HB2  ASP  22           HB2      ASP  22  39.976  20.864  -8.431
  177    HB3  ASP  22           HB1      ASP  22  41.243  19.614  -8.474
  178    H    HIS  23           HN       HIS  23  39.006  17.686 -11.729
  179    HA   HIS  23           HA       HIS  23  40.070  16.104 -13.048
  180    HB2  HIS  23           HB2      HIS  23  40.980  18.218 -14.061
  181    HB3  HIS  23           HB1      HIS  23  42.402  18.057 -13.003
  182    HD1  HIS  23           HD1      HIS  23  44.192  16.355 -13.629
  183    HD2  HIS  23           HD2      HIS  23  40.759  16.114 -16.047
  184    HE1  HIS  23           HE1      HIS  23  44.722  14.751 -15.546
  185    H    LEU  24           HN       LEU  24  40.601  16.328  -9.997
  186    HA   LEU  24           HA       LEU  24  42.297  13.989  -9.870
  187    HB2  LEU  24           HB2      LEU  24  44.132  15.511 -10.242
  188    HB3  LEU  24           HB1      LEU  24  43.488  16.671  -9.060
  189    HG   LEU  24           HG       LEU  24  43.962  15.171  -7.214
  190   HD11  LEU  24          HD11      LEU  24  43.405  13.005  -8.042
  191   HD12  LEU  24          HD12      LEU  24  45.162  12.937  -7.776
  192   HD13  LEU  24          HD13      LEU  24  44.520  13.152  -9.422
  193   HD21  LEU  24          HD21      LEU  24  46.332  15.029  -9.125
  194   HD22  LEU  24          HD22      LEU  24  46.378  15.066  -7.347
  195   HD23  LEU  24          HD23      LEU  24  45.855  16.505  -8.254
  Start of MODEL   29
    1    H1   GLY   1           HT1      GLY   1  55.595  -3.759   5.229
    2    H2   GLY   1           HT2      GLY   1  54.176  -3.027   5.812
    3    H3   GLY   1           HT3      GLY   1  55.532  -2.077   5.425
    4    HA2  GLY   1           HA1      GLY   1  55.290  -3.064   3.112
    5    HA3  GLY   1           HA2      GLY   1  53.647  -3.449   3.663
    6    H    LYS   2           HN       LYS   2  53.969  -1.801   1.518
    7    HA   LYS   2           HA       LYS   2  54.063   0.999   2.286
    8    HB2  LYS   2           HB2      LYS   2  52.812  -0.240  -0.198
    9    HB3  LYS   2           HB1      LYS   2  53.374   1.438   0.006
   10    HG2  LYS   2           HG2      LYS   2  55.691   0.573   0.407
   11    HG3  LYS   2           HG1      LYS   2  55.103  -1.075   0.076
   12    HD2  LYS   2           HD2      LYS   2  54.415  -0.401  -2.190
   13    HD3  LYS   2           HD1      LYS   2  54.935   1.271  -1.867
   14    HE2  LYS   2           HE2      LYS   2  56.755  -1.177  -1.793
   15    HE3  LYS   2           HE1      LYS   2  56.659  -0.012  -3.136
   16    HZ1  LYS   2           HZ1      LYS   2  57.060   1.668  -1.156
   17    HZ2  LYS   2           HZ2      LYS   2  58.351   0.901  -1.954
   18    HZ3  LYS   2           HZ3      LYS   2  57.803   0.312  -0.458
   19    H    GLY   3           HN       GLY   3  51.606   1.509   0.497
   20    HA2  GLY   3           HA1      GLY   3  49.441   2.399   1.106
   21    HA3  GLY   3           HA2      GLY   3  49.187   0.656   1.640
   22    H    ARG   4           HN       ARG   4  50.633   3.438   1.770
   23    HA   ARG   4           HA       ARG   4  49.022   4.523   2.901
   24    HB2  ARG   4           HB2      ARG   4  50.498   3.367   5.240
   25    HB3  ARG   4           HB1      ARG   4  50.111   5.089   5.422
   26    HG2  ARG   4           HG2      ARG   4  47.672   3.789   4.532
   27    HG3  ARG   4           HG1      ARG   4  48.345   2.792   5.835
   28    HD2  ARG   4           HD2      ARG   4  47.941   5.803   6.055
   29    HD3  ARG   4           HD1      ARG   4  46.778   4.589   6.635
   30    HE   ARG   4           HE       ARG   4  49.190   5.371   7.998
   31   HH11  ARG   4          HH11      ARG   4  46.580   3.719   8.748
   32   HH12  ARG   4          HH12      ARG   4  47.341   2.313   9.418
   33   HH21  ARG   4          HH21      ARG   4  50.483   3.094   8.176
   34   HH22  ARG   4          HH22      ARG   4  49.550   1.959   9.093
   35    H    TRP   5           HN       TRP   5  52.108   4.095   2.163
   36    HA   TRP   5           HA       TRP   5  53.713   6.197   2.970
   37    HB2  TRP   5           HB2      TRP   5  54.292   4.430   1.261
   38    HB3  TRP   5           HB1      TRP   5  53.382   5.378   0.060
   39    HD1  TRP   5           HD1      TRP   5  56.126   6.170   2.702
   40    HE1  TRP   5           HE1      TRP   5  57.884   7.760   1.631
   41    HE3  TRP   5           HE3      TRP   5  54.045   6.658  -1.950
   42    HZ2  TRP   5           HZ2      TRP   5  58.298   9.053  -0.909
   43    HZ3  TRP   5           HZ3      TRP   5  55.138   8.075  -3.681
   44    HH2  TRP   5           HH2      TRP   5  57.261   9.272  -3.165
   45    H    LEU   6           HN       LEU   6  50.720   6.384   1.282
   46    HA   LEU   6           HA       LEU   6  51.151   9.295   0.645
   47    HB2  LEU   6           HB2      LEU   6  48.990   7.445  -0.426
   48    HB3  LEU   6           HB1      LEU   6  49.415   9.073  -1.002
   49    HG   LEU   6           HG       LEU   6  51.262   6.642  -1.099
   50   HD11  LEU   6          HD11      LEU   6  49.815   8.067  -3.372
   51   HD12  LEU   6          HD12      LEU   6  49.241   6.558  -2.622
   52   HD13  LEU   6          HD13      LEU   6  50.800   6.589  -3.482
   53   HD21  LEU   6          HD21      LEU   6  52.651   8.574  -1.008
   54   HD22  LEU   6          HD22      LEU   6  51.522   9.546  -1.984
   55   HD23  LEU   6          HD23      LEU   6  52.483   8.258  -2.749
   56    H    GLU   7           HN       GLU   7  49.453   7.001   2.694
   57    HA   GLU   7           HA       GLU   7  47.446   9.142   3.422
   58    HB2  GLU   7           HB2      GLU   7  47.516   6.124   3.768
   59    HB3  GLU   7           HB1      GLU   7  46.379   7.152   4.673
   60    HG2  GLU   7           HG2      GLU   7  45.364   6.266   2.578
   61    HG3  GLU   7           HG1      GLU   7  45.480   8.042   2.555
   62    H    ARG   8           HN       ARG   8  50.324   9.116   4.165
   63    HA   ARG   8           HA       ARG   8  50.874   8.208   6.742
   64    HB2  ARG   8           HB2      ARG   8  51.607  10.893   5.509
   65    HB3  ARG   8           HB1      ARG   8  52.380  10.183   6.948
   66    HG2  ARG   8           HG2      ARG   8  53.048   8.203   5.609
   67    HG3  ARG   8           HG1      ARG   8  52.288   8.925   4.169
   68    HD2  ARG   8           HD2      ARG   8  54.576  10.152   5.771
   69    HD3  ARG   8           HD1      ARG   8  54.731   9.346   4.193
   70    HE   ARG   8           HE       ARG   8  52.787  11.417   3.943
   71   HH11  ARG   8          HH11      ARG   8  53.747  12.664   2.148
   72   HH12  ARG   8          HH12      ARG   8  55.276  13.409   2.480
   73   HH21  ARG   8          HH21      ARG   8  55.803  11.636   5.413
   74   HH22  ARG   8          HH22      ARG   8  56.440  12.826   4.327
   75    H    ILE   9           HN       ILE   9  49.896  11.613   6.154
   76    HA   ILE   9           HA       ILE   9  49.150  12.104   8.852
   77    HB   ILE   9           HB       ILE   9  47.835  14.036   7.920
   78   HG12  ILE   9          HG12      ILE   9  48.672  12.788   5.260
   79   HG13  ILE   9          HG11      ILE   9  47.008  12.917   5.875
   80   HG21  ILE   9          HG21      ILE   9  50.384  14.021   8.264
   81   HG22  ILE   9          HG22      ILE   9  49.758  15.234   7.125
   82   HG23  ILE   9          HG23      ILE   9  50.521  13.747   6.511
   83   HD11  ILE   9           HD1      ILE   9  48.861  15.136   4.946
   84   HD12  ILE   9           HD2      ILE   9  47.474  15.483   6.009
   85   HD13  ILE   9           HD3      ILE   9  47.209  14.765   4.403
   86    H    GLY  10           HN       GLY  10  47.725  10.025   6.642
   87    HA2  GLY  10           HA1      GLY  10  45.659   8.986   6.545
   88    HA3  GLY  10           HA2      GLY  10  45.639   9.205   8.307
   89    H    LYS  11           HN       LYS  11  45.426  11.473   5.534
   90    HA   LYS  11           HA       LYS  11  42.619  12.035   6.030
   91    HB2  LYS  11           HB2      LYS  11  43.730  13.201   7.980
   92    HB3  LYS  11           HB1      LYS  11  44.579  14.229   6.800
   93    HG2  LYS  11           HG2      LYS  11  42.407  14.976   5.877
   94    HG3  LYS  11           HG1      LYS  11  41.552  13.944   7.048
   95    HD2  LYS  11           HD2      LYS  11  42.394  15.222   8.916
   96    HD3  LYS  11           HD1      LYS  11  43.513  16.125   7.866
   97    HE2  LYS  11           HE2      LYS  11  41.625  17.157   6.683
   98    HE3  LYS  11           HE1      LYS  11  40.472  16.201   7.646
   99    HZ1  LYS  11           HZ1      LYS  11  40.753  17.513   9.433
  100    HZ2  LYS  11           HZ2      LYS  11  41.284  18.661   8.299
  101    HZ3  LYS  11           HZ3      LYS  11  42.414  17.737   9.168
  102    H    ALA  12           HN       ALA  12  42.992  11.390   3.735
  103    HA   ALA  12           HA       ALA  12  44.360  13.317   2.002
  104    HB1  ALA  12           HB1      ALA  12  43.277  11.905   0.194
  105    HB2  ALA  12           HB2      ALA  12  42.572  10.919   1.497
  106    HB3  ALA  12           HB3      ALA  12  44.339  11.024   1.316
  107    H    GLY  13           HN       GLY  13  42.922  15.038   3.215
  108    HA2  GLY  13           HA1      GLY  13  41.146  16.529   3.119
  109    HA3  GLY  13           HA2      GLY  13  41.297  16.310   1.364
  110    H    PHE  14           HN       PHE  14  40.213  14.146   4.008
  111    HA   PHE  14           HA       PHE  14  38.232  12.993   4.289
  112    HB2  PHE  14           HB2      PHE  14  37.313  15.400   4.035
  113    HB3  PHE  14           HB1      PHE  14  36.888  14.936   2.372
  114    HD1  PHE  14           HD1      PHE  14  36.458  13.916   5.964
  115    HD2  PHE  14           HD2      PHE  14  34.901  13.684   1.944
  116    HE1  PHE  14           HE1      PHE  14  34.409  12.789   6.822
  117    HE2  PHE  14           HE2      PHE  14  32.852  12.557   2.804
  118    HZ   PHE  14           HZ       PHE  14  32.582  12.161   5.249
  119    H    ILE  15           HN       ILE  15  39.979  11.908   2.537
  120    HA   ILE  15           HA       ILE  15  40.161  10.481   0.725
  121    HB   ILE  15           HB       ILE  15  37.156  10.091   1.035
  122   HG12  ILE  15          HG12      ILE  15  38.022   9.884   3.261
  123   HG13  ILE  15          HG11      ILE  15  37.846   8.226   2.659
  124   HG21  ILE  15          HG21      ILE  15  37.933   7.669   0.413
  125   HG22  ILE  15          HG22      ILE  15  39.427   8.450  -0.149
  126   HG23  ILE  15          HG23      ILE  15  37.867   8.895  -0.870
  127   HD11  ILE  15           HD1      ILE  15  40.342   8.398   1.973
  128   HD12  ILE  15           HD2      ILE  15  39.985   8.281   3.708
  129   HD13  ILE  15           HD3      ILE  15  40.391   9.855   2.988
  130    H    ILE  16           HN       ILE  16  40.458  12.664  -0.383
  131    HA   ILE  16           HA       ILE  16  38.569  12.753  -2.725
  132    HB   ILE  16           HB       ILE  16  39.728  15.095  -1.153
  133   HG12  ILE  16          HG12      ILE  16  37.652  14.170  -0.210
  134   HG13  ILE  16          HG11      ILE  16  37.361  15.778  -0.902
  135   HG21  ILE  16          HG21      ILE  16  38.713  14.936  -3.993
  136   HG22  ILE  16          HG22      ILE  16  39.968  15.979  -3.289
  137   HG23  ILE  16          HG23      ILE  16  38.251  16.365  -3.035
  138   HD11  ILE  16           HD1      ILE  16  36.665  14.361  -3.069
  139   HD12  ILE  16           HD2      ILE  16  35.519  14.599  -1.739
  140   HD13  ILE  16           HD3      ILE  16  36.414  13.073  -1.873
  141    H    ILE  17           HN       ILE  17  41.651  14.225  -1.552
  142    HA   ILE  17           HA       ILE  17  42.775  14.204  -4.214
  143    HB   ILE  17           HB       ILE  17  43.642  15.763  -2.519
  144   HG12  ILE  17          HG12      ILE  17  46.042  15.395  -2.781
  145   HG13  ILE  17          HG11      ILE  17  45.792  13.670  -3.122
  146   HG21  ILE  17          HG21      ILE  17  44.767  15.022  -0.517
  147   HG22  ILE  17          HG22      ILE  17  44.711  13.323  -1.045
  148   HG23  ILE  17          HG23      ILE  17  43.210  14.165  -0.591
  149   HD11  ILE  17           HD1      ILE  17  44.470  15.784  -4.858
  150   HD12  ILE  17           HD2      ILE  17  44.876  14.097  -5.261
  151   HD13  ILE  17           HD3      ILE  17  46.164  15.317  -5.134
  152    H    GLY  18           HN       GLY  18  42.654  11.965  -1.518
  153    HA2  GLY  18           HA1      GLY  18  44.649  10.139  -2.704
  154    HA3  GLY  18           HA2      GLY  18  43.715   9.891  -1.213
  155    H    GLY  19           HN       GLY  19  41.129  10.154  -2.001
  156    HA2  GLY  19           HA1      GLY  19  40.579   7.613  -3.153
  157    HA3  GLY  19           HA2      GLY  19  39.414   8.940  -2.965
  158    H    ALA  20           HN       ALA  20  40.570  10.895  -4.580
  159    HA   ALA  20           HA       ALA  20  39.710   9.952  -7.188
  160    HB1  ALA  20           HB1      ALA  20  40.207  12.192  -7.937
  161    HB2  ALA  20           HB2      ALA  20  41.218  12.497  -6.503
  162    HB3  ALA  20           HB3      ALA  20  39.457  12.300  -6.327
  163    H    LEU  21           HN       LEU  21  42.817  11.534  -6.338
  164    HA   LEU  21           HA       LEU  21  44.937  11.197  -7.213
  165    HB2  LEU  21           HB2      LEU  21  44.534   9.083  -5.831
  166    HB3  LEU  21           HB1      LEU  21  44.125   8.272  -7.357
  167    HG   LEU  21           HG       LEU  21  46.459   9.232  -8.190
  168   HD11  LEU  21          HD11      LEU  21  46.986  10.645  -6.266
  169   HD12  LEU  21          HD12      LEU  21  48.126   9.285  -6.295
  170   HD13  LEU  21          HD13      LEU  21  46.768   9.278  -5.150
  171   HD21  LEU  21          HD21      LEU  21  45.983   6.838  -7.942
  172   HD22  LEU  21          HD22      LEU  21  46.217   6.946  -6.181
  173   HD23  LEU  21          HD23      LEU  21  47.596   7.193  -7.279
  174    H    ASP  22           HN       ASP  22  44.302  12.347  -9.167
  175    HA   ASP  22           HA       ASP  22  44.820  10.691 -11.542
  176    HB2  ASP  22           HB2      ASP  22  42.137  12.069 -11.144
  177    HB3  ASP  22           HB1      ASP  22  42.748  11.526 -12.725
  178    H    HIS  23           HN       HIS  23  43.169  13.827 -10.941
  179    HA   HIS  23           HA       HIS  23  45.554  15.359 -11.608
  180    HB2  HIS  23           HB2      HIS  23  44.603  16.369 -13.702
  181    HB3  HIS  23           HB1      HIS  23  45.054  14.658 -13.877
  182    HD1  HIS  23           HD1      HIS  23  41.882  16.371 -12.513
  183    HD2  HIS  23           HD2      HIS  23  43.036  13.437 -15.295
  184    HE1  HIS  23           HE1      HIS  23  39.748  15.435 -13.561
  185    H    LEU  24           HN       LEU  24  43.663  15.262  -9.467
  186    HA   LEU  24           HA       LEU  24  43.034  18.087  -9.323
  187    HB2  LEU  24           HB2      LEU  24  41.142  16.943 -10.772
  188    HB3  LEU  24           HB1      LEU  24  40.556  16.338  -9.208
  189    HG   LEU  24           HG       LEU  24  41.025  19.264  -9.954
  190   HD11  LEU  24          HD11      LEU  24  38.438  17.798  -9.285
  191   HD12  LEU  24          HD12      LEU  24  39.008  18.081 -10.947
  192   HD13  LEU  24          HD13      LEU  24  38.614  19.462  -9.895
  193   HD21  LEU  24          HD21      LEU  24  40.244  17.885  -7.353
  194   HD22  LEU  24          HD22      LEU  24  39.767  19.569  -7.685
  195   HD23  LEU  24          HD23      LEU  24  41.488  19.129  -7.624
  Start of MODEL   30
    1    H1   GLY   1           HT1      GLY   1  55.386   0.581  -2.612
    2    H2   GLY   1           HT2      GLY   1  56.014  -0.468  -1.431
    3    H3   GLY   1           HT3      GLY   1  56.424  -0.679  -3.066
    4    HA2  GLY   1           HA1      GLY   1  58.016   0.476  -1.396
    5    HA3  GLY   1           HA2      GLY   1  57.900   0.965  -3.097
    6    H    LYS   2           HN       LYS   2  57.736   1.977   0.120
    7    HA   LYS   2           HA       LYS   2  57.114   3.981   1.109
    8    HB2  LYS   2           HB2      LYS   2  57.437   5.100  -1.702
    9    HB3  LYS   2           HB1      LYS   2  57.567   5.993  -0.167
   10    HG2  LYS   2           HG2      LYS   2  59.469   4.425   0.468
   11    HG3  LYS   2           HG1      LYS   2  59.417   3.806  -1.201
   12    HD2  LYS   2           HD2      LYS   2  59.846   6.062  -2.081
   13    HD3  LYS   2           HD1      LYS   2  59.828   6.729  -0.431
   14    HE2  LYS   2           HE2      LYS   2  61.765   4.586  -1.410
   15    HE3  LYS   2           HE1      LYS   2  62.151   6.320  -1.294
   16    HZ1  LYS   2           HZ1      LYS   2  61.853   4.333   0.812
   17    HZ2  LYS   2           HZ2      LYS   2  61.164   5.852   1.140
   18    HZ3  LYS   2           HZ3      LYS   2  62.816   5.729   0.758
   19    H    GLY   3           HN       GLY   3  55.731   6.220   0.166
   20    HA2  GLY   3           HA1      GLY   3  53.541   6.828  -0.787
   21    HA3  GLY   3           HA2      GLY   3  53.007   5.087  -0.685
   22    H    ARG   4           HN       ARG   4  53.485   4.031   0.921
   23    HA   ARG   4           HA       ARG   4  51.183   4.599   1.420
   24    HB2  ARG   4           HB2      ARG   4  52.797   2.682   3.172
   25    HB3  ARG   4           HB1      ARG   4  51.017   2.734   3.134
   26    HG2  ARG   4           HG2      ARG   4  51.028   2.283   0.713
   27    HG3  ARG   4           HG1      ARG   4  52.807   2.293   0.703
   28    HD2  ARG   4           HD2      ARG   4  52.756   0.398   2.378
   29    HD3  ARG   4           HD1      ARG   4  50.992   0.325   2.157
   30    HE   ARG   4           HE       ARG   4  52.292   0.187  -0.406
   31   HH11  ARG   4          HH11      ARG   4  52.197  -1.824  -1.441
   32   HH12  ARG   4          HH12      ARG   4  52.072  -3.265  -0.489
   33   HH21  ARG   4          HH21      ARG   4  51.927  -1.574   2.534
   34   HH22  ARG   4          HH22      ARG   4  51.921  -3.124   1.761
   35    H    TRP   5           HN       TRP   5  53.699   5.964   2.809
   36    HA   TRP   5           HA       TRP   5  53.416   6.447   5.533
   37    HB2  TRP   5           HB2      TRP   5  53.864   8.588   3.420
   38    HB3  TRP   5           HB1      TRP   5  54.308   8.706   5.140
   39    HD1  TRP   5           HD1      TRP   5  55.425   7.242   1.846
   40    HE1  TRP   5           HE1      TRP   5  57.726   6.060   2.116
   41    HE3  TRP   5           HE3      TRP   5  55.789   7.336   6.953
   42    HZ2  TRP   5           HZ2      TRP   5  59.463   5.277   4.273
   43    HZ3  TRP   5           HZ3      TRP   5  57.778   6.366   8.095
   44    HH2  TRP   5           HH2      TRP   5  59.613   5.338   6.762
   45    H    LEU   6           HN       LEU   6  51.146   7.221   3.045
   46    HA   LEU   6           HA       LEU   6  49.540   8.938   4.930
   47    HB2  LEU   6           HB2      LEU   6  49.148   8.649   1.931
   48    HB3  LEU   6           HB1      LEU   6  48.507   9.907   3.015
   49    HG   LEU   6           HG       LEU   6  51.455   9.462   2.353
   50   HD11  LEU   6          HD11      LEU   6  49.482  11.638   1.524
   51   HD12  LEU   6          HD12      LEU   6  50.164  10.383   0.462
   52   HD13  LEU   6          HD13      LEU   6  51.224  11.632   1.158
   53   HD21  LEU   6          HD21      LEU   6  49.975  11.424   4.159
   54   HD22  LEU   6          HD22      LEU   6  51.590  11.787   3.503
   55   HD23  LEU   6          HD23      LEU   6  51.358  10.378   4.561
   56    H    GLU   7           HN       GLU   7  49.675   5.863   3.220
   57    HA   GLU   7           HA       GLU   7  46.979   5.246   2.857
   58    HB2  GLU   7           HB2      GLU   7  49.014   3.776   2.406
   59    HB3  GLU   7           HB1      GLU   7  48.962   3.326   4.128
   60    HG2  GLU   7           HG2      GLU   7  46.673   2.476   3.870
   61    HG3  GLU   7           HG1      GLU   7  46.643   3.001   2.169
   62    H    ARG   8           HN       ARG   8  48.611   5.912   5.834
   63    HA   ARG   8           HA       ARG   8  47.132   4.430   7.708
   64    HB2  ARG   8           HB2      ARG   8  49.054   5.933   8.236
   65    HB3  ARG   8           HB1      ARG   8  47.991   7.337   7.976
   66    HG2  ARG   8           HG2      ARG   8  46.525   6.640   9.791
   67    HG3  ARG   8           HG1      ARG   8  47.423   5.114   9.984
   68    HD2  ARG   8           HD2      ARG   8  48.173   6.667  11.703
   69    HD3  ARG   8           HD1      ARG   8  49.483   6.471  10.516
   70    HE   ARG   8           HE       ARG   8  47.833   8.708   9.775
   71   HH11  ARG   8          HH11      ARG   8  50.191   7.613  12.040
   72   HH12  ARG   8          HH12      ARG   8  50.799   9.200  12.376
   73   HH21  ARG   8          HH21      ARG   8  48.597  10.788  10.221
   74   HH22  ARG   8          HH22      ARG   8  49.896  10.997  11.346
   75    H    ILE   9           HN       ILE   9  46.445   7.883   7.020
   76    HA   ILE   9           HA       ILE   9  43.736   7.631   8.011
   77    HB   ILE   9           HB       ILE   9  44.933   9.762   8.151
   78   HG12  ILE   9          HG12      ILE   9  42.623  10.005   6.175
   79   HG13  ILE   9          HG11      ILE   9  42.425   9.717   7.918
   80   HG21  ILE   9          HG21      ILE   9  44.724  10.134   5.142
   81   HG22  ILE   9          HG22      ILE   9  46.132   9.305   5.847
   82   HG23  ILE   9          HG23      ILE   9  45.759  10.979   6.314
   83   HD11  ILE   9           HD1      ILE   9  42.207  12.099   7.540
   84   HD12  ILE   9           HD2      ILE   9  43.702  12.136   6.575
   85   HD13  ILE   9           HD3      ILE   9  43.780  11.824   8.327
   86    H    GLY  10           HN       GLY  10  45.005   8.327   4.717
   87    HA2  GLY  10           HA1      GLY  10  43.972   8.072   2.658
   88    HA3  GLY  10           HA2      GLY  10  43.619   6.448   3.272
   89    H    LYS  11           HN       LYS  11  42.270   9.548   4.453
   90    HA   LYS  11           HA       LYS  11  39.536   8.469   3.846
   91    HB2  LYS  11           HB2      LYS  11  40.504  10.798   5.553
   92    HB3  LYS  11           HB1      LYS  11  38.790  10.451   5.232
   93    HG2  LYS  11           HG2      LYS  11  39.092   8.165   6.183
   94    HG3  LYS  11           HG1      LYS  11  40.783   8.566   6.565
   95    HD2  LYS  11           HD2      LYS  11  40.030  10.425   8.009
   96    HD3  LYS  11           HD1      LYS  11  38.335  10.046   7.619
   97    HE2  LYS  11           HE2      LYS  11  38.996   9.053   9.795
   98    HE3  LYS  11           HE1      LYS  11  38.604   7.792   8.602
   99    HZ1  LYS  11           HZ1      LYS  11  41.352   8.764   9.207
  100    HZ2  LYS  11           HZ2      LYS  11  40.936   7.491   8.163
  101    HZ3  LYS  11           HZ3      LYS  11  40.669   7.343   9.834
  102    H    ALA  12           HN       ALA  12  41.885  10.235   2.352
  103    HA   ALA  12           HA       ALA  12  41.804  11.506   0.415
  104    HB1  ALA  12           HB1      ALA  12  39.535  10.194   0.105
  105    HB2  ALA  12           HB2      ALA  12  39.871  11.630  -0.889
  106    HB3  ALA  12           HB3      ALA  12  38.792  11.756   0.520
  107    H    GLY  13           HN       GLY  13  39.860  12.368   3.218
  108    HA2  GLY  13           HA1      GLY  13  39.269  14.455   4.087
  109    HA3  GLY  13           HA2      GLY  13  40.999  14.763   3.845
  110    H    PHE  14           HN       PHE  14  37.907  14.728   2.035
  111    HA   PHE  14           HA       PHE  14  37.087  16.209   0.450
  112    HB2  PHE  14           HB2      PHE  14  39.187  18.215   1.350
  113    HB3  PHE  14           HB1      PHE  14  37.599  18.532   0.618
  114    HD1  PHE  14           HD1      PHE  14  39.403  17.792   3.723
  115    HD2  PHE  14           HD2      PHE  14  35.499  18.041   1.899
  116    HE1  PHE  14           HE1      PHE  14  38.352  17.856   5.982
  117    HE2  PHE  14           HE2      PHE  14  34.448  18.104   4.158
  118    HZ   PHE  14           HZ       PHE  14  35.871  17.922   6.196
  119    H    ILE  15           HN       ILE  15  38.468  14.367  -0.637
  120    HA   ILE  15           HA       ILE  15  40.037  13.721  -2.215
  121    HB   ILE  15           HB       ILE  15  39.865  15.132  -4.369
  122   HG12  ILE  15          HG12      ILE  15  37.726  16.573  -2.723
  123   HG13  ILE  15          HG11      ILE  15  39.284  17.290  -3.191
  124   HG21  ILE  15          HG21      ILE  15  37.635  14.307  -4.844
  125   HG22  ILE  15          HG22      ILE  15  37.222  14.273  -3.115
  126   HG23  ILE  15          HG23      ILE  15  38.422  13.132  -3.769
  127   HD11  ILE  15           HD1      ILE  15  37.843  18.062  -4.885
  128   HD12  ILE  15           HD2      ILE  15  36.930  16.539  -4.943
  129   HD13  ILE  15           HD3      ILE  15  38.566  16.623  -5.641
  130    H    ILE  16           HN       ILE  16  41.904  13.992  -0.941
  131    HA   ILE  16           HA       ILE  16  43.725  16.112  -2.049
  132    HB   ILE  16           HB       ILE  16  43.663  15.222   0.872
  133   HG12  ILE  16          HG12      ILE  16  41.775  16.814   0.044
  134   HG13  ILE  16          HG11      ILE  16  42.702  17.299   1.472
  135   HG21  ILE  16          HG21      ILE  16  45.912  15.715   0.216
  136   HG22  ILE  16          HG22      ILE  16  45.323  17.146   1.090
  137   HG23  ILE  16          HG23      ILE  16  45.410  17.162  -0.689
  138   HD11  ILE  16           HD1      ILE  16  42.297  19.138  -0.245
  139   HD12  ILE  16           HD2      ILE  16  43.378  18.261  -1.345
  140   HD13  ILE  16           HD3      ILE  16  43.997  18.887   0.197
  141    H    ILE  17           HN       ILE  17  43.318  13.005  -0.339
  142    HA   ILE  17           HA       ILE  17  46.082  12.200  -1.154
  143    HB   ILE  17           HB       ILE  17  44.041  10.624   0.485
  144   HG12  ILE  17          HG12      ILE  17  45.923  11.389   2.326
  145   HG13  ILE  17          HG11      ILE  17  46.023  12.793   1.244
  146   HG21  ILE  17          HG21      ILE  17  45.775   9.247  -0.575
  147   HG22  ILE  17          HG22      ILE  17  46.094   9.356   1.169
  148   HG23  ILE  17          HG23      ILE  17  47.046  10.335   0.028
  149   HD11  ILE  17           HD1      ILE  17  44.377  13.361   2.872
  150   HD12  ILE  17           HD2      ILE  17  43.615  11.756   2.783
  151   HD13  ILE  17           HD3      ILE  17  43.443  12.898   1.433
  152    H    GLY  18           HN       GLY  18  42.976  10.408  -1.016
  153    HA2  GLY  18           HA1      GLY  18  43.667   8.676  -3.170
  154    HA3  GLY  18           HA2      GLY  18  42.029   8.957  -2.546
  155    H    GLY  19           HN       GLY  19  41.725  11.675  -3.073
  156    HA2  GLY  19           HA1      GLY  19  41.139  11.549  -5.931
  157    HA3  GLY  19           HA2      GLY  19  40.793  12.893  -4.825
  158    H    ALA  20           HN       ALA  20  43.277  13.530  -3.841
  159    HA   ALA  20           HA       ALA  20  45.101  14.846  -4.397
  160    HB1  ALA  20           HB1      ALA  20  45.877  12.594  -5.223
  161    HB2  ALA  20           HB2      ALA  20  46.625  13.987  -6.041
  162    HB3  ALA  20           HB3      ALA  20  45.328  13.072  -6.846
  163    H    LEU  21           HN       LEU  21  42.286  15.003  -5.924
  164    HA   LEU  21           HA       LEU  21  41.343  16.446  -7.473
  165    HB2  LEU  21           HB2      LEU  21  42.421  18.045  -5.803
  166    HB3  LEU  21           HB1      LEU  21  43.779  18.181  -6.937
  167    HG   LEU  21           HG       LEU  21  41.954  18.791  -8.723
  168   HD11  LEU  21          HD11      LEU  21  39.916  18.263  -7.545
  169   HD12  LEU  21          HD12      LEU  21  40.002  20.033  -7.615
  170   HD13  LEU  21          HD13      LEU  21  40.423  19.185  -6.112
  171   HD21  LEU  21          HD21      LEU  21  42.577  20.691  -6.417
  172   HD22  LEU  21          HD22      LEU  21  42.045  21.175  -8.044
  173   HD23  LEU  21          HD23      LEU  21  43.623  20.383  -7.822
  174    H    ASP  22           HN       ASP  22  41.884  14.774  -9.103
  175    HA   ASP  22           HA       ASP  22  43.154  16.034 -11.385
  176    HB2  ASP  22           HB2      ASP  22  44.959  14.354 -11.700
  177    HB3  ASP  22           HB1      ASP  22  45.211  15.346 -10.243
  178    H    HIS  23           HN       HIS  23  40.612  15.147 -11.082
  179    HA   HIS  23           HA       HIS  23  39.029  13.705 -11.980
  180    HB2  HIS  23           HB2      HIS  23  40.258  14.510 -14.050
  181    HB3  HIS  23           HB1      HIS  23  41.204  13.005 -13.989
  182    HD1  HIS  23           HD1      HIS  23  37.499  13.257 -13.124
  183    HD2  HIS  23           HD2      HIS  23  39.958  11.766 -16.195
  184    HE1  HIS  23           HE1      HIS  23  36.022  11.859 -14.671
  185    H    LEU  24           HN       LEU  24  41.190  12.674 -10.053
  186    HA   LEU  24           HA       LEU  24  40.286   9.893 -10.122
  187    HB2  LEU  24           HB2      LEU  24  42.224   9.977 -11.786
  188    HB3  LEU  24           HB1      LEU  24  43.268  10.405 -10.414
  189    HG   LEU  24           HG       LEU  24  42.221   8.245  -9.275
  190   HD11  LEU  24          HD11      LEU  24  41.714   7.741 -12.246
  191   HD12  LEU  24          HD12      LEU  24  40.511   7.726 -10.935
  192   HD13  LEU  24          HD13      LEU  24  41.760   6.464 -11.010
  193   HD21  LEU  24          HD21      LEU  24  44.002   6.848 -10.315
  194   HD22  LEU  24          HD22      LEU  24  44.595   8.473  -9.897
  195   HD23  LEU  24          HD23      LEU  24  44.207   8.074 -11.588
  Start of MODEL   31
    1    H1   GLY   1           HT1      GLY   1  55.514  -2.552   3.629
    2    H2   GLY   1           HT2      GLY   1  56.888  -2.133   4.537
    3    H3   GLY   1           HT3      GLY   1  56.893  -3.536   3.576
    4    HA2  GLY   1           HA1      GLY   1  58.133  -1.956   2.436
    5    HA3  GLY   1           HA2      GLY   1  56.568  -2.119   1.614
    6    H    LYS   2           HN       LYS   2  57.698   0.074   0.910
    7    HA   LYS   2           HA       LYS   2  57.282   2.286   2.784
    8    HB2  LYS   2           HB2      LYS   2  57.630   2.509  -0.225
    9    HB3  LYS   2           HB1      LYS   2  58.080   3.683   1.035
   10    HG2  LYS   2           HG2      LYS   2  59.345   0.942   0.581
   11    HG3  LYS   2           HG1      LYS   2  60.084   2.520   0.218
   12    HD2  LYS   2           HD2      LYS   2  59.726   3.068   2.729
   13    HD3  LYS   2           HD1      LYS   2  59.427   1.325   2.938
   14    HE2  LYS   2           HE2      LYS   2  61.938   2.544   1.710
   15    HE3  LYS   2           HE1      LYS   2  61.807   1.900   3.365
   16    HZ1  LYS   2           HZ1      LYS   2  61.452  -0.258   2.558
   17    HZ2  LYS   2           HZ2      LYS   2  62.720   0.350   1.604
   18    HZ3  LYS   2           HZ3      LYS   2  61.143   0.270   0.976
   19    H    GLY   3           HN       GLY   3  54.965   0.507   2.120
   20    HA2  GLY   3           HA1      GLY   3  53.035   1.546   0.391
   21    HA3  GLY   3           HA2      GLY   3  52.599   1.026   2.082
   22    H    ARG   4           HN       ARG   4  53.433   1.942   3.616
   23    HA   ARG   4           HA       ARG   4  51.273   3.038   3.563
   24    HB2  ARG   4           HB2      ARG   4  53.291   3.504   5.810
   25    HB3  ARG   4           HB1      ARG   4  51.549   3.841   5.965
   26    HG2  ARG   4           HG2      ARG   4  50.983   1.526   5.533
   27    HG3  ARG   4           HG1      ARG   4  52.666   1.142   5.096
   28    HD2  ARG   4           HD2      ARG   4  52.199   0.382   7.390
   29    HD3  ARG   4           HD1      ARG   4  53.380   1.713   7.416
   30    HE   ARG   4           HE       ARG   4  51.794   2.970   8.621
   31   HH11  ARG   4          HH11      ARG   4  49.604   3.810   8.602
   32   HH12  ARG   4          HH12      ARG   4  48.321   2.654   8.464
   33   HH21  ARG   4          HH21      ARG   4  50.425   0.013   7.679
   34   HH22  ARG   4          HH22      ARG   4  48.786   0.507   7.941
   35    H    TRP   5           HN       TRP   5  53.982   4.384   2.576
   36    HA   TRP   5           HA       TRP   5  54.283   7.057   3.261
   37    HB2  TRP   5           HB2      TRP   5  55.627   5.928   1.526
   38    HB3  TRP   5           HB1      TRP   5  54.234   5.964   0.418
   39    HD1  TRP   5           HD1      TRP   5  53.465   8.342  -0.519
   40    HE1  TRP   5           HE1      TRP   5  54.710  10.610  -0.788
   41    HE3  TRP   5           HE3      TRP   5  57.439   7.458   2.588
   42    HZ2  TRP   5           HZ2      TRP   5  57.106  11.843   0.223
   43    HZ3  TRP   5           HZ3      TRP   5  59.192   9.195   2.920
   44    HH2  TRP   5           HH2      TRP   5  59.030  11.384   1.743
   45    H    LEU   6           HN       LEU   6  51.470   5.611   1.887
   46    HA   LEU   6           HA       LEU   6  50.225   8.331   1.563
   47    HB2  LEU   6           HB2      LEU   6  50.770   6.958  -0.610
   48    HB3  LEU   6           HB1      LEU   6  49.414   5.930  -0.105
   49    HG   LEU   6           HG       LEU   6  48.122   8.257   0.144
   50   HD11  LEU   6          HD11      LEU   6  48.873   9.887  -1.605
   51   HD12  LEU   6          HD12      LEU   6  50.348   8.924  -1.839
   52   HD13  LEU   6          HD13      LEU   6  50.047   9.726  -0.283
   53   HD21  LEU   6          HD21      LEU   6  47.471   8.099  -2.288
   54   HD22  LEU   6          HD22      LEU   6  47.446   6.533  -1.443
   55   HD23  LEU   6          HD23      LEU   6  48.800   6.940  -2.525
   56    H    GLU   7           HN       GLU   7  50.236   5.311   3.179
   57    HA   GLU   7           HA       GLU   7  47.292   5.262   3.583
   58    HB2  GLU   7           HB2      GLU   7  48.745   3.181   3.369
   59    HB3  GLU   7           HB1      GLU   7  49.430   3.591   4.957
   60    HG2  GLU   7           HG2      GLU   7  47.284   3.381   6.037
   61    HG3  GLU   7           HG1      GLU   7  46.435   3.279   4.476
   62    H    ARG   8           HN       ARG   8  49.936   6.943   4.817
   63    HA   ARG   8           HA       ARG   8  49.518   6.943   7.611
   64    HB2  ARG   8           HB2      ARG   8  51.415   8.067   6.502
   65    HB3  ARG   8           HB1      ARG   8  50.307   9.286   5.831
   66    HG2  ARG   8           HG2      ARG   8  49.726  10.084   8.046
   67    HG3  ARG   8           HG1      ARG   8  50.600   8.737   8.814
   68    HD2  ARG   8           HD2      ARG   8  51.846  10.945   7.116
   69    HD3  ARG   8           HD1      ARG   8  51.956  10.798   8.887
   70    HE   ARG   8           HE       ARG   8  52.915   8.368   7.777
   71   HH11  ARG   8          HH11      ARG   8  54.812   8.600   6.239
   72   HH12  ARG   8          HH12      ARG   8  56.009   9.738   6.760
   73   HH21  ARG   8          HH21      ARG   8  53.966  11.195   9.152
   74   HH22  ARG   8          HH22      ARG   8  55.530  11.207   8.409
   75    H    ILE   9           HN       ILE   9  48.589   9.840   5.753
   76    HA   ILE   9           HA       ILE   9  46.350  10.302   7.590
   77    HB   ILE   9           HB       ILE   9  45.929  12.311   6.153
   78   HG12  ILE   9          HG12      ILE   9  48.312  11.219   4.581
   79   HG13  ILE   9          HG11      ILE   9  46.639  11.329   3.988
   80   HG21  ILE   9          HG21      ILE   9  47.889  13.506   6.855
   81   HG22  ILE   9          HG22      ILE   9  48.897  12.039   6.785
   82   HG23  ILE   9          HG23      ILE   9  47.659  12.211   8.052
   83   HD11  ILE   9           HD1      ILE   9  46.827  13.872   4.549
   84   HD12  ILE   9           HD2      ILE   9  47.674  13.268   3.105
   85   HD13  ILE   9           HD3      ILE   9  48.582  13.578   4.601
   86    H    GLY  10           HN       GLY  10  46.520   7.964   5.531
   87    HA2  GLY  10           HA1      GLY  10  44.697   8.172   3.474
   88    HA3  GLY  10           HA2      GLY  10  44.852   6.726   4.489
   89    H    LYS  11           HN       LYS  11  43.059   9.680   3.864
   90    HA   LYS  11           HA       LYS  11  40.692   8.503   5.197
   91    HB2  LYS  11           HB2      LYS  11  41.955  11.115   6.122
   92    HB3  LYS  11           HB1      LYS  11  40.296  10.614   6.523
   93    HG2  LYS  11           HG2      LYS  11  41.348   8.442   7.450
   94    HG3  LYS  11           HG1      LYS  11  42.912   9.278   7.331
   95    HD2  LYS  11           HD2      LYS  11  40.493  10.330   8.867
   96    HD3  LYS  11           HD1      LYS  11  41.867   9.476   9.603
   97    HE2  LYS  11           HE2      LYS  11  42.421  11.759   9.901
   98    HE3  LYS  11           HE1      LYS  11  43.340  11.314   8.445
   99    HZ1  LYS  11           HZ1      LYS  11  40.903  12.053   7.479
  100    HZ2  LYS  11           HZ2      LYS  11  42.296  13.024   7.502
  101    HZ3  LYS  11           HZ3      LYS  11  41.149  13.151   8.748
  102    H    ALA  12           HN       ALA  12  42.168  10.211   2.734
  103    HA   ALA  12           HA       ALA  12  41.329  11.476   0.987
  104    HB1  ALA  12           HB1      ALA  12  38.593  10.475   1.838
  105    HB2  ALA  12           HB2      ALA  12  39.759   9.471   0.943
  106    HB3  ALA  12           HB3      ALA  12  39.127  10.967   0.212
  107    H    GLY  13           HN       GLY  13  41.960  13.042   2.969
  108    HA2  GLY  13           HA1      GLY  13  40.148  14.491   4.447
  109    HA3  GLY  13           HA2      GLY  13  41.555  15.230   3.658
  110    H    PHE  14           HN       PHE  14  38.111  14.558   3.453
  111    HA   PHE  14           HA       PHE  14  36.453  15.508   2.131
  112    HB2  PHE  14           HB2      PHE  14  38.440  17.817   2.140
  113    HB3  PHE  14           HB1      PHE  14  36.756  17.932   1.575
  114    HD1  PHE  14           HD1      PHE  14  38.964  17.656   4.508
  115    HD2  PHE  14           HD2      PHE  14  34.863  17.610   3.161
  116    HE1  PHE  14           HE1      PHE  14  38.189  17.979   6.854
  117    HE2  PHE  14           HE2      PHE  14  34.089  17.935   5.505
  118    HZ   PHE  14           HZ       PHE  14  35.751  18.129   7.351
  119    H    ILE  15           HN       ILE  15  38.106  13.738   0.793
  120    HA   ILE  15           HA       ILE  15  38.636  13.074  -1.347
  121    HB   ILE  15           HB       ILE  15  37.186  15.549  -2.367
  122   HG12  ILE  15          HG12      ILE  15  36.056  12.872  -1.431
  123   HG13  ILE  15          HG11      ILE  15  35.746  14.464  -0.702
  124   HG21  ILE  15          HG21      ILE  15  36.798  14.224  -4.332
  125   HG22  ILE  15          HG22      ILE  15  37.355  12.739  -3.522
  126   HG23  ILE  15          HG23      ILE  15  38.518  14.024  -3.930
  127   HD11  ILE  15           HD1      ILE  15  33.842  14.097  -2.064
  128   HD12  ILE  15           HD2      ILE  15  34.806  13.391  -3.381
  129   HD13  ILE  15           HD3      ILE  15  34.872  15.144  -3.070
  130    H    ILE  16           HN       ILE  16  40.862  13.643  -0.662
  131    HA   ILE  16           HA       ILE  16  41.965  15.614  -2.613
  132    HB   ILE  16           HB       ILE  16  41.738  16.910  -0.530
  133   HG12  ILE  16          HG12      ILE  16  44.129  17.554  -0.229
  134   HG13  ILE  16          HG11      ILE  16  44.633  16.095  -1.107
  135   HG21  ILE  16          HG21      ILE  16  43.687  15.063   0.866
  136   HG22  ILE  16          HG22      ILE  16  41.946  14.706   0.909
  137   HG23  ILE  16          HG23      ILE  16  42.559  16.243   1.565
  138   HD11  ILE  16           HD1      ILE  16  43.839  16.905  -3.173
  139   HD12  ILE  16           HD2      ILE  16  44.410  18.400  -2.401
  140   HD13  ILE  16           HD3      ILE  16  42.674  18.014  -2.410
  141    H    ILE  17           HN       ILE  17  42.266  12.825  -0.499
  142    HA   ILE  17           HA       ILE  17  44.912  12.139  -1.784
  143    HB   ILE  17           HB       ILE  17  43.540  10.754   0.570
  144   HG12  ILE  17          HG12      ILE  17  44.127  12.873   1.466
  145   HG13  ILE  17          HG11      ILE  17  45.495  11.838   1.897
  146   HG21  ILE  17          HG21      ILE  17  45.915   9.824   0.850
  147   HG22  ILE  17          HG22      ILE  17  46.257  10.478  -0.769
  148   HG23  ILE  17          HG23      ILE  17  44.998   9.245  -0.556
  149   HD11  ILE  17           HD1      ILE  17  45.355  13.915  -0.327
  150   HD12  ILE  17           HD2      ILE  17  46.649  12.700  -0.234
  151   HD13  ILE  17           HD3      ILE  17  46.444  13.879   1.077
  152    H    GLY  18           HN       GLY  18  41.603  11.046  -1.092
  153    HA2  GLY  18           HA1      GLY  18  41.893   8.540  -2.517
  154    HA3  GLY  18           HA2      GLY  18  40.374   9.296  -1.992
  155    H    GLY  19           HN       GLY  19  40.015  11.525  -3.267
  156    HA2  GLY  19           HA1      GLY  19  39.616  10.682  -6.018
  157    HA3  GLY  19           HA2      GLY  19  39.250  12.276  -5.334
  158    H    ALA  20           HN       ALA  20  41.894  12.814  -4.329
  159    HA   ALA  20           HA       ALA  20  43.740  13.987  -5.118
  160    HB1  ALA  20           HB1      ALA  20  45.169  12.673  -6.711
  161    HB2  ALA  20           HB2      ALA  20  43.844  11.491  -6.838
  162    HB3  ALA  20           HB3      ALA  20  44.649  11.761  -5.273
  163    H    LEU  21           HN       LEU  21  41.026  14.163  -6.664
  164    HA   LEU  21           HA       LEU  21  40.260  15.282  -8.552
  165    HB2  LEU  21           HB2      LEU  21  42.988  16.625  -8.579
  166    HB3  LEU  21           HB1      LEU  21  41.438  17.284  -9.153
  167    HG   LEU  21           HG       LEU  21  42.157  16.617  -6.263
  168   HD11  LEU  21          HD11      LEU  21  41.586  19.295  -7.608
  169   HD12  LEU  21          HD12      LEU  21  43.218  18.675  -7.259
  170   HD13  LEU  21          HD13      LEU  21  42.096  19.033  -5.923
  171   HD21  LEU  21          HD21      LEU  21  39.817  16.212  -6.446
  172   HD22  LEU  21          HD22      LEU  21  39.584  17.544  -7.605
  173   HD23  LEU  21          HD23      LEU  21  39.913  17.898  -5.891
  174    H    ASP  22           HN       ASP  22  42.853  16.231 -10.327
  175    HA   ASP  22           HA       ASP  22  43.559  15.529 -12.431
  176    HB2  ASP  22           HB2      ASP  22  45.034  14.257 -10.816
  177    HB3  ASP  22           HB1      ASP  22  43.947  12.863 -11.021
  178    H    HIS  23           HN       HIS  23  40.653  14.902 -11.526
  179    HA   HIS  23           HA       HIS  23  38.809  13.810 -12.419
  180    HB2  HIS  23           HB2      HIS  23  40.592  13.944 -14.881
  181    HB3  HIS  23           HB1      HIS  23  38.874  13.484 -14.915
  182    HD1  HIS  23           HD1      HIS  23  40.056  16.121 -12.494
  183    HD2  HIS  23           HD2      HIS  23  38.086  15.901 -16.202
  184    HE1  HIS  23           HE1      HIS  23  39.161  18.456 -13.019
  185    H    LEU  24           HN       LEU  24  40.571  12.142 -11.005
  186    HA   LEU  24           HA       LEU  24  41.427   9.813 -12.323
  187    HB2  LEU  24           HB2      LEU  24  41.974  10.195 -10.001
  188    HB3  LEU  24           HB1      LEU  24  40.259  10.210  -9.540
  189    HG   LEU  24           HG       LEU  24  40.033   7.840 -10.017
  190   HD11  LEU  24          HD11      LEU  24  42.189   6.567 -10.721
  191   HD12  LEU  24          HD12      LEU  24  42.807   8.156 -11.229
  192   HD13  LEU  24          HD13      LEU  24  41.337   7.488 -11.980
  193   HD21  LEU  24          HD21      LEU  24  41.663   6.905  -8.409
  194   HD22  LEU  24          HD22      LEU  24  41.036   8.469  -7.834
  195   HD23  LEU  24          HD23      LEU  24  42.660   8.372  -8.556
  Start of MODEL   32
    1    H1   GLY   1           HT1      GLY   1  53.738  -2.135   0.015
    2    H2   GLY   1           HT2      GLY   1  53.657  -3.730   0.595
    3    H3   GLY   1           HT3      GLY   1  54.634  -3.357  -0.744
    4    HA2  GLY   1           HA1      GLY   1  55.171  -3.165   2.038
    5    HA3  GLY   1           HA2      GLY   1  56.285  -3.227   0.657
    6    H    LYS   2           HN       LYS   2  55.662  -1.451   3.230
    7    HA   LYS   2           HA       LYS   2  55.902   0.793   3.781
    8    HB2  LYS   2           HB2      LYS   2  57.626   0.610   1.281
    9    HB3  LYS   2           HB1      LYS   2  57.570   2.053   2.315
   10    HG2  LYS   2           HG2      LYS   2  58.093  -0.651   3.594
   11    HG3  LYS   2           HG1      LYS   2  59.415   0.153   2.724
   12    HD2  LYS   2           HD2      LYS   2  57.816   1.739   4.765
   13    HD3  LYS   2           HD1      LYS   2  59.061   0.603   5.327
   14    HE2  LYS   2           HE2      LYS   2  60.740   1.742   3.882
   15    HE3  LYS   2           HE1      LYS   2  59.494   2.901   3.362
   16    HZ1  LYS   2           HZ1      LYS   2  59.921   2.506   6.240
   17    HZ2  LYS   2           HZ2      LYS   2  59.449   3.902   5.393
   18    HZ3  LYS   2           HZ3      LYS   2  61.073   3.406   5.379
   19    H    GLY   3           HN       GLY   3  53.751  -0.096   1.781
   20    HA2  GLY   3           HA1      GLY   3  53.105   1.735  -0.213
   21    HA3  GLY   3           HA2      GLY   3  51.848   1.176   0.983
   22    H    ARG   4           HN       ARG   4  52.137   1.571   2.912
   23    HA   ARG   4           HA       ARG   4  50.531   3.291   2.321
   24    HB2  ARG   4           HB2      ARG   4  51.414   2.883   5.222
   25    HB3  ARG   4           HB1      ARG   4  49.865   3.612   4.723
   26    HG2  ARG   4           HG2      ARG   4  49.308   1.546   3.458
   27    HG3  ARG   4           HG1      ARG   4  50.843   0.815   3.985
   28    HD2  ARG   4           HD2      ARG   4  48.531   1.695   5.765
   29    HD3  ARG   4           HD1      ARG   4  49.071   0.027   5.459
   30    HE   ARG   4           HE       ARG   4  51.249   1.585   6.518
   31   HH11  ARG   4          HH11      ARG   4  48.593  -0.455   7.200
   32   HH12  ARG   4          HH12      ARG   4  48.859  -0.476   8.911
   33   HH21  ARG   4          HH21      ARG   4  51.459   1.815   8.801
   34   HH22  ARG   4          HH22      ARG   4  50.480   0.810   9.818
   35    H    TRP   5           HN       TRP   5  53.634   3.828   2.782
   36    HA   TRP   5           HA       TRP   5  54.216   6.171   4.161
   37    HB2  TRP   5           HB2      TRP   5  55.872   4.893   2.840
   38    HB3  TRP   5           HB1      TRP   5  55.153   5.516   1.336
   39    HD1  TRP   5           HD1      TRP   5  56.253   7.255   4.643
   40    HE1  TRP   5           HE1      TRP   5  57.723   9.314   4.052
   41    HE3  TRP   5           HE3      TRP   5  56.275   6.795  -0.457
   42    HZ2  TRP   5           HZ2      TRP   5  58.755  10.567   1.673
   43    HZ3  TRP   5           HZ3      TRP   5  57.511   8.433  -1.867
   44    HH2  TRP   5           HH2      TRP   5  58.750  10.317  -0.807
   45    H    LEU   6           HN       LEU   6  52.052   5.829   1.502
   46    HA   LEU   6           HA       LEU   6  51.850   8.821   1.182
   47    HB2  LEU   6           HB2      LEU   6  50.771   6.705  -0.714
   48    HB3  LEU   6           HB1      LEU   6  50.996   8.444  -1.013
   49    HG   LEU   6           HG       LEU   6  53.223   6.412  -0.530
   50   HD11  LEU   6          HD11      LEU   6  52.511   7.978  -3.045
   51   HD12  LEU   6          HD12      LEU   6  52.006   6.297  -2.751
   52   HD13  LEU   6          HD13      LEU   6  53.736   6.697  -2.881
   53   HD21  LEU   6          HD21      LEU   6  53.197   9.427  -0.964
   54   HD22  LEU   6          HD22      LEU   6  54.629   8.441  -1.345
   55   HD23  LEU   6          HD23      LEU   6  54.010   8.500   0.320
   56    H    GLU   7           HN       GLU   7  50.236   5.846   2.171
   57    HA   GLU   7           HA       GLU   7  47.579   7.235   2.223
   58    HB2  GLU   7           HB2      GLU   7  48.424   4.359   2.754
   59    HB3  GLU   7           HB1      GLU   7  46.757   4.965   2.901
   60    HG2  GLU   7           HG2      GLU   7  46.725   5.598   0.544
   61    HG3  GLU   7           HG1      GLU   7  48.445   5.171   0.369
   62    H    ARG   8           HN       ARG   8  50.137   7.539   4.040
   63    HA   ARG   8           HA       ARG   8  49.395   6.632   6.652
   64    HB2  ARG   8           HB2      ARG   8  51.669   7.464   5.927
   65    HB3  ARG   8           HB1      ARG   8  51.010   9.117   5.971
   66    HG2  ARG   8           HG2      ARG   8  50.461   8.878   8.347
   67    HG3  ARG   8           HG1      ARG   8  50.993   7.179   8.327
   68    HD2  ARG   8           HD2      ARG   8  52.754   8.663   9.254
   69    HD3  ARG   8           HD1      ARG   8  53.287   7.893   7.739
   70    HE   ARG   8           HE       ARG   8  52.113  10.388   7.057
   71   HH11  ARG   8          HH11      ARG   8  55.049   9.008   7.060
   72   HH12  ARG   8          HH12      ARG   8  55.958  10.399   7.550
   73   HH21  ARG   8          HH21      ARG   8  53.161  12.238   8.455
   74   HH22  ARG   8          HH22      ARG   8  54.890  12.228   8.340
   75    H    ILE   9           HN       ILE   9  48.641   9.584   4.821
   76    HA   ILE   9           HA       ILE   9  46.282  10.066   6.415
   77    HB   ILE   9           HB       ILE   9  47.906  10.866   8.089
   78   HG12  ILE   9          HG12      ILE   9  47.098  13.131   8.423
   79   HG13  ILE   9          HG11      ILE   9  46.676  13.300   6.711
   80   HG21  ILE   9          HG21      ILE   9  49.750  11.305   6.474
   81   HG22  ILE   9          HG22      ILE   9  49.473  12.681   7.570
   82   HG23  ILE   9          HG23      ILE   9  48.878  12.744   5.893
   83   HD11  ILE   9           HD1      ILE   9  44.771  12.749   8.433
   84   HD12  ILE   9           HD2      ILE   9  45.429  11.096   8.392
   85   HD13  ILE   9           HD3      ILE   9  44.808  11.847   6.901
   86    H    GLY  10           HN       GLY  10  48.425  10.571   3.842
   87    HA2  GLY  10           HA1      GLY  10  47.912  12.952   2.628
   88    HA3  GLY  10           HA2      GLY  10  47.925  11.427   1.723
   89    H    LYS  11           HN       LYS  11  45.518  10.483   3.273
   90    HA   LYS  11           HA       LYS  11  43.533  11.489   1.407
   91    HB2  LYS  11           HB2      LYS  11  43.092   9.920   3.977
   92    HB3  LYS  11           HB1      LYS  11  41.984  10.047   2.591
   93    HG2  LYS  11           HG2      LYS  11  43.659   8.941   1.141
   94    HG3  LYS  11           HG1      LYS  11  44.772   8.812   2.526
   95    HD2  LYS  11           HD2      LYS  11  42.958   7.518   3.745
   96    HD3  LYS  11           HD1      LYS  11  42.045   7.490   2.218
   97    HE2  LYS  11           HE2      LYS  11  43.974   6.382   1.100
   98    HE3  LYS  11           HE1      LYS  11  44.849   6.372   2.650
   99    HZ1  LYS  11           HZ1      LYS  11  43.828   4.468   3.090
  100    HZ2  LYS  11           HZ2      LYS  11  42.846   4.589   1.709
  101    HZ3  LYS  11           HZ3      LYS  11  42.354   5.302   3.171
  102    H    ALA  12           HN       ALA  12  43.014  13.609   1.564
  103    HA   ALA  12           HA       ALA  12  42.904  15.043   4.055
  104    HB1  ALA  12           HB1      ALA  12  43.162  16.002   1.719
  105    HB2  ALA  12           HB2      ALA  12  42.002  16.843   2.775
  106    HB3  ALA  12           HB3      ALA  12  41.414  15.740   1.508
  107    H    GLY  13           HN       GLY  13  41.038  12.524   3.143
  108    HA2  GLY  13           HA1      GLY  13  38.842  11.868   3.561
  109    HA3  GLY  13           HA2      GLY  13  39.168  12.613   5.137
  110    H    PHE  14           HN       PHE  14  38.754  14.090   1.896
  111    HA   PHE  14           HA       PHE  14  36.092  15.093   2.563
  112    HB2  PHE  14           HB2      PHE  14  37.671  16.574   3.913
  113    HB3  PHE  14           HB1      PHE  14  38.317  17.158   2.361
  114    HD1  PHE  14           HD1      PHE  14  35.002  16.565   4.071
  115    HD2  PHE  14           HD2      PHE  14  37.293  19.061   1.394
  116    HE1  PHE  14           HE1      PHE  14  33.080  18.138   3.891
  117    HE2  PHE  14           HE2      PHE  14  35.370  20.632   1.216
  118    HZ   PHE  14           HZ       PHE  14  33.243  20.139   2.416
  119    H    ILE  15           HN       ILE  15  39.048  15.448   0.581
  120    HA   ILE  15           HA       ILE  15  37.402  15.213  -1.858
  121    HB   ILE  15           HB       ILE  15  38.532  17.305  -2.859
  122   HG12  ILE  15          HG12      ILE  15  38.930  17.899   0.113
  123   HG13  ILE  15          HG11      ILE  15  40.232  17.542  -1.043
  124   HG21  ILE  15          HG21      ILE  15  36.625  17.881  -0.554
  125   HG22  ILE  15          HG22      ILE  15  36.099  17.130  -2.079
  126   HG23  ILE  15          HG23      ILE  15  36.783  18.770  -2.086
  127   HD11  ILE  15           HD1      ILE  15  39.244  19.536  -2.430
  128   HD12  ILE  15           HD2      ILE  15  40.202  19.907  -0.976
  129   HD13  ILE  15           HD3      ILE  15  38.426  19.978  -0.911
  130    H    ILE  16           HN       ILE  16  38.897  13.271  -1.227
  131    HA   ILE  16           HA       ILE  16  41.208  13.444  -3.089
  132    HB   ILE  16           HB       ILE  16  41.384  12.724  -0.137
  133   HG12  ILE  16          HG12      ILE  16  41.856  15.072  -0.728
  134   HG13  ILE  16          HG11      ILE  16  43.319  14.257  -0.148
  135   HG21  ILE  16          HG21      ILE  16  42.989  11.612  -2.430
  136   HG22  ILE  16          HG22      ILE  16  42.611  10.893  -0.850
  137   HG23  ILE  16          HG23      ILE  16  43.906  12.102  -0.984
  138   HD11  ILE  16           HD1      ILE  16  43.678  13.818  -2.797
  139   HD12  ILE  16           HD2      ILE  16  44.198  15.327  -2.024
  140   HD13  ILE  16           HD3      ILE  16  42.665  15.272  -2.916
  141    H    ILE  17           HN       ILE  17  38.893  11.685  -1.120
  142    HA   ILE  17           HA       ILE  17  39.373   9.205  -2.777
  143    HB   ILE  17           HB       ILE  17  37.990   9.480  -0.070
  144   HG12  ILE  17          HG12      ILE  17  40.377   9.894   0.198
  145   HG13  ILE  17          HG11      ILE  17  40.009   8.272   0.816
  146   HG21  ILE  17          HG21      ILE  17  37.022   7.563  -0.977
  147   HG22  ILE  17          HG22      ILE  17  38.474   6.842  -0.251
  148   HG23  ILE  17          HG23      ILE  17  38.426   7.183  -1.996
  149   HD11  ILE  17           HD1      ILE  17  40.685   7.454  -1.584
  150   HD12  ILE  17           HD2      ILE  17  41.970   7.938  -0.462
  151   HD13  ILE  17           HD3      ILE  17  41.446   9.052  -1.742
  152    H    GLY  18           HN       GLY  18  36.858  11.200  -1.175
  153    HA2  GLY  18           HA1      GLY  18  34.707   9.950  -2.668
  154    HA3  GLY  18           HA2      GLY  18  34.605  11.429  -1.691
  155    H    GLY  19           HN       GLY  19  36.582  12.968  -2.947
  156    HA2  GLY  19           HA1      GLY  19  35.101  13.745  -5.390
  157    HA3  GLY  19           HA2      GLY  19  36.387  14.659  -4.576
  158    H    ALA  20           HN       ALA  20  38.316  12.560  -4.412
  159    HA   ALA  20           HA       ALA  20  40.093  11.800  -5.694
  160    HB1  ALA  20           HB1      ALA  20  37.879  11.134  -7.666
  161    HB2  ALA  20           HB2      ALA  20  38.390  10.111  -6.303
  162    HB3  ALA  20           HB3      ALA  20  39.515  10.435  -7.644
  163    H    LEU  21           HN       LEU  21  40.476  14.256  -5.808
  164    HA   LEU  21           HA       LEU  21  39.918  15.826  -8.055
  165    HB2  LEU  21           HB2      LEU  21  41.181  16.483  -5.938
  166    HB3  LEU  21           HB1      LEU  21  42.617  15.727  -6.661
  167    HG   LEU  21           HG       LEU  21  42.059  17.286  -8.745
  168   HD11  LEU  21          HD11      LEU  21  40.634  18.708  -6.448
  169   HD12  LEU  21          HD12      LEU  21  39.907  18.156  -7.975
  170   HD13  LEU  21          HD13      LEU  21  41.090  19.481  -7.981
  171   HD21  LEU  21          HD21      LEU  21  44.085  17.473  -7.333
  172   HD22  LEU  21          HD22      LEU  21  43.166  18.414  -6.134
  173   HD23  LEU  21          HD23      LEU  21  43.452  19.081  -7.759
  174    H    ASP  22           HN       ASP  22  40.247  15.570 -10.156
  175    HA   ASP  22           HA       ASP  22  41.129  14.750 -12.140
  176    HB2  ASP  22           HB2      ASP  22  43.695  15.081 -10.538
  177    HB3  ASP  22           HB1      ASP  22  43.634  14.786 -12.292
  178    H    HIS  23           HN       HIS  23  43.703  13.284 -10.198
  179    HA   HIS  23           HA       HIS  23  42.456  10.613 -10.290
  180    HB2  HIS  23           HB2      HIS  23  44.222   9.591 -11.656
  181    HB3  HIS  23           HB1      HIS  23  43.369  10.844 -12.589
  182    HD1  HIS  23           HD1      HIS  23  44.931  13.205 -10.897
  183    HD2  HIS  23           HD2      HIS  23  46.664  10.054 -13.075
  184    HE1  HIS  23           HE1      HIS  23  47.281  13.947 -11.569
  185    H    LEU  24           HN       LEU  24  43.185  12.181  -8.128
  186    HA   LEU  24           HA       LEU  24  44.997  10.382  -6.771
  187    HB2  LEU  24           HB2      LEU  24  46.755  11.554  -7.934
  188    HB3  LEU  24           HB1      LEU  24  46.027  13.133  -7.570
  189    HG   LEU  24           HG       LEU  24  46.544  12.917  -5.211
  190   HD11  LEU  24          HD11      LEU  24  47.252  10.053  -5.960
  191   HD12  LEU  24          HD12      LEU  24  46.116  10.624  -4.714
  192   HD13  LEU  24          HD13      LEU  24  47.867  10.809  -4.470
  193   HD21  LEU  24          HD21      LEU  24  48.386  13.599  -6.780
  194   HD22  LEU  24          HD22      LEU  24  48.933  11.906  -6.816
  195   HD23  LEU  24          HD23      LEU  24  48.985  12.826  -5.294
  Start of MODEL   33
    1    H1   GLY   1           HT1      GLY   1  59.753   7.866  -1.081
    2    H2   GLY   1           HT2      GLY   1  58.672   8.094   0.211
    3    H3   GLY   1           HT3      GLY   1  58.121   7.447  -1.260
    4    HA2  GLY   1           HA1      GLY   1  59.332   5.480  -0.969
    5    HA3  GLY   1           HA2      GLY   1  60.138   6.166   0.455
    6    H    LYS   2           HN       LYS   2  59.229   3.972   1.211
    7    HA   LYS   2           HA       LYS   2  56.379   3.844   1.737
    8    HB2  LYS   2           HB2      LYS   2  58.285   1.966   1.686
    9    HB3  LYS   2           HB1      LYS   2  58.403   2.340   3.419
   10    HG2  LYS   2           HG2      LYS   2  55.880   1.993   3.562
   11    HG3  LYS   2           HG1      LYS   2  55.940   1.396   1.886
   12    HD2  LYS   2           HD2      LYS   2  57.720  -0.266   2.661
   13    HD3  LYS   2           HD1      LYS   2  57.326   0.219   4.329
   14    HE2  LYS   2           HE2      LYS   2  54.913  -0.364   3.852
   15    HE3  LYS   2           HE1      LYS   2  55.437  -1.016   2.280
   16    HZ1  LYS   2           HZ1      LYS   2  56.019  -2.005   4.998
   17    HZ2  LYS   2           HZ2      LYS   2  57.108  -2.331   3.735
   18    HZ3  LYS   2           HZ3      LYS   2  55.498  -2.862   3.630
   19    H    GLY   3           HN       GLY   3  56.999   2.928   4.629
   20    HA2  GLY   3           HA1      GLY   3  56.225   4.045   6.669
   21    HA3  GLY   3           HA2      GLY   3  57.826   4.908   6.376
   22    H    ARG   4           HN       ARG   4  54.879   4.124   5.656
   23    HA   ARG   4           HA       ARG   4  53.851   5.500   7.061
   24    HB2  ARG   4           HB2      ARG   4  54.386   7.482   4.943
   25    HB3  ARG   4           HB1      ARG   4  52.665   7.459   5.362
   26    HG2  ARG   4           HG2      ARG   4  52.989   8.245   7.533
   27    HG3  ARG   4           HG1      ARG   4  54.628   7.587   7.667
   28    HD2  ARG   4           HD2      ARG   4  53.778  10.001   6.009
   29    HD3  ARG   4           HD1      ARG   4  54.714  10.035   7.522
   30    HE   ARG   4           HE       ARG   4  55.956   8.417   5.415
   31   HH11  ARG   4          HH11      ARG   4  57.065  10.319   7.666
   32   HH12  ARG   4          HH12      ARG   4  57.881  11.481   6.675
   33   HH21  ARG   4          HH21      ARG   4  56.349  10.448   3.740
   34   HH22  ARG   4          HH22      ARG   4  57.475  11.556   4.452
   35    H    TRP   5           HN       TRP   5  53.907   3.977   4.262
   36    HA   TRP   5           HA       TRP   5  51.434   3.946   3.001
   37    HB2  TRP   5           HB2      TRP   5  53.270   1.654   3.783
   38    HB3  TRP   5           HB1      TRP   5  51.781   1.363   2.857
   39    HD1  TRP   5           HD1      TRP   5  53.688   4.592   2.219
   40    HE1  TRP   5           HE1      TRP   5  54.772   4.529  -0.141
   41    HE3  TRP   5           HE3      TRP   5  52.800  -0.314   1.051
   42    HZ2  TRP   5           HZ2      TRP   5  55.183   2.593  -2.232
   43    HZ3  TRP   5           HZ3      TRP   5  53.547  -1.246  -1.133
   44    HH2  TRP   5           HH2      TRP   5  54.737   0.202  -2.774
   45    H    LEU   6           HN       LEU   6  52.141   3.226   6.283
   46    HA   LEU   6           HA       LEU   6  49.366   2.154   6.737
   47    HB2  LEU   6           HB2      LEU   6  51.790   1.862   8.550
   48    HB3  LEU   6           HB1      LEU   6  50.222   1.028   8.681
   49    HG   LEU   6           HG       LEU   6  52.226   0.720   6.399
   50   HD11  LEU   6          HD11      LEU   6  51.373  -1.223   8.592
   51   HD12  LEU   6          HD12      LEU   6  52.907  -0.319   8.570
   52   HD13  LEU   6          HD13      LEU   6  52.570  -1.534   7.313
   53   HD21  LEU   6          HD21      LEU   6  50.085   0.349   5.432
   54   HD22  LEU   6          HD22      LEU   6  49.443  -0.407   6.911
   55   HD23  LEU   6          HD23      LEU   6  50.616  -1.282   5.897
   56    H    GLU   7           HN       GLU   7  51.554   4.841   7.232
   57    HA   GLU   7           HA       GLU   7  49.702   5.886   9.394
   58    HB2  GLU   7           HB2      GLU   7  52.671   6.353   8.914
   59    HB3  GLU   7           HB1      GLU   7  51.680   7.350  10.004
   60    HG2  GLU   7           HG2      GLU   7  51.106   5.378  11.344
   61    HG3  GLU   7           HG1      GLU   7  51.984   4.321  10.213
   62    H    ARG   8           HN       ARG   8  49.532   5.907   6.407
   63    HA   ARG   8           HA       ARG   8  50.202   8.547   5.474
   64    HB2  ARG   8           HB2      ARG   8  48.828   7.991   3.554
   65    HB3  ARG   8           HB1      ARG   8  49.743   6.541   4.032
   66    HG2  ARG   8           HG2      ARG   8  47.699   5.834   5.388
   67    HG3  ARG   8           HG1      ARG   8  46.811   7.155   4.591
   68    HD2  ARG   8           HD2      ARG   8  48.153   4.768   3.255
   69    HD3  ARG   8           HD1      ARG   8  46.412   5.136   3.313
   70    HE   ARG   8           HE       ARG   8  47.760   7.343   2.097
   71   HH11  ARG   8          HH11      ARG   8  47.962   7.458  -0.157
   72   HH12  ARG   8          HH12      ARG   8  47.502   6.093  -1.121
   73   HH21  ARG   8          HH21      ARG   8  46.748   4.087   1.604
   74   HH22  ARG   8          HH22      ARG   8  46.815   4.185  -0.123
   75    H    ILE   9           HN       ILE   9  48.830  10.336   5.045
   76    HA   ILE   9           HA       ILE   9  46.997  10.901   7.210
   77    HB   ILE   9           HB       ILE   9  48.327  12.658   6.012
   78   HG12  ILE   9          HG12      ILE   9  45.302  13.047   5.820
   79   HG13  ILE   9          HG11      ILE   9  46.245  13.179   7.322
   80   HG21  ILE   9          HG21      ILE   9  47.777  13.354   3.795
   81   HG22  ILE   9          HG22      ILE   9  46.286  12.383   3.770
   82   HG23  ILE   9          HG23      ILE   9  47.874  11.581   3.712
   83   HD11  ILE   9           HD1      ILE   9  46.382  14.944   4.852
   84   HD12  ILE   9           HD2      ILE   9  47.679  14.932   6.073
   85   HD13  ILE   9           HD3      ILE   9  46.029  15.418   6.528
   86    H    GLY  10           HN       GLY  10  46.599  10.085   3.754
   87    HA2  GLY  10           HA1      GLY  10  44.674   9.592   2.547
   88    HA3  GLY  10           HA2      GLY  10  44.279   8.603   3.965
   89    H    LYS  11           HN       LYS  11  42.209   8.892   4.437
   90    HA   LYS  11           HA       LYS  11  40.185   9.978   4.793
   91    HB2  LYS  11           HB2      LYS  11  42.154  12.021   5.891
   92    HB3  LYS  11           HB1      LYS  11  40.390  12.138   6.104
   93    HG2  LYS  11           HG2      LYS  11  40.313  10.053   7.316
   94    HG3  LYS  11           HG1      LYS  11  42.005   9.683   6.905
   95    HD2  LYS  11           HD2      LYS  11  42.816  11.512   8.267
   96    HD3  LYS  11           HD1      LYS  11  41.163  12.123   8.523
   97    HE2  LYS  11           HE2      LYS  11  40.566  10.105   9.774
   98    HE3  LYS  11           HE1      LYS  11  42.161   9.391   9.438
   99    HZ1  LYS  11           HZ1      LYS  11  43.066  10.545  11.091
  100    HZ2  LYS  11           HZ2      LYS  11  41.494  10.957  11.587
  101    HZ3  LYS  11           HZ3      LYS  11  42.371  12.005  10.578
  102    H    ALA  12           HN       ALA  12  41.845  10.553   2.252
  103    HA   ALA  12           HA       ALA  12  41.394  11.692   0.296
  104    HB1  ALA  12           HB1      ALA  12  39.292  12.646  -0.070
  105    HB2  ALA  12           HB2      ALA  12  39.153  13.245   1.598
  106    HB3  ALA  12           HB3      ALA  12  38.965  11.509   1.257
  107    H    GLY  13           HN       GLY  13  42.039  13.189   3.291
  108    HA2  GLY  13           HA1      GLY  13  42.848  15.306   3.860
  109    HA3  GLY  13           HA2      GLY  13  43.925  14.986   2.486
  110    H    PHE  14           HN       PHE  14  40.474  15.895   2.907
  111    HA   PHE  14           HA       PHE  14  39.274  17.650   1.997
  112    HB2  PHE  14           HB2      PHE  14  41.840  19.010   1.118
  113    HB3  PHE  14           HB1      PHE  14  40.306  19.739   1.643
  114    HD1  PHE  14           HD1      PHE  14  43.605  18.870   2.692
  115    HD2  PHE  14           HD2      PHE  14  39.529  19.099   4.100
  116    HE1  PHE  14           HE1      PHE  14  44.422  18.971   5.043
  117    HE2  PHE  14           HE2      PHE  14  40.349  19.199   6.452
  118    HZ   PHE  14           HZ       PHE  14  42.796  19.163   6.920
  119    H    ILE  15           HN       ILE  15  39.564  15.389   0.522
  120    HA   ILE  15           HA       ILE  15  39.264  14.597  -1.621
  121    HB   ILE  15           HB       ILE  15  39.100  17.483  -2.571
  122   HG12  ILE  15          HG12      ILE  15  37.603  17.441  -0.711
  123   HG13  ILE  15          HG11      ILE  15  36.577  17.187  -2.133
  124   HG21  ILE  15          HG21      ILE  15  37.388  16.369  -4.148
  125   HG22  ILE  15          HG22      ILE  15  38.055  14.816  -3.597
  126   HG23  ILE  15          HG23      ILE  15  39.101  15.993  -4.416
  127   HD11  ILE  15           HD1      ILE  15  37.522  15.115  -0.111
  128   HD12  ILE  15           HD2      ILE  15  36.798  14.664  -1.670
  129   HD13  ILE  15           HD3      ILE  15  35.855  15.595  -0.490
  130    H    ILE  16           HN       ILE  16  41.528  13.918  -1.432
  131    HA   ILE  16           HA       ILE  16  43.191  15.260  -3.551
  132    HB   ILE  16           HB       ILE  16  44.155  14.219  -0.845
  133   HG12  ILE  16          HG12      ILE  16  43.120  16.612  -1.094
  134   HG13  ILE  16          HG11      ILE  16  44.689  16.450  -0.280
  135   HG21  ILE  16          HG21      ILE  16  45.799  13.538  -2.451
  136   HG22  ILE  16          HG22      ILE  16  46.428  15.019  -1.698
  137   HG23  ILE  16          HG23      ILE  16  45.698  15.087  -3.321
  138   HD11  ILE  16           HD1      ILE  16  44.510  18.346  -1.989
  139   HD12  ILE  16           HD2      ILE  16  44.451  17.103  -3.253
  140   HD13  ILE  16           HD3      ILE  16  45.883  17.243  -2.212
  141    H    ILE  17           HN       ILE  17  43.601  12.409  -1.395
  142    HA   ILE  17           HA       ILE  17  44.426  10.816  -3.701
  143    HB   ILE  17           HB       ILE  17  45.406  10.311  -1.522
  144   HG12  ILE  17          HG12      ILE  17  45.000   7.903  -1.381
  145   HG13  ILE  17          HG11      ILE  17  43.463   8.065  -2.255
  146   HG21  ILE  17          HG21      ILE  17  43.947   9.355   0.300
  147   HG22  ILE  17          HG22      ILE  17  42.525   9.834  -0.655
  148   HG23  ILE  17          HG23      ILE  17  43.649  11.073  -0.047
  149   HD11  ILE  17           HD1      ILE  17  44.542   8.550  -4.310
  150   HD12  ILE  17           HD2      ILE  17  45.593   7.312  -3.588
  151   HD13  ILE  17           HD3      ILE  17  46.058   9.028  -3.511
  152    H    GLY  18           HN       GLY  18  41.481  11.431  -1.899
  153    HA2  GLY  18           HA1      GLY  18  40.013   9.160  -2.957
  154    HA3  GLY  18           HA2      GLY  18  39.329  10.586  -2.148
  155    H    GLY  19           HN       GLY  19  39.984  12.684  -3.662
  156    HA2  GLY  19           HA1      GLY  19  38.285  12.296  -6.005
  157    HA3  GLY  19           HA2      GLY  19  39.067  13.803  -5.487
  158    H    ALA  20           HN       ALA  20  41.739  13.061  -5.428
  159    HA   ALA  20           HA       ALA  20  43.545  13.002  -6.884
  160    HB1  ALA  20           HB1      ALA  20  41.949  10.899  -8.377
  161    HB2  ALA  20           HB2      ALA  20  42.803  10.581  -6.849
  162    HB3  ALA  20           HB3      ALA  20  43.718  11.075  -8.294
  163    H    LEU  21           HN       LEU  21  40.797  14.414  -7.642
  164    HA   LEU  21           HA       LEU  21  40.054  15.745  -9.391
  165    HB2  LEU  21           HB2      LEU  21  43.064  15.769  -9.808
  166    HB3  LEU  21           HB1      LEU  21  41.971  16.708 -10.851
  167    HG   LEU  21           HG       LEU  21  41.060  17.876  -8.872
  168   HD11  LEU  21          HD11      LEU  21  42.948  15.998  -7.401
  169   HD12  LEU  21          HD12      LEU  21  41.224  16.314  -7.090
  170   HD13  LEU  21          HD13      LEU  21  42.439  17.546  -6.683
  171   HD21  LEU  21          HD21      LEU  21  44.113  17.880  -8.926
  172   HD22  LEU  21          HD22      LEU  21  43.068  19.195  -8.337
  173   HD23  LEU  21          HD23      LEU  21  43.069  18.764 -10.065
  174    H    ASP  22           HN       ASP  22  42.444  15.159 -11.729
  175    HA   ASP  22           HA       ASP  22  42.338  14.098 -13.786
  176    HB2  ASP  22           HB2      ASP  22  42.750  12.108 -12.403
  177    HB3  ASP  22           HB1      ASP  22  41.002  11.920 -12.128
  178    H    HIS  23           HN       HIS  23  39.360  12.585 -12.547
  179    HA   HIS  23           HA       HIS  23  37.624  14.437 -14.018
  180    HB2  HIS  23           HB2      HIS  23  38.497  13.026 -15.868
  181    HB3  HIS  23           HB1      HIS  23  37.919  11.574 -15.015
  182    HD1  HIS  23           HD1      HIS  23  36.065  14.907 -15.272
  183    HD2  HIS  23           HD2      HIS  23  35.709  10.929 -16.590
  184    HE1  HIS  23           HE1      HIS  23  33.792  14.686 -16.418
  185    H    LEU  24           HN       LEU  24  38.279  12.477 -11.503
  186    HA   LEU  24           HA       LEU  24  35.683  11.169 -11.161
  187    HB2  LEU  24           HB2      LEU  24  37.697  11.747  -8.964
  188    HB3  LEU  24           HB1      LEU  24  36.545  10.396  -9.092
  189    HG   LEU  24           HG       LEU  24  38.988  10.877 -10.856
  190   HD11  LEU  24          HD11      LEU  24  38.324   8.607  -8.930
  191   HD12  LEU  24          HD12      LEU  24  39.377   9.986  -8.527
  192   HD13  LEU  24          HD13      LEU  24  39.849   8.850  -9.815
  193   HD21  LEU  24          HD21      LEU  24  37.325   9.904 -12.280
  194   HD22  LEU  24          HD22      LEU  24  36.724   8.840 -10.985
  195   HD23  LEU  24          HD23      LEU  24  38.314   8.534 -11.725
  Start of MODEL   34
    1    H1   GLY   1           HT1      GLY   1  64.225   0.058   6.370
    2    H2   GLY   1           HT2      GLY   1  62.727  -0.178   5.602
    3    H3   GLY   1           HT3      GLY   1  63.120  -1.065   6.997
    4    HA2  GLY   1           HA1      GLY   1  62.817   0.662   8.393
    5    HA3  GLY   1           HA2      GLY   1  63.098   1.846   7.103
    6    H    LYS   2           HN       LYS   2  60.951  -1.015   7.210
    7    HA   LYS   2           HA       LYS   2  58.761   0.518   6.060
    8    HB2  LYS   2           HB2      LYS   2  57.474  -1.549   6.316
    9    HB3  LYS   2           HB1      LYS   2  59.094  -1.932   5.688
   10    HG2  LYS   2           HG2      LYS   2  59.817  -2.366   8.089
   11    HG3  LYS   2           HG1      LYS   2  58.104  -2.235   8.553
   12    HD2  LYS   2           HD2      LYS   2  57.567  -4.040   6.888
   13    HD3  LYS   2           HD1      LYS   2  59.312  -4.228   6.587
   14    HE2  LYS   2           HE2      LYS   2  58.465  -5.879   8.256
   15    HE3  LYS   2           HE1      LYS   2  59.689  -4.790   8.951
   16    HZ1  LYS   2           HZ1      LYS   2  56.751  -4.359   9.164
   17    HZ2  LYS   2           HZ2      LYS   2  57.976  -3.482   9.950
   18    HZ3  LYS   2           HZ3      LYS   2  57.691  -5.105  10.363
   19    H    GLY   3           HN       GLY   3  56.621  -0.697   7.648
   20    HA2  GLY   3           HA1      GLY   3  55.154   0.216   9.330
   21    HA3  GLY   3           HA2      GLY   3  56.657   0.049  10.392
   22    H    ARG   4           HN       ARG   4  55.033   1.137   7.972
   23    HA   ARG   4           HA       ARG   4  53.837   2.670   8.962
   24    HB2  ARG   4           HB2      ARG   4  56.319   4.287   8.718
   25    HB3  ARG   4           HB1      ARG   4  54.867   5.168   8.189
   26    HG2  ARG   4           HG2      ARG   4  53.971   5.324  10.322
   27    HG3  ARG   4           HG1      ARG   4  54.601   3.757  10.847
   28    HD2  ARG   4           HD2      ARG   4  55.617   5.910  11.907
   29    HD3  ARG   4           HD1      ARG   4  56.749   4.663  11.337
   30    HE   ARG   4           HE       ARG   4  56.199   6.570   9.237
   31   HH11  ARG   4          HH11      ARG   4  58.897   5.421  10.012
   32   HH12  ARG   4          HH12      ARG   4  59.713   6.829  10.602
   33   HH21  ARG   4          HH21      ARG   4  56.808   8.693  10.944
   34   HH22  ARG   4          HH22      ARG   4  58.530   8.683  11.130
   35    H    TRP   5           HN       TRP   5  55.470   1.732   6.386
   36    HA   TRP   5           HA       TRP   5  54.926   3.266   4.135
   37    HB2  TRP   5           HB2      TRP   5  54.735   0.280   4.604
   38    HB3  TRP   5           HB1      TRP   5  54.453   0.966   2.988
   39    HD1  TRP   5           HD1      TRP   5  57.044   2.640   5.212
   40    HE1  TRP   5           HE1      TRP   5  59.427   2.239   4.256
   41    HE3  TRP   5           HE3      TRP   5  55.896  -0.799   1.595
   42    HZ2  TRP   5           HZ2      TRP   5  60.639   0.635   2.195
   43    HZ3  TRP   5           HZ3      TRP   5  57.682  -1.749   0.146
   44    HH2  TRP   5           HH2      TRP   5  60.051  -1.036   0.442
   45    H    LEU   6           HN       LEU   6  52.699   1.760   6.301
   46    HA   LEU   6           HA       LEU   6  50.377   2.170   4.455
   47    HB2  LEU   6           HB2      LEU   6  50.339   0.937   7.231
   48    HB3  LEU   6           HB1      LEU   6  49.156   0.747   5.914
   49    HG   LEU   6           HG       LEU   6  52.026  -0.288   5.936
   50   HD11  LEU   6          HD11      LEU   6  51.014  -2.485   6.035
   51   HD12  LEU   6          HD12      LEU   6  49.383  -1.800   5.832
   52   HD13  LEU   6          HD13      LEU   6  50.292  -1.505   7.334
   53   HD21  LEU   6          HD21      LEU   6  51.177  -1.440   3.771
   54   HD22  LEU   6          HD22      LEU   6  51.557   0.294   3.665
   55   HD23  LEU   6          HD23      LEU   6  49.862  -0.239   3.791
   56    H    GLU   7           HN       GLU   7  52.033   3.557   7.245
   57    HA   GLU   7           HA       GLU   7  49.700   4.905   8.326
   58    HB2  GLU   7           HB2      GLU   7  51.934   4.506   9.479
   59    HB3  GLU   7           HB1      GLU   7  52.588   5.831   8.485
   60    HG2  GLU   7           HG2      GLU   7  51.909   6.821  10.573
   61    HG3  GLU   7           HG1      GLU   7  50.674   7.280   9.379
   62    H    ARG   8           HN       ARG   8  51.913   5.546   5.675
   63    HA   ARG   8           HA       ARG   8  51.368   8.361   5.413
   64    HB2  ARG   8           HB2      ARG   8  52.203   6.299   3.335
   65    HB3  ARG   8           HB1      ARG   8  52.240   8.064   3.102
   66    HG2  ARG   8           HG2      ARG   8  53.798   8.290   5.011
   67    HG3  ARG   8           HG1      ARG   8  53.761   6.528   5.256
   68    HD2  ARG   8           HD2      ARG   8  54.697   7.936   2.716
   69    HD3  ARG   8           HD1      ARG   8  55.761   7.223   3.952
   70    HE   ARG   8           HE       ARG   8  53.999   5.171   3.162
   71   HH11  ARG   8          HH11      ARG   8  56.999   6.502   2.467
   72   HH12  ARG   8          HH12      ARG   8  57.194   5.709   0.940
   73   HH21  ARG   8          HH21      ARG   8  53.962   4.456   0.875
   74   HH22  ARG   8          HH22      ARG   8  55.476   4.550   0.039
   75    H    ILE   9           HN       ILE   9  50.096   9.442   3.801
   76    HA   ILE   9           HA       ILE   9  48.076   7.979   2.306
   77    HB   ILE   9           HB       ILE   9  47.098   7.832   4.608
   78   HG12  ILE   9          HG12      ILE   9  45.591   9.700   2.718
   79   HG13  ILE   9          HG11      ILE   9  45.690   7.932   2.540
   80   HG21  ILE   9          HG21      ILE   9  48.126  10.158   5.247
   81   HG22  ILE   9          HG22      ILE   9  46.517   9.741   5.876
   82   HG23  ILE   9          HG23      ILE   9  46.668  10.840   4.487
   83   HD11  ILE   9           HD1      ILE   9  44.410   9.505   4.810
   84   HD12  ILE   9           HD2      ILE   9  44.743   7.758   4.908
   85   HD13  ILE   9           HD3      ILE   9  43.619   8.383   3.678
   86    H    GLY  10           HN       GLY  10  47.840   9.110   0.517
   87    HA2  GLY  10           HA1      GLY  10  48.494  12.016   0.538
   88    HA3  GLY  10           HA2      GLY  10  48.309  10.969  -0.884
   89    H    LYS  11           HN       LYS  11  45.789   9.821   0.277
   90    HA   LYS  11           HA       LYS  11  43.985  11.844  -0.876
   91    HB2  LYS  11           HB2      LYS  11  43.457   9.097   0.331
   92    HB3  LYS  11           HB1      LYS  11  42.271  10.089  -0.553
   93    HG2  LYS  11           HG2      LYS  11  43.805  10.068  -2.541
   94    HG3  LYS  11           HG1      LYS  11  44.882   8.963  -1.654
   95    HD2  LYS  11           HD2      LYS  11  43.114   7.285  -1.496
   96    HD3  LYS  11           HD1      LYS  11  41.942   8.401  -2.236
   97    HE2  LYS  11           HE2      LYS  11  43.010   6.643  -3.795
   98    HE3  LYS  11           HE1      LYS  11  43.047   8.333  -4.350
   99    HZ1  LYS  11           HZ1      LYS  11  45.197   6.855  -4.355
  100    HZ2  LYS  11           HZ2      LYS  11  45.287   7.340  -2.729
  101    HZ3  LYS  11           HZ3      LYS  11  45.275   8.504  -3.968
  102    H    ALA  12           HN       ALA  12  44.122  13.554   0.664
  103    HA   ALA  12           HA       ALA  12  43.379  12.990   3.463
  104    HB1  ALA  12           HB1      ALA  12  44.972  14.833   2.634
  105    HB2  ALA  12           HB2      ALA  12  43.755  15.297   3.846
  106    HB3  ALA  12           HB3      ALA  12  43.510  15.711   2.132
  107    H    GLY  13           HN       GLY  13  41.622  12.498   0.971
  108    HA2  GLY  13           HA1      GLY  13  39.367  12.629   0.486
  109    HA3  GLY  13           HA2      GLY  13  39.117  12.962   2.213
  110    H    PHE  14           HN       PHE  14  41.181  15.070   0.391
  111    HA   PHE  14           HA       PHE  14  38.980  17.016  -0.130
  112    HB2  PHE  14           HB2      PHE  14  39.820  17.437   2.210
  113    HB3  PHE  14           HB1      PHE  14  41.432  17.746   1.520
  114    HD1  PHE  14           HD1      PHE  14  41.797  19.670  -0.029
  115    HD2  PHE  14           HD2      PHE  14  38.017  19.042   1.963
  116    HE1  PHE  14           HE1      PHE  14  41.124  22.008  -0.566
  117    HE2  PHE  14           HE2      PHE  14  37.347  21.381   1.425
  118    HZ   PHE  14           HZ       PHE  14  38.870  22.837   0.096
  119    H    ILE  15           HN       ILE  15  42.572  16.645  -0.054
  120    HA   ILE  15           HA       ILE  15  42.816  18.277  -2.486
  121    HB   ILE  15           HB       ILE  15  45.222  17.802  -2.328
  122   HG12  ILE  15          HG12      ILE  15  44.347  15.950  -0.064
  123   HG13  ILE  15          HG11      ILE  15  45.154  15.475  -1.575
  124   HG21  ILE  15          HG21      ILE  15  45.630  19.016  -0.302
  125   HG22  ILE  15          HG22      ILE  15  44.158  18.374   0.467
  126   HG23  ILE  15          HG23      ILE  15  44.028  19.551  -0.862
  127   HD11  ILE  15           HD1      ILE  15  47.068  17.071  -0.833
  128   HD12  ILE  15           HD2      ILE  15  46.904  15.523   0.029
  129   HD13  ILE  15           HD3      ILE  15  46.301  17.021   0.773
  130    H    ILE  16           HN       ILE  16  41.185  15.890  -2.643
  131    HA   ILE  16           HA       ILE  16  42.525  14.718  -5.015
  132    HB   ILE  16           HB       ILE  16  43.140  13.310  -2.996
  133   HG12  ILE  16          HG12      ILE  16  42.358  11.121  -4.095
  134   HG13  ILE  16          HG11      ILE  16  41.424  12.120  -5.230
  135   HG21  ILE  16          HG21      ILE  16  40.219  12.465  -3.031
  136   HG22  ILE  16          HG22      ILE  16  40.855  13.680  -1.895
  137   HG23  ILE  16          HG23      ILE  16  41.482  12.016  -1.862
  138   HD11  ILE  16           HD1      ILE  16  44.381  12.705  -4.862
  139   HD12  ILE  16           HD2      ILE  16  43.351  12.955  -6.290
  140   HD13  ILE  16           HD3      ILE  16  43.888  11.319  -5.859
  141    H    ILE  17           HN       ILE  17  39.678  14.706  -2.840
  142    HA   ILE  17           HA       ILE  17  37.905  13.938  -5.058
  143    HB   ILE  17           HB       ILE  17  37.283  13.244  -2.781
  144   HG12  ILE  17          HG12      ILE  17  34.991  14.069  -2.687
  145   HG13  ILE  17          HG11      ILE  17  35.411  15.499  -3.651
  146   HG21  ILE  17          HG21      ILE  17  36.744  14.909  -1.045
  147   HG22  ILE  17          HG22      ILE  17  37.186  16.227  -2.154
  148   HG23  ILE  17          HG23      ILE  17  38.430  15.092  -1.580
  149   HD11  ILE  17           HD1      ILE  17  35.880  12.712  -4.765
  150   HD12  ILE  17           HD2      ILE  17  35.650  14.244  -5.643
  151   HD13  ILE  17           HD3      ILE  17  34.267  13.458  -4.848
  152    H    GLY  18           HN       GLY  18  39.054  16.792  -3.380
  153    HA2  GLY  18           HA1      GLY  18  37.206  18.591  -4.848
  154    HA3  GLY  18           HA2      GLY  18  38.392  19.049  -3.607
  155    H    GLY  19           HN       GLY  19  40.727  17.949  -4.516
  156    HA2  GLY  19           HA1      GLY  19  41.596  19.851  -6.425
  157    HA3  GLY  19           HA2      GLY  19  42.451  18.354  -5.998
  158    H    ALA  20           HN       ALA  20  40.421  16.508  -6.819
  159    HA   ALA  20           HA       ALA  20  41.053  16.441  -9.672
  160    HB1  ALA  20           HB1      ALA  20  39.820  14.348  -9.669
  161    HB2  ALA  20           HB2      ALA  20  39.123  14.722  -8.075
  162    HB3  ALA  20           HB3      ALA  20  40.869  14.413  -8.235
  163    H    LEU  21           HN       LEU  21  37.873  16.211  -8.014
  164    HA   LEU  21           HA       LEU  21  35.800  17.005  -8.641
  165    HB2  LEU  21           HB2      LEU  21  37.507  19.179  -8.657
  166    HB3  LEU  21           HB1      LEU  21  36.858  19.265 -10.306
  167    HG   LEU  21           HG       LEU  21  35.174  19.107  -7.759
  168   HD11  LEU  21          HD11      LEU  21  36.456  21.253  -8.076
  169   HD12  LEU  21          HD12      LEU  21  34.689  21.461  -8.153
  170   HD13  LEU  21          HD13      LEU  21  35.650  21.449  -9.651
  171   HD21  LEU  21          HD21      LEU  21  33.951  18.140  -9.598
  172   HD22  LEU  21          HD22      LEU  21  34.502  19.412 -10.716
  173   HD23  LEU  21          HD23      LEU  21  33.352  19.804  -9.416
  174    H    ASP  22           HN       ASP  22  37.865  15.579 -10.665
  175    HA   ASP  22           HA       ASP  22  36.593  16.138 -13.245
  176    HB2  ASP  22           HB2      ASP  22  38.397  13.831 -12.408
  177    HB3  ASP  22           HB1      ASP  22  38.007  14.323 -14.074
  178    H    HIS  23           HN       HIS  23  34.975  15.166 -10.850
  179    HA   HIS  23           HA       HIS  23  33.238  13.677 -10.460
  180    HB2  HIS  23           HB2      HIS  23  33.281  13.638 -13.503
  181    HB3  HIS  23           HB1      HIS  23  31.984  12.931 -12.510
  182    HD1  HIS  23           HD1      HIS  23  31.788  15.099 -10.291
  183    HD2  HIS  23           HD2      HIS  23  31.912  15.906 -14.415
  184    HE1  HIS  23           HE1      HIS  23  30.776  17.417 -10.643
  185    H    LEU  24           HN       LEU  24  35.918  12.605 -10.404
  186    HA   LEU  24           HA       LEU  24  36.120  10.128 -11.804
  187    HB2  LEU  24           HB2      LEU  24  38.067  11.086 -10.751
  188    HB3  LEU  24           HB1      LEU  24  37.282  11.082  -9.158
  189    HG   LEU  24           HG       LEU  24  37.338   8.661  -9.048
  190   HD11  LEU  24          HD11      LEU  24  38.180   8.872 -11.966
  191   HD12  LEU  24          HD12      LEU  24  36.827   7.949 -11.266
  192   HD13  LEU  24          HD13      LEU  24  38.501   7.409 -11.004
  193   HD21  LEU  24          HD21      LEU  24  39.971   9.741 -10.152
  194   HD22  LEU  24          HD22      LEU  24  39.785   8.255  -9.189
  195   HD23  LEU  24          HD23      LEU  24  39.431   9.840  -8.460
  Start of MODEL   35
    1    H1   GLY   1           HT1      GLY   1  59.524   2.870  -2.544
    2    H2   GLY   1           HT2      GLY   1  60.904   2.211  -1.806
    3    H3   GLY   1           HT3      GLY   1  59.702   2.953  -0.861
    4    HA2  GLY   1           HA1      GLY   1  58.432   1.024  -2.337
    5    HA3  GLY   1           HA2      GLY   1  59.924   0.294  -1.713
    6    H    LYS   2           HN       LYS   2  56.782   1.595  -0.963
    7    HA   LYS   2           HA       LYS   2  55.563   1.633   1.014
    8    HB2  LYS   2           HB2      LYS   2  57.297  -0.805   1.622
    9    HB3  LYS   2           HB1      LYS   2  55.785  -0.376   2.444
   10    HG2  LYS   2           HG2      LYS   2  54.941  -1.868   0.860
   11    HG3  LYS   2           HG1      LYS   2  54.803  -0.353  -0.058
   12    HD2  LYS   2           HD2      LYS   2  56.884  -0.825  -1.248
   13    HD3  LYS   2           HD1      LYS   2  57.201  -2.243  -0.220
   14    HE2  LYS   2           HE2      LYS   2  56.193  -2.750  -2.510
   15    HE3  LYS   2           HE1      LYS   2  55.312  -3.426  -1.120
   16    HZ1  LYS   2           HZ1      LYS   2  53.835  -2.343  -2.723
   17    HZ2  LYS   2           HZ2      LYS   2  54.648  -0.869  -2.496
   18    HZ3  LYS   2           HZ3      LYS   2  53.786  -1.573  -1.212
   19    H    GLY   3           HN       GLY   3  56.320   0.782   3.662
   20    HA2  GLY   3           HA1      GLY   3  57.063   2.026   5.588
   21    HA3  GLY   3           HA2      GLY   3  58.688   1.931   4.707
   22    H    ARG   4           HN       ARG   4  55.702   2.737   4.988
   23    HA   ARG   4           HA       ARG   4  55.845   4.445   6.329
   24    HB2  ARG   4           HB2      ARG   4  56.606   5.900   3.852
   25    HB3  ARG   4           HB1      ARG   4  55.383   6.762   4.808
   26    HG2  ARG   4           HG2      ARG   4  56.829   7.240   6.561
   27    HG3  ARG   4           HG1      ARG   4  57.746   5.738   6.389
   28    HD2  ARG   4           HD2      ARG   4  58.777   6.702   4.277
   29    HD3  ARG   4           HD1      ARG   4  57.958   8.236   4.652
   30    HE   ARG   4           HE       ARG   4  60.316   7.157   6.017
   31   HH11  ARG   4          HH11      ARG   4  60.006   7.680   8.433
   32   HH12  ARG   4          HH12      ARG   4  59.566   9.331   8.718
   33   HH21  ARG   4          HH21      ARG   4  58.678   9.942   5.423
   34   HH22  ARG   4          HH22      ARG   4  58.814  10.611   7.015
   35    H    TRP   5           HN       TRP   5  54.476   3.051   3.845
   36    HA   TRP   5           HA       TRP   5  52.092   4.179   3.044
   37    HB2  TRP   5           HB2      TRP   5  52.885   1.842   2.543
   38    HB3  TRP   5           HB1      TRP   5  52.309   1.365   4.159
   39    HD1  TRP   5           HD1      TRP   5  49.920   0.515   4.224
   40    HE1  TRP   5           HE1      TRP   5  47.786   0.726   2.756
   41    HE3  TRP   5           HE3      TRP   5  51.690   3.772   0.692
   42    HZ2  TRP   5           HZ2      TRP   5  46.988   2.129   0.371
   43    HZ3  TRP   5           HZ3      TRP   5  50.224   4.532  -1.171
   44    HH2  TRP   5           HH2      TRP   5  47.877   3.714  -1.334
   45    H    LEU   6           HN       LEU   6  53.022   3.250   6.261
   46    HA   LEU   6           HA       LEU   6  50.265   3.525   7.348
   47    HB2  LEU   6           HB2      LEU   6  52.953   2.713   8.502
   48    HB3  LEU   6           HB1      LEU   6  51.563   3.053   9.549
   49    HG   LEU   6           HG       LEU   6  51.934   0.601   8.922
   50   HD11  LEU   6          HD11      LEU   6  49.689   1.696   9.658
   51   HD12  LEU   6          HD12      LEU   6  49.623   0.102   8.876
   52   HD13  LEU   6          HD13      LEU   6  49.215   1.560   7.951
   53   HD21  LEU   6          HD21      LEU   6  51.343  -0.169   6.722
   54   HD22  LEU   6          HD22      LEU   6  52.519   1.150   6.510
   55   HD23  LEU   6          HD23      LEU   6  50.787   1.446   6.230
   56    H    GLU   7           HN       GLU   7  53.358   5.283   7.086
   57    HA   GLU   7           HA       GLU   7  52.677   7.208   9.172
   58    HB2  GLU   7           HB2      GLU   7  55.001   6.690   8.197
   59    HB3  GLU   7           HB1      GLU   7  54.523   7.690   6.806
   60    HG2  GLU   7           HG2      GLU   7  54.059   9.591   8.340
   61    HG3  GLU   7           HG1      GLU   7  54.570   8.591   9.722
   62    H    ARG   8           HN       ARG   8  51.686   6.690   5.918
   63    HA   ARG   8           HA       ARG   8  51.104   9.365   5.106
   64    HB2  ARG   8           HB2      ARG   8  51.083   7.229   3.700
   65    HB3  ARG   8           HB1      ARG   8  49.480   6.896   4.393
   66    HG2  ARG   8           HG2      ARG   8  48.697   9.124   3.566
   67    HG3  ARG   8           HG1      ARG   8  50.284   9.367   2.795
   68    HD2  ARG   8           HD2      ARG   8  49.958   7.403   1.386
   69    HD3  ARG   8           HD1      ARG   8  48.443   7.004   2.229
   70    HE   ARG   8           HE       ARG   8  48.192   9.644   1.196
   71   HH11  ARG   8          HH11      ARG   8  46.165   9.258  -0.072
   72   HH12  ARG   8          HH12      ARG   8  46.353   8.234  -1.456
   73   HH21  ARG   8          HH21      ARG   8  49.480   7.076  -0.505
   74   HH22  ARG   8          HH22      ARG   8  48.231   6.999  -1.700
   75    H    ILE   9           HN       ILE   9  49.537  10.781   5.615
   76    HA   ILE   9           HA       ILE   9  47.871  10.307   7.905
   77    HB   ILE   9           HB       ILE   9  46.743  12.445   7.260
   78   HG12  ILE   9          HG12      ILE   9  48.518  12.162   4.789
   79   HG13  ILE   9          HG11      ILE   9  46.740  12.163   4.823
   80   HG21  ILE   9          HG21      ILE   9  48.660  13.841   7.631
   81   HG22  ILE   9          HG22      ILE   9  49.756  12.666   6.863
   82   HG23  ILE   9          HG23      ILE   9  49.022  12.301   8.443
   83   HD11  ILE   9           HD1      ILE   9  47.297  14.382   4.195
   84   HD12  ILE   9           HD2      ILE   9  48.644  14.467   5.354
   85   HD13  ILE   9           HD3      ILE   9  46.962  14.509   5.938
   86    H    GLY  10           HN       GLY  10  47.348   9.997   4.418
   87    HA2  GLY  10           HA1      GLY  10  45.599   9.060   3.236
   88    HA3  GLY  10           HA2      GLY  10  45.208   8.157   4.713
   89    H    LYS  11           HN       LYS  11  45.159  11.667   3.989
   90    HA   LYS  11           HA       LYS  11  42.202  11.692   4.069
   91    HB2  LYS  11           HB2      LYS  11  43.905  13.006   6.226
   92    HB3  LYS  11           HB1      LYS  11  42.201  13.421   5.920
   93    HG2  LYS  11           HG2      LYS  11  41.699  10.902   6.211
   94    HG3  LYS  11           HG1      LYS  11  43.347  10.762   6.864
   95    HD2  LYS  11           HD2      LYS  11  41.132  12.566   7.934
   96    HD3  LYS  11           HD1      LYS  11  41.732  11.075   8.696
   97    HE2  LYS  11           HE2      LYS  11  43.165  13.730   8.348
   98    HE3  LYS  11           HE1      LYS  11  42.868  12.816   9.843
   99    HZ1  LYS  11           HZ1      LYS  11  44.265  11.011   8.619
  100    HZ2  LYS  11           HZ2      LYS  11  45.043  12.298   9.412
  101    HZ3  LYS  11           HZ3      LYS  11  44.851  12.327   7.724
  102    H    ALA  12           HN       ALA  12  42.937  12.332   1.852
  103    HA   ALA  12           HA       ALA  12  44.176  14.985   1.590
  104    HB1  ALA  12           HB1      ALA  12  44.433  13.071  -0.049
  105    HB2  ALA  12           HB2      ALA  12  43.966  14.632  -0.766
  106    HB3  ALA  12           HB3      ALA  12  42.745  13.357  -0.532
  107    H    GLY  13           HN       GLY  13  42.063  15.328   3.250
  108    HA2  GLY  13           HA1      GLY  13  40.221  16.695   3.522
  109    HA3  GLY  13           HA2      GLY  13  40.554  17.348   1.908
  110    H    PHE  14           HN       PHE  14  39.282  14.366   3.450
  111    HA   PHE  14           HA       PHE  14  37.506  13.009   2.836
  112    HB2  PHE  14           HB2      PHE  14  36.402  15.609   1.702
  113    HB3  PHE  14           HB1      PHE  14  35.462  14.145   2.081
  114    HD1  PHE  14           HD1      PHE  14  37.378  16.989   3.500
  115    HD2  PHE  14           HD2      PHE  14  35.007  13.494   4.392
  116    HE1  PHE  14           HE1      PHE  14  37.164  17.737   5.867
  117    HE2  PHE  14           HE2      PHE  14  34.795  14.242   6.759
  118    HZ   PHE  14           HZ       PHE  14  35.953  16.315   7.516
  119    H    ILE  15           HN       ILE  15  39.755  13.310   0.953
  120    HA   ILE  15           HA       ILE  15  40.289  12.627  -1.173
  121    HB   ILE  15           HB       ILE  15  37.439  11.591  -1.459
  122   HG12  ILE  15          HG12      ILE  15  39.817  10.325  -0.020
  123   HG13  ILE  15          HG11      ILE  15  38.293  10.854   0.728
  124   HG21  ILE  15          HG21      ILE  15  39.110  11.577  -3.405
  125   HG22  ILE  15          HG22      ILE  15  38.413  10.002  -2.970
  126   HG23  ILE  15          HG23      ILE  15  40.066  10.417  -2.455
  127   HD11  ILE  15           HD1      ILE  15  37.999   8.518   0.440
  128   HD12  ILE  15           HD2      ILE  15  38.768   8.527  -1.163
  129   HD13  ILE  15           HD3      ILE  15  37.141   9.220  -0.951
  130    H    ILE  16           HN       ILE  16  40.147  15.057  -1.268
  131    HA   ILE  16           HA       ILE  16  38.461  15.784  -3.648
  132    HB   ILE  16           HB       ILE  16  39.060  17.477  -1.190
  133   HG12  ILE  16          HG12      ILE  16  37.186  15.666  -1.064
  134   HG13  ILE  16          HG11      ILE  16  36.785  17.317  -0.566
  135   HG21  ILE  16          HG21      ILE  16  37.509  19.138  -2.370
  136   HG22  ILE  16          HG22      ILE  16  37.671  18.126  -3.825
  137   HG23  ILE  16          HG23      ILE  16  39.101  18.915  -3.126
  138   HD11  ILE  16           HD1      ILE  16  36.240  16.279  -3.382
  139   HD12  ILE  16           HD2      ILE  16  35.613  17.756  -2.622
  140   HD13  ILE  16           HD3      ILE  16  35.063  16.163  -2.059
  141    H    ILE  17           HN       ILE  17  41.216  16.606  -1.510
  142    HA   ILE  17           HA       ILE  17  42.548  18.195  -3.560
  143    HB   ILE  17           HB       ILE  17  43.486  16.988  -0.913
  144   HG12  ILE  17          HG12      ILE  17  43.554  19.361  -0.217
  145   HG13  ILE  17          HG11      ILE  17  43.041  19.865  -1.844
  146   HG21  ILE  17          HG21      ILE  17  45.481  17.035  -2.249
  147   HG22  ILE  17          HG22      ILE  17  45.520  18.531  -1.289
  148   HG23  ILE  17          HG23      ILE  17  45.029  18.583  -2.999
  149   HD11  ILE  17           HD1      ILE  17  40.862  19.003  -1.564
  150   HD12  ILE  17           HD2      ILE  17  41.228  19.658   0.046
  151   HD13  ILE  17           HD3      ILE  17  41.353  17.908  -0.250
  152    H    GLY  18           HN       GLY  18  42.881  14.903  -2.220
  153    HA2  GLY  18           HA1      GLY  18  44.999  14.175  -4.088
  154    HA3  GLY  18           HA2      GLY  18  44.116  13.089  -2.994
  155    H    GLY  19           HN       GLY  19  41.510  13.399  -3.730
  156    HA2  GLY  19           HA1      GLY  19  41.344  11.746  -6.047
  157    HA3  GLY  19           HA2      GLY  19  39.997  12.631  -5.307
  158    H    ALA  20           HN       ALA  20  40.900  15.265  -5.626
  159    HA   ALA  20           HA       ALA  20  40.827  16.967  -7.193
  160    HB1  ALA  20           HB1      ALA  20  42.102  15.034  -9.148
  161    HB2  ALA  20           HB2      ALA  20  43.012  15.817  -7.834
  162    HB3  ALA  20           HB3      ALA  20  42.240  16.806  -9.097
  163    H    LEU  21           HN       LEU  21  39.014  14.259  -7.366
  164    HA   LEU  21           HA       LEU  21  37.169  13.610  -8.625
  165    HB2  LEU  21           HB2      LEU  21  36.875  16.548  -9.337
  166    HB3  LEU  21           HB1      LEU  21  35.599  15.334  -9.082
  167    HG   LEU  21           HG       LEU  21  37.484  16.452  -6.959
  168   HD11  LEU  21          HD11      LEU  21  34.466  16.704  -7.329
  169   HD12  LEU  21          HD12      LEU  21  35.652  17.975  -7.706
  170   HD13  LEU  21          HD13      LEU  21  35.431  17.433  -6.025
  171   HD21  LEU  21          HD21      LEU  21  35.868  15.121  -5.430
  172   HD22  LEU  21          HD22      LEU  21  37.065  14.178  -6.345
  173   HD23  LEU  21          HD23      LEU  21  35.376  14.253  -6.904
  174    H    ASP  22           HN       ASP  22  39.916  14.294 -10.020
  175    HA   ASP  22           HA       ASP  22  39.284  15.032 -12.715
  176    HB2  ASP  22           HB2      ASP  22  41.580  14.995 -11.669
  177    HB3  ASP  22           HB1      ASP  22  41.547  13.220 -11.797
  178    H    HIS  23           HN       HIS  23  40.391  11.780 -11.686
  179    HA   HIS  23           HA       HIS  23  38.095  10.428 -12.815
  180    HB2  HIS  23           HB2      HIS  23  39.316   9.343 -14.723
  181    HB3  HIS  23           HB1      HIS  23  39.029  11.084 -14.956
  182    HD1  HIS  23           HD1      HIS  23  41.777   9.267 -12.968
  183    HD2  HIS  23           HD2      HIS  23  41.354  12.007 -16.130
  184    HE1  HIS  23           HE1      HIS  23  44.125  10.008 -13.653
  185    H    LEU  24           HN       LEU  24  40.141  10.580 -10.536
  186    HA   LEU  24           HA       LEU  24  41.542   8.026 -10.606
  187    HB2  LEU  24           HB2      LEU  24  40.941  10.094  -8.465
  188    HB3  LEU  24           HB1      LEU  24  41.702   8.542  -8.043
  189    HG   LEU  24           HG       LEU  24  43.515   8.994  -9.685
  190   HD11  LEU  24          HD11      LEU  24  43.642  11.443 -10.512
  191   HD12  LEU  24          HD12      LEU  24  41.910  11.545 -10.114
  192   HD13  LEU  24          HD13      LEU  24  42.479  10.377 -11.331
  193   HD21  LEU  24          HD21      LEU  24  43.115  11.361  -7.806
  194   HD22  LEU  24          HD22      LEU  24  44.659  10.668  -8.360
  195   HD23  LEU  24          HD23      LEU  24  43.612   9.744  -7.255
  Start of MODEL   36
    1    H1   GLY   1           HT1      GLY   1  58.006  -3.625  -1.137
    2    H2   GLY   1           HT2      GLY   1  58.113  -5.204  -0.514
    3    H3   GLY   1           HT3      GLY   1  58.440  -3.867   0.484
    4    HA2  GLY   1           HA1      GLY   1  55.899  -3.610  -0.672
    5    HA3  GLY   1           HA2      GLY   1  56.061  -5.180   0.138
    6    H    LYS   2           HN       LYS   2  57.459  -1.955   0.845
    7    HA   LYS   2           HA       LYS   2  55.723  -1.513   3.122
    8    HB2  LYS   2           HB2      LYS   2  57.254  -3.394   3.935
    9    HB3  LYS   2           HB1      LYS   2  58.597  -2.233   3.813
   10    HG2  LYS   2           HG2      LYS   2  57.553  -0.751   5.428
   11    HG3  LYS   2           HG1      LYS   2  56.064  -1.727   5.437
   12    HD2  LYS   2           HD2      LYS   2  57.247  -3.619   6.417
   13    HD3  LYS   2           HD1      LYS   2  58.802  -2.765   6.278
   14    HE2  LYS   2           HE2      LYS   2  58.040  -1.042   7.846
   15    HE3  LYS   2           HE1      LYS   2  56.430  -1.793   7.929
   16    HZ1  LYS   2           HZ1      LYS   2  58.829  -3.388   8.563
   17    HZ2  LYS   2           HZ2      LYS   2  57.230  -3.583   9.106
   18    HZ3  LYS   2           HZ3      LYS   2  58.195  -2.331   9.728
   19    H    GLY   3           HN       GLY   3  56.309   0.427   4.328
   20    HA2  GLY   3           HA1      GLY   3  58.359   2.233   4.046
   21    HA3  GLY   3           HA2      GLY   3  57.449   2.477   2.480
   22    H    ARG   4           HN       ARG   4  55.500   2.048   2.479
   23    HA   ARG   4           HA       ARG   4  55.449   4.471   2.590
   24    HB2  ARG   4           HB2      ARG   4  52.955   2.747   2.218
   25    HB3  ARG   4           HB1      ARG   4  52.997   4.487   1.836
   26    HG2  ARG   4           HG2      ARG   4  54.839   4.135   0.253
   27    HG3  ARG   4           HG1      ARG   4  54.918   2.411   0.689
   28    HD2  ARG   4           HD2      ARG   4  52.506   2.199  -0.069
   29    HD3  ARG   4           HD1      ARG   4  52.621   3.864  -0.689
   30    HE   ARG   4           HE       ARG   4  53.646   1.537  -2.014
   31   HH11  ARG   4          HH11      ARG   4  53.413   4.806  -2.330
   32   HH12  ARG   4          HH12      ARG   4  54.910   5.040  -3.169
   33   HH21  ARG   4          HH21      ARG   4  56.043   1.813  -2.597
   34   HH22  ARG   4          HH22      ARG   4  56.400   3.347  -3.320
   35    H    TRP   5           HN       TRP   5  54.826   2.549   5.056
   36    HA   TRP   5           HA       TRP   5  52.713   3.396   6.665
   37    HB2  TRP   5           HB2      TRP   5  54.466   1.703   7.283
   38    HB3  TRP   5           HB1      TRP   5  55.562   3.051   7.673
   39    HD1  TRP   5           HD1      TRP   5  55.476   3.827  10.086
   40    HE1  TRP   5           HE1      TRP   5  53.798   3.690  12.068
   41    HE3  TRP   5           HE3      TRP   5  51.576   1.542   7.683
   42    HZ2  TRP   5           HZ2      TRP   5  51.127   2.712  12.515
   43    HZ3  TRP   5           HZ3      TRP   5  49.473   1.016   8.907
   44    HH2  TRP   5           HH2      TRP   5  49.244   1.599  11.319
   45    H    LEU   6           HN       LEU   6  55.367   5.288   5.545
   46    HA   LEU   6           HA       LEU   6  54.686   7.521   7.449
   47    HB2  LEU   6           HB2      LEU   6  57.185   7.298   5.735
   48    HB3  LEU   6           HB1      LEU   6  56.895   8.349   7.140
   49    HG   LEU   6           HG       LEU   6  57.081   5.301   7.197
   50   HD11  LEU   6          HD11      LEU   6  59.245   6.475   6.816
   51   HD12  LEU   6          HD12      LEU   6  59.183   5.700   8.418
   52   HD13  LEU   6          HD13      LEU   6  58.953   7.459   8.270
   53   HD21  LEU   6          HD21      LEU   6  56.518   7.406   9.329
   54   HD22  LEU   6          HD22      LEU   6  57.163   5.799   9.741
   55   HD23  LEU   6          HD23      LEU   6  55.579   5.942   8.947
   56    H    GLU   7           HN       GLU   7  54.623   6.432   4.110
   57    HA   GLU   7           HA       GLU   7  54.828   8.834   2.691
   58    HB2  GLU   7           HB2      GLU   7  54.357   6.475   1.803
   59    HB3  GLU   7           HB1      GLU   7  52.643   6.788   2.166
   60    HG2  GLU   7           HG2      GLU   7  52.723   8.820   0.729
   61    HG3  GLU   7           HG1      GLU   7  54.422   8.465   0.338
   62    H    ARG   8           HN       ARG   8  52.366   7.848   4.959
   63    HA   ARG   8           HA       ARG   8  50.471   8.938   5.734
   64    HB2  ARG   8           HB2      ARG   8  52.262  10.743   6.051
   65    HB3  ARG   8           HB1      ARG   8  51.663  11.469   4.540
   66    HG2  ARG   8           HG2      ARG   8  49.411  11.683   5.500
   67    HG3  ARG   8           HG1      ARG   8  49.949  10.880   6.995
   68    HD2  ARG   8           HD2      ARG   8  51.652  12.718   7.291
   69    HD3  ARG   8           HD1      ARG   8  50.924  13.550   5.896
   70    HE   ARG   8           HE       ARG   8  49.862  13.549   8.569
   71   HH11  ARG   8          HH11      ARG   8  47.509  12.361   8.081
   72   HH12  ARG   8          HH12      ARG   8  46.567  13.404   7.068
   73   HH21  ARG   8          HH21      ARG   8  49.282  15.299   6.038
   74   HH22  ARG   8          HH22      ARG   8  47.570  15.067   5.914
   75    H    ILE   9           HN       ILE   9  48.813   8.114   4.514
   76    HA   ILE   9           HA       ILE   9  48.401   8.776   1.758
   77    HB   ILE   9           HB       ILE   9  45.970   8.027   2.254
   78   HG12  ILE   9          HG12      ILE   9  47.033   6.882   4.856
   79   HG13  ILE   9          HG11      ILE   9  46.508   8.578   4.872
   80   HG21  ILE   9          HG21      ILE   9  47.652   6.527   1.301
   81   HG22  ILE   9          HG22      ILE   9  46.688   5.645   2.512
   82   HG23  ILE   9          HG23      ILE   9  48.328   6.207   2.917
   83   HD11  ILE   9           HD1      ILE   9  44.824   6.242   3.878
   84   HD12  ILE   9           HD2      ILE   9  44.312   7.944   3.976
   85   HD13  ILE   9           HD3      ILE   9  44.657   7.029   5.466
   86    H    GLY  10           HN       GLY  10  48.020  10.689   0.951
   87    HA2  GLY  10           HA1      GLY  10  46.981  12.879   2.541
   88    HA3  GLY  10           HA2      GLY  10  47.308  12.895   0.797
   89    H    LYS  11           HN       LYS  11  45.392  10.248   1.609
   90    HA   LYS  11           HA       LYS  11  43.116  11.287   0.180
   91    HB2  LYS  11           HB2      LYS  11  43.329   8.874   2.022
   92    HB3  LYS  11           HB1      LYS  11  42.022   9.187   0.856
   93    HG2  LYS  11           HG2      LYS  11  43.670   9.164  -0.999
   94    HG3  LYS  11           HG1      LYS  11  44.974   8.839   0.169
   95    HD2  LYS  11           HD2      LYS  11  43.728   6.756   0.875
   96    HD3  LYS  11           HD1      LYS  11  42.581   7.054  -0.454
   97    HE2  LYS  11           HE2      LYS  11  44.236   5.503  -1.285
   98    HE3  LYS  11           HE1      LYS  11  44.579   7.082  -2.034
   99    HZ1  LYS  11           HZ1      LYS  11  45.908   6.065   0.429
  100    HZ2  LYS  11           HZ2      LYS  11  46.296   7.476  -0.434
  101    HZ3  LYS  11           HZ3      LYS  11  46.568   5.950  -1.129
  102    H    ALA  12           HN       ALA  12  41.923  12.926   0.946
  103    HA   ALA  12           HA       ALA  12  41.553  13.328   3.817
  104    HB1  ALA  12           HB1      ALA  12  41.594  15.147   2.047
  105    HB2  ALA  12           HB2      ALA  12  40.230  15.220   3.189
  106    HB3  ALA  12           HB3      ALA  12  39.983  14.584   1.545
  107    H    GLY  13           HN       GLY  13  40.453  10.982   1.883
  108    HA2  GLY  13           HA1      GLY  13  38.666   9.525   2.004
  109    HA3  GLY  13           HA2      GLY  13  38.377  10.159   3.636
  110    H    PHE  14           HN       PHE  14  38.350  12.377   0.940
  111    HA   PHE  14           HA       PHE  14  35.450  12.140   0.500
  112    HB2  PHE  14           HB2      PHE  14  36.610  14.491   2.045
  113    HB3  PHE  14           HB1      PHE  14  35.019  14.520   1.251
  114    HD1  PHE  14           HD1      PHE  14  36.691  13.787   4.304
  115    HD2  PHE  14           HD2      PHE  14  33.473  12.397   1.780
  116    HE1  PHE  14           HE1      PHE  14  35.668  12.617   6.249
  117    HE2  PHE  14           HE2      PHE  14  32.454  11.227   3.727
  118    HZ   PHE  14           HZ       PHE  14  33.582  11.289   5.948
  119    H    ILE  15           HN       ILE  15  36.841  15.313   0.372
  120    HA   ILE  15           HA       ILE  15  36.562  15.330  -2.535
  121    HB   ILE  15           HB       ILE  15  37.420  17.726  -2.288
  122   HG12  ILE  15          HG12      ILE  15  37.164  17.066   0.687
  123   HG13  ILE  15          HG11      ILE  15  38.716  17.217  -0.163
  124   HG21  ILE  15          HG21      ILE  15  35.089  17.003  -0.458
  125   HG22  ILE  15          HG22      ILE  15  34.978  17.023  -2.234
  126   HG23  ILE  15          HG23      ILE  15  35.331  18.523  -1.349
  127   HD11  ILE  15           HD1      ILE  15  38.385  19.365   0.781
  128   HD12  ILE  15           HD2      ILE  15  36.648  19.365   0.405
  129   HD13  ILE  15           HD3      ILE  15  37.842  19.572  -0.900
  130    H    ILE  16           HN       ILE  16  38.260  13.444  -2.418
  131    HA   ILE  16           HA       ILE  16  40.751  14.636  -3.492
  132    HB   ILE  16           HB       ILE  16  40.621  12.793  -1.078
  133   HG12  ILE  16          HG12      ILE  16  40.755  15.209  -0.609
  134   HG13  ILE  16          HG11      ILE  16  42.241  14.388  -0.108
  135   HG21  ILE  16          HG21      ILE  16  42.261  11.551  -2.146
  136   HG22  ILE  16          HG22      ILE  16  43.320  12.854  -1.568
  137   HG23  ILE  16          HG23      ILE  16  42.716  12.876  -3.239
  138   HD11  ILE  16           HD1      ILE  16  43.036  15.112  -2.597
  139   HD12  ILE  16           HD2      ILE  16  43.178  16.213  -1.213
  140   HD13  ILE  16           HD3      ILE  16  41.815  16.377  -2.338
  141    H    ILE  17           HN       ILE  17  38.876  11.720  -2.636
  142    HA   ILE  17           HA       ILE  17  39.885  10.379  -5.139
  143    HB   ILE  17           HB       ILE  17  38.341   9.216  -2.776
  144   HG12  ILE  17          HG12      ILE  17  40.570   9.878  -2.045
  145   HG13  ILE  17          HG11      ILE  17  40.522   8.111  -2.201
  146   HG21  ILE  17          HG21      ILE  17  37.847   7.741  -4.513
  147   HG22  ILE  17          HG22      ILE  17  39.384   7.041  -3.962
  148   HG23  ILE  17          HG23      ILE  17  39.347   8.088  -5.399
  149   HD11  ILE  17           HD1      ILE  17  42.572   8.695  -3.227
  150   HD12  ILE  17           HD2      ILE  17  41.890  10.143  -3.996
  151   HD13  ILE  17           HD3      ILE  17  41.474   8.530  -4.611
  152    H    GLY  18           HN       GLY  18  36.917  10.996  -3.220
  153    HA2  GLY  18           HA1      GLY  18  35.153  10.154  -5.349
  154    HA3  GLY  18           HA2      GLY  18  34.702  11.084  -3.905
  155    H    GLY  19           HN       GLY  19  36.358  13.303  -4.182
  156    HA2  GLY  19           HA1      GLY  19  34.890  14.756  -6.282
  157    HA3  GLY  19           HA2      GLY  19  36.001  15.439  -5.076
  158    H    ALA  20           HN       ALA  20  38.274  13.862  -5.530
  159    HA   ALA  20           HA       ALA  20  40.185  13.998  -6.843
  160    HB1  ALA  20           HB1      ALA  20  38.849  12.247  -8.030
  161    HB2  ALA  20           HB2      ALA  20  39.969  13.135  -9.092
  162    HB3  ALA  20           HB3      ALA  20  38.230  13.513  -9.115
  163    H    LEU  21           HN       LEU  21  39.383  16.487  -6.171
  164    HA   LEU  21           HA       LEU  21  38.994  18.181  -8.517
  165    HB2  LEU  21           HB2      LEU  21  40.020  19.082  -5.805
  166    HB3  LEU  21           HB1      LEU  21  39.069  20.004  -6.994
  167    HG   LEU  21           HG       LEU  21  38.104  17.592  -5.391
  168   HD11  LEU  21          HD11      LEU  21  36.591  19.254  -4.346
  169   HD12  LEU  21          HD12      LEU  21  37.339  20.546  -5.315
  170   HD13  LEU  21          HD13      LEU  21  38.296  19.687  -4.084
  171   HD21  LEU  21          HD21      LEU  21  36.830  19.262  -7.600
  172   HD22  LEU  21          HD22      LEU  21  35.852  18.341  -6.433
  173   HD23  LEU  21          HD23      LEU  21  36.985  17.492  -7.506
  174    H    ASP  22           HN       ASP  22  41.717  16.856  -6.758
  175    HA   ASP  22           HA       ASP  22  43.665  18.758  -7.830
  176    HB2  ASP  22           HB2      ASP  22  44.095  16.005  -6.605
  177    HB3  ASP  22           HB1      ASP  22  45.322  17.277  -6.825
  178    H    HIS  23           HN       HIS  23  43.413  15.194  -8.256
  179    HA   HIS  23           HA       HIS  23  45.009  15.200 -10.641
  180    HB2  HIS  23           HB2      HIS  23  44.599  13.221  -9.147
  181    HB3  HIS  23           HB1      HIS  23  42.942  13.134  -9.793
  182    HD1  HIS  23           HD1      HIS  23  42.752  11.441 -11.604
  183    HD2  HIS  23           HD2      HIS  23  46.465  13.413 -11.688
  184    HE1  HIS  23           HE1      HIS  23  44.087  10.465 -13.550
  185    H    LEU  24           HN       LEU  24  42.071  16.592 -10.206
  186    HA   LEU  24           HA       LEU  24  40.392  15.730 -12.264
  187    HB2  LEU  24           HB2      LEU  24  40.207  17.691 -10.494
  188    HB3  LEU  24           HB1      LEU  24  40.832  18.698 -11.817
  189    HG   LEU  24           HG       LEU  24  38.327  16.950 -11.890
  190   HD11  LEU  24          HD11      LEU  24  38.094  19.050 -10.601
  191   HD12  LEU  24          HD12      LEU  24  37.169  19.133 -12.119
  192   HD13  LEU  24          HD13      LEU  24  38.732  19.974 -11.982
  193   HD21  LEU  24          HD21      LEU  24  38.034  18.215 -14.146
  194   HD22  LEU  24          HD22      LEU  24  39.208  16.882 -14.106
  195   HD23  LEU  24          HD23      LEU  24  39.775  18.568 -14.026
  Start of MODEL   37
    1    H1   GLY   1           HT1      GLY   1  63.407   0.274   1.654
    2    H2   GLY   1           HT2      GLY   1  61.919  -0.096   2.387
    3    H3   GLY   1           HT3      GLY   1  62.845   1.215   2.947
    4    HA2  GLY   1           HA1      GLY   1  62.333   2.543   1.224
    5    HA3  GLY   1           HA2      GLY   1  62.005   1.159   0.163
    6    H    LYS   2           HN       LYS   2  60.551   0.161   2.835
    7    HA   LYS   2           HA       LYS   2  57.902   0.946   1.871
    8    HB2  LYS   2           HB2      LYS   2  58.627  -0.504   4.444
    9    HB3  LYS   2           HB1      LYS   2  57.063  -0.517   3.595
   10    HG2  LYS   2           HG2      LYS   2  58.172  -1.576   1.625
   11    HG3  LYS   2           HG1      LYS   2  59.698  -1.628   2.538
   12    HD2  LYS   2           HD2      LYS   2  58.639  -3.037   4.264
   13    HD3  LYS   2           HD1      LYS   2  57.090  -2.961   3.391
   14    HE2  LYS   2           HE2      LYS   2  58.043  -4.122   1.477
   15    HE3  LYS   2           HE1      LYS   2  59.670  -4.062   2.198
   16    HZ1  LYS   2           HZ1      LYS   2  58.650  -5.325   4.121
   17    HZ2  LYS   2           HZ2      LYS   2  58.837  -6.189   2.670
   18    HZ3  LYS   2           HZ3      LYS   2  57.308  -5.604   3.123
   19    H    GLY   3           HN       GLY   3  59.491   3.200   2.639
   20    HA2  GLY   3           HA1      GLY   3  59.209   4.313   5.173
   21    HA3  GLY   3           HA2      GLY   3  58.839   5.292   3.681
   22    H    ARG   4           HN       ARG   4  57.374   4.688   2.486
   23    HA   ARG   4           HA       ARG   4  56.264   6.461   3.715
   24    HB2  ARG   4           HB2      ARG   4  54.873   5.061   1.377
   25    HB3  ARG   4           HB1      ARG   4  54.494   6.706   1.948
   26    HG2  ARG   4           HG2      ARG   4  56.781   7.442   1.491
   27    HG3  ARG   4           HG1      ARG   4  57.263   5.787   1.049
   28    HD2  ARG   4           HD2      ARG   4  55.778   5.799  -0.874
   29    HD3  ARG   4           HD1      ARG   4  55.088   7.366  -0.386
   30    HE   ARG   4           HE       ARG   4  57.810   7.877  -0.648
   31   HH11  ARG   4          HH11      ARG   4  56.374   9.415  -2.480
   32   HH12  ARG   4          HH12      ARG   4  56.612   8.671  -4.025
   33   HH21  ARG   4          HH21      ARG   4  57.677   5.647  -2.705
   34   HH22  ARG   4          HH22      ARG   4  57.348   6.538  -4.153
   35    H    TRP   5           HN       TRP   5  55.761   3.350   4.207
   36    HA   TRP   5           HA       TRP   5  53.098   2.687   4.676
   37    HB2  TRP   5           HB2      TRP   5  54.933   1.147   5.171
   38    HB3  TRP   5           HB1      TRP   5  55.465   2.173   6.523
   39    HD1  TRP   5           HD1      TRP   5  51.905   0.893   5.605
   40    HE1  TRP   5           HE1      TRP   5  50.886  -0.294   7.678
   41    HE3  TRP   5           HE3      TRP   5  55.897   1.261   8.792
   42    HZ2  TRP   5           HZ2      TRP   5  51.716  -0.979  10.347
   43    HZ3  TRP   5           HZ3      TRP   5  55.761   0.331  11.098
   44    HH2  TRP   5           HH2      TRP   5  53.676  -0.788  11.877
   45    H    LEU   6           HN       LEU   6  54.951   5.171   6.197
   46    HA   LEU   6           HA       LEU   6  52.845   5.614   8.300
   47    HB2  LEU   6           HB2      LEU   6  55.781   6.307   8.038
   48    HB3  LEU   6           HB1      LEU   6  54.741   7.348   9.038
   49    HG   LEU   6           HG       LEU   6  54.035   5.377  10.364
   50   HD11  LEU   6          HD11      LEU   6  55.856   3.925   8.406
   51   HD12  LEU   6          HD12      LEU   6  54.174   3.549   8.849
   52   HD13  LEU   6          HD13      LEU   6  55.483   3.253  10.012
   53   HD21  LEU   6          HD21      LEU   6  56.013   6.700  11.060
   54   HD22  LEU   6          HD22      LEU   6  57.063   5.657  10.071
   55   HD23  LEU   6          HD23      LEU   6  56.215   4.985  11.485
   56    H    GLU   7           HN       GLU   7  54.339   6.903   5.352
   57    HA   GLU   7           HA       GLU   7  52.973   9.534   5.734
   58    HB2  GLU   7           HB2      GLU   7  54.736   8.507   3.473
   59    HB3  GLU   7           HB1      GLU   7  54.166  10.178   3.691
   60    HG2  GLU   7           HG2      GLU   7  55.846   8.664   5.739
   61    HG3  GLU   7           HG1      GLU   7  56.519   9.782   4.527
   62    H    ARG   8           HN       ARG   8  51.293   7.208   5.513
   63    HA   ARG   8           HA       ARG   8  50.353   6.931   2.789
   64    HB2  ARG   8           HB2      ARG   8  48.324   5.910   3.922
   65    HB3  ARG   8           HB1      ARG   8  49.883   5.162   4.347
   66    HG2  ARG   8           HG2      ARG   8  49.968   6.325   6.455
   67    HG3  ARG   8           HG1      ARG   8  48.597   7.367   6.007
   68    HD2  ARG   8           HD2      ARG   8  47.849   5.577   7.531
   69    HD3  ARG   8           HD1      ARG   8  47.120   5.367   5.922
   70    HE   ARG   8           HE       ARG   8  49.548   3.865   6.014
   71   HH11  ARG   8          HH11      ARG   8  48.150   1.942   5.087
   72   HH12  ARG   8          HH12      ARG   8  47.275   1.129   6.342
   73   HH21  ARG   8          HH21      ARG   8  47.657   3.700   8.637
   74   HH22  ARG   8          HH22      ARG   8  46.995   2.125   8.352
   75    H    ILE   9           HN       ILE   9  47.947   7.385   2.301
   76    HA   ILE   9           HA       ILE   9  46.722   9.669   3.557
   77    HB   ILE   9           HB       ILE   9  48.512  10.956   2.487
   78   HG12  ILE   9          HG12      ILE   9  47.194  12.484   1.102
   79   HG13  ILE   9          HG11      ILE   9  45.957  11.240   0.829
   80   HG21  ILE   9          HG21      ILE   9  48.937   9.146   0.716
   81   HG22  ILE   9          HG22      ILE   9  49.042  10.832   0.163
   82   HG23  ILE   9          HG23      ILE   9  47.593   9.866  -0.198
   83   HD11  ILE   9           HD1      ILE   9  46.673  12.092   3.656
   84   HD12  ILE   9           HD2      ILE   9  45.165  11.361   3.053
   85   HD13  ILE   9           HD3      ILE   9  45.541  13.058   2.680
   86    H    GLY  10           HN       GLY  10  44.625   9.410   3.237
   87    HA2  GLY  10           HA1      GLY  10  43.452   8.964   0.662
   88    HA3  GLY  10           HA2      GLY  10  43.551   7.423   1.538
   89    H    LYS  11           HN       LYS  11  43.229  10.422   3.296
   90    HA   LYS  11           HA       LYS  11  40.793   9.510   4.560
   91    HB2  LYS  11           HB2      LYS  11  42.291  12.152   4.537
   92    HB3  LYS  11           HB1      LYS  11  40.786  11.932   5.459
   93    HG2  LYS  11           HG2      LYS  11  43.045   9.921   5.801
   94    HG3  LYS  11           HG1      LYS  11  43.153  11.495   6.619
   95    HD2  LYS  11           HD2      LYS  11  40.928  11.089   7.669
   96    HD3  LYS  11           HD1      LYS  11  40.869   9.487   6.897
   97    HE2  LYS  11           HE2      LYS  11  41.686   9.225   9.179
   98    HE3  LYS  11           HE1      LYS  11  43.025   8.908   8.051
   99    HZ1  LYS  11           HZ1      LYS  11  42.757  10.963  10.024
  100    HZ2  LYS  11           HZ2      LYS  11  43.110  11.611   8.493
  101    HZ3  LYS  11           HZ3      LYS  11  44.136  10.446   9.184
  102    H    ALA  12           HN       ALA  12  41.346  10.792   1.504
  103    HA   ALA  12           HA       ALA  12  39.941  11.767  -0.062
  104    HB1  ALA  12           HB1      ALA  12  37.628  11.111  -0.028
  105    HB2  ALA  12           HB2      ALA  12  37.687  10.789   1.722
  106    HB3  ALA  12           HB3      ALA  12  38.579   9.742   0.593
  107    H    GLY  13           HN       GLY  13  40.990  13.680   1.289
  108    HA2  GLY  13           HA1      GLY  13  39.602  15.264   3.083
  109    HA3  GLY  13           HA2      GLY  13  40.630  15.922   1.795
  110    H    PHE  14           HN       PHE  14  37.362  15.055   2.767
  111    HA   PHE  14           HA       PHE  14  35.299  15.697   1.898
  112    HB2  PHE  14           HB2      PHE  14  36.936  18.069   0.905
  113    HB3  PHE  14           HB1      PHE  14  35.158  17.996   0.962
  114    HD1  PHE  14           HD1      PHE  14  33.971  17.822   3.157
  115    HD2  PHE  14           HD2      PHE  14  38.242  18.400   2.919
  116    HE1  PHE  14           HE1      PHE  14  34.011  18.515   5.549
  117    HE2  PHE  14           HE2      PHE  14  38.282  19.094   5.312
  118    HZ   PHE  14           HZ       PHE  14  36.173  19.104   6.640
  119    H    ILE  15           HN       ILE  15  36.744  13.839   0.419
  120    HA   ILE  15           HA       ILE  15  36.718  12.805  -1.640
  121    HB   ILE  15           HB       ILE  15  34.731  14.909  -2.579
  122   HG12  ILE  15          HG12      ILE  15  34.208  12.353  -0.993
  123   HG13  ILE  15          HG11      ILE  15  34.010  14.009  -0.376
  124   HG21  ILE  15          HG21      ILE  15  35.770  13.213  -4.190
  125   HG22  ILE  15          HG22      ILE  15  33.996  13.204  -4.099
  126   HG23  ILE  15          HG23      ILE  15  34.937  11.950  -3.255
  127   HD11  ILE  15           HD1      ILE  15  32.404  14.349  -2.409
  128   HD12  ILE  15           HD2      ILE  15  31.817  13.393  -1.028
  129   HD13  ILE  15           HD3      ILE  15  32.386  12.571  -2.498
  130    H    ILE  16           HN       ILE  16  38.916  13.496  -1.931
  131    HA   ILE  16           HA       ILE  16  39.155  15.284  -4.306
  132    HB   ILE  16           HB       ILE  16  39.589  16.821  -2.442
  133   HG12  ILE  16          HG12      ILE  16  41.885  17.525  -2.988
  134   HG13  ILE  16          HG11      ILE  16  42.235  15.938  -3.703
  135   HG21  ILE  16          HG21      ILE  16  41.070  16.402  -0.654
  136   HG22  ILE  16          HG22      ILE  16  41.904  15.086  -1.510
  137   HG23  ILE  16          HG23      ILE  16  40.263  14.833  -0.869
  138   HD11  ILE  16           HD1      ILE  16  39.894  17.579  -4.727
  139   HD12  ILE  16           HD2      ILE  16  40.840  16.328  -5.569
  140   HD13  ILE  16           HD3      ILE  16  41.547  17.934  -5.281
  141    H    ILE  17           HN       ILE  17  41.113  13.419  -1.916
  142    HA   ILE  17           HA       ILE  17  42.808  12.435  -4.143
  143    HB   ILE  17           HB       ILE  17  43.950  12.974  -2.043
  144   HG12  ILE  17          HG12      ILE  17  45.102  10.863  -1.601
  145   HG13  ILE  17          HG11      ILE  17  43.761   9.932  -2.299
  146   HG21  ILE  17          HG21      ILE  17  42.059  12.710  -0.508
  147   HG22  ILE  17          HG22      ILE  17  43.426  11.710   0.039
  148   HG23  ILE  17          HG23      ILE  17  42.044  10.953  -0.789
  149   HD11  ILE  17           HD1      ILE  17  45.191  12.042  -3.953
  150   HD12  ILE  17           HD2      ILE  17  44.264  10.628  -4.507
  151   HD13  ILE  17           HD3      ILE  17  45.873  10.407  -3.785
  152    H    GLY  18           HN       GLY  18  40.104  11.519  -2.148
  153    HA2  GLY  18           HA1      GLY  18  40.261   8.663  -2.745
  154    HA3  GLY  18           HA2      GLY  18  38.909   9.526  -1.983
  155    H    GLY  19           HN       GLY  19  38.040  11.333  -3.709
  156    HA2  GLY  19           HA1      GLY  19  36.800   9.696  -5.764
  157    HA3  GLY  19           HA2      GLY  19  36.592  11.442  -5.523
  158    H    ALA  20           HN       ALA  20  39.252  12.313  -5.738
  159    HA   ALA  20           HA       ALA  20  40.698  13.015  -7.411
  160    HB1  ALA  20           HB1      ALA  20  41.753  11.283  -8.728
  161    HB2  ALA  20           HB2      ALA  20  40.390  10.175  -8.438
  162    HB3  ALA  20           HB3      ALA  20  41.454  10.650  -7.093
  163    H    LEU  21           HN       LEU  21  37.928  13.543  -7.852
  164    HA   LEU  21           HA       LEU  21  37.583  13.112 -10.803
  165    HB2  LEU  21           HB2      LEU  21  35.615  14.377  -8.863
  166    HB3  LEU  21           HB1      LEU  21  35.291  13.697 -10.474
  167    HG   LEU  21           HG       LEU  21  36.210  12.126  -8.024
  168   HD11  LEU  21          HD11      LEU  21  33.545  12.225  -9.508
  169   HD12  LEU  21          HD12      LEU  21  33.864  12.884  -7.886
  170   HD13  LEU  21          HD13      LEU  21  33.937  11.128  -8.164
  171   HD21  LEU  21          HD21      LEU  21  37.102  10.993  -9.928
  172   HD22  LEU  21          HD22      LEU  21  35.671  11.358 -10.923
  173   HD23  LEU  21          HD23      LEU  21  35.562  10.164  -9.607
  174    H    ASP  22           HN       ASP  22  38.487  15.474  -8.430
  175    HA   ASP  22           HA       ASP  22  37.691  17.893  -9.596
  176    HB2  ASP  22           HB2      ASP  22  38.921  17.693  -7.450
  177    HB3  ASP  22           HB1      ASP  22  40.401  17.278  -8.351
  178    H    HIS  23           HN       HIS  23  40.662  16.005 -10.306
  179    HA   HIS  23           HA       HIS  23  40.567  16.788 -13.111
  180    HB2  HIS  23           HB2      HIS  23  41.462  18.883 -12.133
  181    HB3  HIS  23           HB1      HIS  23  42.784  17.958 -11.382
  182    HD1  HIS  23           HD1      HIS  23  44.837  17.559 -12.769
  183    HD2  HIS  23           HD2      HIS  23  41.500  18.560 -15.123
  184    HE1  HIS  23           HE1      HIS  23  45.656  17.841 -15.171
  185    H    LEU  24           HN       LEU  24  41.931  15.181 -10.361
  186    HA   LEU  24           HA       LEU  24  44.085  13.841 -11.794
  187    HB2  LEU  24           HB2      LEU  24  42.700  13.422  -9.124
  188    HB3  LEU  24           HB1      LEU  24  43.925  12.278  -9.719
  189    HG   LEU  24           HG       LEU  24  45.592  14.057  -9.858
  190   HD11  LEU  24          HD11      LEU  24  44.907  16.357  -8.865
  191   HD12  LEU  24          HD12      LEU  24  43.228  15.838  -9.150
  192   HD13  LEU  24          HD13      LEU  24  44.361  15.987 -10.516
  193   HD21  LEU  24          HD21      LEU  24  44.115  14.316  -7.204
  194   HD22  LEU  24          HD22      LEU  24  45.862  14.502  -7.492
  195   HD23  LEU  24          HD23      LEU  24  45.100  12.901  -7.648
  Start of MODEL   38
    1    H1   GLY   1           HT1      GLY   1  59.796   8.810  10.426
    2    H2   GLY   1           HT2      GLY   1  60.865   7.657   9.783
    3    H3   GLY   1           HT3      GLY   1  60.921   8.045  11.437
    4    HA2  GLY   1           HA1      GLY   1  59.541   6.449  11.876
    5    HA3  GLY   1           HA2      GLY   1  58.333   7.300  10.894
    6    H    LYS   2           HN       LYS   2  57.974   4.722  10.886
    7    HA   LYS   2           HA       LYS   2  58.777   3.925   8.134
    8    HB2  LYS   2           HB2      LYS   2  59.370   2.236  10.600
    9    HB3  LYS   2           HB1      LYS   2  59.462   1.654   8.922
   10    HG2  LYS   2           HG2      LYS   2  61.096   3.569   8.473
   11    HG3  LYS   2           HG1      LYS   2  61.142   3.829  10.233
   12    HD2  LYS   2           HD2      LYS   2  61.899   1.510  10.580
   13    HD3  LYS   2           HD1      LYS   2  61.810   1.205   8.828
   14    HE2  LYS   2           HE2      LYS   2  64.133   1.708   9.501
   15    HE3  LYS   2           HE1      LYS   2  63.498   2.989   8.440
   16    HZ1  LYS   2           HZ1      LYS   2  64.501   3.235  11.042
   17    HZ2  LYS   2           HZ2      LYS   2  62.845   3.608  11.102
   18    HZ3  LYS   2           HZ3      LYS   2  63.870   4.452  10.042
   19    H    GLY   3           HN       GLY   3  57.757   1.571   7.787
   20    HA2  GLY   3           HA1      GLY   3  55.775   0.158   8.298
   21    HA3  GLY   3           HA2      GLY   3  54.929   1.616   8.994
   22    H    ARG   4           HN       ARG   4  55.152   3.371   8.078
   23    HA   ARG   4           HA       ARG   4  52.962   2.704   7.278
   24    HB2  ARG   4           HB2      ARG   4  54.097   5.470   6.630
   25    HB3  ARG   4           HB1      ARG   4  52.362   5.069   6.679
   26    HG2  ARG   4           HG2      ARG   4  52.596   4.330   9.035
   27    HG3  ARG   4           HG1      ARG   4  54.327   4.741   8.991
   28    HD2  ARG   4           HD2      ARG   4  52.124   6.757   8.393
   29    HD3  ARG   4           HD1      ARG   4  52.819   6.525  10.015
   30    HE   ARG   4           HE       ARG   4  54.951   6.934   8.146
   31   HH11  ARG   4          HH11      ARG   4  55.979   8.948   8.193
   32   HH12  ARG   4          HH12      ARG   4  55.116  10.331   8.778
   33   HH21  ARG   4          HH21      ARG   4  52.241   8.548   9.537
   34   HH22  ARG   4          HH22      ARG   4  53.000  10.105   9.538
   35    H    TRP   5           HN       TRP   5  55.613   2.595   5.522
   36    HA   TRP   5           HA       TRP   5  55.299   3.392   2.875
   37    HB2  TRP   5           HB2      TRP   5  56.295   0.718   3.930
   38    HB3  TRP   5           HB1      TRP   5  56.450   1.208   2.226
   39    HD1  TRP   5           HD1      TRP   5  57.457   2.443   5.754
   40    HE1  TRP   5           HE1      TRP   5  59.664   3.809   5.575
   41    HE3  TRP   5           HE3      TRP   5  58.023   2.395   0.667
   42    HZ2  TRP   5           HZ2      TRP   5  61.413   4.739   3.483
   43    HZ3  TRP   5           HZ3      TRP   5  59.967   3.527  -0.398
   44    HH2  TRP   5           HH2      TRP   5  61.661   4.698   1.003
   45    H    LEU   6           HN       LEU   6  53.289   1.188   4.615
   46    HA   LEU   6           HA       LEU   6  51.867   0.388   2.082
   47    HB2  LEU   6           HB2      LEU   6  52.887  -1.412   3.636
   48    HB3  LEU   6           HB1      LEU   6  51.624  -0.952   4.797
   49    HG   LEU   6           HG       LEU   6  49.992  -1.285   2.703
   50   HD11  LEU   6          HD11      LEU   6  51.732  -1.678   1.011
   51   HD12  LEU   6          HD12      LEU   6  50.787  -3.164   1.249
   52   HD13  LEU   6          HD13      LEU   6  52.403  -3.014   1.976
   53   HD21  LEU   6          HD21      LEU   6  49.762  -3.707   3.324
   54   HD22  LEU   6          HD22      LEU   6  49.860  -2.632   4.740
   55   HD23  LEU   6          HD23      LEU   6  51.281  -3.582   4.243
   56    H    GLU   7           HN       GLU   7  51.673   2.094   5.154
   57    HA   GLU   7           HA       GLU   7  48.685   2.309   4.884
   58    HB2  GLU   7           HB2      GLU   7  50.582   3.077   7.140
   59    HB3  GLU   7           HB1      GLU   7  48.813   3.281   7.165
   60    HG2  GLU   7           HG2      GLU   7  50.185   0.602   6.684
   61    HG3  GLU   7           HG1      GLU   7  49.667   1.160   8.293
   62    H    ARG   8           HN       ARG   8  50.347   3.629   2.957
   63    HA   ARG   8           HA       ARG   8  51.001   6.300   3.530
   64    HB2  ARG   8           HB2      ARG   8  50.565   6.745   1.128
   65    HB3  ARG   8           HB1      ARG   8  51.473   5.232   1.368
   66    HG2  ARG   8           HG2      ARG   8  49.275   3.984   1.271
   67    HG3  ARG   8           HG1      ARG   8  48.489   5.517   0.822
   68    HD2  ARG   8           HD2      ARG   8  49.987   5.707  -1.147
   69    HD3  ARG   8           HD1      ARG   8  50.757   4.164  -0.705
   70    HE   ARG   8           HE       ARG   8  47.902   3.821  -0.942
   71   HH11  ARG   8          HH11      ARG   8  50.113   2.048  -2.065
   72   HH12  ARG   8          HH12      ARG   8  49.848   2.219  -3.767
   73   HH21  ARG   8          HH21      ARG   8  47.842   5.029  -3.440
   74   HH22  ARG   8          HH22      ARG   8  48.562   3.908  -4.546
   75    H    ILE   9           HN       ILE   9  49.931   8.210   3.733
   76    HA   ILE   9           HA       ILE   9  47.306   8.217   4.729
   77    HB   ILE   9           HB       ILE   9  48.736  10.128   5.118
   78   HG12  ILE   9          HG12      ILE   9  47.257  11.984   4.591
   79   HG13  ILE   9          HG11      ILE   9  46.509  11.084   3.254
   80   HG21  ILE   9          HG21      ILE   9  49.908   9.883   2.828
   81   HG22  ILE   9          HG22      ILE   9  49.655  11.533   3.438
   82   HG23  ILE   9          HG23      ILE   9  48.590  10.882   2.175
   83   HD11  ILE   9           HD1      ILE   9  45.389   9.595   4.723
   84   HD12  ILE   9           HD2      ILE   9  45.238  11.174   5.528
   85   HD13  ILE   9           HD3      ILE   9  46.451  10.000   6.093
   86    H    GLY  10           HN       GLY  10  48.362   9.203   1.428
   87    HA2  GLY  10           HA1      GLY  10  47.235   8.960  -0.589
   88    HA3  GLY  10           HA2      GLY  10  46.019   7.965   0.236
   89    H    LYS  11           HN       LYS  11  45.253   9.873   2.226
   90    HA   LYS  11           HA       LYS  11  43.403  11.454   0.595
   91    HB2  LYS  11           HB2      LYS  11  43.841  11.579   3.600
   92    HB3  LYS  11           HB1      LYS  11  42.391  12.066   2.689
   93    HG2  LYS  11           HG2      LYS  11  42.274   9.618   1.875
   94    HG3  LYS  11           HG1      LYS  11  43.477   9.258   3.136
   95    HD2  LYS  11           HD2      LYS  11  40.756  10.559   3.602
   96    HD3  LYS  11           HD1      LYS  11  41.167   8.864   3.955
   97    HE2  LYS  11           HE2      LYS  11  43.078   9.833   5.428
   98    HE3  LYS  11           HE1      LYS  11  42.210  11.381   5.297
   99    HZ1  LYS  11           HZ1      LYS  11  41.061   8.822   6.296
  100    HZ2  LYS  11           HZ2      LYS  11  40.232  10.300   6.171
  101    HZ3  LYS  11           HZ3      LYS  11  41.529  10.139   7.257
  102    H    ALA  12           HN       ALA  12  44.232  13.161  -0.460
  103    HA   ALA  12           HA       ALA  12  46.380  14.779   0.707
  104    HB1  ALA  12           HB1      ALA  12  46.256  14.458  -1.701
  105    HB2  ALA  12           HB2      ALA  12  46.023  16.181  -1.319
  106    HB3  ALA  12           HB3      ALA  12  44.624  15.163  -1.742
  107    H    GLY  13           HN       GLY  13  43.357  14.469   1.696
  108    HA2  GLY  13           HA1      GLY  13  41.792  15.851   2.694
  109    HA3  GLY  13           HA2      GLY  13  43.206  16.793   3.208
  110    H    PHE  14           HN       PHE  14  42.185  16.308  -0.147
  111    HA   PHE  14           HA       PHE  14  40.806  18.881  -0.298
  112    HB2  PHE  14           HB2      PHE  14  43.334  19.435  -0.226
  113    HB3  PHE  14           HB1      PHE  14  43.425  18.686  -1.836
  114    HD1  PHE  14           HD1      PHE  14  41.785  19.551  -3.657
  115    HD2  PHE  14           HD2      PHE  14  42.610  21.689   0.002
  116    HE1  PHE  14           HE1      PHE  14  40.935  21.653  -4.692
  117    HE2  PHE  14           HE2      PHE  14  41.760  23.788  -1.033
  118    HZ   PHE  14           HZ       PHE  14  40.859  23.754  -3.356
  119    H    ILE  15           HN       ILE  15  42.901  17.115  -2.620
  120    HA   ILE  15           HA       ILE  15  40.648  16.932  -4.507
  121    HB   ILE  15           HB       ILE  15  42.339  15.691  -5.936
  122   HG12  ILE  15          HG12      ILE  15  44.245  16.470  -3.678
  123   HG13  ILE  15          HG11      ILE  15  43.666  14.816  -3.976
  124   HG21  ILE  15          HG21      ILE  15  43.567  17.676  -6.521
  125   HG22  ILE  15          HG22      ILE  15  43.420  18.336  -4.877
  126   HG23  ILE  15          HG23      ILE  15  41.987  18.229  -5.926
  127   HD11  ILE  15           HD1      ILE  15  44.586  15.139  -6.393
  128   HD12  ILE  15           HD2      ILE  15  45.764  14.899  -5.081
  129   HD13  ILE  15           HD3      ILE  15  45.466  16.532  -5.718
  130    H    ILE  16           HN       ILE  16  40.191  15.652  -2.030
  131    HA   ILE  16           HA       ILE  16  39.721  12.892  -3.034
  132    HB   ILE  16           HB       ILE  16  41.927  12.997  -1.695
  133   HG12  ILE  16          HG12      ILE  16  41.083  10.970  -0.171
  134   HG13  ILE  16          HG11      ILE  16  39.564  11.182  -1.070
  135   HG21  ILE  16          HG21      ILE  16  40.067  13.190   0.698
  136   HG22  ILE  16          HG22      ILE  16  40.903  14.609   0.019
  137   HG23  ILE  16          HG23      ILE  16  41.845  13.250   0.675
  138   HD11  ILE  16           HD1      ILE  16  42.294  10.793  -2.388
  139   HD12  ILE  16           HD2      ILE  16  40.708  10.793  -3.194
  140   HD13  ILE  16           HD3      ILE  16  41.138   9.480  -2.076
  141    H    ILE  17           HN       ILE  17  39.283  15.316  -0.444
  142    HA   ILE  17           HA       ILE  17  36.842  14.008   0.530
  143    HB   ILE  17           HB       ILE  17  36.547  16.223   1.814
  144   HG12  ILE  17          HG12      ILE  17  38.639  17.617   1.972
  145   HG13  ILE  17          HG11      ILE  17  39.308  16.722   0.595
  146   HG21  ILE  17          HG21      ILE  17  38.272  15.666   3.429
  147   HG22  ILE  17          HG22      ILE  17  39.212  14.800   2.194
  148   HG23  ILE  17          HG23      ILE  17  37.644  14.155   2.734
  149   HD11  ILE  17           HD1      ILE  17  38.055  19.036   0.204
  150   HD12  ILE  17           HD2      ILE  17  36.588  18.036   0.311
  151   HD13  ILE  17           HD3      ILE  17  37.812  17.696  -0.936
  152    H    GLY  18           HN       GLY  18  37.550  15.556  -2.260
  153    HA2  GLY  18           HA1      GLY  18  34.715  16.135  -2.788
  154    HA3  GLY  18           HA2      GLY  18  35.780  17.556  -2.811
  155    H    GLY  19           HN       GLY  19  38.115  16.413  -3.888
  156    HA2  GLY  19           HA1      GLY  19  37.521  16.564  -6.672
  157    HA3  GLY  19           HA2      GLY  19  39.038  15.978  -5.963
  158    H    ALA  20           HN       ALA  20  37.873  13.815  -4.461
  159    HA   ALA  20           HA       ALA  20  37.460  11.558  -4.774
  160    HB1  ALA  20           HB1      ALA  20  35.216  12.506  -5.360
  161    HB2  ALA  20           HB2      ALA  20  35.578  10.961  -6.168
  162    HB3  ALA  20           HB3      ALA  20  35.707  12.490  -7.071
  163    H    LEU  21           HN       LEU  21  39.307  13.295  -6.768
  164    HA   LEU  21           HA       LEU  21  40.713  12.806  -8.546
  165    HB2  LEU  21           HB2      LEU  21  41.297  11.091  -6.639
  166    HB3  LEU  21           HB1      LEU  21  40.551   9.893  -7.717
  167    HG   LEU  21           HG       LEU  21  42.156  10.989  -9.556
  168   HD11  LEU  21          HD11      LEU  21  43.569  11.655  -6.932
  169   HD12  LEU  21          HD12      LEU  21  43.013  12.821  -8.155
  170   HD13  LEU  21          HD13      LEU  21  44.332  11.694  -8.538
  171   HD21  LEU  21          HD21      LEU  21  43.961   9.371  -8.876
  172   HD22  LEU  21          HD22      LEU  21  42.330   8.657  -8.862
  173   HD23  LEU  21          HD23      LEU  21  43.108   9.131  -7.332
  174    H    ASP  22           HN       ASP  22  37.631  12.228  -8.724
  175    HA   ASP  22           HA       ASP  22  37.414  10.185 -10.775
  176    HB2  ASP  22           HB2      ASP  22  35.548  10.960  -9.254
  177    HB3  ASP  22           HB1      ASP  22  35.491  12.469 -10.196
  178    H    HIS  23           HN       HIS  23  37.656  13.740 -10.754
  179    HA   HIS  23           HA       HIS  23  38.799  13.733 -13.431
  180    HB2  HIS  23           HB2      HIS  23  37.026  15.043 -14.532
  181    HB3  HIS  23           HB1      HIS  23  36.416  13.449 -14.028
  182    HD1  HIS  23           HD1      HIS  23  36.186  14.267 -10.917
  183    HD2  HIS  23           HD2      HIS  23  34.575  16.404 -14.160
  184    HE1  HIS  23           HE1      HIS  23  34.223  15.638 -10.026
  185    H    LEU  24           HN       LEU  24  38.770  14.794 -10.456
  186    HA   LEU  24           HA       LEU  24  40.170  17.249 -11.087
  187    HB2  LEU  24           HB2      LEU  24  37.720  17.928 -11.323
  188    HB3  LEU  24           HB1      LEU  24  37.545  17.578  -9.590
  189    HG   LEU  24           HG       LEU  24  39.632  19.192  -9.312
  190   HD11  LEU  24          HD11      LEU  24  38.539  19.999 -12.048
  191   HD12  LEU  24          HD12      LEU  24  40.202  19.498 -11.664
  192   HD13  LEU  24          HD13      LEU  24  39.570  21.036 -11.039
  193   HD21  LEU  24          HD21      LEU  24  37.382  19.692  -8.450
  194   HD22  LEU  24          HD22      LEU  24  36.857  20.214 -10.069
  195   HD23  LEU  24          HD23      LEU  24  38.089  21.149  -9.187
  Start of MODEL   39
    1    H1   GLY   1           HT1      GLY   1  55.269   0.088  11.026
    2    H2   GLY   1           HT2      GLY   1  56.423   1.313  10.791
    3    H3   GLY   1           HT3      GLY   1  56.684   0.107  11.959
    4    HA2  GLY   1           HA1      GLY   1  57.955  -0.751  10.378
    5    HA3  GLY   1           HA2      GLY   1  56.392  -1.438   9.894
    6    H    LYS   2           HN       LYS   2  58.462  -1.143   8.079
    7    HA   LYS   2           HA       LYS   2  58.480   1.292   6.620
    8    HB2  LYS   2           HB2      LYS   2  59.167  -0.163   4.675
    9    HB3  LYS   2           HB1      LYS   2  60.116  -0.424   6.158
   10    HG2  LYS   2           HG2      LYS   2  58.656  -2.369   6.725
   11    HG3  LYS   2           HG1      LYS   2  57.775  -2.128   5.197
   12    HD2  LYS   2           HD2      LYS   2  59.870  -2.472   3.926
   13    HD3  LYS   2           HD1      LYS   2  60.760  -2.701   5.451
   14    HE2  LYS   2           HE2      LYS   2  59.210  -4.622   5.986
   15    HE3  LYS   2           HE1      LYS   2  58.513  -4.447   4.358
   16    HZ1  LYS   2           HZ1      LYS   2  61.277  -4.481   4.060
   17    HZ2  LYS   2           HZ2      LYS   2  60.169  -5.686   3.604
   18    HZ3  LYS   2           HZ3      LYS   2  60.906  -5.740   5.134
   19    H    GLY   3           HN       GLY   3  57.659   1.433   4.273
   20    HA2  GLY   3           HA1      GLY   3  55.800   1.014   2.713
   21    HA3  GLY   3           HA2      GLY   3  54.772   0.410   4.093
   22    H    ARG   4           HN       ARG   4  54.843   1.370   5.825
   23    HA   ARG   4           HA       ARG   4  52.782   2.250   4.901
   24    HB2  ARG   4           HB2      ARG   4  53.697   2.852   7.753
   25    HB3  ARG   4           HB1      ARG   4  52.012   3.033   7.204
   26    HG2  ARG   4           HG2      ARG   4  51.869   0.688   6.617
   27    HG3  ARG   4           HG1      ARG   4  53.614   0.460   6.887
   28    HD2  ARG   4           HD2      ARG   4  53.371   0.853   9.265
   29    HD3  ARG   4           HD1      ARG   4  51.670   1.340   9.062
   30    HE   ARG   4           HE       ARG   4  51.815  -1.257   8.026
   31   HH11  ARG   4          HH11      ARG   4  52.308  -3.137   9.332
   32   HH12  ARG   4          HH12      ARG   4  52.068  -2.993  11.042
   33   HH21  ARG   4          HH21      ARG   4  51.596   0.440  10.955
   34   HH22  ARG   4          HH22      ARG   4  51.664  -0.968  11.960
   35    H    TRP   5           HN       TRP   5  55.510   3.878   5.037
   36    HA   TRP   5           HA       TRP   5  55.240   6.560   5.722
   37    HB2  TRP   5           HB2      TRP   5  56.361   5.671   3.042
   38    HB3  TRP   5           HB1      TRP   5  56.842   7.093   4.000
   39    HD1  TRP   5           HD1      TRP   5  57.630   3.503   3.481
   40    HE1  TRP   5           HE1      TRP   5  59.350   2.653   5.235
   41    HE3  TRP   5           HE3      TRP   5  57.496   7.461   6.725
   42    HZ2  TRP   5           HZ2      TRP   5  60.493   3.591   7.706
   43    HZ3  TRP   5           HZ3      TRP   5  58.910   7.463   8.774
   44    HH2  TRP   5           HH2      TRP   5  60.407   5.534   9.268
   45    H    LEU   6           HN       LEU   6  53.429   4.831   3.337
   46    HA   LEU   6           HA       LEU   6  52.286   7.392   2.233
   47    HB2  LEU   6           HB2      LEU   6  51.995   4.604   1.062
   48    HB3  LEU   6           HB1      LEU   6  51.694   6.171   0.276
   49    HG   LEU   6           HG       LEU   6  54.405   5.121   1.204
   50   HD11  LEU   6          HD11      LEU   6  54.911   4.944  -1.172
   51   HD12  LEU   6          HD12      LEU   6  53.339   5.661  -1.602
   52   HD13  LEU   6          HD13      LEU   6  53.407   4.049  -0.849
   53   HD21  LEU   6          HD21      LEU   6  54.494   7.495   1.437
   54   HD22  LEU   6          HD22      LEU   6  53.496   7.762  -0.013
   55   HD23  LEU   6          HD23      LEU   6  55.173   7.187  -0.177
   56    H    GLU   7           HN       GLU   7  51.625   4.533   4.172
   57    HA   GLU   7           HA       GLU   7  48.894   4.129   3.786
   58    HB2  GLU   7           HB2      GLU   7  50.426   2.968   5.446
   59    HB3  GLU   7           HB1      GLU   7  50.182   4.360   6.528
   60    HG2  GLU   7           HG2      GLU   7  47.748   3.973   6.512
   61    HG3  GLU   7           HG1      GLU   7  47.957   2.614   5.381
   62    H    ARG   8           HN       ARG   8  50.479   6.973   4.990
   63    HA   ARG   8           HA       ARG   8  48.102   8.069   6.319
   64    HB2  ARG   8           HB2      ARG   8  50.731   9.348   5.467
   65    HB3  ARG   8           HB1      ARG   8  49.483  10.133   6.465
   66    HG2  ARG   8           HG2      ARG   8  49.691   8.193   8.089
   67    HG3  ARG   8           HG1      ARG   8  51.098   7.642   7.147
   68    HD2  ARG   8           HD2      ARG   8  50.776  10.216   8.727
   69    HD3  ARG   8           HD1      ARG   8  52.032   8.964   8.892
   70    HE   ARG   8           HE       ARG   8  52.079  11.178   7.013
   71   HH11  ARG   8          HH11      ARG   8  53.111   7.984   7.766
   72   HH12  ARG   8          HH12      ARG   8  54.350   7.952   6.556
   73   HH21  ARG   8          HH21      ARG   8  53.600  11.107   5.329
   74   HH22  ARG   8          HH22      ARG   8  54.626   9.721   5.175
   75    H    ILE   9           HN       ILE   9  49.840   8.585   3.231
   76    HA   ILE   9           HA       ILE   9  48.048  10.683   2.346
   77    HB   ILE   9           HB       ILE   9  49.764   8.837   0.631
   78   HG12  ILE   9          HG12      ILE   9  51.224   9.776   2.300
   79   HG13  ILE   9          HG11      ILE   9  51.479  10.716   0.818
   80   HG21  ILE   9          HG21      ILE   9  49.812  11.095  -0.756
   81   HG22  ILE   9          HG22      ILE   9  48.333  11.473   0.155
   82   HG23  ILE   9          HG23      ILE   9  48.401  10.023  -0.866
   83   HD11  ILE   9           HD1      ILE   9  49.683  12.347   1.813
   84   HD12  ILE   9           HD2      ILE   9  51.318  12.370   2.505
   85   HD13  ILE   9           HD3      ILE   9  50.008  11.516   3.350
   86    H    GLY  10           HN       GLY  10  47.547   7.384   2.785
   87    HA2  GLY  10           HA1      GLY  10  46.140   6.526   0.529
   88    HA3  GLY  10           HA2      GLY  10  45.722   6.071   2.195
   89    H    LYS  11           HN       LYS  11  45.291   8.964   2.856
   90    HA   LYS  11           HA       LYS  11  42.592   9.288   1.539
   91    HB2  LYS  11           HB2      LYS  11  43.538   9.905   4.367
   92    HB3  LYS  11           HB1      LYS  11  42.005  10.506   3.689
   93    HG2  LYS  11           HG2      LYS  11  41.300   8.168   3.227
   94    HG3  LYS  11           HG1      LYS  11  42.821   7.577   3.939
   95    HD2  LYS  11           HD2      LYS  11  42.225   8.679   6.091
   96    HD3  LYS  11           HD1      LYS  11  40.684   9.210   5.377
   97    HE2  LYS  11           HE2      LYS  11  40.033   6.863   4.989
   98    HE3  LYS  11           HE1      LYS  11  41.588   6.310   5.656
   99    HZ1  LYS  11           HZ1      LYS  11  40.462   6.251   7.575
  100    HZ2  LYS  11           HZ2      LYS  11  39.224   7.274   7.021
  101    HZ3  LYS  11           HZ3      LYS  11  40.678   7.933   7.600
  102    H    ALA  12           HN       ALA  12  43.855  10.445  -0.130
  103    HA   ALA  12           HA       ALA  12  45.398  12.752   0.367
  104    HB1  ALA  12           HB1      ALA  12  45.036  13.293  -1.922
  105    HB2  ALA  12           HB2      ALA  12  43.479  12.430  -1.958
  106    HB3  ALA  12           HB3      ALA  12  45.003  11.519  -1.827
  107    H    GLY  13           HN       GLY  13  44.428  13.822   2.165
  108    HA2  GLY  13           HA1      GLY  13  42.985  15.341   3.170
  109    HA3  GLY  13           HA2      GLY  13  42.983  16.122   1.577
  110    H    PHE  14           HN       PHE  14  41.615  13.089   2.928
  111    HA   PHE  14           HA       PHE  14  39.473  12.224   2.785
  112    HB2  PHE  14           HB2      PHE  14  38.988  14.297   4.123
  113    HB3  PHE  14           HB1      PHE  14  38.589  15.131   2.603
  114    HD1  PHE  14           HD1      PHE  14  37.794  11.921   4.430
  115    HD2  PHE  14           HD2      PHE  14  36.335  15.096   1.892
  116    HE1  PHE  14           HE1      PHE  14  35.506  10.943   4.517
  117    HE2  PHE  14           HE2      PHE  14  34.047  14.115   1.983
  118    HZ   PHE  14           HZ       PHE  14  33.615  12.096   3.377
  119    H    ILE  15           HN       ILE  15  40.960  12.398   0.393
  120    HA   ILE  15           HA       ILE  15  40.660  12.151  -1.880
  121    HB   ILE  15           HB       ILE  15  37.657  12.099  -1.382
  122   HG12  ILE  15          HG12      ILE  15  39.711   9.867  -1.037
  123   HG13  ILE  15          HG11      ILE  15  38.737  10.605   0.256
  124   HG21  ILE  15          HG21      ILE  15  39.343  10.514  -3.360
  125   HG22  ILE  15          HG22      ILE  15  38.670  12.115  -3.748
  126   HG23  ILE  15          HG23      ILE  15  37.580  10.763  -3.368
  127   HD11  ILE  15           HD1      ILE  15  37.557   8.617  -0.285
  128   HD12  ILE  15           HD2      ILE  15  37.817   8.831  -2.031
  129   HD13  ILE  15           HD3      ILE  15  36.672   9.886  -1.165
  130    H    ILE  16           HN       ILE  16  41.376  14.508  -1.666
  131    HA   ILE  16           HA       ILE  16  39.422  16.140  -3.246
  132    HB   ILE  16           HB       ILE  16  39.306  16.844  -0.812
  133   HG12  ILE  16          HG12      ILE  16  39.712  19.303  -1.318
  134   HG13  ILE  16          HG11      ILE  16  40.420  18.810  -2.872
  135   HG21  ILE  16          HG21      ILE  16  41.161  17.828   0.280
  136   HG22  ILE  16          HG22      ILE  16  42.082  17.980  -1.229
  137   HG23  ILE  16          HG23      ILE  16  41.842  16.379  -0.494
  138   HD11  ILE  16           HD1      ILE  16  38.352  18.144  -3.759
  139   HD12  ILE  16           HD2      ILE  16  37.831  19.470  -2.698
  140   HD13  ILE  16           HD3      ILE  16  37.655  17.785  -2.161
  141    H    ILE  17           HN       ILE  17  42.783  15.851  -1.967
  142    HA   ILE  17           HA       ILE  17  43.843  17.416  -4.237
  143    HB   ILE  17           HB       ILE  17  45.292  15.626  -2.223
  144   HG12  ILE  17          HG12      ILE  17  44.328  17.468  -1.007
  145   HG13  ILE  17          HG11      ILE  17  46.040  17.852  -1.230
  146   HG21  ILE  17          HG21      ILE  17  46.246  17.407  -4.487
  147   HG22  ILE  17          HG22      ILE  17  46.773  15.774  -4.035
  148   HG23  ILE  17          HG23      ILE  17  47.279  17.167  -3.058
  149   HD11  ILE  17           HD1      ILE  17  44.965  19.883  -1.773
  150   HD12  ILE  17           HD2      ILE  17  43.627  19.069  -2.610
  151   HD13  ILE  17           HD3      ILE  17  45.230  19.149  -3.367
  152    H    GLY  18           HN       GLY  18  43.401  14.057  -3.247
  153    HA2  GLY  18           HA1      GLY  18  44.819  12.972  -5.560
  154    HA3  GLY  18           HA2      GLY  18  43.827  12.073  -4.391
  155    H    GLY  19           HN       GLY  19  41.386  13.217  -4.522
  156    HA2  GLY  19           HA1      GLY  19  40.361  12.150  -6.995
  157    HA3  GLY  19           HA2      GLY  19  39.446  13.063  -5.780
  158    H    ALA  20           HN       ALA  20  41.089  15.426  -5.825
  159    HA   ALA  20           HA       ALA  20  41.382  17.384  -7.020
  160    HB1  ALA  20           HB1      ALA  20  41.892  17.338  -9.301
  161    HB2  ALA  20           HB2      ALA  20  40.749  16.018  -9.643
  162    HB3  ALA  20           HB3      ALA  20  42.277  15.677  -8.799
  163    H    LEU  21           HN       LEU  21  38.630  15.327  -7.920
  164    HA   LEU  21           HA       LEU  21  36.425  15.876  -8.379
  165    HB2  LEU  21           HB2      LEU  21  37.243  18.078  -6.458
  166    HB3  LEU  21           HB1      LEU  21  35.589  17.975  -7.090
  167    HG   LEU  21           HG       LEU  21  36.011  16.858  -4.824
  168   HD11  LEU  21          HD11      LEU  21  35.042  14.818  -6.861
  169   HD12  LEU  21          HD12      LEU  21  34.109  16.290  -6.516
  170   HD13  LEU  21          HD13      LEU  21  34.451  15.129  -5.217
  171   HD21  LEU  21          HD21      LEU  21  37.156  14.743  -4.737
  172   HD22  LEU  21          HD22      LEU  21  38.249  15.889  -5.547
  173   HD23  LEU  21          HD23      LEU  21  37.346  14.691  -6.504
  174    H    ASP  22           HN       ASP  22  38.875  17.323  -9.806
  175    HA   ASP  22           HA       ASP  22  37.568  19.708 -10.913
  176    HB2  ASP  22           HB2      ASP  22  40.059  19.459 -10.610
  177    HB3  ASP  22           HB1      ASP  22  40.041  18.249 -11.915
  178    H    HIS  23           HN       HIS  23  38.173  16.343 -11.903
  179    HA   HIS  23           HA       HIS  23  35.958  16.442 -13.778
  180    HB2  HIS  23           HB2      HIS  23  37.721  17.656 -15.084
  181    HB3  HIS  23           HB1      HIS  23  38.745  16.204 -14.977
  182    HD1  HIS  23           HD1      HIS  23  35.035  16.799 -15.854
  183    HD2  HIS  23           HD2      HIS  23  38.394  14.685 -17.245
  184    HE1  HIS  23           HE1      HIS  23  34.328  15.550 -17.967
  185    H    LEU  24           HN       LEU  24  38.663  14.896 -12.228
  186    HA   LEU  24           HA       LEU  24  38.401  12.291 -13.395
  187    HB2  LEU  24           HB2      LEU  24  40.229  13.347 -11.791
  188    HB3  LEU  24           HB1      LEU  24  39.206  12.686 -10.498
  189    HG   LEU  24           HG       LEU  24  40.454  11.129 -12.810
  190   HD11  LEU  24          HD11      LEU  24  40.927  11.083  -9.795
  191   HD12  LEU  24          HD12      LEU  24  42.032  11.761 -11.016
  192   HD13  LEU  24          HD13      LEU  24  41.710  10.010 -10.981
  193   HD21  LEU  24          HD21      LEU  24  38.364  10.058 -12.385
  194   HD22  LEU  24          HD22      LEU  24  38.477  10.341 -10.630
  195   HD23  LEU  24          HD23      LEU  24  39.535   9.141 -11.410
  Start of MODEL   40
    1    H1   GLY   1           HT1      GLY   1  57.946  -2.590   6.387
    2    H2   GLY   1           HT2      GLY   1  57.953  -1.043   7.091
    3    H3   GLY   1           HT3      GLY   1  59.255  -2.106   7.348
    4    HA2  GLY   1           HA1      GLY   1  60.218  -0.945   5.760
    5    HA3  GLY   1           HA2      GLY   1  59.269  -2.033   4.728
    6    H    LYS   2           HN       LYS   2  59.673  -0.095   3.269
    7    HA   LYS   2           HA       LYS   2  58.156   2.324   3.799
    8    HB2  LYS   2           HB2      LYS   2  58.575   2.738   1.326
    9    HB3  LYS   2           HB1      LYS   2  60.032   2.469   2.312
   10    HG2  LYS   2           HG2      LYS   2  60.256   0.206   1.542
   11    HG3  LYS   2           HG1      LYS   2  58.633   0.221   0.809
   12    HD2  LYS   2           HD2      LYS   2  60.349   0.481  -0.935
   13    HD3  LYS   2           HD1      LYS   2  59.388   1.972  -0.794
   14    HE2  LYS   2           HE2      LYS   2  61.969   1.665   0.780
   15    HE3  LYS   2           HE1      LYS   2  62.005   2.165  -0.927
   16    HZ1  LYS   2           HZ1      LYS   2  61.486   3.756   1.283
   17    HZ2  LYS   2           HZ2      LYS   2  60.003   3.603   0.468
   18    HZ3  LYS   2           HZ3      LYS   2  61.370   4.192  -0.352
   19    H    GLY   3           HN       GLY   3  56.577   3.051   1.939
   20    HA2  GLY   3           HA1      GLY   3  54.812   1.816   0.398
   21    HA3  GLY   3           HA2      GLY   3  54.329   0.997   1.955
   22    H    ARG   4           HN       ARG   4  54.558   1.997   3.658
   23    HA   ARG   4           HA       ARG   4  52.174   2.261   3.280
   24    HB2  ARG   4           HB2      ARG   4  53.505   3.203   5.864
   25    HB3  ARG   4           HB1      ARG   4  51.769   2.818   5.708
   26    HG2  ARG   4           HG2      ARG   4  52.361   0.528   4.924
   27    HG3  ARG   4           HG1      ARG   4  54.088   0.914   5.132
   28    HD2  ARG   4           HD2      ARG   4  51.944   0.761   7.289
   29    HD3  ARG   4           HD1      ARG   4  53.396  -0.257   7.124
   30    HE   ARG   4           HE       ARG   4  54.295   2.415   7.340
   31   HH11  ARG   4          HH11      ARG   4  51.800   1.182   9.183
   32   HH12  ARG   4          HH12      ARG   4  52.614   1.310  10.706
   33   HH21  ARG   4          HH21      ARG   4  55.679   2.118   9.298
   34   HH22  ARG   4          HH22      ARG   4  54.811   1.838  10.771
   35    H    TRP   5           HN       TRP   5  54.311   4.557   2.802
   36    HA   TRP   5           HA       TRP   5  53.600   7.091   3.640
   37    HB2  TRP   5           HB2      TRP   5  54.119   6.276   0.757
   38    HB3  TRP   5           HB1      TRP   5  54.237   7.937   1.390
   39    HD1  TRP   5           HD1      TRP   5  56.182   4.786   1.007
   40    HE1  TRP   5           HE1      TRP   5  58.481   4.952   2.209
   41    HE3  TRP   5           HE3      TRP   5  55.380   9.069   3.695
   42    HZ2  TRP   5           HZ2      TRP   5  59.767   6.720   4.083
   43    HZ3  TRP   5           HZ3      TRP   5  57.156   9.976   5.184
   44    HH2  TRP   5           HH2      TRP   5  59.348   8.808   5.380
   45    H    LEU   6           HN       LEU   6  51.692   4.955   1.639
   46    HA   LEU   6           HA       LEU   6  49.687   7.077   1.024
   47    HB2  LEU   6           HB2      LEU   6  50.089   4.194   0.158
   48    HB3  LEU   6           HB1      LEU   6  48.569   5.048  -0.163
   49    HG   LEU   6           HG       LEU   6  50.309   5.070  -2.043
   50   HD11  LEU   6          HD11      LEU   6  49.708   7.238  -2.781
   51   HD12  LEU   6          HD12      LEU   6  49.633   7.893  -1.134
   52   HD13  LEU   6          HD13      LEU   6  48.378   6.771  -1.703
   53   HD21  LEU   6          HD21      LEU   6  52.213   6.531  -1.877
   54   HD22  LEU   6          HD22      LEU   6  52.247   5.469  -0.451
   55   HD23  LEU   6          HD23      LEU   6  51.686   7.151  -0.297
   56    H    GLU   7           HN       GLU   7  50.189   4.155   3.007
   57    HA   GLU   7           HA       GLU   7  47.367   4.325   4.007
   58    HB2  GLU   7           HB2      GLU   7  49.603   2.320   4.513
   59    HB3  GLU   7           HB1      GLU   7  47.956   2.212   5.180
   60    HG2  GLU   7           HG2      GLU   7  46.999   2.060   2.946
   61    HG3  GLU   7           HG1      GLU   7  48.588   2.362   2.200
   62    H    ARG   8           HN       ARG   8  49.891   6.139   4.572
   63    HA   ARG   8           HA       ARG   8  50.396   5.761   7.395
   64    HB2  ARG   8           HB2      ARG   8  51.728   7.087   5.512
   65    HB3  ARG   8           HB1      ARG   8  50.714   8.449   6.033
   66    HG2  ARG   8           HG2      ARG   8  52.569   6.778   7.792
   67    HG3  ARG   8           HG1      ARG   8  52.812   8.469   7.297
   68    HD2  ARG   8           HD2      ARG   8  50.544   8.954   8.442
   69    HD3  ARG   8           HD1      ARG   8  50.712   7.343   9.182
   70    HE   ARG   8           HE       ARG   8  53.104   8.955   9.540
   71   HH11  ARG   8          HH11      ARG   8  51.996   7.087  11.595
   72   HH12  ARG   8          HH12      ARG   8  51.377   8.180  12.787
   73   HH21  ARG   8          HH21      ARG   8  51.405  10.926  10.669
   74   HH22  ARG   8          HH22      ARG   8  51.043  10.354  12.263
   75    H    ILE   9           HN       ILE   9  48.780   8.540   5.774
   76    HA   ILE   9           HA       ILE   9  47.128   8.919   8.248
   77    HB   ILE   9           HB       ILE   9  46.553  11.123   7.239
   78   HG12  ILE   9          HG12      ILE   9  48.449  10.181   5.035
   79   HG13  ILE   9          HG11      ILE   9  46.714  10.529   4.862
   80   HG21  ILE   9          HG21      ILE   9  49.568  10.704   7.168
   81   HG22  ILE   9          HG22      ILE   9  48.637  10.690   8.686
   82   HG23  ILE   9          HG23      ILE   9  48.671  12.154   7.677
   83   HD11  ILE   9           HD1      ILE   9  47.308  12.912   5.732
   84   HD12  ILE   9           HD2      ILE   9  47.772  12.496   4.065
   85   HD13  ILE   9           HD3      ILE   9  48.992  12.472   5.359
   86    H    GLY  10           HN       GLY  10  46.922   8.226   4.776
   87    HA2  GLY  10           HA1      GLY  10  45.098   7.691   3.447
   88    HA3  GLY  10           HA2      GLY  10  44.513   6.829   4.885
   89    H    LYS  11           HN       LYS  11  44.857  10.234   3.794
   90    HA   LYS  11           HA       LYS  11  41.966  10.651   3.950
   91    HB2  LYS  11           HB2      LYS  11  42.540  10.750   6.352
   92    HB3  LYS  11           HB1      LYS  11  43.764  11.995   6.006
   93    HG2  LYS  11           HG2      LYS  11  42.112  13.588   5.334
   94    HG3  LYS  11           HG1      LYS  11  40.846  12.344   5.213
   95    HD2  LYS  11           HD2      LYS  11  40.525  13.641   7.269
   96    HD3  LYS  11           HD1      LYS  11  41.009  11.980   7.684
   97    HE2  LYS  11           HE2      LYS  11  43.240  12.648   8.213
   98    HE3  LYS  11           HE1      LYS  11  43.040  14.232   7.424
   99    HZ1  LYS  11           HZ1      LYS  11  41.043  13.930   9.377
  100    HZ2  LYS  11           HZ2      LYS  11  42.318  15.051   9.332
  101    HZ3  LYS  11           HZ3      LYS  11  42.532  13.547  10.090
  102    H    ALA  12           HN       ALA  12  42.455  11.227   1.757
  103    HA   ALA  12           HA       ALA  12  44.235  13.501   1.245
  104    HB1  ALA  12           HB1      ALA  12  43.632  13.197  -1.047
  105    HB2  ALA  12           HB2      ALA  12  42.172  12.275  -0.610
  106    HB3  ALA  12           HB3      ALA  12  43.786  11.572  -0.339
  107    H    GLY  13           HN       GLY  13  42.709  14.524   3.111
  108    HA2  GLY  13           HA1      GLY  13  41.252  16.253   3.588
  109    HA3  GLY  13           HA2      GLY  13  41.490  16.774   1.908
  110    H    PHE  14           HN       PHE  14  39.782  14.200   3.745
  111    HA   PHE  14           HA       PHE  14  37.659  13.316   3.445
  112    HB2  PHE  14           HB2      PHE  14  37.133  15.731   4.043
  113    HB3  PHE  14           HB1      PHE  14  36.950  16.045   2.300
  114    HD1  PHE  14           HD1      PHE  14  34.849  15.651   1.268
  115    HD2  PHE  14           HD2      PHE  14  35.773  13.705   5.010
  116    HE1  PHE  14           HE1      PHE  14  32.530  14.746   1.372
  117    HE2  PHE  14           HE2      PHE  14  33.454  12.801   5.111
  118    HZ   PHE  14           HZ       PHE  14  31.810  13.392   3.336
  119    H    ILE  15           HN       ILE  15  39.599  13.022   1.286
  120    HA   ILE  15           HA       ILE  15  39.667  12.262  -0.878
  121    HB   ILE  15           HB       ILE  15  36.642  11.937  -0.790
  122   HG12  ILE  15          HG12      ILE  15  38.789  10.154   0.450
  123   HG13  ILE  15          HG11      ILE  15  37.523  11.048   1.324
  124   HG21  ILE  15          HG21      ILE  15  38.772  10.132  -2.003
  125   HG22  ILE  15          HG22      ILE  15  38.041  11.484  -2.898
  126   HG23  ILE  15          HG23      ILE  15  37.022  10.143  -2.331
  127   HD11  ILE  15           HD1      ILE  15  36.654   8.847   1.163
  128   HD12  ILE  15           HD2      ILE  15  37.221   8.649  -0.511
  129   HD13  ILE  15           HD3      ILE  15  35.840   9.717  -0.158
  130    H    ILE  16           HN       ILE  16  40.101  14.646  -1.030
  131    HA   ILE  16           HA       ILE  16  38.307  15.776  -3.164
  132    HB   ILE  16           HB       ILE  16  39.683  17.266  -0.895
  133   HG12  ILE  16          HG12      ILE  16  37.484  15.952  -0.395
  134   HG13  ILE  16          HG11      ILE  16  37.571  17.652   0.095
  135   HG21  ILE  16          HG21      ILE  16  39.733  18.647  -2.873
  136   HG22  ILE  16          HG22      ILE  16  38.393  19.249  -1.876
  137   HG23  ILE  16          HG23      ILE  16  38.060  18.223  -3.292
  138   HD11  ILE  16           HD1      ILE  16  36.208  18.355  -1.760
  139   HD12  ILE  16           HD2      ILE  16  35.402  16.941  -1.050
  140   HD13  ILE  16           HD3      ILE  16  36.334  16.768  -2.550
  141    H    ILE  17           HN       ILE  17  41.470  16.038  -1.478
  142    HA   ILE  17           HA       ILE  17  42.805  17.188  -3.786
  143    HB   ILE  17           HB       ILE  17  44.090  15.616  -1.505
  144   HG12  ILE  17          HG12      ILE  17  42.727  17.246  -0.405
  145   HG13  ILE  17          HG11      ILE  17  44.358  17.938  -0.433
  146   HG21  ILE  17          HG21      ILE  17  45.952  17.376  -2.016
  147   HG22  ILE  17          HG22      ILE  17  45.087  17.638  -3.548
  148   HG23  ILE  17          HG23      ILE  17  45.729  16.031  -3.154
  149   HD11  ILE  17           HD1      ILE  17  41.972  18.666  -2.168
  150   HD12  ILE  17           HD2      ILE  17  43.626  19.154  -2.595
  151   HD13  ILE  17           HD3      ILE  17  42.899  19.716  -1.076
  152    H    GLY  18           HN       GLY  18  42.522  13.931  -2.369
  153    HA2  GLY  18           HA1      GLY  18  44.119  12.702  -4.491
  154    HA3  GLY  18           HA2      GLY  18  43.197  11.869  -3.221
  155    H    GLY  19           HN       GLY  19  40.658  12.922  -3.601
  156    HA2  GLY  19           HA1      GLY  19  39.686  11.269  -5.711
  157    HA3  GLY  19           HA2      GLY  19  38.767  12.536  -4.875
  158    H    ALA  20           HN       ALA  20  40.271  14.799  -5.557
  159    HA   ALA  20           HA       ALA  20  39.148  15.440  -8.089
  160    HB1  ALA  20           HB1      ALA  20  39.748  17.180  -6.539
  161    HB2  ALA  20           HB2      ALA  20  40.728  17.398  -8.009
  162    HB3  ALA  20           HB3      ALA  20  41.454  16.677  -6.553
  163    H    LEU  21           HN       LEU  21  42.059  13.753  -7.239
  164    HA   LEU  21           HA       LEU  21  43.671  14.276  -9.506
  165    HB2  LEU  21           HB2      LEU  21  44.185  12.909  -7.363
  166    HB3  LEU  21           HB1      LEU  21  43.420  11.544  -8.205
  167    HG   LEU  21           HG       LEU  21  45.075  12.193 -10.188
  168   HD11  LEU  21          HD11      LEU  21  46.438  13.426  -7.747
  169   HD12  LEU  21          HD12      LEU  21  45.979  14.263  -9.248
  170   HD13  LEU  21          HD13      LEU  21  47.267  13.041  -9.270
  171   HD21  LEU  21          HD21      LEU  21  46.016  10.865  -7.604
  172   HD22  LEU  21          HD22      LEU  21  46.819  10.709  -9.185
  173   HD23  LEU  21          HD23      LEU  21  45.175  10.068  -8.955
  174    H    ASP  22           HN       ASP  22  40.658  12.620  -9.239
  175    HA   ASP  22           HA       ASP  22  40.779  10.707 -11.288
  176    HB2  ASP  22           HB2      ASP  22  38.501  12.611 -10.609
  177    HB3  ASP  22           HB1      ASP  22  38.346  11.133 -11.589
  178    H    HIS  23           HN       HIS  23  39.925  14.185 -11.592
  179    HA   HIS  23           HA       HIS  23  41.122  14.233 -14.299
  180    HB2  HIS  23           HB2      HIS  23  38.199  14.988 -13.926
  181    HB3  HIS  23           HB1      HIS  23  39.129  14.964 -15.443
  182    HD1  HIS  23           HD1      HIS  23  40.249  12.434 -15.959
  183    HD2  HIS  23           HD2      HIS  23  36.746  12.669 -13.649
  184    HE1  HIS  23           HE1      HIS  23  39.184  10.112 -15.953
  185    H    LEU  24           HN       LEU  24  41.836  15.448 -11.834
  186    HA   LEU  24           HA       LEU  24  41.938  18.216 -12.718
  187    HB2  LEU  24           HB2      LEU  24  39.713  18.371 -11.802
  188    HB3  LEU  24           HB1      LEU  24  40.185  17.476 -10.343
  189    HG   LEU  24           HG       LEU  24  41.563  19.311  -9.566
  190   HD11  LEU  24          HD11      LEU  24  41.586  21.477 -10.996
  191   HD12  LEU  24          HD12      LEU  24  41.064  20.442 -12.348
  192   HD13  LEU  24          HD13      LEU  24  42.620  20.136 -11.539
  193   HD21  LEU  24          HD21      LEU  24  38.984  20.465 -10.715
  194   HD22  LEU  24          HD22      LEU  24  39.877  21.061  -9.295
  195   HD23  LEU  24          HD23      LEU  24  39.077  19.471  -9.241
  Start of MODEL   41
    1    H1   GLY   1           HT1      GLY   1  59.624   0.886  12.659
    2    H2   GLY   1           HT2      GLY   1  59.768  -0.745  12.201
    3    H3   GLY   1           HT3      GLY   1  58.860  -0.319  13.573
    4    HA2  GLY   1           HA1      GLY   1  57.299  -0.763  11.965
    5    HA3  GLY   1           HA2      GLY   1  57.415   1.005  12.069
    6    H    LYS   2           HN       LYS   2  56.437  -0.542   9.843
    7    HA   LYS   2           HA       LYS   2  57.937   0.767   7.744
    8    HB2  LYS   2           HB2      LYS   2  59.466  -1.160   8.231
    9    HB3  LYS   2           HB1      LYS   2  58.135  -2.270   7.829
   10    HG2  LYS   2           HG2      LYS   2  58.049  -1.488   5.552
   11    HG3  LYS   2           HG1      LYS   2  59.136  -0.123   5.912
   12    HD2  LYS   2           HD2      LYS   2  60.961  -1.724   6.438
   13    HD3  LYS   2           HD1      LYS   2  59.876  -3.080   6.046
   14    HE2  LYS   2           HE2      LYS   2  60.521  -0.843   4.083
   15    HE3  LYS   2           HE1      LYS   2  61.439  -2.365   4.162
   16    HZ1  LYS   2           HZ1      LYS   2  58.818  -1.852   3.083
   17    HZ2  LYS   2           HZ2      LYS   2  58.858  -3.196   4.122
   18    HZ3  LYS   2           HZ3      LYS   2  59.888  -3.131   2.773
   19    H    GLY   3           HN       GLY   3  56.983   0.443   5.627
   20    HA2  GLY   3           HA1      GLY   3  55.082  -0.869   4.424
   21    HA3  GLY   3           HA2      GLY   3  54.056  -0.423   5.870
   22    H    ARG   4           HN       ARG   4  54.473   1.316   6.779
   23    HA   ARG   4           HA       ARG   4  52.485   1.898   5.512
   24    HB2  ARG   4           HB2      ARG   4  53.765   3.798   7.535
   25    HB3  ARG   4           HB1      ARG   4  52.072   3.929   6.988
   26    HG2  ARG   4           HG2      ARG   4  51.569   1.697   7.810
   27    HG3  ARG   4           HG1      ARG   4  53.282   1.398   8.185
   28    HD2  ARG   4           HD2      ARG   4  51.654   3.641   9.447
   29    HD3  ARG   4           HD1      ARG   4  51.858   2.036  10.190
   30    HE   ARG   4           HE       ARG   4  54.448   3.018   9.558
   31   HH11  ARG   4          HH11      ARG   4  54.067   2.113  12.248
   32   HH12  ARG   4          HH12      ARG   4  53.987   3.563  13.193
   33   HH21  ARG   4          HH21      ARG   4  53.346   5.615  10.472
   34   HH22  ARG   4          HH22      ARG   4  53.579   5.546  12.187
   35    H    TRP   5           HN       TRP   5  55.422   2.768   4.694
   36    HA   TRP   5           HA       TRP   5  55.739   5.356   3.792
   37    HB2  TRP   5           HB2      TRP   5  56.248   2.822   2.189
   38    HB3  TRP   5           HB1      TRP   5  56.896   4.424   1.764
   39    HD1  TRP   5           HD1      TRP   5  57.373   1.523   4.136
   40    HE1  TRP   5           HE1      TRP   5  59.475   1.906   5.617
   41    HE3  TRP   5           HE3      TRP   5  58.347   6.399   2.912
   42    HZ2  TRP   5           HZ2      TRP   5  61.311   4.053   6.172
   43    HZ3  TRP   5           HZ3      TRP   5  60.281   7.593   3.930
   44    HH2  TRP   5           HH2      TRP   5  61.762   6.427   5.558
   45    H    LEU   6           HN       LEU   6  53.316   3.098   2.719
   46    HA   LEU   6           HA       LEU   6  52.483   4.905   0.475
   47    HB2  LEU   6           HB2      LEU   6  52.760   2.562  -0.135
   48    HB3  LEU   6           HB1      LEU   6  51.728   2.047   1.215
   49    HG   LEU   6           HG       LEU   6  49.776   3.130   0.194
   50   HD11  LEU   6          HD11      LEU   6  51.849   4.157  -1.780
   51   HD12  LEU   6          HD12      LEU   6  50.598   5.069  -0.902
   52   HD13  LEU   6          HD13      LEU   6  50.138   4.007  -2.249
   53   HD21  LEU   6          HD21      LEU   6  51.348   1.493  -1.843
   54   HD22  LEU   6          HD22      LEU   6  49.583   1.716  -1.817
   55   HD23  LEU   6          HD23      LEU   6  50.386   0.823  -0.504
   56    H    GLU   7           HN       GLU   7  51.529   3.605   3.646
   57    HA   GLU   7           HA       GLU   7  48.832   4.895   3.396
   58    HB2  GLU   7           HB2      GLU   7  49.978   3.236   5.676
   59    HB3  GLU   7           HB1      GLU   7  48.276   3.688   5.415
   60    HG2  GLU   7           HG2      GLU   7  49.946   1.954   3.538
   61    HG3  GLU   7           HG1      GLU   7  48.733   1.350   4.690
   62    H    ARG   8           HN       ARG   8  50.972   6.688   3.368
   63    HA   ARG   8           HA       ARG   8  51.876   7.662   5.836
   64    HB2  ARG   8           HB2      ARG   8  52.442   8.495   3.479
   65    HB3  ARG   8           HB1      ARG   8  50.941   9.443   3.558
   66    HG2  ARG   8           HG2      ARG   8  52.462  11.024   4.373
   67    HG3  ARG   8           HG1      ARG   8  51.959  10.268   5.901
   68    HD2  ARG   8           HD2      ARG   8  53.951   8.736   5.742
   69    HD3  ARG   8           HD1      ARG   8  54.461   9.607   4.278
   70    HE   ARG   8           HE       ARG   8  54.106  11.567   6.271
   71   HH11  ARG   8          HH11      ARG   8  55.244   8.936   7.633
   72   HH12  ARG   8          HH12      ARG   8  56.915   9.383   7.728
   73   HH21  ARG   8          HH21      ARG   8  56.590  12.075   5.566
   74   HH22  ARG   8          HH22      ARG   8  57.676  11.161   6.558
   75    H    ILE   9           HN       ILE   9  48.738   8.170   4.235
   76    HA   ILE   9           HA       ILE   9  47.549   8.900   6.837
   77    HB   ILE   9           HB       ILE   9  46.531  11.019   5.920
   78   HG12  ILE   9          HG12      ILE   9  48.591  10.527   3.719
   79   HG13  ILE   9          HG11      ILE   9  46.824  10.591   3.529
   80   HG21  ILE   9          HG21      ILE   9  48.412  12.395   6.465
   81   HG22  ILE   9          HG22      ILE   9  49.574  11.173   5.898
   82   HG23  ILE   9          HG23      ILE   9  48.648  10.899   7.393
   83   HD11  ILE   9           HD1      ILE   9  48.737  12.861   4.169
   84   HD12  ILE   9           HD2      ILE   9  46.992  12.993   4.508
   85   HD13  ILE   9           HD3      ILE   9  47.561  12.741   2.840
   86    H    GLY  10           HN       GLY  10  47.270   8.424   3.330
   87    HA2  GLY  10           HA1      GLY  10  45.632   7.303   2.135
   88    HA3  GLY  10           HA2      GLY  10  44.941   6.754   3.674
   89    H    LYS  11           HN       LYS  11  44.978   9.863   4.299
   90    HA   LYS  11           HA       LYS  11  42.186  10.249   3.356
   91    HB2  LYS  11           HB2      LYS  11  43.968  11.874   5.214
   92    HB3  LYS  11           HB1      LYS  11  42.256  12.223   4.871
   93    HG2  LYS  11           HG2      LYS  11  41.758   9.822   5.646
   94    HG3  LYS  11           HG1      LYS  11  43.424   9.781   6.266
   95    HD2  LYS  11           HD2      LYS  11  41.317  11.856   7.029
   96    HD3  LYS  11           HD1      LYS  11  41.762  10.446   8.017
   97    HE2  LYS  11           HE2      LYS  11  43.481  12.849   7.295
   98    HE3  LYS  11           HE1      LYS  11  43.021  12.269   8.910
   99    HZ1  LYS  11           HZ1      LYS  11  44.241  10.112   7.900
  100    HZ2  LYS  11           HZ2      LYS  11  45.025  11.296   8.833
  101    HZ3  LYS  11           HZ3      LYS  11  45.123  11.343   7.137
  102    H    ALA  12           HN       ALA  12  42.054  10.936   1.293
  103    HA   ALA  12           HA       ALA  12  44.066  12.748   0.166
  104    HB1  ALA  12           HB1      ALA  12  42.618  12.660  -1.827
  105    HB2  ALA  12           HB2      ALA  12  41.383  11.788  -0.892
  106    HB3  ALA  12           HB3      ALA  12  42.963  11.030  -1.206
  107    H    GLY  13           HN       GLY  13  43.458  14.152   2.227
  108    HA2  GLY  13           HA1      GLY  13  42.431  16.067   3.054
  109    HA3  GLY  13           HA2      GLY  13  42.468  16.601   1.360
  110    H    PHE  14           HN       PHE  14  40.651  14.058   3.108
  111    HA   PHE  14           HA       PHE  14  38.382  13.626   3.192
  112    HB2  PHE  14           HB2      PHE  14  38.383  15.957   4.224
  113    HB3  PHE  14           HB1      PHE  14  37.959  16.587   2.615
  114    HD1  PHE  14           HD1      PHE  14  35.708  16.470   1.809
  115    HD2  PHE  14           HD2      PHE  14  36.867  14.195   5.291
  116    HE1  PHE  14           HE1      PHE  14  33.323  15.883   2.220
  117    HE2  PHE  14           HE2      PHE  14  34.481  13.610   5.701
  118    HZ   PHE  14           HZ       PHE  14  32.720  14.385   4.118
  119    H    ILE  15           HN       ILE  15  39.227  12.646   1.043
  120    HA   ILE  15           HA       ILE  15  39.037  12.373  -1.269
  121    HB   ILE  15           HB       ILE  15  36.587  12.082  -1.956
  122   HG12  ILE  15          HG12      ILE  15  36.106  12.696   1.001
  123   HG13  ILE  15          HG11      ILE  15  35.715  13.816  -0.323
  124   HG21  ILE  15          HG21      ILE  15  37.366  10.713   0.657
  125   HG22  ILE  15          HG22      ILE  15  38.059  10.284  -0.925
  126   HG23  ILE  15          HG23      ILE  15  36.321  10.070  -0.630
  127   HD11  ILE  15           HD1      ILE  15  33.669  12.701   0.065
  128   HD12  ILE  15           HD2      ILE  15  34.461  11.132   0.328
  129   HD13  ILE  15           HD3      ILE  15  34.348  11.809  -1.314
  130    H    ILE  16           HN       ILE  16  40.044  14.667  -1.361
  131    HA   ILE  16           HA       ILE  16  38.231  16.295  -3.141
  132    HB   ILE  16           HB       ILE  16  38.581  17.333  -0.824
  133   HG12  ILE  16          HG12      ILE  16  39.381  19.616  -1.926
  134   HG13  ILE  16          HG11      ILE  16  39.341  18.692  -3.442
  135   HG21  ILE  16          HG21      ILE  16  40.701  18.238  -0.225
  136   HG22  ILE  16          HG22      ILE  16  41.377  17.950  -1.845
  137   HG23  ILE  16          HG23      ILE  16  41.040  16.579  -0.762
  138   HD11  ILE  16           HD1      ILE  16  36.969  18.846  -1.527
  139   HD12  ILE  16           HD2      ILE  16  36.976  18.245  -3.201
  140   HD13  ILE  16           HD3      ILE  16  37.211  19.974  -2.877
  141    H    ILE  17           HN       ILE  17  41.661  15.676  -2.184
  142    HA   ILE  17           HA       ILE  17  42.554  16.718  -4.799
  143    HB   ILE  17           HB       ILE  17  44.019  17.068  -2.849
  144   HG12  ILE  17          HG12      ILE  17  46.120  16.219  -3.751
  145   HG13  ILE  17          HG11      ILE  17  45.278  14.955  -4.670
  146   HG21  ILE  17          HG21      ILE  17  44.316  14.042  -2.718
  147   HG22  ILE  17          HG22      ILE  17  43.225  14.965  -1.660
  148   HG23  ILE  17          HG23      ILE  17  44.980  15.249  -1.594
  149   HD11  ILE  17           HD1      ILE  17  44.399  16.496  -6.231
  150   HD12  ILE  17           HD2      ILE  17  46.022  17.151  -5.912
  151   HD13  ILE  17           HD3      ILE  17  44.601  17.880  -5.129
  152    H    GLY  18           HN       GLY  18  41.949  13.643  -3.195
  153    HA2  GLY  18           HA1      GLY  18  42.992  12.104  -5.517
  154    HA3  GLY  18           HA2      GLY  18  42.397  11.450  -3.977
  155    H    GLY  19           HN       GLY  19  39.964  12.983  -3.890
  156    HA2  GLY  19           HA1      GLY  19  38.312  11.213  -5.477
  157    HA3  GLY  19           HA2      GLY  19  37.761  12.575  -4.482
  158    H    ALA  20           HN       ALA  20  39.334  14.619  -5.761
  159    HA   ALA  20           HA       ALA  20  37.535  15.193  -7.965
  160    HB1  ALA  20           HB1      ALA  20  40.136  16.544  -7.164
  161    HB2  ALA  20           HB2      ALA  20  38.521  16.944  -6.529
  162    HB3  ALA  20           HB3      ALA  20  38.894  17.212  -8.249
  163    H    LEU  21           HN       LEU  21  41.126  15.033  -7.980
  164    HA   LEU  21           HA       LEU  21  42.570  14.396  -9.664
  165    HB2  LEU  21           HB2      LEU  21  41.227  12.211  -9.016
  166    HB3  LEU  21           HB1      LEU  21  40.506  12.392 -10.621
  167    HG   LEU  21           HG       LEU  21  42.375  10.927 -10.895
  168   HD11  LEU  21          HD11      LEU  21  43.751  12.084 -12.487
  169   HD12  LEU  21          HD12      LEU  21  43.442  13.658 -11.723
  170   HD13  LEU  21          HD13      LEU  21  42.130  12.806 -12.573
  171   HD21  LEU  21          HD21      LEU  21  44.338  12.921  -9.696
  172   HD22  LEU  21          HD22      LEU  21  44.524  11.176  -9.956
  173   HD23  LEU  21          HD23      LEU  21  43.472  11.769  -8.654
  174    H    ASP  22           HN       ASP  22  42.395  16.392 -10.775
  175    HA   ASP  22           HA       ASP  22  41.910  17.744 -12.600
  176    HB2  ASP  22           HB2      ASP  22  43.131  15.851 -13.697
  177    HB3  ASP  22           HB1      ASP  22  41.560  15.085 -14.036
  178    H    HIS  23           HN       HIS  23  39.685  17.084 -10.877
  179    HA   HIS  23           HA       HIS  23  37.367  17.218 -10.855
  180    HB2  HIS  23           HB2      HIS  23  37.936  19.372 -11.992
  181    HB3  HIS  23           HB1      HIS  23  37.762  18.552 -13.563
  182    HD1  HIS  23           HD1      HIS  23  35.496  17.806 -10.606
  183    HD2  HIS  23           HD2      HIS  23  35.349  19.809 -14.302
  184    HE1  HIS  23           HE1      HIS  23  33.060  18.447 -11.030
  185    H    LEU  24           HN       LEU  24  38.277  14.737 -11.635
  186    HA   LEU  24           HA       LEU  24  35.962  13.762 -13.089
  187    HB2  LEU  24           HB2      LEU  24  37.689  14.689 -14.869
  188    HB3  LEU  24           HB1      LEU  24  38.574  13.189 -14.523
  189    HG   LEU  24           HG       LEU  24  35.676  13.407 -15.464
  190   HD11  LEU  24          HD11      LEU  24  37.373  13.866 -17.210
  191   HD12  LEU  24          HD12      LEU  24  36.558  12.311 -17.506
  192   HD13  LEU  24          HD13      LEU  24  38.198  12.340 -16.814
  193   HD21  LEU  24          HD21      LEU  24  37.395  11.051 -14.581
  194   HD22  LEU  24          HD22      LEU  24  36.032  10.834 -15.705
  195   HD23  LEU  24          HD23      LEU  24  35.741  11.473 -14.073
  Start of MODEL   42
    1    H1   GLY   1           HT1      GLY   1  64.410   0.703   7.343
    2    H2   GLY   1           HT2      GLY   1  63.480   1.281   6.044
    3    H3   GLY   1           HT3      GLY   1  63.943  -0.353   6.103
    4    HA2  GLY   1           HA1      GLY   1  62.527  -0.852   7.816
    5    HA3  GLY   1           HA2      GLY   1  62.317   0.865   8.213
    6    H    LYS   2           HN       LYS   2  60.454   1.725   7.631
    7    HA   LYS   2           HA       LYS   2  59.339   1.349   4.992
    8    HB2  LYS   2           HB2      LYS   2  58.780  -0.868   6.137
    9    HB3  LYS   2           HB1      LYS   2  57.754   0.065   7.246
   10    HG2  LYS   2           HG2      LYS   2  56.193  -0.551   5.600
   11    HG3  LYS   2           HG1      LYS   2  56.697   1.048   5.013
   12    HD2  LYS   2           HD2      LYS   2  58.238   0.028   3.409
   13    HD3  LYS   2           HD1      LYS   2  57.921  -1.590   4.078
   14    HE2  LYS   2           HE2      LYS   2  55.759   0.186   2.881
   15    HE3  LYS   2           HE1      LYS   2  56.637  -1.055   1.958
   16    HZ1  LYS   2           HZ1      LYS   2  54.725  -2.119   2.736
   17    HZ2  LYS   2           HZ2      LYS   2  54.828  -1.416   4.279
   18    HZ3  LYS   2           HZ3      LYS   2  55.932  -2.621   3.816
   19    H    GLY   3           HN       GLY   3  59.842   3.682   5.757
   20    HA2  GLY   3           HA1      GLY   3  58.401   5.185   7.611
   21    HA3  GLY   3           HA2      GLY   3  58.673   5.797   5.915
   22    H    ARG   4           HN       ARG   4  57.937   4.748   4.398
   23    HA   ARG   4           HA       ARG   4  56.288   6.518   4.578
   24    HB2  ARG   4           HB2      ARG   4  56.256   4.485   2.295
   25    HB3  ARG   4           HB1      ARG   4  55.452   6.076   2.220
   26    HG2  ARG   4           HG2      ARG   4  57.598   7.207   2.662
   27    HG3  ARG   4           HG1      ARG   4  58.417   5.631   2.802
   28    HD2  ARG   4           HD2      ARG   4  56.906   6.496   0.304
   29    HD3  ARG   4           HD1      ARG   4  58.647   6.786   0.535
   30    HE   ARG   4           HE       ARG   4  58.327   4.063   1.033
   31   HH11  ARG   4          HH11      ARG   4  60.031   4.555  -1.162
   32   HH12  ARG   4          HH12      ARG   4  59.114   4.126  -2.567
   33   HH21  ARG   4          HH21      ARG   4  56.058   4.239  -0.930
   34   HH22  ARG   4          HH22      ARG   4  56.863   3.946  -2.436
   35    H    TRP   5           HN       TRP   5  55.812   3.528   5.560
   36    HA   TRP   5           HA       TRP   5  53.276   2.521   5.008
   37    HB2  TRP   5           HB2      TRP   5  54.851   1.528   6.650
   38    HB3  TRP   5           HB1      TRP   5  54.454   2.832   7.797
   39    HD1  TRP   5           HD1      TRP   5  52.284   0.460   5.603
   40    HE1  TRP   5           HE1      TRP   5  50.388  -0.538   7.074
   41    HE3  TRP   5           HE3      TRP   5  53.475   2.669  10.065
   42    HZ2  TRP   5           HZ2      TRP   5  49.530  -0.379   9.817
   43    HZ3  TRP   5           HZ3      TRP   5  52.103   2.231  12.097
   44    HH2  TRP   5           HH2      TRP   5  50.134   0.710  11.977
   45    H    LEU   6           HN       LEU   6  54.042   5.560   6.451
   46    HA   LEU   6           HA       LEU   6  51.183   6.004   7.283
   47    HB2  LEU   6           HB2      LEU   6  53.584   7.756   7.920
   48    HB3  LEU   6           HB1      LEU   6  51.986   7.747   8.701
   49    HG   LEU   6           HG       LEU   6  54.014   5.467   8.783
   50   HD11  LEU   6          HD11      LEU   6  54.230   6.092  11.169
   51   HD12  LEU   6          HD12      LEU   6  53.105   7.449  10.917
   52   HD13  LEU   6          HD13      LEU   6  54.693   7.445  10.110
   53   HD21  LEU   6          HD21      LEU   6  52.367   4.689  10.637
   54   HD22  LEU   6          HD22      LEU   6  51.845   4.480   8.950
   55   HD23  LEU   6          HD23      LEU   6  51.210   5.834   9.918
   56    H    GLU   7           HN       GLU   7  53.742   6.939   5.035
   57    HA   GLU   7           HA       GLU   7  52.243   9.362   4.170
   58    HB2  GLU   7           HB2      GLU   7  54.877   8.073   3.369
   59    HB3  GLU   7           HB1      GLU   7  54.172   9.432   2.460
   60    HG2  GLU   7           HG2      GLU   7  55.803  10.197   4.191
   61    HG3  GLU   7           HG1      GLU   7  54.164  10.824   4.486
   62    H    ARG   8           HN       ARG   8  52.010   6.070   3.665
   63    HA   ARG   8           HA       ARG   8  51.596   6.058   0.785
   64    HB2  ARG   8           HB2      ARG   8  52.199   4.048   2.219
   65    HB3  ARG   8           HB1      ARG   8  50.532   4.081   2.831
   66    HG2  ARG   8           HG2      ARG   8  50.618   2.491   0.999
   67    HG3  ARG   8           HG1      ARG   8  49.706   3.914   0.452
   68    HD2  ARG   8           HD2      ARG   8  51.392   4.588  -1.028
   69    HD3  ARG   8           HD1      ARG   8  52.690   3.844  -0.063
   70    HE   ARG   8           HE       ARG   8  52.426   1.976  -1.455
   71   HH11  ARG   8          HH11      ARG   8  51.105   0.278  -2.247
   72   HH12  ARG   8          HH12      ARG   8  49.476   0.645  -2.710
   73   HH21  ARG   8          HH21      ARG   8  49.596   3.906  -1.539
   74   HH22  ARG   8          HH22      ARG   8  48.622   2.698  -2.309
   75    H    ILE   9           HN       ILE   9  49.620   6.662   3.633
   76    HA   ILE   9           HA       ILE   9  47.044   6.224   2.653
   77    HB   ILE   9           HB       ILE   9  47.417   6.931   4.948
   78   HG12  ILE   9          HG12      ILE   9  45.796   9.094   3.521
   79   HG13  ILE   9          HG11      ILE   9  45.219   7.437   3.810
   80   HG21  ILE   9          HG21      ILE   9  48.328   8.988   5.626
   81   HG22  ILE   9          HG22      ILE   9  47.962   9.792   4.085
   82   HG23  ILE   9          HG23      ILE   9  49.298   8.622   4.183
   83   HD11  ILE   9           HD1      ILE   9  46.026   9.490   5.913
   84   HD12  ILE   9           HD2      ILE   9  45.648   7.788   6.273
   85   HD13  ILE   9           HD3      ILE   9  44.393   8.856   5.603
   86    H    GLY  10           HN       GLY  10  46.578   6.628   0.566
   87    HA2  GLY  10           HA1      GLY  10  47.337   9.126  -0.728
   88    HA3  GLY  10           HA2      GLY  10  46.293   7.854  -1.392
   89    H    LYS  11           HN       LYS  11  44.788   8.179   1.354
   90    HA   LYS  11           HA       LYS  11  42.740   9.931   0.249
   91    HB2  LYS  11           HB2      LYS  11  43.048   8.702   3.019
   92    HB3  LYS  11           HB1      LYS  11  41.582   9.500   2.398
   93    HG2  LYS  11           HG2      LYS  11  41.255   7.823   0.717
   94    HG3  LYS  11           HG1      LYS  11  42.887   7.157   0.955
   95    HD2  LYS  11           HD2      LYS  11  41.264   5.684   2.035
   96    HD3  LYS  11           HD1      LYS  11  42.234   6.493   3.286
   97    HE2  LYS  11           HE2      LYS  11  40.464   7.997   3.838
   98    HE3  LYS  11           HE1      LYS  11  39.559   7.605   2.355
   99    HZ1  LYS  11           HZ1      LYS  11  38.470   6.307   3.852
  100    HZ2  LYS  11           HZ2      LYS  11  39.830   6.073   4.844
  101    HZ3  LYS  11           HZ3      LYS  11  39.675   5.207   3.390
  102    H    ALA  12           HN       ALA  12  43.430  12.013   0.007
  103    HA   ALA  12           HA       ALA  12  45.034  13.430   1.899
  104    HB1  ALA  12           HB1      ALA  12  44.340  15.430   0.690
  105    HB2  ALA  12           HB2      ALA  12  42.990  14.541  -0.055
  106    HB3  ALA  12           HB3      ALA  12  44.670  14.113  -0.460
  107    H    GLY  13           HN       GLY  13  41.969  12.196   2.310
  108    HA2  GLY  13           HA1      GLY  13  40.355  12.565   3.927
  109    HA3  GLY  13           HA2      GLY  13  41.565  13.523   4.804
  110    H    PHE  14           HN       PHE  14  41.015  14.575   1.606
  111    HA   PHE  14           HA       PHE  14  38.722  16.287   2.167
  112    HB2  PHE  14           HB2      PHE  14  40.733  17.365   3.408
  113    HB3  PHE  14           HB1      PHE  14  41.372  17.735   1.791
  114    HD1  PHE  14           HD1      PHE  14  38.780  18.510   4.291
  115    HD2  PHE  14           HD2      PHE  14  40.128  19.257   0.261
  116    HE1  PHE  14           HE1      PHE  14  37.283  20.496   4.159
  117    HE2  PHE  14           HE2      PHE  14  38.629  21.244   0.127
  118    HZ   PHE  14           HZ       PHE  14  37.278  21.915   2.111
  119    H    ILE  15           HN       ILE  15  41.711  15.848   0.249
  120    HA   ILE  15           HA       ILE  15  40.208  16.612  -2.230
  121    HB   ILE  15           HB       ILE  15  43.177  15.973  -2.060
  122   HG12  ILE  15          HG12      ILE  15  42.512  17.806  -0.374
  123   HG13  ILE  15          HG11      ILE  15  43.735  18.243  -1.577
  124   HG21  ILE  15          HG21      ILE  15  41.426  17.551  -3.981
  125   HG22  ILE  15          HG22      ILE  15  42.384  16.088  -4.310
  126   HG23  ILE  15          HG23      ILE  15  43.203  17.634  -3.998
  127   HD11  ILE  15           HD1      ILE  15  41.885  19.969  -1.179
  128   HD12  ILE  15           HD2      ILE  15  40.778  18.837  -1.984
  129   HD13  ILE  15           HD3      ILE  15  42.164  19.506  -2.873
  130    H    ILE  16           HN       ILE  16  39.239  14.356  -1.265
  131    HA   ILE  16           HA       ILE  16  40.163  12.367  -3.261
  132    HB   ILE  16           HB       ILE  16  41.474  11.893  -1.158
  133   HG12  ILE  16          HG12      ILE  16  40.765   9.466  -0.985
  134   HG13  ILE  16          HG11      ILE  16  39.348   9.853  -1.983
  135   HG21  ILE  16          HG21      ILE  16  40.398  11.242   0.863
  136   HG22  ILE  16          HG22      ILE  16  38.808  11.122   0.076
  137   HG23  ILE  16          HG23      ILE  16  39.550  12.717   0.344
  138   HD11  ILE  16           HD1      ILE  16  41.574   8.911  -3.113
  139   HD12  ILE  16           HD2      ILE  16  42.102  10.605  -3.011
  140   HD13  ILE  16           HD3      ILE  16  40.634  10.181  -3.923
  141    H    ILE  17           HN       ILE  17  37.979  13.164  -0.544
  142    HA   ILE  17           HA       ILE  17  35.823  11.486  -1.672
  143    HB   ILE  17           HB       ILE  17  34.460  12.899   0.154
  144   HG12  ILE  17          HG12      ILE  17  35.867  13.723   1.981
  145   HG13  ILE  17          HG11      ILE  17  37.341  13.245   1.114
  146   HG21  ILE  17          HG21      ILE  17  36.587  10.815   0.793
  147   HG22  ILE  17          HG22      ILE  17  34.869  10.535   0.430
  148   HG23  ILE  17          HG23      ILE  17  35.339  11.341   1.946
  149   HD11  ILE  17           HD1      ILE  17  37.027  14.921  -0.561
  150   HD12  ILE  17           HD2      ILE  17  36.653  15.732   0.977
  151   HD13  ILE  17           HD3      ILE  17  35.333  15.191  -0.085
  152    H    GLY  18           HN       GLY  18  37.290  14.141  -2.709
  153    HA2  GLY  18           HA1      GLY  18  34.885  15.106  -4.139
  154    HA3  GLY  18           HA2      GLY  18  35.721  16.289  -3.111
  155    H    GLY  19           HN       GLY  19  38.402  15.534  -3.486
  156    HA2  GLY  19           HA1      GLY  19  39.041  16.919  -5.857
  157    HA3  GLY  19           HA2      GLY  19  40.136  15.832  -4.980
  158    H    ALA  20           HN       ALA  20  38.514  13.458  -5.300
  159    HA   ALA  20           HA       ALA  20  39.605  12.456  -7.712
  160    HB1  ALA  20           HB1      ALA  20  37.943  10.603  -7.423
  161    HB2  ALA  20           HB2      ALA  20  37.188  11.544  -6.114
  162    HB3  ALA  20           HB3      ALA  20  38.867  10.974  -5.949
  163    H    LEU  21           HN       LEU  21  36.621  14.207  -7.080
  164    HA   LEU  21           HA       LEU  21  35.474  13.581  -9.723
  165    HB2  LEU  21           HB2      LEU  21  34.587  15.785  -7.834
  166    HB3  LEU  21           HB1      LEU  21  33.620  14.887  -9.029
  167    HG   LEU  21           HG       LEU  21  34.840  13.768  -6.467
  168   HD11  LEU  21          HD11      LEU  21  31.950  14.174  -7.360
  169   HD12  LEU  21          HD12      LEU  21  32.811  15.168  -6.160
  170   HD13  LEU  21          HD13      LEU  21  32.473  13.453  -5.820
  171   HD21  LEU  21          HD21      LEU  21  34.941  11.992  -8.068
  172   HD22  LEU  21          HD22      LEU  21  33.386  12.454  -8.802
  173   HD23  LEU  21          HD23      LEU  21  33.426  11.716  -7.182
  174    H    ASP  22           HN       ASP  22  37.497  16.045  -8.254
  175    HA   ASP  22           HA       ASP  22  37.079  18.229  -9.962
  176    HB2  ASP  22           HB2      ASP  22  38.654  18.110  -7.987
  177    HB3  ASP  22           HB1      ASP  22  39.806  17.252  -9.038
  178    H    HIS  23           HN       HIS  23  39.564  15.664 -10.420
  179    HA   HIS  23           HA       HIS  23  38.987  15.419 -13.245
  180    HB2  HIS  23           HB2      HIS  23  40.097  17.657 -13.256
  181    HB3  HIS  23           HB1      HIS  23  41.542  16.913 -12.532
  182    HD1  HIS  23           HD1      HIS  23  43.222  16.833 -14.396
  183    HD2  HIS  23           HD2      HIS  23  39.442  15.419 -15.577
  184    HE1  HIS  23           HE1      HIS  23  43.451  15.948 -16.782
  185    H    LEU  24           HN       LEU  24  40.345  14.499 -10.346
  186    HA   LEU  24           HA       LEU  24  42.225  12.512 -11.585
  187    HB2  LEU  24           HB2      LEU  24  41.764  13.016  -8.624
  188    HB3  LEU  24           HB1      LEU  24  43.168  12.262  -9.417
  189    HG   LEU  24           HG       LEU  24  42.313  15.183  -9.632
  190   HD11  LEU  24          HD11      LEU  24  44.808  13.895  -8.439
  191   HD12  LEU  24          HD12      LEU  24  43.419  14.475  -7.491
  192   HD13  LEU  24          HD13      LEU  24  44.398  15.627  -8.430
  193   HD21  LEU  24          HD21      LEU  24  44.602  15.321 -10.851
  194   HD22  LEU  24          HD22      LEU  24  43.242  14.627 -11.761
  195   HD23  LEU  24          HD23      LEU  24  44.469  13.556 -11.041
  Start of MODEL   43
    1    H1   GLY   1           HT1      GLY   1  60.935  -0.915   8.064
    2    H2   GLY   1           HT2      GLY   1  61.306   0.451   7.124
    3    H3   GLY   1           HT3      GLY   1  62.458  -0.780   7.334
    4    HA2  GLY   1           HA1      GLY   1  61.614  -1.058   5.210
    5    HA3  GLY   1           HA2      GLY   1  60.906  -2.323   6.235
    6    H    LYS   2           HN       LYS   2  60.347   0.822   4.695
    7    HA   LYS   2           HA       LYS   2  58.369   1.884   4.105
    8    HB2  LYS   2           HB2      LYS   2  57.203  -0.918   3.961
    9    HB3  LYS   2           HB1      LYS   2  56.721   0.517   3.025
   10    HG2  LYS   2           HG2      LYS   2  59.027   0.567   2.017
   11    HG3  LYS   2           HG1      LYS   2  59.379  -0.965   2.853
   12    HD2  LYS   2           HD2      LYS   2  57.409  -2.002   1.696
   13    HD3  LYS   2           HD1      LYS   2  57.187  -0.487   0.788
   14    HE2  LYS   2           HE2      LYS   2  59.718  -2.190   0.772
   15    HE3  LYS   2           HE1      LYS   2  58.490  -2.161  -0.517
   16    HZ1  LYS   2           HZ1      LYS   2  59.029   0.457  -0.172
   17    HZ2  LYS   2           HZ2      LYS   2  59.753  -0.530  -1.349
   18    HZ3  LYS   2           HZ3      LYS   2  60.551  -0.232   0.121
   19    H    GLY   3           HN       GLY   3  55.690   1.332   4.484
   20    HA2  GLY   3           HA1      GLY   3  54.392   0.540   6.655
   21    HA3  GLY   3           HA2      GLY   3  55.457   1.763   7.489
   22    H    ARG   4           HN       ARG   4  56.040   3.364   6.465
   23    HA   ARG   4           HA       ARG   4  54.241   4.297   7.799
   24    HB2  ARG   4           HB2      ARG   4  56.055   6.033   6.060
   25    HB3  ARG   4           HB1      ARG   4  55.089   6.664   7.417
   26    HG2  ARG   4           HG2      ARG   4  56.228   5.228   8.998
   27    HG3  ARG   4           HG1      ARG   4  57.043   4.341   7.688
   28    HD2  ARG   4           HD2      ARG   4  57.426   7.310   8.269
   29    HD3  ARG   4           HD1      ARG   4  58.538   6.023   8.793
   30    HE   ARG   4           HE       ARG   4  58.368   7.132   6.115
   31   HH11  ARG   4          HH11      ARG   4  58.173   5.034   4.634
   32   HH12  ARG   4          HH12      ARG   4  59.510   3.964   4.896
   33   HH21  ARG   4          HH21      ARG   4  60.435   5.429   7.899
   34   HH22  ARG   4          HH22      ARG   4  60.790   4.187   6.745
   35    H    TRP   5           HN       TRP   5  54.003   3.649   4.697
   36    HA   TRP   5           HA       TRP   5  52.627   5.542   3.203
   37    HB2  TRP   5           HB2      TRP   5  53.083   3.132   2.574
   38    HB3  TRP   5           HB1      TRP   5  51.646   2.689   3.525
   39    HD1  TRP   5           HD1      TRP   5  49.477   2.636   2.205
   40    HE1  TRP   5           HE1      TRP   5  48.572   3.672  -0.002
   41    HE3  TRP   5           HE3      TRP   5  53.514   5.527   0.954
   42    HZ2  TRP   5           HZ2      TRP   5  49.503   5.508  -2.016
   43    HZ3  TRP   5           HZ3      TRP   5  53.483   6.912  -1.114
   44    HH2  TRP   5           HH2      TRP   5  51.483   6.905  -2.599
   45    H    LEU   6           HN       LEU   6  51.574   3.996   6.143
   46    HA   LEU   6           HA       LEU   6  48.794   5.059   5.876
   47    HB2  LEU   6           HB2      LEU   6  50.176   3.106   7.738
   48    HB3  LEU   6           HB1      LEU   6  48.620   3.825   8.190
   49    HG   LEU   6           HG       LEU   6  48.498   1.560   7.036
   50   HD11  LEU   6          HD11      LEU   6  46.640   3.408   7.055
   51   HD12  LEU   6          HD12      LEU   6  46.487   2.059   5.912
   52   HD13  LEU   6          HD13      LEU   6  47.060   3.638   5.343
   53   HD21  LEU   6          HD21      LEU   6  49.192   3.142   4.528
   54   HD22  LEU   6          HD22      LEU   6  48.900   1.394   4.669
   55   HD23  LEU   6          HD23      LEU   6  50.352   2.115   5.403
   56    H    GLU   7           HN       GLU   7  51.869   5.577   7.601
   57    HA   GLU   7           HA       GLU   7  50.562   7.433   9.523
   58    HB2  GLU   7           HB2      GLU   7  53.426   6.540   9.054
   59    HB3  GLU   7           HB1      GLU   7  52.996   7.805  10.227
   60    HG2  GLU   7           HG2      GLU   7  53.131   5.608  11.341
   61    HG3  GLU   7           HG1      GLU   7  51.454   6.203  11.354
   62    H    ARG   8           HN       ARG   8  51.633   7.580   6.322
   63    HA   ARG   8           HA       ARG   8  52.696  10.325   6.440
   64    HB2  ARG   8           HB2      ARG   8  51.959   8.435   4.171
   65    HB3  ARG   8           HB1      ARG   8  52.516  10.103   3.893
   66    HG2  ARG   8           HG2      ARG   8  54.604   9.636   5.112
   67    HG3  ARG   8           HG1      ARG   8  54.046   7.985   5.469
   68    HD2  ARG   8           HD2      ARG   8  55.576   7.974   3.533
   69    HD3  ARG   8           HD1      ARG   8  53.936   7.507   3.029
   70    HE   ARG   8           HE       ARG   8  54.115  10.301   2.671
   71   HH11  ARG   8          HH11      ARG   8  53.924  10.686   0.376
   72   HH12  ARG   8          HH12      ARG   8  55.069   9.901  -0.660
   73   HH21  ARG   8          HH21      ARG   8  56.346   7.873   1.846
   74   HH22  ARG   8          HH22      ARG   8  56.441   8.310   0.172
   75    H    ILE   9           HN       ILE   9  50.690  10.049   3.750
   76    HA   ILE   9           HA       ILE   9  48.862  12.092   4.847
   77    HB   ILE   9           HB       ILE   9  48.847  10.752   2.107
   78   HG12  ILE   9          HG12      ILE   9  51.010  12.042   2.828
   79   HG13  ILE   9          HG11      ILE   9  50.263  12.453   1.273
   80   HG21  ILE   9          HG21      ILE   9  47.633  12.905   1.494
   81   HG22  ILE   9          HG22      ILE   9  47.505  13.236   3.239
   82   HG23  ILE   9          HG23      ILE   9  46.732  11.790   2.548
   83   HD11  ILE   9           HD1      ILE   9  49.680  13.993   3.842
   84   HD12  ILE   9           HD2      ILE   9  49.277  14.460   2.176
   85   HD13  ILE   9           HD3      ILE   9  50.972  14.439   2.710
   86    H    GLY  10           HN       GLY  10  48.122   9.240   2.805
   87    HA2  GLY  10           HA1      GLY  10  46.542   7.568   3.111
   88    HA3  GLY  10           HA2      GLY  10  46.389   8.057   4.809
   89    H    LYS  11           HN       LYS  11  45.750  10.845   4.183
   90    HA   LYS  11           HA       LYS  11  42.945  10.453   3.132
   91    HB2  LYS  11           HB2      LYS  11  43.956  12.449   5.200
   92    HB3  LYS  11           HB1      LYS  11  42.273  12.243   4.657
   93    HG2  LYS  11           HG2      LYS  11  42.465   9.801   5.433
   94    HG3  LYS  11           HG1      LYS  11  43.986  10.275   6.228
   95    HD2  LYS  11           HD2      LYS  11  41.230  11.484   6.734
   96    HD3  LYS  11           HD1      LYS  11  42.126  10.409   7.833
   97    HE2  LYS  11           HE2      LYS  11  44.020  12.204   7.711
   98    HE3  LYS  11           HE1      LYS  11  42.756  13.275   7.056
   99    HZ1  LYS  11           HZ1      LYS  11  43.179  13.102   9.617
  100    HZ2  LYS  11           HZ2      LYS  11  42.179  11.734   9.490
  101    HZ3  LYS  11           HZ3      LYS  11  41.603  13.258   9.009
  102    H    ALA  12           HN       ALA  12  44.031  10.859   1.010
  103    HA   ALA  12           HA       ALA  12  45.274  13.372   0.436
  104    HB1  ALA  12           HB1      ALA  12  45.250  11.269  -0.992
  105    HB2  ALA  12           HB2      ALA  12  44.973  12.797  -1.861
  106    HB3  ALA  12           HB3      ALA  12  43.602  11.725  -1.485
  107    H    GLY  13           HN       GLY  13  43.882  14.789   1.741
  108    HA2  GLY  13           HA1      GLY  13  42.163  16.331   1.942
  109    HA3  GLY  13           HA2      GLY  13  42.204  16.391   0.167
  110    H    PHE  14           HN       PHE  14  41.198  13.958   2.611
  111    HA   PHE  14           HA       PHE  14  39.227  12.761   2.806
  112    HB2  PHE  14           HB2      PHE  14  37.865  14.983   1.244
  113    HB3  PHE  14           HB1      PHE  14  37.163  13.902   2.472
  114    HD1  PHE  14           HD1      PHE  14  38.907  17.036   1.889
  115    HD2  PHE  14           HD2      PHE  14  38.051  14.037   4.873
  116    HE1  PHE  14           HE1      PHE  14  39.529  18.645   3.686
  117    HE2  PHE  14           HE2      PHE  14  38.673  15.648   6.670
  118    HZ   PHE  14           HZ       PHE  14  39.502  17.919   6.070
  119    H    ILE  15           HN       ILE  15  40.983  12.270   0.579
  120    HA   ILE  15           HA       ILE  15  41.010  11.032  -1.364
  121    HB   ILE  15           HB       ILE  15  38.063  10.423  -0.918
  122   HG12  ILE  15          HG12      ILE  15  40.498   9.109   0.375
  123   HG13  ILE  15          HG11      ILE  15  39.288  10.100   1.220
  124   HG21  ILE  15          HG21      ILE  15  38.535   8.404  -2.115
  125   HG22  ILE  15          HG22      ILE  15  40.293   8.648  -1.984
  126   HG23  ILE  15          HG23      ILE  15  39.322   9.701  -3.039
  127   HD11  ILE  15           HD1      ILE  15  38.580   7.872   1.624
  128   HD12  ILE  15           HD2      ILE  15  38.943   7.360  -0.039
  129   HD13  ILE  15           HD3      ILE  15  37.540   8.408   0.284
  130    H    ILE  16           HN       ILE  16  41.060  13.452  -2.066
  131    HA   ILE  16           HA       ILE  16  39.012  13.713  -4.248
  132    HB   ILE  16           HB       ILE  16  38.555  15.292  -2.281
  133   HG12  ILE  16          HG12      ILE  16  38.545  17.391  -3.916
  134   HG13  ILE  16          HG11      ILE  16  39.104  16.219  -5.131
  135   HG21  ILE  16          HG21      ILE  16  40.028  17.082  -1.797
  136   HG22  ILE  16          HG22      ILE  16  40.962  16.835  -3.288
  137   HG23  ILE  16          HG23      ILE  16  41.106  15.674  -1.947
  138   HD11  ILE  16           HD1      ILE  16  37.101  14.880  -4.862
  139   HD12  ILE  16           HD2      ILE  16  36.583  16.570  -5.029
  140   HD13  ILE  16           HD3      ILE  16  36.602  15.804  -3.427
  141    H    ILE  17           HN       ILE  17  42.224  14.572  -2.939
  142    HA   ILE  17           HA       ILE  17  43.194  15.398  -5.615
  143    HB   ILE  17           HB       ILE  17  44.717  14.856  -3.019
  144   HG12  ILE  17          HG12      ILE  17  43.227  16.752  -2.711
  145   HG13  ILE  17          HG11      ILE  17  44.879  17.367  -2.891
  146   HG21  ILE  17          HG21      ILE  17  46.422  16.424  -4.376
  147   HG22  ILE  17          HG22      ILE  17  45.572  15.744  -5.784
  148   HG23  ILE  17          HG23      ILE  17  46.387  14.666  -4.634
  149   HD11  ILE  17           HD1      ILE  17  44.250  17.605  -5.438
  150   HD12  ILE  17           HD2      ILE  17  43.634  18.806  -4.287
  151   HD13  ILE  17           HD3      ILE  17  42.573  17.502  -4.860
  152    H    GLY  18           HN       GLY  18  43.518  12.702  -3.316
  153    HA2  GLY  18           HA1      GLY  18  45.262  11.166  -5.056
  154    HA3  GLY  18           HA2      GLY  18  44.404  10.576  -3.615
  155    H    GLY  19           HN       GLY  19  41.776  11.057  -4.206
  156    HA2  GLY  19           HA1      GLY  19  41.203   8.870  -5.996
  157    HA3  GLY  19           HA2      GLY  19  40.024   9.986  -5.280
  158    H    ALA  20           HN       ALA  20  41.153  12.421  -6.325
  159    HA   ALA  20           HA       ALA  20  40.702  13.748  -8.185
  160    HB1  ALA  20           HB1      ALA  20  41.921  13.090 -10.210
  161    HB2  ALA  20           HB2      ALA  20  42.115  11.442  -9.566
  162    HB3  ALA  20           HB3      ALA  20  42.907  12.814  -8.755
  163    H    LEU  21           HN       LEU  21  38.418  12.494  -7.514
  164    HA   LEU  21           HA       LEU  21  37.287  10.862  -9.603
  165    HB2  LEU  21           HB2      LEU  21  35.716  12.694  -7.759
  166    HB3  LEU  21           HB1      LEU  21  35.214  11.141  -8.470
  167    HG   LEU  21           HG       LEU  21  37.374  11.565  -6.356
  168   HD11  LEU  21          HD11      LEU  21  34.731  10.045  -6.257
  169   HD12  LEU  21          HD12      LEU  21  34.971  11.689  -5.616
  170   HD13  LEU  21          HD13      LEU  21  35.859  10.318  -4.908
  171   HD21  LEU  21          HD21      LEU  21  36.516   9.115  -7.953
  172   HD22  LEU  21          HD22      LEU  21  37.311   8.971  -6.367
  173   HD23  LEU  21          HD23      LEU  21  38.158   9.759  -7.716
  174    H    ASP  22           HN       ASP  22  37.330  11.580 -11.651
  175    HA   ASP  22           HA       ASP  22  36.888  12.936 -13.480
  176    HB2  ASP  22           HB2      ASP  22  34.560  12.568 -12.626
  177    HB3  ASP  22           HB1      ASP  22  34.700  14.085 -11.705
  178    H    HIS  23           HN       HIS  23  38.972  13.841 -11.875
  179    HA   HIS  23           HA       HIS  23  40.207  15.747 -11.391
  180    HB2  HIS  23           HB2      HIS  23  38.491  17.009 -13.563
  181    HB3  HIS  23           HB1      HIS  23  40.115  17.521 -13.042
  182    HD1  HIS  23           HD1      HIS  23  38.290  14.976 -15.119
  183    HD2  HIS  23           HD2      HIS  23  42.219  15.665 -13.791
  184    HE1  HIS  23           HE1      HIS  23  39.838  13.503 -16.521
  185    H    LEU  24           HN       LEU  24  37.726  15.306  -9.883
  186    HA   LEU  24           HA       LEU  24  37.599  17.932  -8.623
  187    HB2  LEU  24           HB2      LEU  24  36.013  18.127 -10.620
  188    HB3  LEU  24           HB1      LEU  24  35.023  16.874  -9.842
  189    HG   LEU  24           HG       LEU  24  35.151  18.469  -7.717
  190   HD11  LEU  24          HD11      LEU  24  35.749  20.380 -10.024
  191   HD12  LEU  24          HD12      LEU  24  36.754  20.100  -8.584
  192   HD13  LEU  24          HD13      LEU  24  35.171  20.889  -8.423
  193   HD21  LEU  24          HD21      LEU  24  33.081  17.932  -8.966
  194   HD22  LEU  24          HD22      LEU  24  33.482  19.178 -10.173
  195   HD23  LEU  24          HD23      LEU  24  33.114  19.647  -8.496
  Start of MODEL   44
    1    H1   GLY   1           HT1      GLY   1  51.835   1.540  -5.000
    2    H2   GLY   1           HT2      GLY   1  51.020   2.530  -6.115
    3    H3   GLY   1           HT3      GLY   1  50.145   1.645  -4.959
    4    HA2  GLY   1           HA1      GLY   1  51.443   4.173  -4.759
    5    HA3  GLY   1           HA2      GLY   1  50.128   3.480  -3.791
    6    H    LYS   2           HN       LYS   2  52.654   4.968  -3.086
    7    HA   LYS   2           HA       LYS   2  53.454   3.136  -0.886
    8    HB2  LYS   2           HB2      LYS   2  55.453   4.326  -2.853
    9    HB3  LYS   2           HB1      LYS   2  55.871   3.508  -1.329
   10    HG2  LYS   2           HG2      LYS   2  54.521   1.495  -2.227
   11    HG3  LYS   2           HG1      LYS   2  54.556   2.320  -3.803
   12    HD2  LYS   2           HD2      LYS   2  56.997   1.540  -2.145
   13    HD3  LYS   2           HD1      LYS   2  56.421   0.700  -3.604
   14    HE2  LYS   2           HE2      LYS   2  56.643   2.998  -4.792
   15    HE3  LYS   2           HE1      LYS   2  57.601   3.489  -3.373
   16    HZ1  LYS   2           HZ1      LYS   2  59.308   2.544  -4.410
   17    HZ2  LYS   2           HZ2      LYS   2  58.318   1.777  -5.558
   18    HZ3  LYS   2           HZ3      LYS   2  58.604   1.042  -4.053
   19    H    GLY   3           HN       GLY   3  55.292   4.410   0.418
   20    HA2  GLY   3           HA1      GLY   3  55.978   6.660   1.215
   21    HA3  GLY   3           HA2      GLY   3  54.387   7.340   0.642
   22    H    ARG   4           HN       ARG   4  52.741   6.262   0.892
   23    HA   ARG   4           HA       ARG   4  52.556   7.820   2.743
   24    HB2  ARG   4           HB2      ARG   4  50.294   5.873   2.067
   25    HB3  ARG   4           HB1      ARG   4  50.077   7.403   2.958
   26    HG2  ARG   4           HG2      ARG   4  51.065   8.649   1.048
   27    HG3  ARG   4           HG1      ARG   4  51.249   7.120   0.153
   28    HD2  ARG   4           HD2      ARG   4  48.597   8.224   1.179
   29    HD3  ARG   4           HD1      ARG   4  49.179   8.376  -0.497
   30    HE   ARG   4           HE       ARG   4  48.059   5.967   0.720
   31   HH11  ARG   4          HH11      ARG   4  47.887   4.188  -0.664
   32   HH12  ARG   4          HH12      ARG   4  48.827   4.144  -2.117
   33   HH21  ARG   4          HH21      ARG   4  50.294   7.240  -1.577
   34   HH22  ARG   4          HH22      ARG   4  50.190   5.871  -2.634
   35    H    TRP   5           HN       TRP   5  53.393   4.765   3.056
   36    HA   TRP   5           HA       TRP   5  52.296   3.473   5.263
   37    HB2  TRP   5           HB2      TRP   5  55.285   3.845   4.815
   38    HB3  TRP   5           HB1      TRP   5  54.508   2.530   5.727
   39    HD1  TRP   5           HD1      TRP   5  55.337   3.675   2.229
   40    HE1  TRP   5           HE1      TRP   5  54.630   1.869   0.496
   41    HE3  TRP   5           HE3      TRP   5  52.641   0.604   5.314
   42    HZ2  TRP   5           HZ2      TRP   5  53.098  -0.570   0.484
   43    HZ3  TRP   5           HZ3      TRP   5  51.566  -1.457   4.420
   44    HH2  TRP   5           HH2      TRP   5  51.793  -2.045   2.010
   45    H    LEU   6           HN       LEU   6  53.853   6.550   5.227
   46    HA   LEU   6           HA       LEU   6  53.940   6.626   8.236
   47    HB2  LEU   6           HB2      LEU   6  56.121   7.028   7.218
   48    HB3  LEU   6           HB1      LEU   6  55.430   8.246   6.127
   49    HG   LEU   6           HG       LEU   6  54.906   9.712   8.031
   50   HD11  LEU   6          HD11      LEU   6  54.361   8.276   9.841
   51   HD12  LEU   6          HD12      LEU   6  55.930   8.954  10.323
   52   HD13  LEU   6          HD13      LEU   6  55.841   7.310   9.645
   53   HD21  LEU   6          HD21      LEU   6  57.163   9.824   7.018
   54   HD22  LEU   6          HD22      LEU   6  57.742   8.595   8.169
   55   HD23  LEU   6          HD23      LEU   6  57.224  10.192   8.759
   56    H    GLU   7           HN       GLU   7  52.504   7.931   5.296
   57    HA   GLU   7           HA       GLU   7  51.349  10.254   6.782
   58    HB2  GLU   7           HB2      GLU   7  50.925   9.457   3.880
   59    HB3  GLU   7           HB1      GLU   7  50.642  11.044   4.636
   60    HG2  GLU   7           HG2      GLU   7  53.097  11.181   5.154
   61    HG3  GLU   7           HG1      GLU   7  53.334   9.660   4.257
   62    H    ARG   8           HN       ARG   8  50.679   7.273   7.163
   63    HA   ARG   8           HA       ARG   8  48.001   6.910   6.142
   64    HB2  ARG   8           HB2      ARG   8  49.554   5.084   6.942
   65    HB3  ARG   8           HB1      ARG   8  49.239   5.630   8.606
   66    HG2  ARG   8           HG2      ARG   8  46.848   5.196   8.348
   67    HG3  ARG   8           HG1      ARG   8  47.074   4.783   6.631
   68    HD2  ARG   8           HD2      ARG   8  48.487   2.867   7.250
   69    HD3  ARG   8           HD1      ARG   8  48.344   3.297   8.972
   70    HE   ARG   8           HE       ARG   8  46.273   2.184   8.955
   71   HH11  ARG   8          HH11      ARG   8  44.372   3.562   7.605
   72   HH12  ARG   8          HH12      ARG   8  44.152   2.798   6.065
   73   HH21  ARG   8          HH21      ARG   8  47.164   1.084   6.189
   74   HH22  ARG   8          HH22      ARG   8  45.733   1.395   5.264
   75    H    ILE   9           HN       ILE   9  46.184   7.873   6.741
   76    HA   ILE   9           HA       ILE   9  45.671   8.462   9.582
   77    HB   ILE   9           HB       ILE   9  45.105  10.889   9.092
   78   HG12  ILE   9          HG12      ILE   9  46.754  10.334   6.580
   79   HG13  ILE   9          HG11      ILE   9  45.001  10.632   6.610
   80   HG21  ILE   9          HG21      ILE   9  48.050  10.307   8.585
   81   HG22  ILE   9          HG22      ILE   9  47.292  10.043  10.173
   82   HG23  ILE   9          HG23      ILE   9  47.332  11.674   9.467
   83   HD11  ILE   9           HD1      ILE   9  45.589  12.851   7.829
   84   HD12  ILE   9           HD2      ILE   9  45.947  12.749   6.090
   85   HD13  ILE   9           HD3      ILE   9  47.255  12.554   7.278
   86    H    GLY  10           HN       GLY  10  44.771   7.738   6.406
   87    HA2  GLY  10           HA1      GLY  10  42.716   7.383   5.405
   88    HA3  GLY  10           HA2      GLY  10  42.115   7.078   7.047
   89    H    LYS  11           HN       LYS  11  43.451  10.118   5.773
   90    HA   LYS  11           HA       LYS  11  40.730  11.314   5.620
   91    HB2  LYS  11           HB2      LYS  11  42.882  12.210   7.580
   92    HB3  LYS  11           HB1      LYS  11  41.517  13.240   7.088
   93    HG2  LYS  11           HG2      LYS  11  39.950  11.406   7.847
   94    HG3  LYS  11           HG1      LYS  11  41.364  10.537   8.489
   95    HD2  LYS  11           HD2      LYS  11  41.898  12.440   9.957
   96    HD3  LYS  11           HD1      LYS  11  40.527  13.357   9.289
   97    HE2  LYS  11           HE2      LYS  11  40.295  10.679  10.730
   98    HE3  LYS  11           HE1      LYS  11  39.968  12.266  11.468
   99    HZ1  LYS  11           HZ1      LYS  11  37.949  12.241  10.586
  100    HZ2  LYS  11           HZ2      LYS  11  38.233  10.687   9.961
  101    HZ3  LYS  11           HZ3      LYS  11  38.579  12.060   9.022
  102    H    ALA  12           HN       ALA  12  41.476  11.234   3.362
  103    HA   ALA  12           HA       ALA  12  43.739  12.920   2.592
  104    HB1  ALA  12           HB1      ALA  12  43.197  11.067   1.177
  105    HB2  ALA  12           HB2      ALA  12  42.780  12.543   0.275
  106    HB3  ALA  12           HB3      ALA  12  41.499  11.579   1.048
  107    H    GLY  13           HN       GLY  13  41.732  14.226   4.264
  108    HA2  GLY  13           HA1      GLY  13  40.526  16.200   4.329
  109    HA3  GLY  13           HA2      GLY  13  41.592  16.729   3.013
  110    H    PHE  14           HN       PHE  14  39.053  14.212   3.198
  111    HA   PHE  14           HA       PHE  14  37.106  13.945   1.994
  112    HB2  PHE  14           HB2      PHE  14  36.802  16.418   2.735
  113    HB3  PHE  14           HB1      PHE  14  37.268  16.839   1.072
  114    HD1  PHE  14           HD1      PHE  14  35.671  16.716  -0.693
  115    HD2  PHE  14           HD2      PHE  14  34.861  14.745   3.062
  116    HE1  PHE  14           HE1      PHE  14  33.351  16.219  -1.452
  117    HE2  PHE  14           HE2      PHE  14  32.542  14.249   2.301
  118    HZ   PHE  14           HZ       PHE  14  31.773  15.025   0.062
  119    H    ILE  15           HN       ILE  15  39.312  12.997   0.799
  120    HA   ILE  15           HA       ILE  15  40.124  12.322  -1.239
  121    HB   ILE  15           HB       ILE  15  37.633  13.564  -2.471
  122   HG12  ILE  15          HG12      ILE  15  36.855  12.233  -0.617
  123   HG13  ILE  15          HG11      ILE  15  36.595  11.271  -2.084
  124   HG21  ILE  15          HG21      ILE  15  38.949  12.835  -4.260
  125   HG22  ILE  15          HG22      ILE  15  37.986  11.379  -3.942
  126   HG23  ILE  15          HG23      ILE  15  39.658  11.484  -3.351
  127   HD11  ILE  15           HD1      ILE  15  37.544   9.741  -0.536
  128   HD12  ILE  15           HD2      ILE  15  38.726  10.931   0.053
  129   HD13  ILE  15           HD3      ILE  15  38.916  10.210  -1.561
  130    H    ILE  16           HN       ILE  16  41.730  13.984  -0.806
  131    HA   ILE  16           HA       ILE  16  41.825  15.918  -3.097
  132    HB   ILE  16           HB       ILE  16  42.657  16.514  -0.225
  133   HG12  ILE  16          HG12      ILE  16  40.126  16.611  -0.812
  134   HG13  ILE  16          HG11      ILE  16  40.850  18.033  -0.044
  135   HG21  ILE  16          HG21      ILE  16  43.070  18.840  -1.208
  136   HG22  ILE  16          HG22      ILE  16  42.905  18.094  -2.817
  137   HG23  ILE  16          HG23      ILE  16  44.210  17.576  -1.724
  138   HD11  ILE  16           HD1      ILE  16  39.305  18.528  -2.008
  139   HD12  ILE  16           HD2      ILE  16  40.520  17.784  -3.067
  140   HD13  ILE  16           HD3      ILE  16  40.928  19.238  -2.131
  141    H    ILE  17           HN       ILE  17  43.604  14.438  -0.353
  142    HA   ILE  17           HA       ILE  17  46.175  14.642  -1.697
  143    HB   ILE  17           HB       ILE  17  45.192  13.029   0.705
  144   HG12  ILE  17          HG12      ILE  17  46.677  14.586   1.941
  145   HG13  ILE  17          HG11      ILE  17  47.131  15.372   0.412
  146   HG21  ILE  17          HG21      ILE  17  47.929  13.075  -0.631
  147   HG22  ILE  17          HG22      ILE  17  46.944  11.658  -0.192
  148   HG23  ILE  17          HG23      ILE  17  47.718  12.631   1.081
  149   HD11  ILE  17           HD1      ILE  17  44.993  16.329   0.122
  150   HD12  ILE  17           HD2      ILE  17  45.238  16.454   1.876
  151   HD13  ILE  17           HD3      ILE  17  44.209  15.164   1.213
  152    H    GLY  18           HN       GLY  18  43.939  11.924  -0.981
  153    HA2  GLY  18           HA1      GLY  18  45.394  10.058  -2.641
  154    HA3  GLY  18           HA2      GLY  18  43.765   9.835  -1.970
  155    H    GLY  19           HN       GLY  19  42.287  11.827  -3.048
  156    HA2  GLY  19           HA1      GLY  19  41.770  10.852  -5.676
  157    HA3  GLY  19           HA2      GLY  19  41.137  12.358  -4.985
  158    H    ALA  20           HN       ALA  20  43.440  13.811  -4.557
  159    HA   ALA  20           HA       ALA  20  44.904  15.216  -5.663
  160    HB1  ALA  20           HB1      ALA  20  45.229  13.079  -7.785
  161    HB2  ALA  20           HB2      ALA  20  45.969  12.938  -6.174
  162    HB3  ALA  20           HB3      ALA  20  46.409  14.294  -7.240
  163    H    LEU  21           HN       LEU  21  41.978  14.277  -6.870
  164    HA   LEU  21           HA       LEU  21  40.616  15.044  -8.596
  165    HB2  LEU  21           HB2      LEU  21  42.206  17.623  -8.392
  166    HB3  LEU  21           HB1      LEU  21  40.478  17.411  -8.760
  167    HG   LEU  21           HG       LEU  21  41.843  16.816  -6.095
  168   HD11  LEU  21          HD11      LEU  21  39.786  18.924  -6.893
  169   HD12  LEU  21          HD12      LEU  21  41.519  19.233  -6.630
  170   HD13  LEU  21          HD13      LEU  21  40.493  18.702  -5.275
  171   HD21  LEU  21          HD21      LEU  21  39.367  16.557  -5.373
  172   HD22  LEU  21          HD22      LEU  21  40.071  15.223  -6.315
  173   HD23  LEU  21          HD23      LEU  21  38.999  16.402  -7.108
  174    H    ASP  22           HN       ASP  22  41.804  13.505 -10.039
  175    HA   ASP  22           HA       ASP  22  42.468  14.866 -12.503
  176    HB2  ASP  22           HB2      ASP  22  44.820  14.092 -12.694
  177    HB3  ASP  22           HB1      ASP  22  44.609  15.273 -11.379
  178    H    HIS  23           HN       HIS  23  40.666  12.825 -11.535
  179    HA   HIS  23           HA       HIS  23  39.924  10.698 -12.099
  180    HB2  HIS  23           HB2      HIS  23  41.626  11.228 -14.568
  181    HB3  HIS  23           HB1      HIS  23  40.338  10.007 -14.430
  182    HD1  HIS  23           HD1      HIS  23  38.258  11.719 -12.829
  183    HD2  HIS  23           HD2      HIS  23  40.353  13.095 -16.205
  184    HE1  HIS  23           HE1      HIS  23  36.872  13.595 -13.871
  185    H    LEU  24           HN       LEU  24  42.114  10.698 -10.357
  186    HA   LEU  24           HA       LEU  24  44.296   9.071 -11.164
  187    HB2  LEU  24           HB2      LEU  24  43.795  10.390  -8.930
  188    HB3  LEU  24           HB1      LEU  24  43.092   8.851  -8.387
  189    HG   LEU  24           HG       LEU  24  45.938   9.266  -9.420
  190   HD11  LEU  24          HD11      LEU  24  46.578   8.766  -7.090
  191   HD12  LEU  24          HD12      LEU  24  44.864   8.596  -6.643
  192   HD13  LEU  24          HD13      LEU  24  45.500  10.180  -7.148
  193   HD21  LEU  24          HD21      LEU  24  44.362   6.795  -8.592
  194   HD22  LEU  24          HD22      LEU  24  46.137   6.841  -8.463
  195   HD23  LEU  24          HD23      LEU  24  45.357   7.047 -10.046
  Start of MODEL   45
    1    H1   GLY   1           HT1      GLY   1  62.407   4.897   7.285
    2    H2   GLY   1           HT2      GLY   1  63.945   4.175   7.232
    3    H3   GLY   1           HT3      GLY   1  63.286   4.674   8.718
    4    HA2  GLY   1           HA1      GLY   1  63.152   2.201   7.589
    5    HA3  GLY   1           HA2      GLY   1  62.274   2.790   9.013
    6    H    LYS   2           HN       LYS   2  61.321   0.813   7.208
    7    HA   LYS   2           HA       LYS   2  59.439   2.058   5.353
    8    HB2  LYS   2           HB2      LYS   2  59.499  -0.773   6.471
    9    HB3  LYS   2           HB1      LYS   2  58.598  -0.217   5.040
   10    HG2  LYS   2           HG2      LYS   2  60.739   0.439   3.958
   11    HG3  LYS   2           HG1      LYS   2  61.629  -0.165   5.378
   12    HD2  LYS   2           HD2      LYS   2  60.697  -2.429   5.005
   13    HD3  LYS   2           HD1      LYS   2  59.806  -1.829   3.585
   14    HE2  LYS   2           HE2      LYS   2  61.975  -1.162   2.539
   15    HE3  LYS   2           HE1      LYS   2  62.836  -1.853   3.936
   16    HZ1  LYS   2           HZ1      LYS   2  61.101  -3.294   1.995
   17    HZ2  LYS   2           HZ2      LYS   2  61.696  -3.988   3.428
   18    HZ3  LYS   2           HZ3      LYS   2  62.772  -3.481   2.215
   19    H    GLY   3           HN       GLY   3  57.065   0.891   5.638
   20    HA2  GLY   3           HA1      GLY   3  55.553   0.482   7.797
   21    HA3  GLY   3           HA2      GLY   3  55.975   2.224   8.137
   22    H    ARG   4           HN       ARG   4  56.312   3.435   6.607
   23    HA   ARG   4           HA       ARG   4  54.045   4.062   7.193
   24    HB2  ARG   4           HB2      ARG   4  55.673   5.578   5.097
   25    HB3  ARG   4           HB1      ARG   4  54.260   6.267   5.938
   26    HG2  ARG   4           HG2      ARG   4  55.330   5.963   8.106
   27    HG3  ARG   4           HG1      ARG   4  56.693   5.096   7.358
   28    HD2  ARG   4           HD2      ARG   4  57.289   7.132   6.077
   29    HD3  ARG   4           HD1      ARG   4  55.931   8.002   6.827
   30    HE   ARG   4           HE       ARG   4  57.574   6.922   8.902
   31   HH11  ARG   4          HH11      ARG   4  59.632   7.964   6.920
   32   HH12  ARG   4          HH12      ARG   4  59.847   9.591   7.476
   33   HH21  ARG   4          HH21      ARG   4  56.962   9.591   9.400
   34   HH22  ARG   4          HH22      ARG   4  58.333  10.512   8.880
   35    H    TRP   5           HN       TRP   5  54.813   2.296   4.656
   36    HA   TRP   5           HA       TRP   5  53.381   2.880   2.349
   37    HB2  TRP   5           HB2      TRP   5  54.673   0.801   2.671
   38    HB3  TRP   5           HB1      TRP   5  53.405   0.178   3.754
   39    HD1  TRP   5           HD1      TRP   5  51.605  -1.209   2.626
   40    HE1  TRP   5           HE1      TRP   5  50.696  -1.539   0.213
   41    HE3  TRP   5           HE3      TRP   5  54.402   2.339   0.220
   42    HZ2  TRP   5           HZ2      TRP   5  51.148  -0.397  -2.393
   43    HZ3  TRP   5           HZ3      TRP   5  54.146   2.703  -2.230
   44    HH2  TRP   5           HH2      TRP   5  52.523   1.338  -3.537
   45    H    LEU   6           HN       LEU   6  52.071   2.401   5.505
   46    HA   LEU   6           HA       LEU   6  49.271   2.343   4.383
   47    HB2  LEU   6           HB2      LEU   6  50.226   1.383   7.114
   48    HB3  LEU   6           HB1      LEU   6  48.577   1.286   6.462
   49    HG   LEU   6           HG       LEU   6  49.889  -0.019   4.447
   50   HD11  LEU   6          HD11      LEU   6  51.450  -0.851   6.931
   51   HD12  LEU   6          HD12      LEU   6  52.094   0.289   5.730
   52   HD13  LEU   6          HD13      LEU   6  51.701  -1.377   5.250
   53   HD21  LEU   6          HD21      LEU   6  48.005  -0.982   5.641
   54   HD22  LEU   6          HD22      LEU   6  48.982  -1.192   7.114
   55   HD23  LEU   6          HD23      LEU   6  49.332  -2.166   5.666
   56    H    GLU   7           HN       GLU   7  51.655   4.092   6.254
   57    HA   GLU   7           HA       GLU   7  49.574   5.719   7.633
   58    HB2  GLU   7           HB2      GLU   7  52.606   5.988   7.612
   59    HB3  GLU   7           HB1      GLU   7  51.472   6.823   8.699
   60    HG2  GLU   7           HG2      GLU   7  51.754   3.792   8.508
   61    HG3  GLU   7           HG1      GLU   7  52.545   4.798   9.744
   62    H    ARG   8           HN       ARG   8  51.155   5.642   4.633
   63    HA   ARG   8           HA       ARG   8  51.308   8.568   4.277
   64    HB2  ARG   8           HB2      ARG   8  52.876   6.888   3.187
   65    HB3  ARG   8           HB1      ARG   8  51.509   6.395   2.159
   66    HG2  ARG   8           HG2      ARG   8  51.273   8.718   1.342
   67    HG3  ARG   8           HG1      ARG   8  52.625   9.227   2.382
   68    HD2  ARG   8           HD2      ARG   8  54.101   7.583   1.186
   69    HD3  ARG   8           HD1      ARG   8  52.750   7.225   0.084
   70    HE   ARG   8           HE       ARG   8  53.108  10.031   0.047
   71   HH11  ARG   8          HH11      ARG   8  53.310   8.039  -2.285
   72   HH12  ARG   8          HH12      ARG   8  54.913   8.368  -2.851
   73   HH21  ARG   8          HH21      ARG   8  55.854  10.087   0.010
   74   HH22  ARG   8          HH22      ARG   8  56.354   9.527  -1.551
   75    H    ILE   9           HN       ILE   9  48.929   8.656   4.984
   76    HA   ILE   9           HA       ILE   9  46.949   7.796   3.023
   77    HB   ILE   9           HB       ILE   9  45.401   9.280   4.366
   78   HG12  ILE   9          HG12      ILE   9  47.331   9.580   6.625
   79   HG13  ILE   9          HG11      ILE   9  47.822  10.524   5.205
   80   HG21  ILE   9          HG21      ILE   9  45.594   6.930   4.906
   81   HG22  ILE   9          HG22      ILE   9  45.579   7.837   6.438
   82   HG23  ILE   9          HG23      ILE   9  47.112   7.201   5.795
   83   HD11  ILE   9           HD1      ILE   9  45.020  10.609   6.398
   84   HD12  ILE   9           HD2      ILE   9  45.691  11.672   5.139
   85   HD13  ILE   9           HD3      ILE   9  46.313  11.763   6.805
   86    H    GLY  10           HN       GLY  10  47.898   8.714   1.090
   87    HA2  GLY  10           HA1      GLY  10  48.476  11.399   0.614
   88    HA3  GLY  10           HA2      GLY  10  47.785  10.300  -0.597
   89    H    LYS  11           HN       LYS  11  45.317   9.847   0.926
   90    HA   LYS  11           HA       LYS  11  43.734  11.923  -0.209
   91    HB2  LYS  11           HB2      LYS  11  43.125   9.999   2.070
   92    HB3  LYS  11           HB1      LYS  11  41.915  11.015   1.251
   93    HG2  LYS  11           HG2      LYS  11  42.252   9.902  -0.849
   94    HG3  LYS  11           HG1      LYS  11  43.729   9.098  -0.267
   95    HD2  LYS  11           HD2      LYS  11  41.907   7.478  -0.258
   96    HD3  LYS  11           HD1      LYS  11  42.332   7.863   1.425
   97    HE2  LYS  11           HE2      LYS  11  40.411   9.258   1.703
   98    HE3  LYS  11           HE1      LYS  11  40.105   9.323  -0.050
   99    HZ1  LYS  11           HZ1      LYS  11  39.792   6.993   1.766
  100    HZ2  LYS  11           HZ2      LYS  11  39.772   6.857   0.072
  101    HZ3  LYS  11           HZ3      LYS  11  38.588   7.780   0.868
  102    H    ALA  12           HN       ALA  12  44.006  14.010   0.307
  103    HA   ALA  12           HA       ALA  12  44.813  14.881   2.942
  104    HB1  ALA  12           HB1      ALA  12  45.179  16.119   0.774
  105    HB2  ALA  12           HB2      ALA  12  44.500  17.107   2.090
  106    HB3  ALA  12           HB3      ALA  12  43.445  16.517   0.783
  107    H    GLY  13           HN       GLY  13  42.029  13.460   1.993
  108    HA2  GLY  13           HA1      GLY  13  39.820  13.534   2.716
  109    HA3  GLY  13           HA2      GLY  13  40.572  13.822   4.296
  110    H    PHE  14           HN       PHE  14  40.606  16.005   1.476
  111    HA   PHE  14           HA       PHE  14  38.441  17.651   2.459
  112    HB2  PHE  14           HB2      PHE  14  40.283  18.073   4.177
  113    HB3  PHE  14           HB1      PHE  14  41.211  18.836   2.865
  114    HD1  PHE  14           HD1      PHE  14  40.944  21.168   2.571
  115    HD2  PHE  14           HD2      PHE  14  37.722  18.892   4.330
  116    HE1  PHE  14           HE1      PHE  14  39.642  23.263   2.902
  117    HE2  PHE  14           HE2      PHE  14  36.423  20.990   4.659
  118    HZ   PHE  14           HZ       PHE  14  37.354  23.166   3.883
  119    H    ILE  15           HN       ILE  15  41.007  16.872   0.296
  120    HA   ILE  15           HA       ILE  15  39.736  18.508  -1.792
  121    HB   ILE  15           HB       ILE  15  41.933  19.603  -2.459
  122   HG12  ILE  15          HG12      ILE  15  42.708  18.759   0.373
  123   HG13  ILE  15          HG11      ILE  15  43.394  18.089  -1.126
  124   HG21  ILE  15          HG21      ILE  15  40.029  20.728  -1.126
  125   HG22  ILE  15          HG22      ILE  15  41.631  21.486  -1.023
  126   HG23  ILE  15          HG23      ILE  15  41.039  20.476   0.315
  127   HD11  ILE  15           HD1      ILE  15  44.961  19.746  -0.453
  128   HD12  ILE  15           HD2      ILE  15  43.682  20.898  -0.007
  129   HD13  ILE  15           HD3      ILE  15  44.004  20.546  -1.722
  130    H    ILE  16           HN       ILE  16  39.769  15.830  -1.629
  131    HA   ILE  16           HA       ILE  16  41.492  15.125  -3.956
  132    HB   ILE  16           HB       ILE  16  41.592  13.901  -1.200
  133   HG12  ILE  16          HG12      ILE  16  43.416  15.381  -2.329
  134   HG13  ILE  16          HG11      ILE  16  43.935  13.903  -1.505
  135   HG21  ILE  16          HG21      ILE  16  41.791  12.300  -3.779
  136   HG22  ILE  16          HG22      ILE  16  40.825  11.951  -2.327
  137   HG23  ILE  16          HG23      ILE  16  42.593  11.776  -2.279
  138   HD11  ILE  16           HD1      ILE  16  44.318  12.750  -3.547
  139   HD12  ILE  16           HD2      ILE  16  44.935  14.388  -3.852
  140   HD13  ILE  16           HD3      ILE  16  43.353  13.904  -4.494
  141    H    ILE  17           HN       ILE  17  39.032  13.986  -1.604
  142    HA   ILE  17           HA       ILE  17  37.816  12.202  -3.580
  143    HB   ILE  17           HB       ILE  17  35.899  12.214  -1.739
  144   HG12  ILE  17          HG12      ILE  17  36.637  12.905   0.477
  145   HG13  ILE  17          HG11      ILE  17  38.237  13.363  -0.143
  146   HG21  ILE  17          HG21      ILE  17  38.721  11.163  -1.263
  147   HG22  ILE  17          HG22      ILE  17  37.376  10.313  -2.061
  148   HG23  ILE  17          HG23      ILE  17  37.298  10.665  -0.318
  149   HD11  ILE  17           HD1      ILE  17  36.561  15.276   0.239
  150   HD12  ILE  17           HD2      ILE  17  35.669  14.640  -1.161
  151   HD13  ILE  17           HD3      ILE  17  37.341  15.225  -1.357
  152    H    GLY  18           HN       GLY  18  38.069  15.295  -3.883
  153    HA2  GLY  18           HA1      GLY  18  35.634  15.587  -5.399
  154    HA3  GLY  18           HA2      GLY  18  35.528  16.486  -3.872
  155    H    GLY  19           HN       GLY  19  38.416  17.030  -3.777
  156    HA2  GLY  19           HA1      GLY  19  38.360  19.469  -5.374
  157    HA3  GLY  19           HA2      GLY  19  39.674  18.913  -4.318
  158    H    ALA  20           HN       ALA  20  39.625  16.241  -5.760
  159    HA   ALA  20           HA       ALA  20  41.702  16.887  -7.655
  160    HB1  ALA  20           HB1      ALA  20  41.514  14.467  -8.263
  161    HB2  ALA  20           HB2      ALA  20  40.095  14.353  -7.193
  162    HB3  ALA  20           HB3      ALA  20  41.693  14.754  -6.516
  163    H    LEU  21           HN       LEU  21  38.322  15.732  -8.053
  164    HA   LEU  21           HA       LEU  21  36.920  15.823  -9.904
  165    HB2  LEU  21           HB2      LEU  21  38.618  18.197 -10.763
  166    HB3  LEU  21           HB1      LEU  21  36.931  17.861 -11.210
  167    HG   LEU  21           HG       LEU  21  37.853  18.321  -8.334
  168   HD11  LEU  21          HD11      LEU  21  36.557  20.281 -10.276
  169   HD12  LEU  21          HD12      LEU  21  38.260  20.324  -9.759
  170   HD13  LEU  21          HD13      LEU  21  36.961  20.599  -8.573
  171   HD21  LEU  21          HD21      LEU  21  35.750  17.148  -8.376
  172   HD22  LEU  21          HD22      LEU  21  35.141  18.141  -9.721
  173   HD23  LEU  21          HD23      LEU  21  35.345  18.857  -8.105
  174    H    ASP  22           HN       ASP  22  38.611  13.846 -10.233
  175    HA   ASP  22           HA       ASP  22  39.071  13.843 -13.143
  176    HB2  ASP  22           HB2      ASP  22  41.387  13.555 -11.187
  177    HB3  ASP  22           HB1      ASP  22  41.462  13.144 -12.918
  178    H    HIS  23           HN       HIS  23  37.243  12.328 -12.429
  179    HA   HIS  23           HA       HIS  23  36.495  10.157 -12.075
  180    HB2  HIS  23           HB2      HIS  23  37.875   9.836 -14.124
  181    HB3  HIS  23           HB1      HIS  23  39.273   9.442 -13.095
  182    HD1  HIS  23           HD1      HIS  23  39.522   7.052 -12.384
  183    HD2  HIS  23           HD2      HIS  23  35.616   7.935 -13.670
  184    HE1  HIS  23           HE1      HIS  23  38.211   4.859 -12.401
  185    H    LEU  24           HN       LEU  24  37.564  11.447  -9.780
  186    HA   LEU  24           HA       LEU  24  38.012   9.094  -8.124
  187    HB2  LEU  24           HB2      LEU  24  40.297   9.291  -8.890
  188    HB3  LEU  24           HB1      LEU  24  40.300  11.044  -8.605
  189    HG   LEU  24           HG       LEU  24  40.189  10.728  -6.199
  190   HD11  LEU  24          HD11      LEU  24  39.687   7.818  -6.938
  191   HD12  LEU  24          HD12      LEU  24  38.716   8.882  -5.891
  192   HD13  LEU  24          HD13      LEU  24  40.289   8.278  -5.327
  193   HD21  LEU  24          HD21      LEU  24  42.156   8.713  -7.376
  194   HD22  LEU  24          HD22      LEU  24  42.304   9.554  -5.814
  195   HD23  LEU  24          HD23      LEU  24  42.411  10.475  -7.333
  Start of MODEL   46
    1    H1   GLY   1           HT1      GLY   1  57.297  -3.647   5.455
    2    H2   GLY   1           HT2      GLY   1  56.077  -2.917   6.384
    3    H3   GLY   1           HT3      GLY   1  57.455  -3.562   7.140
    4    HA2  GLY   1           HA1      GLY   1  58.492  -1.680   6.979
    5    HA3  GLY   1           HA2      GLY   1  58.302  -1.758   5.217
    6    H    LYS   2           HN       LYS   2  58.144   0.564   5.279
    7    HA   LYS   2           HA       LYS   2  55.389   1.438   5.264
    8    HB2  LYS   2           HB2      LYS   2  55.516   3.088   7.104
    9    HB3  LYS   2           HB1      LYS   2  55.706   1.429   7.714
   10    HG2  LYS   2           HG2      LYS   2  58.225   1.765   7.567
   11    HG3  LYS   2           HG1      LYS   2  57.903   3.485   7.242
   12    HD2  LYS   2           HD2      LYS   2  56.704   3.701   9.372
   13    HD3  LYS   2           HD1      LYS   2  56.912   1.962   9.692
   14    HE2  LYS   2           HE2      LYS   2  58.624   3.153  10.933
   15    HE3  LYS   2           HE1      LYS   2  59.415   2.318   9.574
   16    HZ1  LYS   2           HZ1      LYS   2  58.811   5.195   9.891
   17    HZ2  LYS   2           HZ2      LYS   2  59.008   4.524   8.342
   18    HZ3  LYS   2           HZ3      LYS   2  60.276   4.449   9.472
   19    H    GLY   3           HN       GLY   3  56.251   4.258   6.009
   20    HA2  GLY   3           HA1      GLY   3  56.799   6.135   4.594
   21    HA3  GLY   3           HA2      GLY   3  58.374   5.193   4.376
   22    H    ARG   4           HN       ARG   4  55.316   5.627   4.188
   23    HA   ARG   4           HA       ARG   4  55.160   6.903   2.447
   24    HB2  ARG   4           HB2      ARG   4  55.441   4.349   0.942
   25    HB3  ARG   4           HB1      ARG   4  54.149   5.404   0.319
   26    HG2  ARG   4           HG2      ARG   4  55.615   7.000  -0.505
   27    HG3  ARG   4           HG1      ARG   4  56.782   6.798   0.805
   28    HD2  ARG   4           HD2      ARG   4  57.812   6.013  -1.241
   29    HD3  ARG   4           HD1      ARG   4  57.443   4.574  -0.266
   30    HE   ARG   4           HE       ARG   4  56.238   5.262  -2.831
   31   HH11  ARG   4          HH11      ARG   4  53.702   4.995  -1.976
   32   HH12  ARG   4          HH12      ARG   4  53.426   3.327  -1.601
   33   HH21  ARG   4          HH21      ARG   4  56.798   2.539  -1.405
   34   HH22  ARG   4          HH22      ARG   4  55.178   1.937  -1.276
   35    H    TRP   5           HN       TRP   5  54.002   4.518   4.177
   36    HA   TRP   5           HA       TRP   5  51.391   3.838   3.591
   37    HB2  TRP   5           HB2      TRP   5  52.575   3.237   5.691
   38    HB3  TRP   5           HB1      TRP   5  52.366   4.913   6.257
   39    HD1  TRP   5           HD1      TRP   5  50.106   2.031   4.962
   40    HE1  TRP   5           HE1      TRP   5  47.868   2.059   6.285
   41    HE3  TRP   5           HE3      TRP   5  50.955   6.136   7.899
   42    HZ2  TRP   5           HZ2      TRP   5  46.642   3.664   8.337
   43    HZ3  TRP   5           HZ3      TRP   5  49.238   6.898   9.533
   44    HH2  TRP   5           HH2      TRP   5  47.085   5.667   9.754
   45    H    LEU   6           HN       LEU   6  52.680   6.994   4.240
   46    HA   LEU   6           HA       LEU   6  49.996   8.229   4.588
   47    HB2  LEU   6           HB2      LEU   6  52.780   9.469   4.552
   48    HB3  LEU   6           HB1      LEU   6  51.264  10.306   4.942
   49    HG   LEU   6           HG       LEU   6  51.040   8.288   6.744
   50   HD11  LEU   6          HD11      LEU   6  53.281   7.807   7.734
   51   HD12  LEU   6          HD12      LEU   6  54.052   8.641   6.366
   52   HD13  LEU   6          HD13      LEU   6  53.128   7.148   6.092
   53   HD21  LEU   6          HD21      LEU   6  51.026  10.653   7.353
   54   HD22  LEU   6          HD22      LEU   6  52.777  10.778   7.061
   55   HD23  LEU   6          HD23      LEU   6  52.167   9.794   8.414
   56    H    GLU   7           HN       GLU   7  52.559   7.768   2.154
   57    HA   GLU   7           HA       GLU   7  51.484   9.910   0.428
   58    HB2  GLU   7           HB2      GLU   7  53.394   7.630  -0.186
   59    HB3  GLU   7           HB1      GLU   7  53.083   9.043  -1.222
   60    HG2  GLU   7           HG2      GLU   7  53.780  10.485   0.807
   61    HG3  GLU   7           HG1      GLU   7  54.393   8.977   1.527
   62    H    ARG   8           HN       ARG   8  50.624   6.674   1.161
   63    HA   ARG   8           HA       ARG   8  49.598   5.917  -1.441
   64    HB2  ARG   8           HB2      ARG   8  48.931   4.950   1.365
   65    HB3  ARG   8           HB1      ARG   8  48.344   4.186  -0.132
   66    HG2  ARG   8           HG2      ARG   8  50.745   3.923  -0.863
   67    HG3  ARG   8           HG1      ARG   8  51.247   4.520   0.738
   68    HD2  ARG   8           HD2      ARG   8  49.934   2.661   1.794
   69    HD3  ARG   8           HD1      ARG   8  49.573   2.035   0.167
   70    HE   ARG   8           HE       ARG   8  52.412   2.359   0.454
   71   HH11  ARG   8          HH11      ARG   8  50.386  -0.018  -0.254
   72   HH12  ARG   8          HH12      ARG   8  51.042  -1.231   0.793
   73   HH21  ARG   8          HH21      ARG   8  52.999   0.999   2.588
   74   HH22  ARG   8          HH22      ARG   8  52.522  -0.656   2.402
   75    H    ILE   9           HN       ILE   9  47.111   5.203  -1.418
   76    HA   ILE   9           HA       ILE   9  45.658   7.636  -1.669
   77    HB   ILE   9           HB       ILE   9  44.945   5.715  -2.946
   78   HG12  ILE   9          HG12      ILE   9  42.556   5.664  -2.503
   79   HG13  ILE   9          HG11      ILE   9  42.797   6.164  -0.817
   80   HG21  ILE   9          HG21      ILE   9  44.272   3.623  -2.048
   81   HG22  ILE   9          HG22      ILE   9  44.124   4.267  -0.399
   82   HG23  ILE   9          HG23      ILE   9  45.730   4.050  -1.127
   83   HD11  ILE   9           HD1      ILE   9  42.084   7.983  -2.538
   84   HD12  ILE   9           HD2      ILE   9  43.763   7.897  -3.120
   85   HD13  ILE   9           HD3      ILE   9  43.425   8.369  -1.436
   86    H    GLY  10           HN       GLY  10  45.331   8.971  -0.023
   87    HA2  GLY  10           HA1      GLY  10  43.395   8.726   1.884
   88    HA3  GLY  10           HA2      GLY  10  44.778   7.947   2.682
   89    H    LYS  11           HN       LYS  11  44.709  10.732   0.443
   90    HA   LYS  11           HA       LYS  11  46.593  12.274   1.833
   91    HB2  LYS  11           HB2      LYS  11  45.462  12.689  -0.466
   92    HB3  LYS  11           HB1      LYS  11  44.182  13.507   0.455
   93    HG2  LYS  11           HG2      LYS  11  45.591  15.326   0.016
   94    HG3  LYS  11           HG1      LYS  11  46.237  14.796   1.583
   95    HD2  LYS  11           HD2      LYS  11  48.216  14.967   0.335
   96    HD3  LYS  11           HD1      LYS  11  47.817  13.255   0.071
   97    HE2  LYS  11           HE2      LYS  11  46.718  13.844  -2.079
   98    HE3  LYS  11           HE1      LYS  11  47.108  15.558  -1.805
   99    HZ1  LYS  11           HZ1      LYS  11  48.681  14.126  -3.235
  100    HZ2  LYS  11           HZ2      LYS  11  49.238  13.511  -1.752
  101    HZ3  LYS  11           HZ3      LYS  11  49.354  15.174  -2.084
  102    H    ALA  12           HN       ALA  12  43.160  11.789   2.458
  103    HA   ALA  12           HA       ALA  12  43.467  12.905   5.148
  104    HB1  ALA  12           HB1      ALA  12  43.176  14.994   3.986
  105    HB2  ALA  12           HB2      ALA  12  41.647  14.607   4.813
  106    HB3  ALA  12           HB3      ALA  12  41.805  14.343   3.059
  107    H    GLY  13           HN       GLY  13  41.967  11.034   2.754
  108    HA2  GLY  13           HA1      GLY  13  40.232   9.509   2.843
  109    HA3  GLY  13           HA2      GLY  13  40.435   9.529   4.607
  110    H    PHE  14           HN       PHE  14  39.638  12.358   2.651
  111    HA   PHE  14           HA       PHE  14  36.762  12.178   3.320
  112    HB2  PHE  14           HB2      PHE  14  37.870  13.128   5.380
  113    HB3  PHE  14           HB1      PHE  14  38.429  14.493   4.384
  114    HD1  PHE  14           HD1      PHE  14  35.263  12.558   5.110
  115    HD2  PHE  14           HD2      PHE  14  37.041  16.406   4.280
  116    HE1  PHE  14           HE1      PHE  14  33.043  13.650   5.399
  117    HE2  PHE  14           HE2      PHE  14  34.821  17.493   4.568
  118    HZ   PHE  14           HZ       PHE  14  32.827  16.120   5.156
  119    H    ILE  15           HN       ILE  15  39.408  13.183   1.478
  120    HA   ILE  15           HA       ILE  15  37.629  14.421  -0.506
  121    HB   ILE  15           HB       ILE  15  39.069  16.489  -0.722
  122   HG12  ILE  15          HG12      ILE  15  40.055  15.617   2.035
  123   HG13  ILE  15          HG11      ILE  15  41.023  15.570   0.545
  124   HG21  ILE  15          HG21      ILE  15  37.780  16.318   2.030
  125   HG22  ILE  15          HG22      ILE  15  36.822  16.364   0.532
  126   HG23  ILE  15          HG23      ILE  15  37.884  17.726   0.949
  127   HD11  ILE  15           HD1      ILE  15  39.964  17.994   2.033
  128   HD12  ILE  15           HD2      ILE  15  40.459  18.101   0.327
  129   HD13  ILE  15           HD3      ILE  15  41.639  17.622   1.569
  130    H    ILE  16           HN       ILE  16  39.095  12.038  -0.442
  131    HA   ILE  16           HA       ILE  16  40.859  12.520  -2.777
  132    HB   ILE  16           HB       ILE  16  42.312  12.674  -0.716
  133   HG12  ILE  16          HG12      ILE  16  43.974  10.900  -1.502
  134   HG13  ILE  16          HG11      ILE  16  42.727  10.327  -2.632
  135   HG21  ILE  16          HG21      ILE  16  41.722   9.707  -0.402
  136   HG22  ILE  16          HG22      ILE  16  40.911  10.965   0.562
  137   HG23  ILE  16          HG23      ILE  16  42.674  10.755   0.675
  138   HD11  ILE  16           HD1      ILE  16  44.540  12.088  -3.445
  139   HD12  ILE  16           HD2      ILE  16  43.486  13.269  -2.634
  140   HD13  ILE  16           HD3      ILE  16  42.851  12.267  -3.962
  141    H    ILE  17           HN       ILE  17  38.994  10.470  -0.642
  142    HA   ILE  17           HA       ILE  17  39.372   8.069  -2.328
  143    HB   ILE  17           HB       ILE  17  37.392   7.249  -0.745
  144   HG12  ILE  17          HG12      ILE  17  37.265   8.445   1.380
  145   HG13  ILE  17          HG11      ILE  17  38.485   9.619   0.844
  146   HG21  ILE  17          HG21      ILE  17  40.171   7.913   0.327
  147   HG22  ILE  17          HG22      ILE  17  39.727   6.460  -0.599
  148   HG23  ILE  17          HG23      ILE  17  39.049   6.721   1.026
  149   HD11  ILE  17           HD1      ILE  17  37.000  10.581  -0.765
  150   HD12  ILE  17           HD2      ILE  17  36.020  10.360   0.701
  151   HD13  ILE  17           HD3      ILE  17  35.865   9.213  -0.650
  152    H    GLY  18           HN       GLY  18  37.901  10.867  -2.914
  153    HA2  GLY  18           HA1      GLY  18  36.131   9.729  -4.893
  154    HA3  GLY  18           HA2      GLY  18  35.213  10.364  -3.514
  155    H    GLY  19           HN       GLY  19  37.288  12.447  -2.990
  156    HA2  GLY  19           HA1      GLY  19  36.111  14.498  -4.653
  157    HA3  GLY  19           HA2      GLY  19  37.444  14.704  -3.500
  158    H    ALA  20           HN       ALA  20  39.376  13.030  -4.486
  159    HA   ALA  20           HA       ALA  20  41.122  13.088  -6.009
  160    HB1  ALA  20           HB1      ALA  20  39.568  11.797  -7.365
  161    HB2  ALA  20           HB2      ALA  20  40.477  12.920  -8.405
  162    HB3  ALA  20           HB3      ALA  20  38.796  13.288  -7.952
  163    H    LEU  21           HN       LEU  21  40.379  15.586  -4.803
  164    HA   LEU  21           HA       LEU  21  40.344  17.673  -6.819
  165    HB2  LEU  21           HB2      LEU  21  41.343  17.964  -3.965
  166    HB3  LEU  21           HB1      LEU  21  40.581  19.193  -5.000
  167    HG   LEU  21           HG       LEU  21  39.223  16.688  -3.904
  168   HD11  LEU  21          HD11      LEU  21  37.995  18.213  -2.476
  169   HD12  LEU  21          HD12      LEU  21  38.729  19.627  -3.269
  170   HD13  LEU  21          HD13      LEU  21  39.728  18.551  -2.262
  171   HD21  LEU  21          HD21      LEU  21  37.149  17.953  -4.805
  172   HD22  LEU  21          HD22      LEU  21  38.196  17.174  -6.011
  173   HD23  LEU  21          HD23      LEU  21  38.299  18.931  -5.748
  174    H    ASP  22           HN       ASP  22  42.702  15.472  -5.949
  175    HA   ASP  22           HA       ASP  22  45.086  16.943  -5.743
  176    HB2  ASP  22           HB2      ASP  22  44.958  14.488  -5.536
  177    HB3  ASP  22           HB1      ASP  22  44.623  14.355  -7.279
  178    H    HIS  23           HN       HIS  23  43.122  16.206  -8.603
  179    HA   HIS  23           HA       HIS  23  44.298  18.421 -10.058
  180    HB2  HIS  23           HB2      HIS  23  45.327  17.104 -11.885
  181    HB3  HIS  23           HB1      HIS  23  46.157  16.834 -10.334
  182    HD1  HIS  23           HD1      HIS  23  46.644  14.609 -12.194
  183    HD2  HIS  23           HD2      HIS  23  43.107  14.772  -9.924
  184    HE1  HIS  23           HE1      HIS  23  45.715  12.233 -12.060
  185    H    LEU  24           HN       LEU  24  41.733  16.973  -9.222
  186    HA   LEU  24           HA       LEU  24  40.271  17.600 -11.651
  187    HB2  LEU  24           HB2      LEU  24  41.022  15.443 -12.425
  188    HB3  LEU  24           HB1      LEU  24  40.642  14.682 -10.865
  189    HG   LEU  24           HG       LEU  24  38.260  14.942 -11.228
  190   HD11  LEU  24          HD11      LEU  24  38.045  17.099 -12.227
  191   HD12  LEU  24          HD12      LEU  24  37.499  15.967 -13.485
  192   HD13  LEU  24          HD13      LEU  24  39.129  16.676 -13.573
  193   HD21  LEU  24          HD21      LEU  24  39.343  13.034 -12.369
  194   HD22  LEU  24          HD22      LEU  24  39.629  14.047 -13.805
  195   HD23  LEU  24          HD23      LEU  24  37.964  13.639 -13.319
  Start of MODEL   47
    1    H1   GLY   1           HT1      GLY   1  55.502  10.863  -3.830
    2    H2   GLY   1           HT2      GLY   1  55.707  10.790  -5.517
    3    H3   GLY   1           HT3      GLY   1  57.002  10.418  -4.482
    4    HA2  GLY   1           HA1      GLY   1  54.563   8.887  -5.021
    5    HA3  GLY   1           HA2      GLY   1  56.255   8.388  -5.214
    6    H    LYS   2           HN       LYS   2  54.138   7.034  -3.752
    7    HA   LYS   2           HA       LYS   2  53.777   6.049  -1.675
    8    HB2  LYS   2           HB2      LYS   2  56.716   6.647  -1.167
    9    HB3  LYS   2           HB1      LYS   2  55.741   5.314  -0.505
   10    HG2  LYS   2           HG2      LYS   2  55.460   4.383  -2.787
   11    HG3  LYS   2           HG1      LYS   2  56.440   5.713  -3.449
   12    HD2  LYS   2           HD2      LYS   2  58.334   4.993  -1.956
   13    HD3  LYS   2           HD1      LYS   2  57.355   3.589  -1.463
   14    HE2  LYS   2           HE2      LYS   2  57.190   2.915  -3.877
   15    HE3  LYS   2           HE1      LYS   2  58.289   4.253  -4.289
   16    HZ1  LYS   2           HZ1      LYS   2  59.025   1.726  -3.546
   17    HZ2  LYS   2           HZ2      LYS   2  59.288   2.644  -2.141
   18    HZ3  LYS   2           HZ3      LYS   2  60.036   3.087  -3.601
   19    H    GLY   3           HN       GLY   3  55.573   6.739   0.701
   20    HA2  GLY   3           HA1      GLY   3  55.009   7.993   2.696
   21    HA3  GLY   3           HA2      GLY   3  55.371   9.402   1.562
   22    H    ARG   4           HN       ARG   4  53.770   6.869   2.467
   23    HA   ARG   4           HA       ARG   4  52.564   7.803   4.068
   24    HB2  ARG   4           HB2      ARG   4  50.876   8.679   1.789
   25    HB3  ARG   4           HB1      ARG   4  49.916   7.895   3.060
   26    HG2  ARG   4           HG2      ARG   4  50.194   9.617   4.576
   27    HG3  ARG   4           HG1      ARG   4  51.854   9.972   4.066
   28    HD2  ARG   4           HD2      ARG   4  50.332  11.835   3.504
   29    HD3  ARG   4           HD1      ARG   4  50.972  11.091   2.020
   30    HE   ARG   4           HE       ARG   4  48.452   9.886   2.791
   31   HH11  ARG   4          HH11      ARG   4  48.140  12.960   2.814
   32   HH12  ARG   4          HH12      ARG   4  47.566  13.229   1.203
   33   HH21  ARG   4          HH21      ARG   4  48.484  10.084   0.067
   34   HH22  ARG   4          HH22      ARG   4  47.762  11.601  -0.353
   35    H    TRP   5           HN       TRP   5  52.782   5.650   1.688
   36    HA   TRP   5           HA       TRP   5  50.785   3.732   1.817
   37    HB2  TRP   5           HB2      TRP   5  52.887   3.532   0.476
   38    HB3  TRP   5           HB1      TRP   5  53.766   3.117   1.968
   39    HD1  TRP   5           HD1      TRP   5  53.691   0.674   2.735
   40    HE1  TRP   5           HE1      TRP   5  52.461  -1.487   1.974
   41    HE3  TRP   5           HE3      TRP   5  50.467   2.734  -0.667
   42    HZ2  TRP   5           HZ2      TRP   5  50.364  -2.193   0.132
   43    HZ3  TRP   5           HZ3      TRP   5  48.860   1.298  -1.914
   44    HH2  TRP   5           HH2      TRP   5  48.805  -1.160  -1.519
   45    H    LEU   6           HN       LEU   6  52.786   4.859   4.365
   46    HA   LEU   6           HA       LEU   6  51.803   2.677   6.192
   47    HB2  LEU   6           HB2      LEU   6  54.334   4.346   6.460
   48    HB3  LEU   6           HB1      LEU   6  53.823   2.993   7.500
   49    HG   LEU   6           HG       LEU   6  54.456   2.791   4.520
   50   HD11  LEU   6          HD11      LEU   6  56.417   3.243   6.053
   51   HD12  LEU   6          HD12      LEU   6  56.503   1.678   5.208
   52   HD13  LEU   6          HD13      LEU   6  56.018   1.740   6.920
   53   HD21  LEU   6          HD21      LEU   6  54.482   0.253   5.243
   54   HD22  LEU   6          HD22      LEU   6  52.917   1.044   4.956
   55   HD23  LEU   6          HD23      LEU   6  53.501   0.808   6.621
   56    H    GLU   7           HN       GLU   7  51.591   6.039   5.370
   57    HA   GLU   7           HA       GLU   7  50.689   6.644   8.200
   58    HB2  GLU   7           HB2      GLU   7  51.670   8.595   6.083
   59    HB3  GLU   7           HB1      GLU   7  51.231   8.968   7.763
   60    HG2  GLU   7           HG2      GLU   7  53.066   7.586   8.597
   61    HG3  GLU   7           HG1      GLU   7  53.461   7.057   6.944
   62    H    ARG   8           HN       ARG   8  49.189   5.291   6.098
   63    HA   ARG   8           HA       ARG   8  47.454   6.912   4.620
   64    HB2  ARG   8           HB2      ARG   8  46.906   4.350   6.161
   65    HB3  ARG   8           HB1      ARG   8  45.747   5.068   5.022
   66    HG2  ARG   8           HG2      ARG   8  48.618   4.487   4.182
   67    HG3  ARG   8           HG1      ARG   8  47.385   3.210   4.148
   68    HD2  ARG   8           HD2      ARG   8  45.954   4.834   2.736
   69    HD3  ARG   8           HD1      ARG   8  47.433   5.809   2.562
   70    HE   ARG   8           HE       ARG   8  48.042   3.101   1.885
   71   HH11  ARG   8          HH11      ARG   8  46.055   5.720   0.852
   72   HH12  ARG   8          HH12      ARG   8  46.222   5.358  -0.834
   73   HH21  ARG   8          HH21      ARG   8  48.336   2.658  -0.316
   74   HH22  ARG   8          HH22      ARG   8  47.512   3.622  -1.495
   75    H    ILE   9           HN       ILE   9  46.975   8.866   5.626
   76    HA   ILE   9           HA       ILE   9  45.800   8.969   8.279
   77    HB   ILE   9           HB       ILE   9  45.251  11.339   7.671
   78   HG12  ILE   9          HG12      ILE   9  46.397  10.479   4.972
   79   HG13  ILE   9          HG11      ILE   9  44.727  11.000   5.293
   80   HG21  ILE   9          HG21      ILE   9  48.069  10.618   6.767
   81   HG22  ILE   9          HG22      ILE   9  47.559  10.532   8.470
   82   HG23  ILE   9          HG23      ILE   9  47.530  12.089   7.612
   83   HD11  ILE   9           HD1      ILE   9  45.769  12.945   4.425
   84   HD12  ILE   9           HD2      ILE   9  47.268  12.660   5.338
   85   HD13  ILE   9           HD3      ILE   9  45.799  13.205   6.184
   86    H    GLY  10           HN       GLY  10  44.561   8.715   4.980
   87    HA2  GLY  10           HA1      GLY  10  42.412   8.393   4.193
   88    HA3  GLY  10           HA2      GLY  10  42.072   7.640   5.764
   89    H    LYS  11           HN       LYS  11  43.168  10.781   6.237
   90    HA   LYS  11           HA       LYS  11  40.576  11.662   7.165
   91    HB2  LYS  11           HB2      LYS  11  42.914  12.393   7.984
   92    HB3  LYS  11           HB1      LYS  11  42.953  13.463   6.563
   93    HG2  LYS  11           HG2      LYS  11  40.947  14.625   7.312
   94    HG3  LYS  11           HG1      LYS  11  40.723  13.473   8.649
   95    HD2  LYS  11           HD2      LYS  11  42.786  14.209   9.708
   96    HD3  LYS  11           HD1      LYS  11  43.181  15.243   8.313
   97    HE2  LYS  11           HE2      LYS  11  41.163  16.606   8.737
   98    HE3  LYS  11           HE1      LYS  11  40.741  15.563  10.116
   99    HZ1  LYS  11           HZ1      LYS  11  42.084  16.756  11.390
  100    HZ2  LYS  11           HZ2      LYS  11  42.461  17.770  10.080
  101    HZ3  LYS  11           HZ3      LYS  11  43.410  16.397  10.395
  102    H    ALA  12           HN       ALA  12  41.872  11.382   4.084
  103    HA   ALA  12           HA       ALA  12  41.009  12.022   2.039
  104    HB1  ALA  12           HB1      ALA  12  38.781  12.075   3.446
  105    HB2  ALA  12           HB2      ALA  12  38.832  12.841   1.840
  106    HB3  ALA  12           HB3      ALA  12  38.955  13.840   3.307
  107    H    GLY  13           HN       GLY  13  41.858  14.294   4.528
  108    HA2  GLY  13           HA1      GLY  13  42.674  16.477   4.406
  109    HA3  GLY  13           HA2      GLY  13  43.606  15.822   3.044
  110    H    PHE  14           HN       PHE  14  40.155  16.602   3.570
  111    HA   PHE  14           HA       PHE  14  38.740  18.028   2.427
  112    HB2  PHE  14           HB2      PHE  14  40.827  19.608   2.602
  113    HB3  PHE  14           HB1      PHE  14  41.072  19.222   0.884
  114    HD1  PHE  14           HD1      PHE  14  39.685  20.203  -0.815
  115    HD2  PHE  14           HD2      PHE  14  38.614  20.602   3.348
  116    HE1  PHE  14           HE1      PHE  14  37.925  21.859  -1.425
  117    HE2  PHE  14           HE2      PHE  14  36.856  22.258   2.737
  118    HZ   PHE  14           HZ       PHE  14  36.471  22.839   0.345
  119    H    ILE  15           HN       ILE  15  39.110  15.452   1.560
  120    HA   ILE  15           HA       ILE  15  38.668  14.093  -0.257
  121    HB   ILE  15           HB       ILE  15  37.975  16.597  -1.844
  122   HG12  ILE  15          HG12      ILE  15  36.208  15.042   0.104
  123   HG13  ILE  15          HG11      ILE  15  36.863  16.670   0.396
  124   HG21  ILE  15          HG21      ILE  15  36.712  13.829  -1.892
  125   HG22  ILE  15          HG22      ILE  15  38.090  14.273  -2.926
  126   HG23  ILE  15          HG23      ILE  15  36.544  15.133  -3.091
  127   HD11  ILE  15           HD1      ILE  15  35.708  17.318  -1.850
  128   HD12  ILE  15           HD2      ILE  15  34.676  17.078  -0.421
  129   HD13  ILE  15           HD3      ILE  15  34.798  15.801  -1.652
  130    H    ILE  16           HN       ILE  16  41.044  13.815  -0.206
  131    HA   ILE  16           HA       ILE  16  42.193  14.585  -2.868
  132    HB   ILE  16           HB       ILE  16  43.625  14.739  -0.174
  133   HG12  ILE  16          HG12      ILE  16  42.115  16.710  -0.979
  134   HG13  ILE  16          HG11      ILE  16  43.769  17.083  -0.470
  135   HG21  ILE  16          HG21      ILE  16  45.194  13.810  -1.729
  136   HG22  ILE  16          HG22      ILE  16  45.576  15.541  -1.620
  137   HG23  ILE  16          HG23      ILE  16  44.678  14.917  -3.024
  138   HD11  ILE  16           HD1      ILE  16  43.040  16.596  -3.392
  139   HD12  ILE  16           HD2      ILE  16  44.521  17.323  -2.737
  140   HD13  ILE  16           HD3      ILE  16  42.981  18.201  -2.637
  141    H    ILE  17           HN       ILE  17  43.311  12.814   0.050
  142    HA   ILE  17           HA       ILE  17  44.290  10.642  -1.620
  143    HB   ILE  17           HB       ILE  17  45.390  11.123   0.529
  144   HG12  ILE  17          HG12      ILE  17  45.458   8.876   1.485
  145   HG13  ILE  17          HG11      ILE  17  43.893   8.464   0.752
  146   HG21  ILE  17          HG21      ILE  17  42.734  10.325   1.799
  147   HG22  ILE  17          HG22      ILE  17  43.358  11.989   1.683
  148   HG23  ILE  17          HG23      ILE  17  44.224  10.780   2.663
  149   HD11  ILE  17           HD1      ILE  17  46.215   9.354  -0.997
  150   HD12  ILE  17           HD2      ILE  17  44.802   8.359  -1.431
  151   HD13  ILE  17           HD3      ILE  17  46.103   7.668  -0.435
  152    H    GLY  18           HN       GLY  18  41.316  11.506  -0.069
  153    HA2  GLY  18           HA1      GLY  18  40.200   8.794  -0.064
  154    HA3  GLY  18           HA2      GLY  18  39.345  10.309   0.292
  155    H    GLY  19           HN       GLY  19  39.509  11.838  -1.865
  156    HA2  GLY  19           HA1      GLY  19  37.783  10.446  -3.745
  157    HA3  GLY  19           HA2      GLY  19  38.362  12.118  -3.866
  158    H    ALA  20           HN       ALA  20  41.155  11.627  -3.778
  159    HA   ALA  20           HA       ALA  20  42.858  11.240  -5.306
  160    HB1  ALA  20           HB1      ALA  20  43.029   8.985  -6.195
  161    HB2  ALA  20           HB2      ALA  20  41.297   8.700  -5.892
  162    HB3  ALA  20           HB3      ALA  20  42.419   8.911  -4.525
  163    H    LEU  21           HN       LEU  21  41.372  13.083  -6.335
  164    HA   LEU  21           HA       LEU  21  39.823  12.670  -8.622
  165    HB2  LEU  21           HB2      LEU  21  41.801  14.851  -7.880
  166    HB3  LEU  21           HB1      LEU  21  40.884  14.921  -9.403
  167    HG   LEU  21           HG       LEU  21  38.758  14.731  -8.113
  168   HD11  LEU  21          HD11      LEU  21  39.010  15.212  -5.575
  169   HD12  LEU  21          HD12      LEU  21  40.700  14.688  -5.769
  170   HD13  LEU  21          HD13      LEU  21  39.368  13.561  -6.126
  171   HD21  LEU  21          HD21      LEU  21  39.679  16.951  -8.703
  172   HD22  LEU  21          HD22      LEU  21  40.627  16.964  -7.197
  173   HD23  LEU  21          HD23      LEU  21  38.849  17.011  -7.130
  174    H    ASP  22           HN       ASP  22  40.165  11.535 -10.400
  175    HA   ASP  22           HA       ASP  22  41.272  10.518 -12.165
  176    HB2  ASP  22           HB2      ASP  22  41.586  12.877 -12.847
  177    HB3  ASP  22           HB1      ASP  22  43.105  12.938 -11.919
  178    H    HIS  23           HN       HIS  23  41.861   9.287  -9.861
  179    HA   HIS  23           HA       HIS  23  43.448   7.964  -8.804
  180    HB2  HIS  23           HB2      HIS  23  45.020   8.207 -11.394
  181    HB3  HIS  23           HB1      HIS  23  45.044   6.868 -10.220
  182    HD1  HIS  23           HD1      HIS  23  44.054   7.015 -13.419
  183    HD2  HIS  23           HD2      HIS  23  41.707   6.556  -9.960
  184    HE1  HIS  23           HE1      HIS  23  41.878   5.872 -14.120
  185    H    LEU  24           HN       LEU  24  43.675  10.834  -8.448
  186    HA   LEU  24           HA       LEU  24  46.316  10.871  -7.260
  187    HB2  LEU  24           HB2      LEU  24  47.093  11.303  -9.513
  188    HB3  LEU  24           HB1      LEU  24  45.832  12.528  -9.769
  189    HG   LEU  24           HG       LEU  24  46.861  14.027  -8.156
  190   HD11  LEU  24          HD11      LEU  24  48.598  11.610  -7.523
  191   HD12  LEU  24          HD12      LEU  24  47.643  12.615  -6.407
  192   HD13  LEU  24          HD13      LEU  24  49.132  13.261  -7.130
  193   HD21  LEU  24          HD21      LEU  24  49.072  12.787  -9.851
  194   HD22  LEU  24          HD22      LEU  24  48.974  14.468  -9.274
  195   HD23  LEU  24          HD23      LEU  24  47.816  13.875 -10.490
  Start of MODEL   48
    1    H1   GLY   1           HT1      GLY   1  62.600   4.918   6.142
    2    H2   GLY   1           HT2      GLY   1  63.525   4.752   7.558
    3    H3   GLY   1           HT3      GLY   1  61.928   5.325   7.643
    4    HA2  GLY   1           HA1      GLY   1  62.879   2.623   7.002
    5    HA3  GLY   1           HA2      GLY   1  61.851   3.137   8.354
    6    H    LYS   2           HN       LYS   2  61.683   1.319   5.779
    7    HA   LYS   2           HA       LYS   2  59.544   2.378   4.194
    8    HB2  LYS   2           HB2      LYS   2  60.292  -0.512   4.801
    9    HB3  LYS   2           HB1      LYS   2  59.208   0.022   3.494
   10    HG2  LYS   2           HG2      LYS   2  60.963   1.134   2.327
   11    HG3  LYS   2           HG1      LYS   2  62.039   1.109   3.744
   12    HD2  LYS   2           HD2      LYS   2  62.776  -0.588   2.142
   13    HD3  LYS   2           HD1      LYS   2  62.123  -1.392   3.589
   14    HE2  LYS   2           HE2      LYS   2  60.065  -1.930   2.479
   15    HE3  LYS   2           HE1      LYS   2  60.431  -0.841   1.119
   16    HZ1  LYS   2           HZ1      LYS   2  62.522  -2.369   0.923
   17    HZ2  LYS   2           HZ2      LYS   2  61.037  -2.857   0.260
   18    HZ3  LYS   2           HZ3      LYS   2  61.552  -3.487   1.751
   19    H    GLY   3           HN       GLY   3  57.404   0.965   4.060
   20    HA2  GLY   3           HA1      GLY   3  55.803  -0.245   5.714
   21    HA3  GLY   3           HA2      GLY   3  56.135   1.149   6.843
   22    H    ARG   4           HN       ARG   4  56.465   2.943   6.073
   23    HA   ARG   4           HA       ARG   4  54.149   3.161   6.759
   24    HB2  ARG   4           HB2      ARG   4  55.762   5.534   5.707
   25    HB3  ARG   4           HB1      ARG   4  54.295   5.695   6.706
   26    HG2  ARG   4           HG2      ARG   4  55.343   4.343   8.489
   27    HG3  ARG   4           HG1      ARG   4  56.807   4.150   7.495
   28    HD2  ARG   4           HD2      ARG   4  57.291   6.506   7.594
   29    HD3  ARG   4           HD1      ARG   4  55.698   6.870   8.298
   30    HE   ARG   4           HE       ARG   4  56.619   6.342  10.400
   31   HH11  ARG   4          HH11      ARG   4  57.260   3.488   9.432
   32   HH12  ARG   4          HH12      ARG   4  58.954   3.407   9.786
   33   HH21  ARG   4          HH21      ARG   4  59.304   6.834  10.186
   34   HH22  ARG   4          HH22      ARG   4  60.111   5.301  10.212
   35    H    TRP   5           HN       TRP   5  55.088   2.801   3.742
   36    HA   TRP   5           HA       TRP   5  53.729   4.355   1.888
   37    HB2  TRP   5           HB2      TRP   5  55.077   2.279   1.400
   38    HB3  TRP   5           HB1      TRP   5  53.649   1.313   1.843
   39    HD1  TRP   5           HD1      TRP   5  52.085   0.774  -0.082
   40    HE1  TRP   5           HE1      TRP   5  51.585   1.731  -2.448
   41    HE3  TRP   5           HE3      TRP   5  55.185   4.847   0.026
   42    HZ2  TRP   5           HZ2      TRP   5  52.435   3.970  -4.047
   43    HZ3  TRP   5           HZ3      TRP   5  55.323   6.380  -1.932
   44    HH2  TRP   5           HH2      TRP   5  53.954   5.946  -3.967
   45    H    LEU   6           HN       LEU   6  52.316   2.401   4.372
   46    HA   LEU   6           HA       LEU   6  49.566   2.742   3.191
   47    HB2  LEU   6           HB2      LEU   6  50.354   0.955   5.520
   48    HB3  LEU   6           HB1      LEU   6  48.872   0.903   4.537
   49    HG   LEU   6           HG       LEU   6  51.696   0.288   3.554
   50   HD11  LEU   6          HD11      LEU   6  49.265  -1.499   4.015
   51   HD12  LEU   6          HD12      LEU   6  50.727  -1.454   5.029
   52   HD13  LEU   6          HD13      LEU   6  50.828  -2.022   3.345
   53   HD21  LEU   6          HD21      LEU   6  50.319  -0.556   1.518
   54   HD22  LEU   6          HD22      LEU   6  50.511   1.202   1.690
   55   HD23  LEU   6          HD23      LEU   6  48.984   0.424   2.171
   56    H    GLU   7           HN       GLU   7  51.734   3.623   5.842
   57    HA   GLU   7           HA       GLU   7  49.472   4.700   7.456
   58    HB2  GLU   7           HB2      GLU   7  52.488   4.723   7.884
   59    HB3  GLU   7           HB1      GLU   7  51.280   5.334   9.039
   60    HG2  GLU   7           HG2      GLU   7  51.271   2.486   7.956
   61    HG3  GLU   7           HG1      GLU   7  52.075   2.952   9.474
   62    H    ARG   8           HN       ARG   8  49.920   5.766   4.783
   63    HA   ARG   8           HA       ARG   8  50.228   8.631   5.553
   64    HB2  ARG   8           HB2      ARG   8  51.884   7.210   3.430
   65    HB3  ARG   8           HB1      ARG   8  51.645   8.975   3.449
   66    HG2  ARG   8           HG2      ARG   8  52.556   9.041   5.780
   67    HG3  ARG   8           HG1      ARG   8  52.877   7.293   5.677
   68    HD2  ARG   8           HD2      ARG   8  54.454   7.600   3.881
   69    HD3  ARG   8           HD1      ARG   8  53.985   9.306   3.678
   70    HE   ARG   8           HE       ARG   8  55.843   8.265   5.672
   71   HH11  ARG   8          HH11      ARG   8  54.464   9.445   7.721
   72   HH12  ARG   8          HH12      ARG   8  54.699  11.156   7.584
   73   HH21  ARG   8          HH21      ARG   8  55.739  11.016   4.280
   74   HH22  ARG   8          HH22      ARG   8  55.421  12.044   5.636
   75    H    ILE   9           HN       ILE   9  47.841   8.116   5.272
   76    HA   ILE   9           HA       ILE   9  46.774   7.529   2.688
   77    HB   ILE   9           HB       ILE   9  45.474   7.490   4.846
   78   HG12  ILE   9          HG12      ILE   9  44.339   9.255   2.631
   79   HG13  ILE   9          HG11      ILE   9  44.371   7.476   2.619
   80   HG21  ILE   9          HG21      ILE   9  46.439   9.839   5.517
   81   HG22  ILE   9          HG22      ILE   9  44.747   9.467   5.918
   82   HG23  ILE   9          HG23      ILE   9  45.121  10.491   4.513
   83   HD11  ILE   9           HD1      ILE   9  42.842   9.305   4.512
   84   HD12  ILE   9           HD2      ILE   9  43.078   7.569   4.832
   85   HD13  ILE   9           HD3      ILE   9  42.181   8.096   3.387
   86    H    GLY  10           HN       GLY  10  46.861   8.626   0.860
   87    HA2  GLY  10           HA1      GLY  10  47.906  11.320   0.775
   88    HA3  GLY  10           HA2      GLY  10  47.241  10.397  -0.589
   89    H    LYS  11           HN       LYS  11  44.688   9.889   0.772
   90    HA   LYS  11           HA       LYS  11  43.312  12.273  -0.123
   91    HB2  LYS  11           HB2      LYS  11  42.357   9.890   1.513
   92    HB3  LYS  11           HB1      LYS  11  41.297  11.144   0.826
   93    HG2  LYS  11           HG2      LYS  11  41.926  10.558  -1.430
   94    HG3  LYS  11           HG1      LYS  11  43.234   9.497  -0.852
   95    HD2  LYS  11           HD2      LYS  11  41.566   8.011   0.217
   96    HD3  LYS  11           HD1      LYS  11  40.254   9.068  -0.358
   97    HE2  LYS  11           HE2      LYS  11  41.012   8.664  -2.712
   98    HE3  LYS  11           HE1      LYS  11  42.230   7.522  -2.092
   99    HZ1  LYS  11           HZ1      LYS  11  39.275   7.300  -1.989
  100    HZ2  LYS  11           HZ2      LYS  11  40.276   6.378  -0.972
  101    HZ3  LYS  11           HZ3      LYS  11  40.393   6.215  -2.660
  102    H    ALA  12           HN       ALA  12  43.954  14.076   1.007
  103    HA   ALA  12           HA       ALA  12  44.369  14.258   3.790
  104    HB1  ALA  12           HB1      ALA  12  44.809  15.995   1.962
  105    HB2  ALA  12           HB2      ALA  12  44.199  16.610   3.517
  106    HB3  ALA  12           HB3      ALA  12  43.096  16.452   2.127
  107    H    GLY  13           HN       GLY  13  41.518  13.462   2.166
  108    HA2  GLY  13           HA1      GLY  13  39.371  13.121   2.966
  109    HA3  GLY  13           HA2      GLY  13  39.988  13.425   4.604
  110    H    PHE  14           HN       PHE  14  40.959  15.979   2.783
  111    HA   PHE  14           HA       PHE  14  38.886  17.713   3.945
  112    HB2  PHE  14           HB2      PHE  14  41.559  18.042   3.434
  113    HB3  PHE  14           HB1      PHE  14  40.889  18.827   1.991
  114    HD1  PHE  14           HD1      PHE  14  38.292  19.886   3.251
  115    HD2  PHE  14           HD2      PHE  14  42.385  19.950   4.624
  116    HE1  PHE  14           HE1      PHE  14  37.808  21.919   4.599
  117    HE2  PHE  14           HE2      PHE  14  41.896  21.985   5.973
  118    HZ   PHE  14           HZ       PHE  14  39.625  23.005   5.910
  119    H    ILE  15           HN       ILE  15  40.241  17.505   0.607
  120    HA   ILE  15           HA       ILE  15  37.547  17.234  -0.536
  121    HB   ILE  15           HB       ILE  15  37.770  19.320  -1.965
  122   HG12  ILE  15          HG12      ILE  15  39.898  20.005   0.116
  123   HG13  ILE  15          HG11      ILE  15  40.207  19.647  -1.599
  124   HG21  ILE  15          HG21      ILE  15  36.763  20.759  -0.353
  125   HG22  ILE  15          HG22      ILE  15  37.661  20.023   0.991
  126   HG23  ILE  15          HG23      ILE  15  36.358  19.117   0.189
  127   HD11  ILE  15           HD1      ILE  15  38.756  22.031  -0.399
  128   HD12  ILE  15           HD2      ILE  15  38.547  21.580  -2.110
  129   HD13  ILE  15           HD3      ILE  15  40.157  22.021  -1.493
  130    H    ILE  16           HN       ILE  16  39.778  15.587  -0.620
  131    HA   ILE  16           HA       ILE  16  41.127  16.053  -3.220
  132    HB   ILE  16           HB       ILE  16  41.298  13.960  -1.020
  133   HG12  ILE  16          HG12      ILE  16  43.635  14.677  -0.934
  134   HG13  ILE  16          HG11      ILE  16  43.425  15.662  -2.399
  135   HG21  ILE  16          HG21      ILE  16  41.437  12.554  -2.959
  136   HG22  ILE  16          HG22      ILE  16  43.126  12.878  -2.502
  137   HG23  ILE  16          HG23      ILE  16  42.385  13.761  -3.860
  138   HD11  ILE  16           HD1      ILE  16  41.785  16.114   0.124
  139   HD12  ILE  16           HD2      ILE  16  41.971  17.202  -1.274
  140   HD13  ILE  16           HD3      ILE  16  43.339  16.930  -0.171
  141    H    ILE  17           HN       ILE  17  38.895  13.675  -1.725
  142    HA   ILE  17           HA       ILE  17  38.409  12.340  -4.274
  143    HB   ILE  17           HB       ILE  17  36.859  10.948  -3.121
  144   HG12  ILE  17          HG12      ILE  17  35.431  12.512  -1.974
  145   HG13  ILE  17          HG11      ILE  17  36.131  11.471  -0.726
  146   HG21  ILE  17          HG21      ILE  17  38.167  10.381  -0.967
  147   HG22  ILE  17          HG22      ILE  17  39.236  11.733  -1.396
  148   HG23  ILE  17          HG23      ILE  17  39.064  10.354  -2.498
  149   HD11  ILE  17           HD1      ILE  17  36.216  13.752   0.070
  150   HD12  ILE  17           HD2      ILE  17  36.967  14.316  -1.436
  151   HD13  ILE  17           HD3      ILE  17  37.878  13.270  -0.321
  152    H    GLY  18           HN       GLY  18  37.824  15.337  -3.813
  153    HA2  GLY  18           HA1      GLY  18  35.268  15.290  -5.313
  154    HA3  GLY  18           HA2      GLY  18  35.245  16.129  -3.749
  155    H    GLY  19           HN       GLY  19  37.421  17.555  -3.522
  156    HA2  GLY  19           HA1      GLY  19  37.047  19.737  -5.282
  157    HA3  GLY  19           HA2      GLY  19  38.468  19.486  -4.250
  158    H    ALA  20           HN       ALA  20  39.194  16.937  -5.497
  159    HA   ALA  20           HA       ALA  20  40.860  18.004  -7.600
  160    HB1  ALA  20           HB1      ALA  20  41.373  16.029  -6.102
  161    HB2  ALA  20           HB2      ALA  20  41.675  15.764  -7.836
  162    HB3  ALA  20           HB3      ALA  20  40.217  15.087  -7.071
  163    H    LEU  21           HN       LEU  21  38.410  15.378  -7.792
  164    HA   LEU  21           HA       LEU  21  36.933  14.839  -9.478
  165    HB2  LEU  21           HB2      LEU  21  36.536  17.459  -9.170
  166    HB3  LEU  21           HB1      LEU  21  37.268  17.555 -10.777
  167    HG   LEU  21           HG       LEU  21  34.881  17.433 -11.075
  168   HD11  LEU  21          HD11      LEU  21  36.318  16.063 -12.614
  169   HD12  LEU  21          HD12      LEU  21  34.649  15.470 -12.472
  170   HD13  LEU  21          HD13      LEU  21  35.962  14.634 -11.616
  171   HD21  LEU  21          HD21      LEU  21  34.612  16.229  -8.705
  172   HD22  LEU  21          HD22      LEU  21  34.639  14.744  -9.681
  173   HD23  LEU  21          HD23      LEU  21  33.402  15.980  -9.980
  174    H    ASP  22           HN       ASP  22  38.811  13.454 -10.062
  175    HA   ASP  22           HA       ASP  22  39.353  13.754 -12.930
  176    HB2  ASP  22           HB2      ASP  22  41.586  14.037 -10.882
  177    HB3  ASP  22           HB1      ASP  22  41.878  13.561 -12.572
  178    H    HIS  23           HN       HIS  23  38.021  11.894 -11.097
  179    HA   HIS  23           HA       HIS  23  37.899   9.606 -10.729
  180    HB2  HIS  23           HB2      HIS  23  38.112   9.649 -13.242
  181    HB3  HIS  23           HB1      HIS  23  39.864   9.406 -13.045
  182    HD1  HIS  23           HD1      HIS  23  40.696   7.059 -12.612
  183    HD2  HIS  23           HD2      HIS  23  36.537   7.415 -12.104
  184    HE1  HIS  23           HE1      HIS  23  39.761   4.700 -12.306
  185    H    LEU  24           HN       LEU  24  39.761  11.055  -9.157
  186    HA   LEU  24           HA       LEU  24  41.430   8.822  -8.260
  187    HB2  LEU  24           HB2      LEU  24  42.932   9.608  -9.973
  188    HB3  LEU  24           HB1      LEU  24  42.679  11.302  -9.505
  189    HG   LEU  24           HG       LEU  24  43.860  10.985  -7.413
  190   HD11  LEU  24          HD11      LEU  24  43.721   8.036  -8.152
  191   HD12  LEU  24          HD12      LEU  24  43.159   8.829  -6.662
  192   HD13  LEU  24          HD13      LEU  24  44.900   8.650  -6.970
  193   HD21  LEU  24          HD21      LEU  24  45.356   9.515  -9.628
  194   HD22  LEU  24          HD22      LEU  24  46.085  10.349  -8.235
  195   HD23  LEU  24          HD23      LEU  24  45.227  11.284  -9.484
  Start of MODEL   49
    1    H1   GLY   1           HT1      GLY   1  61.981  -1.331   1.574
    2    H2   GLY   1           HT2      GLY   1  61.820   0.355   1.430
    3    H3   GLY   1           HT3      GLY   1  61.875  -0.621   0.039
    4    HA2  GLY   1           HA1      GLY   1  59.677  -0.187   0.198
    5    HA3  GLY   1           HA2      GLY   1  59.843  -1.755   1.014
    6    H    LYS   2           HN       LYS   2  61.062  -0.845   3.414
    7    HA   LYS   2           HA       LYS   2  58.817  -0.325   5.003
    8    HB2  LYS   2           HB2      LYS   2  60.316   0.104   6.797
    9    HB3  LYS   2           HB1      LYS   2  61.164  -1.037   5.733
   10    HG2  LYS   2           HG2      LYS   2  61.611   1.976   5.948
   11    HG3  LYS   2           HG1      LYS   2  62.744   0.676   6.381
   12    HD2  LYS   2           HD2      LYS   2  62.621  -0.061   3.919
   13    HD3  LYS   2           HD1      LYS   2  61.806   1.489   3.601
   14    HE2  LYS   2           HE2      LYS   2  64.587   1.094   4.782
   15    HE3  LYS   2           HE1      LYS   2  64.184   1.787   3.192
   16    HZ1  LYS   2           HZ1      LYS   2  63.500   2.925   5.858
   17    HZ2  LYS   2           HZ2      LYS   2  62.957   3.553   4.376
   18    HZ3  LYS   2           HZ3      LYS   2  64.615   3.549   4.743
   19    H    GLY   3           HN       GLY   3  58.875   1.747   6.581
   20    HA2  GLY   3           HA1      GLY   3  59.187   4.271   6.454
   21    HA3  GLY   3           HA2      GLY   3  58.632   4.183   4.721
   22    H    ARG   4           HN       ARG   4  57.233   2.874   4.226
   23    HA   ARG   4           HA       ARG   4  55.918   4.904   4.378
   24    HB2  ARG   4           HB2      ARG   4  54.713   2.282   3.371
   25    HB3  ARG   4           HB1      ARG   4  54.051   3.894   3.002
   26    HG2  ARG   4           HG2      ARG   4  56.189   4.568   1.984
   27    HG3  ARG   4           HG1      ARG   4  56.906   2.993   2.404
   28    HD2  ARG   4           HD2      ARG   4  56.224   2.881   0.084
   29    HD3  ARG   4           HD1      ARG   4  55.080   1.895   1.025
   30    HE   ARG   4           HE       ARG   4  53.980   4.495   0.879
   31   HH11  ARG   4          HH11      ARG   4  55.028   4.612  -1.858
   32   HH12  ARG   4          HH12      ARG   4  53.810   3.802  -2.786
   33   HH21  ARG   4          HH21      ARG   4  52.346   2.286  -0.032
   34   HH22  ARG   4          HH22      ARG   4  52.290   2.485  -1.752
   35    H    TRP   5           HN       TRP   5  55.884   2.579   6.560
   36    HA   TRP   5           HA       TRP   5  53.361   2.039   7.617
   37    HB2  TRP   5           HB2      TRP   5  55.499   1.288   8.634
   38    HB3  TRP   5           HB1      TRP   5  55.770   2.936   9.250
   39    HD1  TRP   5           HD1      TRP   5  53.043   0.182   9.449
   40    HE1  TRP   5           HE1      TRP   5  51.939   0.258  11.803
   41    HE3  TRP   5           HE3      TRP   5  55.542   4.211  11.384
   42    HZ2  TRP   5           HZ2      TRP   5  52.136   1.866  14.182
   43    HZ3  TRP   5           HZ3      TRP   5  55.066   4.998  13.698
   44    HH2  TRP   5           HH2      TRP   5  53.369   3.831  15.097
   45    H    LEU   6           HN       LEU   6  54.827   5.127   7.227
   46    HA   LEU   6           HA       LEU   6  52.708   6.420   8.931
   47    HB2  LEU   6           HB2      LEU   6  54.976   6.893   9.726
   48    HB3  LEU   6           HB1      LEU   6  55.474   7.398   8.098
   49    HG   LEU   6           HG       LEU   6  53.913   9.302   8.174
   50   HD11  LEU   6          HD11      LEU   6  53.065   7.998  10.789
   51   HD12  LEU   6          HD12      LEU   6  52.047   8.598   9.457
   52   HD13  LEU   6          HD13      LEU   6  52.855   9.749  10.541
   53   HD21  LEU   6          HD21      LEU   6  55.523   9.118  10.757
   54   HD22  LEU   6          HD22      LEU   6  55.050  10.603   9.895
   55   HD23  LEU   6          HD23      LEU   6  56.219   9.480   9.160
   56    H    GLU   7           HN       GLU   7  54.029   5.984   5.698
   57    HA   GLU   7           HA       GLU   7  52.654   8.423   4.680
   58    HB2  GLU   7           HB2      GLU   7  54.208   6.234   3.246
   59    HB3  GLU   7           HB1      GLU   7  53.602   7.735   2.509
   60    HG2  GLU   7           HG2      GLU   7  55.475   7.689   4.913
   61    HG3  GLU   7           HG1      GLU   7  56.050   7.792   3.231
   62    H    ARG   8           HN       ARG   8  51.320   5.904   5.886
   63    HA   ARG   8           HA       ARG   8  49.861   4.761   3.611
   64    HB2  ARG   8           HB2      ARG   8  50.409   3.607   5.848
   65    HB3  ARG   8           HB1      ARG   8  49.097   4.582   6.549
   66    HG2  ARG   8           HG2      ARG   8  47.538   3.662   4.809
   67    HG3  ARG   8           HG1      ARG   8  48.857   2.617   4.227
   68    HD2  ARG   8           HD2      ARG   8  49.038   1.634   6.528
   69    HD3  ARG   8           HD1      ARG   8  47.630   2.607   7.019
   70    HE   ARG   8           HE       ARG   8  46.866   1.152   4.711
   71   HH11  ARG   8          HH11      ARG   8  47.126   1.002   8.097
   72   HH12  ARG   8          HH12      ARG   8  46.596  -0.641   8.221
   73   HH21  ARG   8          HH21      ARG   8  46.516  -1.157   4.794
   74   HH22  ARG   8          HH22      ARG   8  46.250  -1.864   6.353
   75    H    ILE   9           HN       ILE   9  49.529   7.329   3.165
   76    HA   ILE   9           HA       ILE   9  47.246   8.479   4.571
   77    HB   ILE   9           HB       ILE   9  47.290  10.147   2.662
   78   HG12  ILE   9          HG12      ILE   9  49.984   9.262   1.716
   79   HG13  ILE   9          HG11      ILE   9  48.716   8.091   1.305
   80   HG21  ILE   9          HG21      ILE   9  48.523  10.494   4.770
   81   HG22  ILE   9          HG22      ILE   9  49.437  11.153   3.392
   82   HG23  ILE   9          HG23      ILE   9  49.917   9.600   4.118
   83   HD11  ILE   9           HD1      ILE   9  49.036   9.815  -0.467
   84   HD12  ILE   9           HD2      ILE   9  48.577  11.077   0.702
   85   HD13  ILE   9           HD3      ILE   9  47.393   9.839   0.215
   86    H    GLY  10           HN       GLY  10  45.699   6.759   4.404
   87    HA2  GLY  10           HA1      GLY  10  44.763   5.862   1.810
   88    HA3  GLY  10           HA2      GLY  10  43.968   5.600   3.375
   89    H    LYS  11           HN       LYS  11  44.071   8.571   3.900
   90    HA   LYS  11           HA       LYS  11  41.475   9.165   2.673
   91    HB2  LYS  11           HB2      LYS  11  43.216  11.098   4.241
   92    HB3  LYS  11           HB1      LYS  11  41.444  11.071   4.089
   93    HG2  LYS  11           HG2      LYS  11  43.169   8.999   5.516
   94    HG3  LYS  11           HG1      LYS  11  42.101  10.196   6.285
   95    HD2  LYS  11           HD2      LYS  11  40.191   9.131   4.890
   96    HD3  LYS  11           HD1      LYS  11  41.327   7.795   4.584
   97    HE2  LYS  11           HE2      LYS  11  41.582   7.421   7.003
   98    HE3  LYS  11           HE1      LYS  11  40.502   8.795   7.344
   99    HZ1  LYS  11           HZ1      LYS  11  38.726   7.533   6.978
  100    HZ2  LYS  11           HZ2      LYS  11  39.756   6.181   6.961
  101    HZ3  LYS  11           HZ3      LYS  11  39.330   6.948   5.505
  102    H    ALA  12           HN       ALA  12  41.417   9.684   0.576
  103    HA   ALA  12           HA       ALA  12  43.642  11.108  -0.703
  104    HB1  ALA  12           HB1      ALA  12  42.347   9.418  -1.921
  105    HB2  ALA  12           HB2      ALA  12  42.183  11.012  -2.698
  106    HB3  ALA  12           HB3      ALA  12  40.862  10.371  -1.691
  107    H    GLY  13           HN       GLY  13  43.053  12.722   1.303
  108    HA2  GLY  13           HA1      GLY  13  42.334  14.853   1.857
  109    HA3  GLY  13           HA2      GLY  13  42.425  15.191   0.117
  110    H    PHE  14           HN       PHE  14  40.330  13.008   2.022
  111    HA   PHE  14           HA       PHE  14  38.028  12.859   2.140
  112    HB2  PHE  14           HB2      PHE  14  38.365  15.255   3.000
  113    HB3  PHE  14           HB1      PHE  14  37.917  15.801   1.367
  114    HD1  PHE  14           HD1      PHE  14  35.623  16.021   0.786
  115    HD2  PHE  14           HD2      PHE  14  36.734  13.599   4.183
  116    HE1  PHE  14           HE1      PHE  14  33.219  15.730   1.366
  117    HE2  PHE  14           HE2      PHE  14  34.329  13.309   4.762
  118    HZ   PHE  14           HZ       PHE  14  32.574  14.409   3.378
  119    H    ILE  15           HN       ILE  15  39.183  12.006  -0.193
  120    HA   ILE  15           HA       ILE  15  38.636  11.433  -2.360
  121    HB   ILE  15           HB       ILE  15  35.890  12.654  -1.880
  122   HG12  ILE  15          HG12      ILE  15  36.983   9.927  -1.050
  123   HG13  ILE  15          HG11      ILE  15  36.429  11.218   0.040
  124   HG21  ILE  15          HG21      ILE  15  35.152  11.085  -3.536
  125   HG22  ILE  15          HG22      ILE  15  36.689  10.187  -3.475
  126   HG23  ILE  15          HG23      ILE  15  36.634  11.814  -4.195
  127   HD11  ILE  15           HD1      ILE  15  34.159  11.043  -1.229
  128   HD12  ILE  15           HD2      ILE  15  34.574   9.743  -0.089
  129   HD13  ILE  15           HD3      ILE  15  34.782   9.489  -1.837
  130    H    ILE  16           HN       ILE  16  40.210  13.229  -2.737
  131    HA   ILE  16           HA       ILE  16  38.939  15.232  -4.575
  132    HB   ILE  16           HB       ILE  16  41.087  15.790  -2.477
  133   HG12  ILE  16          HG12      ILE  16  38.544  15.861  -1.873
  134   HG13  ILE  16          HG11      ILE  16  39.554  17.246  -1.423
  135   HG21  ILE  16          HG21      ILE  16  41.806  16.935  -4.456
  136   HG22  ILE  16          HG22      ILE  16  41.001  18.157  -3.447
  137   HG23  ILE  16          HG23      ILE  16  40.149  17.456  -4.845
  138   HD11  ILE  16           HD1      ILE  16  37.946  17.188  -4.014
  139   HD12  ILE  16           HD2      ILE  16  38.702  18.585  -3.223
  140   HD13  ILE  16           HD3      ILE  16  37.289  17.802  -2.484
  141    H    ILE  17           HN       ILE  17  42.194  14.249  -3.380
  142    HA   ILE  17           HA       ILE  17  43.319  14.485  -6.045
  143    HB   ILE  17           HB       ILE  17  44.759  14.755  -4.064
  144   HG12  ILE  17          HG12      ILE  17  46.612  13.285  -4.682
  145   HG13  ILE  17          HG11      ILE  17  45.510  12.160  -5.501
  146   HG21  ILE  17          HG21      ILE  17  43.428  13.119  -2.657
  147   HG22  ILE  17          HG22      ILE  17  45.194  12.948  -2.519
  148   HG23  ILE  17          HG23      ILE  17  44.264  11.802  -3.514
  149   HD11  ILE  17           HD1      ILE  17  46.847  13.906  -6.943
  150   HD12  ILE  17           HD2      ILE  17  45.635  15.072  -6.360
  151   HD13  ILE  17           HD3      ILE  17  45.125  13.647  -7.299
  152    H    GLY  18           HN       GLY  18  41.724  12.001  -4.188
  153    HA2  GLY  18           HA1      GLY  18  42.601   9.805  -5.942
  154    HA3  GLY  18           HA2      GLY  18  41.436   9.714  -4.605
  155    H    GLY  19           HN       GLY  19  39.448  11.350  -5.143
  156    HA2  GLY  19           HA1      GLY  19  38.073  10.030  -7.305
  157    HA3  GLY  19           HA2      GLY  19  37.487  11.424  -6.376
  158    H    ALA  20           HN       ALA  20  39.744  13.133  -6.965
  159    HA   ALA  20           HA       ALA  20  40.322  14.720  -8.548
  160    HB1  ALA  20           HB1      ALA  20  40.941  13.955 -10.721
  161    HB2  ALA  20           HB2      ALA  20  39.835  12.563 -10.622
  162    HB3  ALA  20           HB3      ALA  20  41.290  12.621  -9.598
  163    H    LEU  21           HN       LEU  21  37.741  14.923  -7.687
  164    HA   LEU  21           HA       LEU  21  35.861  14.978  -9.904
  165    HB2  LEU  21           HB2      LEU  21  35.061  14.713  -7.619
  166    HB3  LEU  21           HB1      LEU  21  35.818  16.243  -7.132
  167    HG   LEU  21           HG       LEU  21  34.296  17.513  -8.573
  168   HD11  LEU  21          HD11      LEU  21  33.919  16.151 -10.483
  169   HD12  LEU  21          HD12      LEU  21  32.351  16.128  -9.650
  170   HD13  LEU  21          HD13      LEU  21  33.455  14.740  -9.503
  171   HD21  LEU  21          HD21      LEU  21  32.188  17.031  -7.410
  172   HD22  LEU  21          HD22      LEU  21  33.552  16.839  -6.282
  173   HD23  LEU  21          HD23      LEU  21  32.768  15.403  -6.985
  174    H    ASP  22           HN       ASP  22  38.071  17.273  -8.361
  175    HA   ASP  22           HA       ASP  22  37.020  19.577  -9.846
  176    HB2  ASP  22           HB2      ASP  22  38.078  19.799  -7.608
  177    HB3  ASP  22           HB1      ASP  22  39.621  19.242  -8.299
  178    H    HIS  23           HN       HIS  23  37.565  17.509 -11.635
  179    HA   HIS  23           HA       HIS  23  38.763  17.040 -13.570
  180    HB2  HIS  23           HB2      HIS  23  39.417  20.008 -13.371
  181    HB3  HIS  23           HB1      HIS  23  39.567  19.002 -14.831
  182    HD1  HIS  23           HD1      HIS  23  37.256  21.229 -13.160
  183    HD2  HIS  23           HD2      HIS  23  36.887  17.771 -15.525
  184    HE1  HIS  23           HE1      HIS  23  34.839  21.122 -13.980
  185    H    LEU  24           HN       LEU  24  40.177  17.177 -10.802
  186    HA   LEU  24           HA       LEU  24  42.775  16.384 -11.824
  187    HB2  LEU  24           HB2      LEU  24  42.893  18.930 -11.886
  188    HB3  LEU  24           HB1      LEU  24  42.716  18.898 -10.120
  189    HG   LEU  24           HG       LEU  24  44.756  17.231 -10.169
  190   HD11  LEU  24          HD11      LEU  24  46.330  17.805 -12.093
  191   HD12  LEU  24          HD12      LEU  24  44.940  18.539 -12.922
  192   HD13  LEU  24          HD13      LEU  24  44.937  16.801 -12.544
  193   HD21  LEU  24          HD21      LEU  24  45.110  20.179 -10.880
  194   HD22  LEU  24          HD22      LEU  24  46.338  19.141 -10.118
  195   HD23  LEU  24          HD23      LEU  24  44.835  19.528  -9.246
  Start of MODEL   50
    1    H1   GLY   1           HT1      GLY   1  60.757  -1.661   4.216
    2    H2   GLY   1           HT2      GLY   1  60.151  -2.546   5.534
    3    H3   GLY   1           HT3      GLY   1  59.462  -1.048   5.122
    4    HA2  GLY   1           HA1      GLY   1  59.484  -2.884   2.957
    5    HA3  GLY   1           HA2      GLY   1  58.587  -3.479   4.367
    6    H    LYS   2           HN       LYS   2  57.212  -1.639   5.446
    7    HA   LYS   2           HA       LYS   2  55.930   0.058   3.326
    8    HB2  LYS   2           HB2      LYS   2  54.329  -1.655   5.263
    9    HB3  LYS   2           HB1      LYS   2  53.722  -0.683   3.905
   10    HG2  LYS   2           HG2      LYS   2  53.744  -2.763   2.857
   11    HG3  LYS   2           HG1      LYS   2  55.405  -2.254   2.492
   12    HD2  LYS   2           HD2      LYS   2  55.871  -4.358   3.380
   13    HD3  LYS   2           HD1      LYS   2  55.886  -3.432   4.896
   14    HE2  LYS   2           HE2      LYS   2  53.609  -5.108   3.758
   15    HE3  LYS   2           HE1      LYS   2  54.506  -5.373   5.272
   16    HZ1  LYS   2           HZ1      LYS   2  52.430  -4.359   5.793
   17    HZ2  LYS   2           HZ2      LYS   2  52.656  -3.129   4.644
   18    HZ3  LYS   2           HZ3      LYS   2  53.635  -3.190   6.031
   19    H    GLY   3           HN       GLY   3  53.698   0.531   5.271
   20    HA2  GLY   3           HA1      GLY   3  53.567   1.607   7.535
   21    HA3  GLY   3           HA2      GLY   3  55.225   2.314   7.260
   22    H    ARG   4           HN       ARG   4  55.708   2.934   5.440
   23    HA   ARG   4           HA       ARG   4  55.171   5.041   6.512
   24    HB2  ARG   4           HB2      ARG   4  56.341   4.938   3.691
   25    HB3  ARG   4           HB1      ARG   4  56.441   6.351   4.771
   26    HG2  ARG   4           HG2      ARG   4  57.678   5.092   6.429
   27    HG3  ARG   4           HG1      ARG   4  57.407   3.568   5.554
   28    HD2  ARG   4           HD2      ARG   4  59.693   4.470   5.149
   29    HD3  ARG   4           HD1      ARG   4  58.735   4.397   3.651
   30    HE   ARG   4           HE       ARG   4  58.391   6.981   4.823
   31   HH11  ARG   4          HH11      ARG   4  60.659   4.960   3.196
   32   HH12  ARG   4          HH12      ARG   4  61.604   6.280   2.590
   33   HH21  ARG   4          HH21      ARG   4  59.651   8.715   4.102
   34   HH22  ARG   4          HH22      ARG   4  61.033   8.407   3.103
   35    H    TRP   5           HN       TRP   5  53.283   3.575   4.410
   36    HA   TRP   5           HA       TRP   5  52.026   5.308   2.614
   37    HB2  TRP   5           HB2      TRP   5  51.359   2.950   2.981
   38    HB3  TRP   5           HB1      TRP   5  50.623   3.414   4.534
   39    HD1  TRP   5           HD1      TRP   5  50.388   4.680   0.864
   40    HE1  TRP   5           HE1      TRP   5  47.899   5.181   0.308
   41    HE3  TRP   5           HE3      TRP   5  48.297   3.479   5.380
   42    HZ2  TRP   5           HZ2      TRP   5  45.362   5.066   1.666
   43    HZ3  TRP   5           HZ3      TRP   5  45.839   3.683   5.727
   44    HH2  TRP   5           HH2      TRP   5  44.371   4.473   3.877
   45    H    LEU   6           HN       LEU   6  52.176   5.552   6.052
   46    HA   LEU   6           HA       LEU   6  50.019   7.636   6.111
   47    HB2  LEU   6           HB2      LEU   6  49.739   5.831   7.732
   48    HB3  LEU   6           HB1      LEU   6  51.400   6.054   8.320
   49    HG   LEU   6           HG       LEU   6  50.842   8.291   9.172
   50   HD11  LEU   6          HD11      LEU   6  48.202   7.756   7.759
   51   HD12  LEU   6          HD12      LEU   6  49.242   9.198   7.673
   52   HD13  LEU   6          HD13      LEU   6  48.284   8.883   9.135
   53   HD21  LEU   6          HD21      LEU   6  50.375   6.262  10.564
   54   HD22  LEU   6          HD22      LEU   6  48.703   6.264   9.954
   55   HD23  LEU   6          HD23      LEU   6  49.290   7.621  10.944
   56    H    GLU   7           HN       GLU   7  53.499   7.090   6.329
   57    HA   GLU   7           HA       GLU   7  54.347   9.255   7.886
   58    HB2  GLU   7           HB2      GLU   7  55.798   7.560   6.701
   59    HB3  GLU   7           HB1      GLU   7  55.561   8.497   5.206
   60    HG2  GLU   7           HG2      GLU   7  56.512  10.501   6.297
   61    HG3  GLU   7           HG1      GLU   7  56.733   9.582   7.805
   62    H    ARG   8           HN       ARG   8  53.060   9.275   4.581
   63    HA   ARG   8           HA       ARG   8  53.643  12.112   4.163
   64    HB2  ARG   8           HB2      ARG   8  51.665  10.356   2.664
   65    HB3  ARG   8           HB1      ARG   8  52.450  11.847   2.089
   66    HG2  ARG   8           HG2      ARG   8  54.683  10.672   2.377
   67    HG3  ARG   8           HG1      ARG   8  53.777   9.171   2.685
   68    HD2  ARG   8           HD2      ARG   8  52.702   9.322   0.487
   69    HD3  ARG   8           HD1      ARG   8  53.496  10.885   0.178
   70    HE   ARG   8           HE       ARG   8  55.472   9.702  -0.359
   71   HH11  ARG   8          HH11      ARG   8  54.245   7.399  -1.447
   72   HH12  ARG   8          HH12      ARG   8  54.723   6.092  -0.415
   73   HH21  ARG   8          HH21      ARG   8  55.668   8.156   2.207
   74   HH22  ARG   8          HH22      ARG   8  55.527   6.521   1.654
   75    H    ILE   9           HN       ILE   9  50.539  10.299   4.337
   76    HA   ILE   9           HA       ILE   9  49.395  12.119   6.272
   77    HB   ILE   9           HB       ILE   9  49.404  13.639   4.279
   78   HG12  ILE   9          HG12      ILE   9  46.616  12.679   5.082
   79   HG13  ILE   9          HG11      ILE   9  47.642  13.741   6.074
   80   HG21  ILE   9          HG21      ILE   9  49.116  11.677   2.638
   81   HG22  ILE   9          HG22      ILE   9  48.140  13.127   2.309
   82   HG23  ILE   9          HG23      ILE   9  47.389  11.702   3.069
   83   HD11  ILE   9           HD1      ILE   9  46.395  14.322   3.362
   84   HD12  ILE   9           HD2      ILE   9  47.742  15.295   4.004
   85   HD13  ILE   9           HD3      ILE   9  46.198  15.219   4.885
   86    H    GLY  10           HN       GLY  10  48.848   9.879   3.555
   87    HA2  GLY  10           HA1      GLY  10  47.627   7.894   3.562
   88    HA3  GLY  10           HA2      GLY  10  47.222   8.160   5.270
   89    H    LYS  11           HN       LYS  11  45.931  10.541   5.289
   90    HA   LYS  11           HA       LYS  11  43.367   9.807   4.043
   91    HB2  LYS  11           HB2      LYS  11  44.278  12.098   5.826
   92    HB3  LYS  11           HB1      LYS  11  42.620  11.956   5.192
   93    HG2  LYS  11           HG2      LYS  11  42.261   9.872   6.333
   94    HG3  LYS  11           HG1      LYS  11  43.987   9.717   6.736
   95    HD2  LYS  11           HD2      LYS  11  42.705  10.479   8.704
   96    HD3  LYS  11           HD1      LYS  11  43.831  11.746   8.164
   97    HE2  LYS  11           HE2      LYS  11  42.093  13.053   7.213
   98    HE3  LYS  11           HE1      LYS  11  40.954  11.684   7.181
   99    HZ1  LYS  11           HZ1      LYS  11  42.030  12.512   9.778
  100    HZ2  LYS  11           HZ2      LYS  11  40.496  11.899   9.380
  101    HZ3  LYS  11           HZ3      LYS  11  40.878  13.523   9.052
  102    H    ALA  12           HN       ALA  12  43.517  10.043   1.833
  103    HA   ALA  12           HA       ALA  12  44.667  12.477   0.665
  104    HB1  ALA  12           HB1      ALA  12  43.735  11.479  -1.458
  105    HB2  ALA  12           HB2      ALA  12  43.113  10.133  -0.475
  106    HB3  ALA  12           HB3      ALA  12  44.866  10.428  -0.575
  107    H    GLY  13           HN       GLY  13  42.800  13.267   2.501
  108    HA2  GLY  13           HA1      GLY  13  40.899  14.567   2.725
  109    HA3  GLY  13           HA2      GLY  13  41.152  15.009   1.024
  110    H    PHE  14           HN       PHE  14  40.206  12.008   2.754
  111    HA   PHE  14           HA       PHE  14  38.459  10.543   2.344
  112    HB2  PHE  14           HB2      PHE  14  37.040  13.098   1.486
  113    HB3  PHE  14           HB1      PHE  14  36.252  11.550   1.871
  114    HD1  PHE  14           HD1      PHE  14  37.981  14.508   3.240
  115    HD2  PHE  14           HD2      PHE  14  36.259  10.663   4.183
  116    HE1  PHE  14           HE1      PHE  14  37.997  15.094   5.660
  117    HE2  PHE  14           HE2      PHE  14  36.276  11.250   6.605
  118    HZ   PHE  14           HZ       PHE  14  37.232  13.429   7.348
  119    H    ILE  15           HN       ILE  15  40.330  10.474   0.386
  120    HA   ILE  15           HA       ILE  15  40.643   9.769  -1.790
  121    HB   ILE  15           HB       ILE  15  37.629   9.392  -1.989
  122   HG12  ILE  15          HG12      ILE  15  39.725   7.583  -0.701
  123   HG13  ILE  15          HG11      ILE  15  38.386   8.401   0.135
  124   HG21  ILE  15          HG21      ILE  15  39.899   7.722  -3.139
  125   HG22  ILE  15          HG22      ILE  15  39.188   9.101  -4.008
  126   HG23  ILE  15          HG23      ILE  15  38.178   7.698  -3.594
  127   HD11  ILE  15           HD1      ILE  15  37.575   6.199  -0.213
  128   HD12  ILE  15           HD2      ILE  15  38.259   6.109  -1.852
  129   HD13  ILE  15           HD3      ILE  15  36.834   7.130  -1.536
  130    H    ILE  16           HN       ILE  16  41.122  12.148  -2.020
  131    HA   ILE  16           HA       ILE  16  39.419  13.228  -4.243
  132    HB   ILE  16           HB       ILE  16  40.409  14.764  -1.795
  133   HG12  ILE  16          HG12      ILE  16  38.118  13.496  -1.823
  134   HG13  ILE  16          HG11      ILE  16  38.146  15.180  -1.273
  135   HG21  ILE  16          HG21      ILE  16  39.367  16.780  -3.003
  136   HG22  ILE  16          HG22      ILE  16  39.428  15.793  -4.483
  137   HG23  ILE  16          HG23      ILE  16  40.929  16.203  -3.622
  138   HD11  ILE  16           HD1      ILE  16  36.264  14.515  -2.907
  139   HD12  ILE  16           HD2      ILE  16  37.510  14.461  -4.167
  140   HD13  ILE  16           HD3      ILE  16  37.184  15.979  -3.307
  141    H    ILE  17           HN       ILE  17  42.343  14.229  -2.384
  142    HA   ILE  17           HA       ILE  17  43.678  15.041  -4.816
  143    HB   ILE  17           HB       ILE  17  44.314  16.039  -2.658
  144   HG12  ILE  17          HG12      ILE  17  46.747  15.831  -2.788
  145   HG13  ILE  17          HG11      ILE  17  46.617  14.295  -3.667
  146   HG21  ILE  17          HG21      ILE  17  45.351  14.743  -0.890
  147   HG22  ILE  17          HG22      ILE  17  45.364  13.281  -1.905
  148   HG23  ILE  17          HG23      ILE  17  43.820  13.954  -1.331
  149   HD11  ILE  17           HD1      ILE  17  45.855  15.347  -5.645
  150   HD12  ILE  17           HD2      ILE  17  47.060  16.499  -5.027
  151   HD13  ILE  17           HD3      ILE  17  45.325  16.810  -4.780
  152    H    GLY  18           HN       GLY  18  43.248  12.057  -3.122
  153    HA2  GLY  18           HA1      GLY  18  45.540  10.718  -4.423
  154    HA3  GLY  18           HA2      GLY  18  44.351   9.991  -3.322
  155    H    GLY  19           HN       GLY  19  41.980  10.180  -4.324
  156    HA2  GLY  19           HA1      GLY  19  42.024   8.420  -6.598
  157    HA3  GLY  19           HA2      GLY  19  40.594   9.211  -5.907
  158    H    ALA  20           HN       ALA  20  41.706  11.919  -6.229
  159    HA   ALA  20           HA       ALA  20  41.533  13.598  -7.820
  160    HB1  ALA  20           HB1      ALA  20  43.707  12.640  -8.494
  161    HB2  ALA  20           HB2      ALA  20  42.804  13.269  -9.892
  162    HB3  ALA  20           HB3      ALA  20  42.868  11.516  -9.588
  163    H    LEU  21           HN       LEU  21  39.146  12.619  -7.497
  164    HA   LEU  21           HA       LEU  21  37.893  11.271  -9.658
  165    HB2  LEU  21           HB2      LEU  21  36.574  13.478  -8.039
  166    HB3  LEU  21           HB1      LEU  21  35.824  12.031  -8.751
  167    HG   LEU  21           HG       LEU  21  37.788  12.125  -6.419
  168   HD11  LEU  21          HD11      LEU  21  35.375  12.702  -5.985
  169   HD12  LEU  21          HD12      LEU  21  35.917  11.233  -5.140
  170   HD13  LEU  21          HD13      LEU  21  34.925  11.098  -6.611
  171   HD21  LEU  21          HD21      LEU  21  38.385  10.155  -7.643
  172   HD22  LEU  21          HD22      LEU  21  36.691   9.800  -8.056
  173   HD23  LEU  21          HD23      LEU  21  37.267   9.586  -6.384
  174    H    ASP  22           HN       ASP  22  38.693  11.988 -11.639
  175    HA   ASP  22           HA       ASP  22  38.772  13.348 -13.515
  176    HB2  ASP  22           HB2      ASP  22  36.267  14.639 -12.371
  177    HB3  ASP  22           HB1      ASP  22  36.750  14.528 -14.080
  178    H    HIS  23           HN       HIS  23  37.346  16.149 -13.233
  179    HA   HIS  23           HA       HIS  23  39.835  17.581 -12.683
  180    HB2  HIS  23           HB2      HIS  23  36.997  18.501 -13.277
  181    HB3  HIS  23           HB1      HIS  23  38.376  19.608 -13.069
  182    HD1  HIS  23           HD1      HIS  23  36.546  18.020 -15.676
  183    HD2  HIS  23           HD2      HIS  23  40.652  18.560 -14.930
  184    HE1  HIS  23           HE1      HIS  23  37.772  17.718 -17.899
  185    H    LEU  24           HN       LEU  24  38.365  15.991 -10.507
  186    HA   LEU  24           HA       LEU  24  38.915  17.877  -8.382
  187    HB2  LEU  24           HB2      LEU  24  36.780  18.851  -8.934
  188    HB3  LEU  24           HB1      LEU  24  36.013  17.253  -9.053
  189    HG   LEU  24           HG       LEU  24  36.200  16.897  -6.664
  190   HD11  LEU  24          HD11      LEU  24  38.345  17.777  -6.099
  191   HD12  LEU  24          HD12      LEU  24  37.194  18.826  -5.242
  192   HD13  LEU  24          HD13      LEU  24  37.952  19.384  -6.754
  193   HD21  LEU  24          HD21      LEU  24  35.336  19.766  -7.245
  194   HD22  LEU  24          HD22      LEU  24  34.884  18.822  -5.804
  195   HD23  LEU  24          HD23      LEU  24  34.319  18.315  -7.415
  Start of MODEL   51
    1    H1   GLY   1           HT1      GLY   1  64.032   3.573   7.992
    2    H2   GLY   1           HT2      GLY   1  63.104   4.419   6.847
    3    H3   GLY   1           HT3      GLY   1  63.069   2.721   6.888
    4    HA2  GLY   1           HA1      GLY   1  62.270   3.023   9.272
    5    HA3  GLY   1           HA2      GLY   1  61.872   4.661   8.714
    6    H    LYS   2           HN       LYS   2  60.530   1.786   9.313
    7    HA   LYS   2           HA       LYS   2  58.964   1.397   6.869
    8    HB2  LYS   2           HB2      LYS   2  58.868   0.267   9.687
    9    HB3  LYS   2           HB1      LYS   2  57.594  -0.105   8.502
   10    HG2  LYS   2           HG2      LYS   2  59.428  -1.819   8.556
   11    HG3  LYS   2           HG1      LYS   2  59.225  -1.058   6.961
   12    HD2  LYS   2           HD2      LYS   2  61.164   0.307   7.238
   13    HD3  LYS   2           HD1      LYS   2  61.239  -0.010   8.989
   14    HE2  LYS   2           HE2      LYS   2  61.579  -2.171   6.867
   15    HE3  LYS   2           HE1      LYS   2  62.939  -1.296   7.609
   16    HZ1  LYS   2           HZ1      LYS   2  61.971  -2.014   9.805
   17    HZ2  LYS   2           HZ2      LYS   2  62.644  -3.254   8.858
   18    HZ3  LYS   2           HZ3      LYS   2  60.957  -3.063   8.940
   19    H    GLY   3           HN       GLY   3  58.905   4.102   7.896
   20    HA2  GLY   3           HA1      GLY   3  56.686   4.895   9.416
   21    HA3  GLY   3           HA2      GLY   3  57.157   5.768   7.886
   22    H    ARG   4           HN       ARG   4  57.163   4.757   6.180
   23    HA   ARG   4           HA       ARG   4  55.060   5.951   5.998
   24    HB2  ARG   4           HB2      ARG   4  56.201   4.298   3.694
   25    HB3  ARG   4           HB1      ARG   4  54.998   5.595   3.481
   26    HG2  ARG   4           HG2      ARG   4  56.501   7.249   4.402
   27    HG3  ARG   4           HG1      ARG   4  57.653   5.996   4.923
   28    HD2  ARG   4           HD2      ARG   4  58.002   5.360   2.532
   29    HD3  ARG   4           HD1      ARG   4  56.915   6.683   2.045
   30    HE   ARG   4           HE       ARG   4  58.827   7.932   3.630
   31   HH11  ARG   4          HH11      ARG   4  58.555   6.297   0.630
   32   HH12  ARG   4          HH12      ARG   4  60.129   6.757   0.074
   33   HH21  ARG   4          HH21      ARG   4  60.999   8.348   3.030
   34   HH22  ARG   4          HH22      ARG   4  61.514   7.918   1.433
   35    H    TRP   5           HN       TRP   5  55.298   2.852   6.669
   36    HA   TRP   5           HA       TRP   5  53.452   1.205   5.432
   37    HB2  TRP   5           HB2      TRP   5  54.780   0.638   7.481
   38    HB3  TRP   5           HB1      TRP   5  53.596   1.545   8.453
   39    HD1  TRP   5           HD1      TRP   5  51.137   0.548   8.650
   40    HE1  TRP   5           HE1      TRP   5  50.171  -1.844   8.312
   41    HE3  TRP   5           HE3      TRP   5  55.040  -1.543   6.083
   42    HZ2  TRP   5           HZ2      TRP   5  51.009  -4.310   7.086
   43    HZ3  TRP   5           HZ3      TRP   5  54.937  -3.917   5.338
   44    HH2  TRP   5           HH2      TRP   5  52.926  -5.301   5.837
   45    H    LEU   6           HN       LEU   6  52.752   4.167   7.077
   46    HA   LEU   6           HA       LEU   6  49.793   3.642   6.838
   47    HB2  LEU   6           HB2      LEU   6  50.844   4.026   9.183
   48    HB3  LEU   6           HB1      LEU   6  51.087   5.704   8.653
   49    HG   LEU   6           HG       LEU   6  48.501   5.553   7.981
   50   HD11  LEU   6          HD11      LEU   6  47.239   4.127   9.606
   51   HD12  LEU   6          HD12      LEU   6  48.775   3.403  10.132
   52   HD13  LEU   6          HD13      LEU   6  48.200   3.160   8.467
   53   HD21  LEU   6          HD21      LEU   6  47.904   6.295  10.314
   54   HD22  LEU   6          HD22      LEU   6  49.346   7.106   9.660
   55   HD23  LEU   6          HD23      LEU   6  49.526   5.790  10.844
   56    H    GLU   7           HN       GLU   7  52.537   5.576   5.839
   57    HA   GLU   7           HA       GLU   7  50.800   7.810   4.916
   58    HB2  GLU   7           HB2      GLU   7  53.779   7.340   4.511
   59    HB3  GLU   7           HB1      GLU   7  52.887   8.851   4.221
   60    HG2  GLU   7           HG2      GLU   7  52.319   9.012   6.603
   61    HG3  GLU   7           HG1      GLU   7  53.107   7.447   6.921
   62    H    ARG   8           HN       ARG   8  50.602   4.970   3.867
   63    HA   ARG   8           HA       ARG   8  51.648   5.094   1.139
   64    HB2  ARG   8           HB2      ARG   8  49.464   3.278   2.216
   65    HB3  ARG   8           HB1      ARG   8  50.519   3.002   0.811
   66    HG2  ARG   8           HG2      ARG   8  52.498   3.135   2.460
   67    HG3  ARG   8           HG1      ARG   8  51.285   3.019   3.758
   68    HD2  ARG   8           HD2      ARG   8  52.007   0.772   3.346
   69    HD3  ARG   8           HD1      ARG   8  50.416   0.914   2.558
   70    HE   ARG   8           HE       ARG   8  52.612   1.548   0.746
   71   HH11  ARG   8          HH11      ARG   8  50.889  -0.991   2.319
   72   HH12  ARG   8          HH12      ARG   8  51.109  -2.121   1.025
   73   HH21  ARG   8          HH21      ARG   8  52.851   0.107  -0.980
   74   HH22  ARG   8          HH22      ARG   8  52.219  -1.500  -0.841
   75    H    ILE   9           HN       ILE   9  48.280   4.908   2.401
   76    HA   ILE   9           HA       ILE   9  46.977   5.565   0.015
   77    HB   ILE   9           HB       ILE   9  45.747   4.849   2.001
   78   HG12  ILE   9          HG12      ILE   9  44.883   7.683   1.247
   79   HG13  ILE   9          HG11      ILE   9  44.615   6.248   0.228
   80   HG21  ILE   9          HG21      ILE   9  47.279   6.305   3.561
   81   HG22  ILE   9          HG22      ILE   9  45.575   6.071   4.009
   82   HG23  ILE   9          HG23      ILE   9  46.092   7.595   3.257
   83   HD11  ILE   9           HD1      ILE   9  43.416   5.185   2.199
   84   HD12  ILE   9           HD2      ILE   9  42.599   6.611   1.515
   85   HD13  ILE   9           HD3      ILE   9  43.525   6.756   3.027
   86    H    GLY  10           HN       GLY  10  47.443   7.157  -1.329
   87    HA2  GLY  10           HA1      GLY  10  48.557   9.683  -0.411
   88    HA3  GLY  10           HA2      GLY  10  48.078   9.270  -2.069
   89    H    LYS  11           HN       LYS  11  45.336   8.478  -1.136
   90    HA   LYS  11           HA       LYS  11  44.030  10.936  -1.653
   91    HB2  LYS  11           HB2      LYS  11  43.132   8.365  -0.306
   92    HB3  LYS  11           HB1      LYS  11  42.025   9.751  -0.465
   93    HG2  LYS  11           HG2      LYS  11  41.798   8.119  -2.346
   94    HG3  LYS  11           HG1      LYS  11  42.291   9.736  -2.901
   95    HD2  LYS  11           HD2      LYS  11  44.564   9.050  -3.217
   96    HD3  LYS  11           HD1      LYS  11  44.312   7.538  -2.310
   97    HE2  LYS  11           HE2      LYS  11  44.361   7.138  -4.765
   98    HE3  LYS  11           HE1      LYS  11  42.776   6.727  -4.066
   99    HZ1  LYS  11           HZ1      LYS  11  41.946   8.085  -5.605
  100    HZ2  LYS  11           HZ2      LYS  11  43.462   8.749  -5.986
  101    HZ3  LYS  11           HZ3      LYS  11  42.560   9.372  -4.689
  102    H    ALA  12           HN       ALA  12  44.223  12.746  -0.508
  103    HA   ALA  12           HA       ALA  12  44.933  12.709   2.303
  104    HB1  ALA  12           HB1      ALA  12  45.619  14.528   0.847
  105    HB2  ALA  12           HB2      ALA  12  44.568  15.162   2.140
  106    HB3  ALA  12           HB3      ALA  12  43.920  14.929   0.498
  107    H    GLY  13           HN       GLY  13  42.169  11.777   0.886
  108    HA2  GLY  13           HA1      GLY  13  39.910  11.827   1.465
  109    HA3  GLY  13           HA2      GLY  13  40.578  11.479   3.070
  110    H    PHE  14           HN       PHE  14  40.895  14.500   1.213
  111    HA   PHE  14           HA       PHE  14  38.777  15.853   2.655
  112    HB2  PHE  14           HB2      PHE  14  40.589  15.537   4.442
  113    HB3  PHE  14           HB1      PHE  14  41.586  16.663   3.492
  114    HD1  PHE  14           HD1      PHE  14  38.074  16.366   4.856
  115    HD2  PHE  14           HD2      PHE  14  41.413  18.970   3.999
  116    HE1  PHE  14           HE1      PHE  14  36.848  18.279   5.877
  117    HE2  PHE  14           HE2      PHE  14  40.183  20.878   5.020
  118    HZ   PHE  14           HZ       PHE  14  37.874  20.549   5.893
  119    H    ILE  15           HN       ILE  15  41.471  15.713   0.503
  120    HA   ILE  15           HA       ILE  15  40.397  18.034  -0.988
  121    HB   ILE  15           HB       ILE  15  42.714  19.036  -1.234
  122   HG12  ILE  15          HG12      ILE  15  43.271  17.165   1.116
  123   HG13  ILE  15          HG11      ILE  15  44.014  17.081  -0.498
  124   HG21  ILE  15          HG21      ILE  15  41.763  19.020   1.659
  125   HG22  ILE  15          HG22      ILE  15  40.894  19.881   0.367
  126   HG23  ILE  15          HG23      ILE  15  42.561  20.343   0.777
  127   HD11  ILE  15           HD1      ILE  15  44.408  19.176   1.661
  128   HD12  ILE  15           HD2      ILE  15  44.781  19.539  -0.042
  129   HD13  ILE  15           HD3      ILE  15  45.636  18.223   0.797
  130    H    ILE  16           HN       ILE  16  40.161  15.433  -1.640
  131    HA   ILE  16           HA       ILE  16  41.867  15.296  -4.073
  132    HB   ILE  16           HB       ILE  16  42.972  13.932  -2.233
  133   HG12  ILE  16          HG12      ILE  16  43.128  11.819  -3.662
  134   HG13  ILE  16          HG11      ILE  16  41.870  12.513  -4.707
  135   HG21  ILE  16          HG21      ILE  16  41.925  11.956  -1.392
  136   HG22  ILE  16          HG22      ILE  16  40.607  12.055  -2.583
  137   HG23  ILE  16          HG23      ILE  16  40.700  13.236  -1.255
  138   HD11  ILE  16           HD1      ILE  16  44.448  12.858  -5.294
  139   HD12  ILE  16           HD2      ILE  16  44.340  14.170  -4.100
  140   HD13  ILE  16           HD3      ILE  16  43.295  14.187  -5.541
  141    H    ILE  17           HN       ILE  17  39.117  14.177  -2.139
  142    HA   ILE  17           HA       ILE  17  37.861  12.844  -4.462
  143    HB   ILE  17           HB       ILE  17  35.844  12.797  -2.711
  144   HG12  ILE  17          HG12      ILE  17  36.566  12.926  -0.381
  145   HG13  ILE  17          HG11      ILE  17  38.235  13.281  -0.874
  146   HG21  ILE  17          HG21      ILE  17  36.785  10.772  -1.685
  147   HG22  ILE  17          HG22      ILE  17  38.421  11.250  -2.196
  148   HG23  ILE  17          HG23      ILE  17  37.195  10.828  -3.415
  149   HD11  ILE  17           HD1      ILE  17  36.782  15.288  -0.160
  150   HD12  ILE  17           HD2      ILE  17  35.898  15.053  -1.685
  151   HD13  ILE  17           HD3      ILE  17  37.637  15.442  -1.710
  152    H    GLY  18           HN       GLY  18  38.421  15.961  -3.787
  153    HA2  GLY  18           HA1      GLY  18  36.211  16.863  -5.465
  154    HA3  GLY  18           HA2      GLY  18  36.055  17.393  -3.778
  155    H    GLY  19           HN       GLY  19  38.928  17.586  -3.314
  156    HA2  GLY  19           HA1      GLY  19  39.309  20.304  -4.037
  157    HA3  GLY  19           HA2      GLY  19  40.578  19.196  -3.476
  158    H    ALA  20           HN       ALA  20  40.528  17.297  -5.533
  159    HA   ALA  20           HA       ALA  20  42.177  18.625  -7.480
  160    HB1  ALA  20           HB1      ALA  20  42.304  16.488  -8.561
  161    HB2  ALA  20           HB2      ALA  20  40.805  15.935  -7.775
  162    HB3  ALA  20           HB3      ALA  20  42.277  16.192  -6.808
  163    H    LEU  21           HN       LEU  21  38.876  17.220  -7.694
  164    HA   LEU  21           HA       LEU  21  37.180  17.622  -9.220
  165    HB2  LEU  21           HB2      LEU  21  37.503  19.935  -8.190
  166    HB3  LEU  21           HB1      LEU  21  38.498  20.333  -9.607
  167    HG   LEU  21           HG       LEU  21  36.418  19.504 -11.009
  168   HD11  LEU  21          HD11      LEU  21  35.055  18.551  -9.241
  169   HD12  LEU  21          HD12      LEU  21  34.251  20.036  -9.787
  170   HD13  LEU  21          HD13      LEU  21  35.176  20.036  -8.270
  171   HD21  LEU  21          HD21      LEU  21  37.212  21.849 -10.915
  172   HD22  LEU  21          HD22      LEU  21  36.314  22.096  -9.397
  173   HD23  LEU  21          HD23      LEU  21  35.434  21.779 -10.911
  174    H    ASP  22           HN       ASP  22  37.535  16.224 -10.877
  175    HA   ASP  22           HA       ASP  22  38.470  17.378 -13.388
  176    HB2  ASP  22           HB2      ASP  22  40.634  16.790 -12.224
  177    HB3  ASP  22           HB1      ASP  22  40.109  15.090 -12.232
  178    H    HIS  23           HN       HIS  23  37.589  14.519 -11.465
  179    HA   HIS  23           HA       HIS  23  35.598  13.730 -13.412
  180    HB2  HIS  23           HB2      HIS  23  36.633  11.545 -14.042
  181    HB3  HIS  23           HB1      HIS  23  37.517  12.946 -14.695
  182    HD1  HIS  23           HD1      HIS  23  37.612  10.911 -11.417
  183    HD2  HIS  23           HD2      HIS  23  40.211  12.586 -14.268
  184    HE1  HIS  23           HE1      HIS  23  39.999  10.405 -10.662
  185    H    LEU  24           HN       LEU  24  36.910  13.838 -10.404
  186    HA   LEU  24           HA       LEU  24  36.463  11.406  -9.146
  187    HB2  LEU  24           HB2      LEU  24  36.170  12.607  -7.106
  188    HB3  LEU  24           HB1      LEU  24  37.270  13.564  -8.108
  189    HG   LEU  24           HG       LEU  24  35.772  15.151  -7.189
  190   HD11  LEU  24          HD11      LEU  24  36.143  15.307  -9.676
  191   HD12  LEU  24          HD12      LEU  24  34.669  16.114  -9.095
  192   HD13  LEU  24          HD13      LEU  24  34.554  14.542  -9.914
  193   HD21  LEU  24          HD21      LEU  24  33.564  14.816  -6.609
  194   HD22  LEU  24          HD22      LEU  24  33.949  13.094  -6.799
  195   HD23  LEU  24          HD23      LEU  24  33.166  13.981  -8.123
  Start of MODEL   52
    1    H1   GLY   1           HT1      GLY   1  58.730   1.387  -2.295
    2    H2   GLY   1           HT2      GLY   1  60.349   1.597  -2.766
    3    H3   GLY   1           HT3      GLY   1  59.571   2.783  -1.831
    4    HA2  GLY   1           HA1      GLY   1  60.499   0.116  -1.060
    5    HA3  GLY   1           HA2      GLY   1  60.881   1.689  -0.331
    6    H    LYS   2           HN       LYS   2  60.025   1.913   1.610
    7    HA   LYS   2           HA       LYS   2  57.141   1.295   1.995
    8    HB2  LYS   2           HB2      LYS   2  59.361   0.005   3.637
    9    HB3  LYS   2           HB1      LYS   2  57.642   0.018   4.098
   10    HG2  LYS   2           HG2      LYS   2  57.147  -1.059   1.831
   11    HG3  LYS   2           HG1      LYS   2  58.904  -1.286   1.652
   12    HD2  LYS   2           HD2      LYS   2  58.885  -2.485   3.890
   13    HD3  LYS   2           HD1      LYS   2  57.106  -2.424   3.831
   14    HE2  LYS   2           HE2      LYS   2  57.151  -3.628   1.653
   15    HE3  LYS   2           HE1      LYS   2  58.925  -3.723   1.755
   16    HZ1  LYS   2           HZ1      LYS   2  57.377  -4.680   4.050
   17    HZ2  LYS   2           HZ2      LYS   2  58.840  -5.257   3.407
   18    HZ3  LYS   2           HZ3      LYS   2  57.367  -5.641   2.651
   19    H    GLY   3           HN       GLY   3  56.628   1.793   4.449
   20    HA2  GLY   3           HA1      GLY   3  57.751   3.406   6.258
   21    HA3  GLY   3           HA2      GLY   3  57.658   4.612   4.894
   22    H    ARG   4           HN       ARG   4  56.205   4.450   3.568
   23    HA   ARG   4           HA       ARG   4  55.335   6.223   4.971
   24    HB2  ARG   4           HB2      ARG   4  53.988   5.360   2.369
   25    HB3  ARG   4           HB1      ARG   4  53.683   6.930   3.152
   26    HG2  ARG   4           HG2      ARG   4  56.075   7.489   3.035
   27    HG3  ARG   4           HG1      ARG   4  56.437   5.892   2.340
   28    HD2  ARG   4           HD2      ARG   4  54.561   7.920   1.055
   29    HD3  ARG   4           HD1      ARG   4  56.278   7.739   0.624
   30    HE   ARG   4           HE       ARG   4  55.251   5.170   0.371
   31   HH11  ARG   4          HH11      ARG   4  52.626   6.344  -0.302
   32   HH12  ARG   4          HH12      ARG   4  52.750   6.616  -2.008
   33   HH21  ARG   4          HH21      ARG   4  56.209   6.362  -2.067
   34   HH22  ARG   4          HH22      ARG   4  54.779   6.627  -3.007
   35    H    TRP   5           HN       TRP   5  54.263   3.220   5.004
   36    HA   TRP   5           HA       TRP   5  51.504   2.973   5.253
   37    HB2  TRP   5           HB2      TRP   5  53.459   1.868   7.305
   38    HB3  TRP   5           HB1      TRP   5  51.874   1.194   6.857
   39    HD1  TRP   5           HD1      TRP   5  55.468   1.013   5.996
   40    HE1  TRP   5           HE1      TRP   5  55.858  -0.375   3.833
   41    HE3  TRP   5           HE3      TRP   5  50.634   0.736   4.335
   42    HZ2  TRP   5           HZ2      TRP   5  54.261  -1.446   1.689
   43    HZ3  TRP   5           HZ3      TRP   5  50.091  -0.474   2.228
   44    HH2  TRP   5           HH2      TRP   5  51.898  -1.565   0.905
   45    H    LEU   6           HN       LEU   6  53.586   4.954   7.161
   46    HA   LEU   6           HA       LEU   6  51.372   5.495   9.134
   47    HB2  LEU   6           HB2      LEU   6  54.313   6.166   9.493
   48    HB3  LEU   6           HB1      LEU   6  53.031   6.105  10.725
   49    HG   LEU   6           HG       LEU   6  54.110   3.714   9.160
   50   HD11  LEU   6          HD11      LEU   6  55.643   4.738  10.899
   51   HD12  LEU   6          HD12      LEU   6  55.159   3.060  11.243
   52   HD13  LEU   6          HD13      LEU   6  54.386   4.405  12.115
   53   HD21  LEU   6          HD21      LEU   6  51.942   4.035  11.278
   54   HD22  LEU   6          HD22      LEU   6  52.751   2.476  10.985
   55   HD23  LEU   6          HD23      LEU   6  51.819   3.251   9.685
   56    H    GLU   7           HN       GLU   7  53.360   6.809   6.540
   57    HA   GLU   7           HA       GLU   7  52.865   9.607   7.404
   58    HB2  GLU   7           HB2      GLU   7  54.120   8.434   4.893
   59    HB3  GLU   7           HB1      GLU   7  54.032  10.168   5.278
   60    HG2  GLU   7           HG2      GLU   7  55.306   8.103   7.123
   61    HG3  GLU   7           HG1      GLU   7  56.225   9.028   5.910
   62    H    ARG   8           HN       ARG   8  51.263   7.153   5.600
   63    HA   ARG   8           HA       ARG   8  49.803   9.001   3.837
   64    HB2  ARG   8           HB2      ARG   8  50.317   6.611   3.240
   65    HB3  ARG   8           HB1      ARG   8  49.192   6.098   4.522
   66    HG2  ARG   8           HG2      ARG   8  47.333   7.218   3.425
   67    HG3  ARG   8           HG1      ARG   8  48.424   7.948   2.222
   68    HD2  ARG   8           HD2      ARG   8  48.957   5.772   1.287
   69    HD3  ARG   8           HD1      ARG   8  48.075   4.943   2.592
   70    HE   ARG   8           HE       ARG   8  46.248   6.695   1.297
   71   HH11  ARG   8          HH11      ARG   8  46.817   3.498   1.615
   72   HH12  ARG   8          HH12      ARG   8  46.334   3.026   0.021
   73   HH21  ARG   8          HH21      ARG   8  46.197   6.273  -1.187
   74   HH22  ARG   8          HH22      ARG   8  45.983   4.596  -1.565
   75    H    ILE   9           HN       ILE   9  48.524  10.445   4.852
   76    HA   ILE   9           HA       ILE   9  47.143   9.904   7.316
   77    HB   ILE   9           HB       ILE   9  45.809  11.965   6.736
   78   HG12  ILE   9          HG12      ILE   9  47.503  11.843   4.195
   79   HG13  ILE   9          HG11      ILE   9  45.742  11.605   4.281
   80   HG21  ILE   9          HG21      ILE   9  48.781  12.352   6.183
   81   HG22  ILE   9          HG22      ILE   9  48.147  11.971   7.801
   82   HG23  ILE   9          HG23      ILE   9  47.661  13.476   6.989
   83   HD11  ILE   9           HD1      ILE   9  45.687  13.965   5.401
   84   HD12  ILE   9           HD2      ILE   9  45.968  13.877   3.646
   85   HD13  ILE   9           HD3      ILE   9  47.335  14.146   4.752
   86    H    GLY  10           HN       GLY  10  46.330   9.430   3.917
   87    HA2  GLY  10           HA1      GLY  10  44.422   8.564   2.918
   88    HA3  GLY  10           HA2      GLY  10  44.406   7.471   4.314
   89    H    LYS  11           HN       LYS  11  44.046  10.944   4.683
   90    HA   LYS  11           HA       LYS  11  41.446  10.537   5.979
   91    HB2  LYS  11           HB2      LYS  11  43.279  12.232   6.639
   92    HB3  LYS  11           HB1      LYS  11  42.716  13.203   5.259
   93    HG2  LYS  11           HG2      LYS  11  40.437  13.266   6.201
   94    HG3  LYS  11           HG1      LYS  11  40.946  12.226   7.548
   95    HD2  LYS  11           HD2      LYS  11  41.066  14.378   8.506
   96    HD3  LYS  11           HD1      LYS  11  42.748  14.090   8.009
   97    HE2  LYS  11           HE2      LYS  11  41.934  16.369   7.379
   98    HE3  LYS  11           HE1      LYS  11  42.396  15.409   5.959
   99    HZ1  LYS  11           HZ1      LYS  11  40.153  14.982   5.456
  100    HZ2  LYS  11           HZ2      LYS  11  40.209  16.637   5.835
  101    HZ3  LYS  11           HZ3      LYS  11  39.606  15.523   6.967
  102    H    ALA  12           HN       ALA  12  42.582  11.274   2.792
  103    HA   ALA  12           HA       ALA  12  41.362  11.498   0.836
  104    HB1  ALA  12           HB1      ALA  12  38.733  11.828   2.283
  105    HB2  ALA  12           HB2      ALA  12  39.521  10.234   2.267
  106    HB3  ALA  12           HB3      ALA  12  39.085  11.027   0.735
  107    H    GLY  13           HN       GLY  13  41.071  13.569   3.596
  108    HA2  GLY  13           HA1      GLY  13  40.588  15.848   3.783
  109    HA3  GLY  13           HA2      GLY  13  41.689  15.953   2.394
  110    H    PHE  14           HN       PHE  14  38.542  14.379   2.454
  111    HA   PHE  14           HA       PHE  14  36.545  14.896   1.404
  112    HB2  PHE  14           HB2      PHE  14  37.112  17.308   2.302
  113    HB3  PHE  14           HB1      PHE  14  37.553  17.654   0.615
  114    HD1  PHE  14           HD1      PHE  14  34.786  16.038   2.614
  115    HD2  PHE  14           HD2      PHE  14  35.846  18.390  -0.850
  116    HE1  PHE  14           HE1      PHE  14  32.374  16.320   2.063
  117    HE2  PHE  14           HE2      PHE  14  33.432  18.671  -1.397
  118    HZ   PHE  14           HZ       PHE  14  31.699  17.589   0.028
  119    H    ILE  15           HN       ILE  15  38.421  13.431   0.132
  120    HA   ILE  15           HA       ILE  15  38.965  12.636  -1.953
  121    HB   ILE  15           HB       ILE  15  37.055  14.705  -3.125
  122   HG12  ILE  15          HG12      ILE  15  36.471  11.888  -2.092
  123   HG13  ILE  15          HG11      ILE  15  35.977  13.395  -1.286
  124   HG21  ILE  15          HG21      ILE  15  37.936  11.944  -4.071
  125   HG22  ILE  15          HG22      ILE  15  38.558  13.488  -4.697
  126   HG23  ILE  15          HG23      ILE  15  36.852  13.058  -4.935
  127   HD11  ILE  15           HD1      ILE  15  34.954  12.190  -3.871
  128   HD12  ILE  15           HD2      ILE  15  34.858  13.952  -3.630
  129   HD13  ILE  15           HD3      ILE  15  34.038  12.851  -2.500
  130    H    ILE  16           HN       ILE  16  41.014  13.729  -1.274
  131    HA   ILE  16           HA       ILE  16  41.794  15.668  -3.435
  132    HB   ILE  16           HB       ILE  16  42.503  15.848  -0.473
  133   HG12  ILE  16          HG12      ILE  16  40.244  16.805  -1.364
  134   HG13  ILE  16          HG11      ILE  16  41.271  17.864  -0.384
  135   HG21  ILE  16          HG21      ILE  16  43.615  17.328  -2.890
  136   HG22  ILE  16          HG22      ILE  16  44.509  16.385  -1.672
  137   HG23  ILE  16          HG23      ILE  16  43.774  17.940  -1.226
  138   HD11  ILE  16           HD1      ILE  16  40.271  18.910  -2.501
  139   HD12  ILE  16           HD2      ILE  16  41.371  17.877  -3.433
  140   HD13  ILE  16           HD3      ILE  16  42.028  19.083  -2.309
  141    H    ILE  17           HN       ILE  17  43.515  14.238  -0.637
  142    HA   ILE  17           HA       ILE  17  45.782  13.549  -2.256
  143    HB   ILE  17           HB       ILE  17  46.480  12.136  -0.293
  144   HG12  ILE  17          HG12      ILE  17  44.994  12.461   1.799
  145   HG13  ILE  17          HG11      ILE  17  43.705  12.968   0.686
  146   HG21  ILE  17          HG21      ILE  17  46.996  14.546  -0.417
  147   HG22  ILE  17          HG22      ILE  17  46.675  14.056   1.264
  148   HG23  ILE  17          HG23      ILE  17  45.430  14.928   0.337
  149   HD11  ILE  17           HD1      ILE  17  43.385  10.807  -0.139
  150   HD12  ILE  17           HD2      ILE  17  43.985  10.392   1.476
  151   HD13  ILE  17           HD3      ILE  17  45.086  10.342   0.084
  152    H    GLY  18           HN       GLY  18  42.711  12.258  -2.187
  153    HA2  GLY  18           HA1      GLY  18  43.634   9.505  -2.959
  154    HA3  GLY  18           HA2      GLY  18  42.002   9.950  -2.417
  155    H    GLY  19           HN       GLY  19  40.933  11.716  -3.837
  156    HA2  GLY  19           HA1      GLY  19  40.745  10.577  -6.488
  157    HA3  GLY  19           HA2      GLY  19  39.955  12.058  -5.918
  158    H    ALA  20           HN       ALA  20  42.763  12.999  -5.059
  159    HA   ALA  20           HA       ALA  20  44.427  14.325  -5.977
  160    HB1  ALA  20           HB1      ALA  20  45.553  13.569  -7.913
  161    HB2  ALA  20           HB2      ALA  20  44.083  12.830  -8.592
  162    HB3  ALA  20           HB3      ALA  20  44.880  12.095  -7.179
  163    H    LEU  21           HN       LEU  21  41.319  14.574  -6.676
  164    HA   LEU  21           HA       LEU  21  40.012  16.093  -7.836
  165    HB2  LEU  21           HB2      LEU  21  41.988  17.483  -6.500
  166    HB3  LEU  21           HB1      LEU  21  42.238  18.085  -8.150
  167    HG   LEU  21           HG       LEU  21  39.567  18.092  -6.661
  168   HD11  LEU  21          HD11      LEU  21  41.413  20.413  -7.362
  169   HD12  LEU  21          HD12      LEU  21  41.332  19.655  -5.753
  170   HD13  LEU  21          HD13      LEU  21  39.906  20.487  -6.419
  171   HD21  LEU  21          HD21      LEU  21  40.472  19.170  -9.367
  172   HD22  LEU  21          HD22      LEU  21  38.957  19.663  -8.572
  173   HD23  LEU  21          HD23      LEU  21  39.198  17.967  -9.051
  174    H    ASP  22           HN       ASP  22  42.171  14.304  -9.266
  175    HA   ASP  22           HA       ASP  22  42.723  15.684 -11.754
  176    HB2  ASP  22           HB2      ASP  22  44.092  13.797 -11.013
  177    HB3  ASP  22           HB1      ASP  22  42.676  12.720 -11.050
  178    H    HIS  23           HN       HIS  23  41.285  12.579 -12.207
  179    HA   HIS  23           HA       HIS  23  39.380  13.625 -14.105
  180    HB2  HIS  23           HB2      HIS  23  40.353  11.349 -14.255
  181    HB3  HIS  23           HB1      HIS  23  39.498  10.892 -12.763
  182    HD1  HIS  23           HD1      HIS  23  36.898  10.650 -12.858
  183    HD2  HIS  23           HD2      HIS  23  38.723  11.448 -16.561
  184    HE1  HIS  23           HE1      HIS  23  35.143  10.256 -14.674
  185    H    LEU  24           HN       LEU  24  39.400  13.932 -10.848
  186    HA   LEU  24           HA       LEU  24  36.552  14.548 -10.760
  187    HB2  LEU  24           HB2      LEU  24  36.870  11.937 -10.415
  188    HB3  LEU  24           HB1      LEU  24  37.385  12.404  -8.781
  189    HG   LEU  24           HG       LEU  24  34.721  13.075 -10.119
  190   HD11  LEU  24          HD11      LEU  24  35.396  11.375  -7.676
  191   HD12  LEU  24          HD12      LEU  24  35.003  10.732  -9.290
  192   HD13  LEU  24          HD13      LEU  24  33.777  11.635  -8.367
  193   HD21  LEU  24          HD21      LEU  24  35.973  13.957  -7.486
  194   HD22  LEU  24          HD22      LEU  24  34.209  13.940  -7.725
  195   HD23  LEU  24          HD23      LEU  24  35.235  14.966  -8.753
  Start of MODEL   53
    1    H1   GLY   1           HT1      GLY   1  64.065   0.080   6.010
    2    H2   GLY   1           HT2      GLY   1  64.216   1.366   4.909
    3    H3   GLY   1           HT3      GLY   1  62.970   0.225   4.726
    4    HA2  GLY   1           HA1      GLY   1  62.489   1.045   7.182
    5    HA3  GLY   1           HA2      GLY   1  63.176   2.512   6.458
    6    H    LYS   2           HN       LYS   2  60.521   0.237   6.486
    7    HA   LYS   2           HA       LYS   2  59.136   1.464   4.208
    8    HB2  LYS   2           HB2      LYS   2  58.059  -0.374   6.382
    9    HB3  LYS   2           HB1      LYS   2  57.304  -0.025   4.809
   10    HG2  LYS   2           HG2      LYS   2  59.415  -0.927   3.709
   11    HG3  LYS   2           HG1      LYS   2  59.931  -1.478   5.321
   12    HD2  LYS   2           HD2      LYS   2  57.844  -2.810   5.526
   13    HD3  LYS   2           HD1      LYS   2  57.349  -2.275   3.903
   14    HE2  LYS   2           HE2      LYS   2  58.354  -4.426   3.590
   15    HE3  LYS   2           HE1      LYS   2  59.582  -3.250   3.063
   16    HZ1  LYS   2           HZ1      LYS   2  59.972  -3.560   5.771
   17    HZ2  LYS   2           HZ2      LYS   2  60.932  -4.203   4.526
   18    HZ3  LYS   2           HZ3      LYS   2  59.681  -5.131   5.205
   19    H    GLY   3           HN       GLY   3  59.532   3.685   5.254
   20    HA2  GLY   3           HA1      GLY   3  58.195   4.665   7.540
   21    HA3  GLY   3           HA2      GLY   3  58.334   5.631   6.000
   22    H    ARG   4           HN       ARG   4  57.557   4.875   4.337
   23    HA   ARG   4           HA       ARG   4  55.847   6.478   4.955
   24    HB2  ARG   4           HB2      ARG   4  55.829   4.937   2.319
   25    HB3  ARG   4           HB1      ARG   4  54.855   6.403   2.581
   26    HG2  ARG   4           HG2      ARG   4  56.924   7.650   3.199
   27    HG3  ARG   4           HG1      ARG   4  57.887   6.187   2.877
   28    HD2  ARG   4           HD2      ARG   4  56.975   6.184   0.524
   29    HD3  ARG   4           HD1      ARG   4  56.199   7.749   0.875
   30    HE   ARG   4           HE       ARG   4  59.005   7.877   1.519
   31   HH11  ARG   4          HH11      ARG   4  60.502   7.984  -0.317
   32   HH12  ARG   4          HH12      ARG   4  59.894   8.729  -1.757
   33   HH21  ARG   4          HH21      ARG   4  56.599   8.742  -0.679
   34   HH22  ARG   4          HH22      ARG   4  57.685   9.159  -1.962
   35    H    TRP   5           HN       TRP   5  55.557   3.328   5.316
   36    HA   TRP   5           HA       TRP   5  53.054   2.296   4.711
   37    HB2  TRP   5           HB2      TRP   5  54.820   1.158   6.081
   38    HB3  TRP   5           HB1      TRP   5  54.301   2.124   7.482
   39    HD1  TRP   5           HD1      TRP   5  52.769  -0.341   4.913
   40    HE1  TRP   5           HE1      TRP   5  50.875  -1.696   6.071
   41    HE3  TRP   5           HE3      TRP   5  52.829   1.941   9.494
   42    HZ2  TRP   5           HZ2      TRP   5  49.583  -1.755   8.644
   43    HZ3  TRP   5           HZ3      TRP   5  51.257   1.220  11.285
   44    HH2  TRP   5           HH2      TRP   5  49.636  -0.625  10.865
   45    H    LEU   6           HN       LEU   6  53.693   5.074   6.658
   46    HA   LEU   6           HA       LEU   6  50.786   5.221   7.439
   47    HB2  LEU   6           HB2      LEU   6  52.577   4.878   9.311
   48    HB3  LEU   6           HB1      LEU   6  53.046   6.555   8.966
   49    HG   LEU   6           HG       LEU   6  50.418   7.021   9.211
   50   HD11  LEU   6          HD11      LEU   6  49.413   5.545  10.959
   51   HD12  LEU   6          HD12      LEU   6  50.818   4.463  10.831
   52   HD13  LEU   6          HD13      LEU   6  49.724   4.671   9.444
   53   HD21  LEU   6          HD21      LEU   6  52.168   7.964  10.683
   54   HD22  LEU   6          HD22      LEU   6  52.222   6.440  11.603
   55   HD23  LEU   6          HD23      LEU   6  50.755   7.447  11.632
   56    H    GLU   7           HN       GLU   7  53.427   6.619   5.668
   57    HA   GLU   7           HA       GLU   7  52.377   9.373   5.851
   58    HB2  GLU   7           HB2      GLU   7  54.844   8.651   5.507
   59    HB3  GLU   7           HB1      GLU   7  54.385   8.338   3.821
   60    HG2  GLU   7           HG2      GLU   7  53.619  10.668   3.569
   61    HG3  GLU   7           HG1      GLU   7  54.005  10.993   5.276
   62    H    ARG   8           HN       ARG   8  51.499   6.556   4.206
   63    HA   ARG   8           HA       ARG   8  50.900   7.372   1.591
   64    HB2  ARG   8           HB2      ARG   8  49.354   5.584   3.504
   65    HB3  ARG   8           HB1      ARG   8  48.920   5.775   1.788
   66    HG2  ARG   8           HG2      ARG   8  51.143   4.991   1.103
   67    HG3  ARG   8           HG1      ARG   8  51.651   4.875   2.804
   68    HD2  ARG   8           HD2      ARG   8  51.025   2.651   2.117
   69    HD3  ARG   8           HD1      ARG   8  49.713   3.254   3.158
   70    HE   ARG   8           HE       ARG   8  49.152   3.869   0.397
   71   HH11  ARG   8          HH11      ARG   8  46.903   3.033   0.326
   72   HH12  ARG   8          HH12      ARG   8  46.735   1.327   0.582
   73   HH21  ARG   8          HH21      ARG   8  49.973   0.916   1.754
   74   HH22  ARG   8          HH22      ARG   8  48.472   0.130   1.392
   75    H    ILE   9           HN       ILE   9  49.898   9.120   0.873
   76    HA   ILE   9           HA       ILE   9  48.133  10.685   2.556
   77    HB   ILE   9           HB       ILE   9  49.538  11.652   0.716
   78   HG12  ILE   9          HG12      ILE   9  46.537  12.080   0.331
   79   HG13  ILE   9          HG11      ILE   9  47.499  12.806   1.639
   80   HG21  ILE   9          HG21      ILE   9  48.966  11.329  -1.590
   81   HG22  ILE   9          HG22      ILE   9  47.448  10.496  -1.175
   82   HG23  ILE   9          HG23      ILE   9  49.011   9.703  -0.873
   83   HD11  ILE   9           HD1      ILE   9  49.018  13.745  -0.243
   84   HD12  ILE   9           HD2      ILE   9  47.412  14.484  -0.047
   85   HD13  ILE   9           HD3      ILE   9  47.696  13.308  -1.351
   86    H    GLY  10           HN       GLY  10  47.706   8.017   0.363
   87    HA2  GLY  10           HA1      GLY  10  45.125   8.328  -0.601
   88    HA3  GLY  10           HA2      GLY  10  45.799   6.772  -0.082
   89    H    LYS  11           HN       LYS  11  43.866   9.569   0.844
   90    HA   LYS  11           HA       LYS  11  42.428   7.876   2.823
   91    HB2  LYS  11           HB2      LYS  11  43.897  10.448   3.534
   92    HB3  LYS  11           HB1      LYS  11  42.557   9.799   4.509
   93    HG2  LYS  11           HG2      LYS  11  43.816   7.639   4.734
   94    HG3  LYS  11           HG1      LYS  11  45.174   8.375   3.856
   95    HD2  LYS  11           HD2      LYS  11  45.633   8.560   6.233
   96    HD3  LYS  11           HD1      LYS  11  45.269  10.182   5.604
   97    HE2  LYS  11           HE2      LYS  11  42.962   8.572   6.710
   98    HE3  LYS  11           HE1      LYS  11  44.123   9.270   7.861
   99    HZ1  LYS  11           HZ1      LYS  11  42.839  11.075   7.630
  100    HZ2  LYS  11           HZ2      LYS  11  42.203  10.591   6.131
  101    HZ3  LYS  11           HZ3      LYS  11  43.730  11.332   6.210
  102    H    ALA  12           HN       ALA  12  42.397   9.848   0.230
  103    HA   ALA  12           HA       ALA  12  40.796  11.230  -0.728
  104    HB1  ALA  12           HB1      ALA  12  39.373   9.299  -0.584
  105    HB2  ALA  12           HB2      ALA  12  38.412  10.712  -0.083
  106    HB3  ALA  12           HB3      ALA  12  39.056   9.594   1.142
  107    H    GLY  13           HN       GLY  13  42.235  12.668   0.908
  108    HA2  GLY  13           HA1      GLY  13  41.308  13.827   3.212
  109    HA3  GLY  13           HA2      GLY  13  42.103  14.760   1.929
  110    H    PHE  14           HN       PHE  14  39.047  13.758   3.345
  111    HA   PHE  14           HA       PHE  14  36.905  14.634   3.115
  112    HB2  PHE  14           HB2      PHE  14  38.535  17.120   2.456
  113    HB3  PHE  14           HB1      PHE  14  36.778  17.118   2.744
  114    HD1  PHE  14           HD1      PHE  14  35.899  16.208   4.970
  115    HD2  PHE  14           HD2      PHE  14  40.066  17.112   4.294
  116    HE1  PHE  14           HE1      PHE  14  36.286  16.273   7.431
  117    HE2  PHE  14           HE2      PHE  14  40.451  17.176   6.754
  118    HZ   PHE  14           HZ       PHE  14  38.550  16.810   8.323
  119    H    ILE  15           HN       ILE  15  37.652  13.126   0.967
  120    HA   ILE  15           HA       ILE  15  37.060  12.698  -1.218
  121    HB   ILE  15           HB       ILE  15  35.326  15.198  -1.138
  122   HG12  ILE  15          HG12      ILE  15  34.701  12.387  -0.124
  123   HG13  ILE  15          HG11      ILE  15  34.901  13.833   0.891
  124   HG21  ILE  15          HG21      ILE  15  35.714  13.904  -3.306
  125   HG22  ILE  15          HG22      ILE  15  34.019  14.064  -2.800
  126   HG23  ILE  15          HG23      ILE  15  34.887  12.532  -2.535
  127   HD11  ILE  15           HD1      ILE  15  33.006  14.868  -0.589
  128   HD12  ILE  15           HD2      ILE  15  32.553  13.660   0.637
  129   HD13  ILE  15           HD3      ILE  15  32.679  13.186  -1.073
  130    H    ILE  16           HN       ILE  16  39.280  13.212  -1.765
  131    HA   ILE  16           HA       ILE  16  39.350  15.426  -3.739
  132    HB   ILE  16           HB       ILE  16  40.207  16.517  -1.710
  133   HG12  ILE  16          HG12      ILE  16  42.460  17.176  -2.540
  134   HG13  ILE  16          HG11      ILE  16  42.444  15.813  -3.675
  135   HG21  ILE  16          HG21      ILE  16  42.505  14.551  -1.608
  136   HG22  ILE  16          HG22      ILE  16  40.997  14.216  -0.731
  137   HG23  ILE  16          HG23      ILE  16  41.941  15.678  -0.360
  138   HD11  ILE  16           HD1      ILE  16  40.768  16.780  -5.023
  139   HD12  ILE  16           HD2      ILE  16  41.692  18.209  -4.506
  140   HD13  ILE  16           HD3      ILE  16  40.156  17.808  -3.702
  141    H    ILE  17           HN       ILE  17  40.794  12.525  -2.257
  142    HA   ILE  17           HA       ILE  17  42.334  12.027  -4.802
  143    HB   ILE  17           HB       ILE  17  42.366  10.367  -2.236
  144   HG12  ILE  17          HG12      ILE  17  43.352  12.403  -1.528
  145   HG13  ILE  17          HG11      ILE  17  44.740  11.418  -2.004
  146   HG21  ILE  17          HG21      ILE  17  44.034  10.376  -4.780
  147   HG22  ILE  17          HG22      ILE  17  43.015   9.072  -4.139
  148   HG23  ILE  17          HG23      ILE  17  44.518   9.513  -3.302
  149   HD11  ILE  17           HD1      ILE  17  44.629  12.564  -4.291
  150   HD12  ILE  17           HD2      ILE  17  45.096  13.608  -2.934
  151   HD13  ILE  17           HD3      ILE  17  43.444  13.680  -3.581
  152    H    GLY  18           HN       GLY  18  39.790  10.829  -2.655
  153    HA2  GLY  18           HA1      GLY  18  39.283   8.427  -4.203
  154    HA3  GLY  18           HA2      GLY  18  38.241   9.126  -2.946
  155    H    GLY  19           HN       GLY  19  37.413  11.480  -3.750
  156    HA2  GLY  19           HA1      GLY  19  35.596  10.848  -5.898
  157    HA3  GLY  19           HA2      GLY  19  35.823  12.437  -5.144
  158    H    ALA  20           HN       ALA  20  38.526  12.893  -5.687
  159    HA   ALA  20           HA       ALA  20  39.754  13.923  -7.371
  160    HB1  ALA  20           HB1      ALA  20  40.274  11.534  -7.767
  161    HB2  ALA  20           HB2      ALA  20  40.307  12.488  -9.268
  162    HB3  ALA  20           HB3      ALA  20  38.913  11.441  -8.908
  163    H    LEU  21           HN       LEU  21  37.095  14.861  -7.183
  164    HA   LEU  21           HA       LEU  21  35.824  14.935  -9.780
  165    HB2  LEU  21           HB2      LEU  21  35.565  17.036  -7.600
  166    HB3  LEU  21           HB1      LEU  21  34.366  16.571  -8.830
  167    HG   LEU  21           HG       LEU  21  35.375  14.788  -6.566
  168   HD11  LEU  21          HD11      LEU  21  33.062  15.057  -5.697
  169   HD12  LEU  21          HD12      LEU  21  32.703  16.190  -7.022
  170   HD13  LEU  21          HD13      LEU  21  33.912  16.618  -5.787
  171   HD21  LEU  21          HD21      LEU  21  33.338  13.392  -7.373
  172   HD22  LEU  21          HD22      LEU  21  34.798  13.349  -8.386
  173   HD23  LEU  21          HD23      LEU  21  33.416  14.365  -8.861
  174    H    ASP  22           HN       ASP  22  38.440  16.713  -8.281
  175    HA   ASP  22           HA       ASP  22  38.294  18.978 -10.122
  176    HB2  ASP  22           HB2      ASP  22  39.292  19.138  -7.853
  177    HB3  ASP  22           HB1      ASP  22  40.591  18.036  -8.363
  178    H    HIS  23           HN       HIS  23  38.282  16.374 -11.410
  179    HA   HIS  23           HA       HIS  23  39.286  15.303 -13.201
  180    HB2  HIS  23           HB2      HIS  23  39.049  17.611 -14.132
  181    HB3  HIS  23           HB1      HIS  23  40.706  17.965 -13.587
  182    HD1  HIS  23           HD1      HIS  23  42.139  17.938 -15.637
  183    HD2  HIS  23           HD2      HIS  23  39.485  14.679 -15.504
  184    HE1  HIS  23           HE1      HIS  23  42.657  16.452 -17.650
  185    H    LEU  24           HN       LEU  24  40.669  15.248 -10.537
  186    HA   LEU  24           HA       LEU  24  43.541  15.157 -11.260
  187    HB2  LEU  24           HB2      LEU  24  42.016  14.442  -8.726
  188    HB3  LEU  24           HB1      LEU  24  43.782  14.336  -8.887
  189    HG   LEU  24           HG       LEU  24  42.312  16.926  -9.531
  190   HD11  LEU  24          HD11      LEU  24  41.648  16.241  -7.232
  191   HD12  LEU  24          HD12      LEU  24  42.712  17.668  -7.210
  192   HD13  LEU  24          HD13      LEU  24  43.366  16.065  -6.799
  193   HD21  LEU  24          HD21      LEU  24  45.161  16.196  -8.698
  194   HD22  LEU  24          HD22      LEU  24  44.555  17.866  -8.731
  195   HD23  LEU  24          HD23      LEU  24  44.628  16.922 -10.232
  Start of MODEL   54
    1    H1   GLY   1           HT1      GLY   1  60.519   1.272   0.676
    2    H2   GLY   1           HT2      GLY   1  61.388  -0.077   1.236
    3    H3   GLY   1           HT3      GLY   1  62.211   1.332   0.761
    4    HA2  GLY   1           HA1      GLY   1  61.067   0.639   3.249
    5    HA3  GLY   1           HA2      GLY   1  62.219   1.927   2.841
    6    H    LYS   2           HN       LYS   2  59.274   1.807   1.030
    7    HA   LYS   2           HA       LYS   2  57.913   3.761   2.835
    8    HB2  LYS   2           HB2      LYS   2  58.443   4.369  -0.098
    9    HB3  LYS   2           HB1      LYS   2  57.668   5.427   1.107
   10    HG2  LYS   2           HG2      LYS   2  59.849   5.307   2.437
   11    HG3  LYS   2           HG1      LYS   2  60.579   4.536   1.010
   12    HD2  LYS   2           HD2      LYS   2  59.275   7.292   1.123
   13    HD3  LYS   2           HD1      LYS   2  61.012   6.949   0.950
   14    HE2  LYS   2           HE2      LYS   2  58.779   6.496  -1.056
   15    HE3  LYS   2           HE1      LYS   2  60.312   7.371  -1.272
   16    HZ1  LYS   2           HZ1      LYS   2  60.246   5.129  -2.315
   17    HZ2  LYS   2           HZ2      LYS   2  60.137   4.444  -0.764
   18    HZ3  LYS   2           HZ3      LYS   2  61.514   5.335  -1.208
   19    H    GLY   3           HN       GLY   3  56.029   4.603   0.904
   20    HA2  GLY   3           HA1      GLY   3  54.581   3.124  -0.758
   21    HA3  GLY   3           HA2      GLY   3  54.364   2.064   0.709
   22    H    ARG   4           HN       ARG   4  54.360   2.869   2.499
   23    HA   ARG   4           HA       ARG   4  51.978   2.615   2.126
   24    HB2  ARG   4           HB2      ARG   4  53.152   3.496   4.802
   25    HB3  ARG   4           HB1      ARG   4  51.499   2.854   4.629
   26    HG2  ARG   4           HG2      ARG   4  52.417   0.791   3.586
   27    HG3  ARG   4           HG1      ARG   4  54.066   1.425   3.795
   28    HD2  ARG   4           HD2      ARG   4  52.122   1.059   6.110
   29    HD3  ARG   4           HD1      ARG   4  53.287  -0.190   5.611
   30    HE   ARG   4           HE       ARG   4  54.604   2.358   6.024
   31   HH11  ARG   4          HH11      ARG   4  55.768   2.639   7.943
   32   HH12  ARG   4          HH12      ARG   4  55.628   1.459   9.204
   33   HH21  ARG   4          HH21      ARG   4  53.310  -0.475   7.501
   34   HH22  ARG   4          HH22      ARG   4  54.236  -0.303   8.955
   35    H    TRP   5           HN       TRP   5  53.523   5.393   1.975
   36    HA   TRP   5           HA       TRP   5  52.163   7.549   3.089
   37    HB2  TRP   5           HB2      TRP   5  54.096   7.654   1.470
   38    HB3  TRP   5           HB1      TRP   5  52.927   7.406   0.149
   39    HD1  TRP   5           HD1      TRP   5  53.069   9.749   3.253
   40    HE1  TRP   5           HE1      TRP   5  52.388  12.149   2.519
   41    HE3  TRP   5           HE3      TRP   5  52.230   8.866  -1.719
   42    HZ2  TRP   5           HZ2      TRP   5  51.593  13.474   0.088
   43    HZ3  TRP   5           HZ3      TRP   5  51.511  10.711  -3.227
   44    HH2  TRP   5           HH2      TRP   5  51.192  13.013  -2.328
   45    H    LEU   6           HN       LEU   6  50.905   5.216   0.880
   46    HA   LEU   6           HA       LEU   6  48.441   6.872   0.381
   47    HB2  LEU   6           HB2      LEU   6  49.289   4.317  -1.033
   48    HB3  LEU   6           HB1      LEU   6  48.034   5.477  -1.527
   49    HG   LEU   6           HG       LEU   6  51.015   6.113  -1.339
   50   HD11  LEU   6          HD11      LEU   6  50.958   6.080  -3.804
   51   HD12  LEU   6          HD12      LEU   6  49.239   5.614  -3.767
   52   HD13  LEU   6          HD13      LEU   6  50.479   4.497  -3.147
   53   HD21  LEU   6          HD21      LEU   6  48.556   7.680  -2.222
   54   HD22  LEU   6          HD22      LEU   6  50.191   8.115  -2.774
   55   HD23  LEU   6          HD23      LEU   6  49.799   8.151  -1.040
   56    H    GLU   7           HN       GLU   7  49.751   3.981   1.934
   57    HA   GLU   7           HA       GLU   7  47.023   2.851   2.338
   58    HB2  GLU   7           HB2      GLU   7  49.163   1.483   1.883
   59    HB3  GLU   7           HB1      GLU   7  49.635   1.873   3.551
   60    HG2  GLU   7           HG2      GLU   7  47.618   0.808   4.427
   61    HG3  GLU   7           HG1      GLU   7  46.999   0.541   2.780
   62    H    ARG   8           HN       ARG   8  48.918   5.248   3.695
   63    HA   ARG   8           HA       ARG   8  48.520   4.751   6.508
   64    HB2  ARG   8           HB2      ARG   8  50.195   6.345   5.525
   65    HB3  ARG   8           HB1      ARG   8  48.847   7.426   5.096
   66    HG2  ARG   8           HG2      ARG   8  48.204   7.644   7.438
   67    HG3  ARG   8           HG1      ARG   8  49.420   6.437   7.922
   68    HD2  ARG   8           HD2      ARG   8  51.199   7.958   6.955
   69    HD3  ARG   8           HD1      ARG   8  49.935   9.188   6.716
   70    HE   ARG   8           HE       ARG   8  49.694   8.502   9.396
   71   HH11  ARG   8          HH11      ARG   8  50.349  10.680  10.290
   72   HH12  ARG   8          HH12      ARG   8  52.052  10.989  10.234
   73   HH21  ARG   8          HH21      ARG   8  52.720   8.390   8.036
   74   HH22  ARG   8          HH22      ARG   8  53.396   9.693   8.958
   75    H    ILE   9           HN       ILE   9  46.796   6.851   4.149
   76    HA   ILE   9           HA       ILE   9  44.246   6.312   5.425
   77    HB   ILE   9           HB       ILE   9  45.272   7.928   7.080
   78   HG12  ILE   9          HG12      ILE   9  42.850   8.904   5.495
   79   HG13  ILE   9          HG11      ILE   9  42.825   7.716   6.818
   80   HG21  ILE   9          HG21      ILE   9  45.714  10.195   6.475
   81   HG22  ILE   9          HG22      ILE   9  44.926  10.011   4.888
   82   HG23  ILE   9          HG23      ILE   9  46.490   9.221   5.205
   83   HD11  ILE   9           HD1      ILE   9  42.220   9.768   7.855
   84   HD12  ILE   9           HD2      ILE   9  43.449  10.686   6.956
   85   HD13  ILE   9           HD3      ILE   9  43.944   9.572   8.254
   86    H    GLY  10           HN       GLY  10  46.153   8.613   3.455
   87    HA2  GLY  10           HA1      GLY  10  45.770   9.293   1.264
   88    HA3  GLY  10           HA2      GLY  10  44.386   8.187   1.179
   89    H    LYS  11           HN       LYS  11  42.917   9.198   3.400
   90    HA   LYS  11           HA       LYS  11  41.693  11.518   2.088
   91    HB2  LYS  11           HB2      LYS  11  41.038  10.246   4.775
   92    HB3  LYS  11           HB1      LYS  11  39.993  11.309   3.806
   93    HG2  LYS  11           HG2      LYS  11  40.118   9.590   1.944
   94    HG3  LYS  11           HG1      LYS  11  40.948   8.507   3.087
   95    HD2  LYS  11           HD2      LYS  11  39.025   8.578   4.609
   96    HD3  LYS  11           HD1      LYS  11  38.201   9.748   3.550
   97    HE2  LYS  11           HE2      LYS  11  38.257   8.055   1.702
   98    HE3  LYS  11           HE1      LYS  11  38.964   6.882   2.839
   99    HZ1  LYS  11           HZ1      LYS  11  36.251   8.023   2.777
  100    HZ2  LYS  11           HZ2      LYS  11  36.912   7.568   4.274
  101    HZ3  LYS  11           HZ3      LYS  11  36.743   6.421   3.033
  102    H    ALA  12           HN       ALA  12  43.528  12.983   2.242
  103    HA   ALA  12           HA       ALA  12  44.408  13.822   4.918
  104    HB1  ALA  12           HB1      ALA  12  45.827  15.347   3.776
  105    HB2  ALA  12           HB2      ALA  12  44.823  15.311   2.307
  106    HB3  ALA  12           HB3      ALA  12  45.789  13.887   2.761
  107    H    GLY  13           HN       GLY  13  41.511  13.983   3.785
  108    HA2  GLY  13           HA1      GLY  13  39.718  15.395   4.187
  109    HA3  GLY  13           HA2      GLY  13  40.776  16.337   5.257
  110    H    PHE  14           HN       PHE  14  41.868  15.844   2.020
  111    HA   PHE  14           HA       PHE  14  40.679  18.395   1.042
  112    HB2  PHE  14           HB2      PHE  14  43.684  17.928   1.255
  113    HB3  PHE  14           HB1      PHE  14  42.902  19.288   0.415
  114    HD1  PHE  14           HD1      PHE  14  41.040  20.558   1.904
  115    HD2  PHE  14           HD2      PHE  14  44.370  18.306   3.485
  116    HE1  PHE  14           HE1      PHE  14  40.875  21.814   4.047
  117    HE2  PHE  14           HE2      PHE  14  44.201  19.565   5.627
  118    HZ   PHE  14           HZ       PHE  14  42.466  21.333   5.900
  119    H    ILE  15           HN       ILE  15  43.142  15.857   0.369
  120    HA   ILE  15           HA       ILE  15  42.573  15.994  -2.508
  121    HB   ILE  15           HB       ILE  15  44.185  14.138  -2.702
  122   HG12  ILE  15          HG12      ILE  15  44.073  14.217   0.349
  123   HG13  ILE  15          HG11      ILE  15  43.624  12.857  -0.703
  124   HG21  ILE  15          HG21      ILE  15  45.249  16.166  -0.694
  125   HG22  ILE  15          HG22      ILE  15  44.890  16.591  -2.385
  126   HG23  ILE  15          HG23      ILE  15  46.129  15.368  -2.019
  127   HD11  ILE  15           HD1      ILE  15  46.075  12.960  -1.565
  128   HD12  ILE  15           HD2      ILE  15  45.801  12.301   0.065
  129   HD13  ILE  15           HD3      ILE  15  46.391  13.967  -0.132
  130    H    ILE  16           HN       ILE  16  40.339  15.400  -0.759
  131    HA   ILE  16           HA       ILE  16  39.465  12.917  -2.129
  132    HB   ILE  16           HB       ILE  16  40.491  12.277   0.115
  133   HG12  ILE  16          HG12      ILE  16  38.252  11.021   0.846
  134   HG13  ILE  16          HG11      ILE  16  37.591  11.729  -0.644
  135   HG21  ILE  16          HG21      ILE  16  39.395  12.883   2.152
  136   HG22  ILE  16          HG22      ILE  16  38.005  13.577   1.288
  137   HG23  ILE  16          HG23      ILE  16  39.584  14.398   1.241
  138   HD11  ILE  16           HD1      ILE  16  39.274  10.604  -1.997
  139   HD12  ILE  16           HD2      ILE  16  38.543   9.398  -0.917
  140   HD13  ILE  16           HD3      ILE  16  40.149  10.062  -0.546
  141    H    ILE  17           HN       ILE  17  38.666  15.552   0.164
  142    HA   ILE  17           HA       ILE  17  35.814  15.363  -0.375
  143    HB   ILE  17           HB       ILE  17  35.767  17.719   0.676
  144   HG12  ILE  17          HG12      ILE  17  37.857  18.324   1.945
  145   HG13  ILE  17          HG11      ILE  17  38.726  17.052   1.068
  146   HG21  ILE  17          HG21      ILE  17  35.406  15.576   1.934
  147   HG22  ILE  17          HG22      ILE  17  36.142  16.858   2.923
  148   HG23  ILE  17          HG23      ILE  17  37.148  15.535   2.290
  149   HD11  ILE  17           HD1      ILE  17  38.659  18.222  -0.971
  150   HD12  ILE  17           HD2      ILE  17  38.794  19.561   0.189
  151   HD13  ILE  17           HD3      ILE  17  37.212  19.153  -0.512
  152    H    GLY  18           HN       GLY  18  38.285  16.108  -2.362
  153    HA2  GLY  18           HA1      GLY  18  36.523  17.459  -4.257
  154    HA3  GLY  18           HA2      GLY  18  37.805  18.514  -3.628
  155    H    GLY  19           HN       GLY  19  39.871  16.582  -3.343
  156    HA2  GLY  19           HA1      GLY  19  40.789  16.526  -6.097
  157    HA3  GLY  19           HA2      GLY  19  41.632  15.869  -4.681
  158    H    ALA  20           HN       ALA  20  39.280  14.227  -3.910
  159    HA   ALA  20           HA       ALA  20  38.641  12.022  -4.217
  160    HB1  ALA  20           HB1      ALA  20  38.601  12.976  -7.098
  161    HB2  ALA  20           HB2      ALA  20  37.240  12.935  -5.950
  162    HB3  ALA  20           HB3      ALA  20  37.944  11.415  -6.553
  163    H    LEU  21           HN       LEU  21  41.617  13.045  -4.885
  164    HA   LEU  21           HA       LEU  21  43.609  12.022  -5.496
  165    HB2  LEU  21           HB2      LEU  21  42.842  10.702  -3.469
  166    HB3  LEU  21           HB1      LEU  21  42.192   9.487  -4.587
  167    HG   LEU  21           HG       LEU  21  44.665   9.567  -5.626
  168   HD11  LEU  21          HD11      LEU  21  45.087  10.529  -2.759
  169   HD12  LEU  21          HD12      LEU  21  45.493  11.428  -4.240
  170   HD13  LEU  21          HD13      LEU  21  46.369   9.934  -3.837
  171   HD21  LEU  21          HD21      LEU  21  43.963   8.216  -2.982
  172   HD22  LEU  21          HD22      LEU  21  45.351   7.778  -4.006
  173   HD23  LEU  21          HD23      LEU  21  43.693   7.562  -4.615
  174    H    ASP  22           HN       ASP  22  42.708   8.841  -6.134
  175    HA   ASP  22           HA       ASP  22  42.658   7.615  -8.091
  176    HB2  ASP  22           HB2      ASP  22  41.190  10.049  -9.183
  177    HB3  ASP  22           HB1      ASP  22  41.198   8.417  -9.892
  178    H    HIS  23           HN       HIS  23  42.774  10.814  -9.683
  179    HA   HIS  23           HA       HIS  23  45.639  10.499 -10.310
  180    HB2  HIS  23           HB2      HIS  23  45.287  10.485 -12.764
  181    HB3  HIS  23           HB1      HIS  23  44.640   9.016 -11.995
  182    HD1  HIS  23           HD1      HIS  23  41.926   9.611 -11.081
  183    HD2  HIS  23           HD2      HIS  23  43.429  11.290 -14.632
  184    HE1  HIS  23           HE1      HIS  23  39.922  10.344 -12.487
  185    H    LEU  24           HN       LEU  24  42.936  12.305  -9.651
  186    HA   LEU  24           HA       LEU  24  43.587  14.661 -11.289
  187    HB2  LEU  24           HB2      LEU  24  41.822  14.575  -8.818
  188    HB3  LEU  24           HB1      LEU  24  41.752  15.709 -10.187
  189    HG   LEU  24           HG       LEU  24  41.102  12.728 -10.247
  190   HD11  LEU  24          HD11      LEU  24  39.406  14.332  -9.251
  191   HD12  LEU  24          HD12      LEU  24  38.835  13.461 -10.695
  192   HD13  LEU  24          HD13      LEU  24  39.355  15.158 -10.828
  193   HD21  LEU  24          HD21      LEU  24  40.363  13.368 -12.659
  194   HD22  LEU  24          HD22      LEU  24  42.107  13.183 -12.366
  195   HD23  LEU  24          HD23      LEU  24  41.387  14.810 -12.455
  Start of MODEL   55
    1    H1   GLY   1           HT1      GLY   1  59.601  -0.133  -1.497
    2    H2   GLY   1           HT2      GLY   1  59.247  -1.792  -1.597
    3    H3   GLY   1           HT3      GLY   1  59.850  -1.133  -0.152
    4    HA2  GLY   1           HA1      GLY   1  57.381  -0.078  -1.273
    5    HA3  GLY   1           HA2      GLY   1  57.354  -1.642  -0.437
    6    H    LYS   2           HN       LYS   2  55.956  -0.633   1.126
    7    HA   LYS   2           HA       LYS   2  55.538   0.499   3.115
    8    HB2  LYS   2           HB2      LYS   2  58.499   0.056   3.657
    9    HB3  LYS   2           HB1      LYS   2  57.182   0.197   4.845
   10    HG2  LYS   2           HG2      LYS   2  56.140  -1.870   3.824
   11    HG3  LYS   2           HG1      LYS   2  57.606  -2.049   2.829
   12    HD2  LYS   2           HD2      LYS   2  58.966  -2.049   4.958
   13    HD3  LYS   2           HD1      LYS   2  57.439  -2.075   5.873
   14    HE2  LYS   2           HE2      LYS   2  58.370  -4.364   5.576
   15    HE3  LYS   2           HE1      LYS   2  56.794  -4.186   4.770
   16    HZ1  LYS   2           HZ1      LYS   2  59.418  -3.864   3.405
   17    HZ2  LYS   2           HZ2      LYS   2  57.883  -3.884   2.679
   18    HZ3  LYS   2           HZ3      LYS   2  58.507  -5.294   3.392
   19    H    GLY   3           HN       GLY   3  57.815   1.931   4.579
   20    HA2  GLY   3           HA1      GLY   3  58.125   4.308   4.890
   21    HA3  GLY   3           HA2      GLY   3  58.836   4.153   3.189
   22    H    ARG   4           HN       ARG   4  56.549   3.952   5.292
   23    HA   ARG   4           HA       ARG   4  56.017   6.047   5.533
   24    HB2  ARG   4           HB2      ARG   4  54.536   5.632   2.990
   25    HB3  ARG   4           HB1      ARG   4  53.559   6.458   4.224
   26    HG2  ARG   4           HG2      ARG   4  54.823   8.403   4.179
   27    HG3  ARG   4           HG1      ARG   4  56.345   7.565   3.838
   28    HD2  ARG   4           HD2      ARG   4  55.698   8.891   1.889
   29    HD3  ARG   4           HD1      ARG   4  55.533   7.166   1.484
   30    HE   ARG   4           HE       ARG   4  53.038   8.209   2.498
   31   HH11  ARG   4          HH11      ARG   4  53.867   6.508  -0.024
   32   HH12  ARG   4          HH12      ARG   4  53.181   7.499  -1.267
   33   HH21  ARG   4          HH21      ARG   4  52.699  10.233   0.813
   34   HH22  ARG   4          HH22      ARG   4  52.520   9.608  -0.794
   35    H    TRP   5           HN       TRP   5  55.066   3.014   5.350
   36    HA   TRP   5           HA       TRP   5  52.492   2.568   6.206
   37    HB2  TRP   5           HB2      TRP   5  54.393   0.876   6.026
   38    HB3  TRP   5           HB1      TRP   5  54.876   1.375   7.665
   39    HD1  TRP   5           HD1      TRP   5  53.758   0.105   9.566
   40    HE1  TRP   5           HE1      TRP   5  51.656  -1.399   9.861
   41    HE3  TRP   5           HE3      TRP   5  51.760   0.582   4.876
   42    HZ2  TRP   5           HZ2      TRP   5  49.426  -2.259   8.254
   43    HZ3  TRP   5           HZ3      TRP   5  49.645  -0.590   4.278
   44    HH2  TRP   5           HH2      TRP   5  48.477  -2.008   5.961
   45    H    LEU   6           HN       LEU   6  54.976   4.331   7.873
   46    HA   LEU   6           HA       LEU   6  53.406   4.449  10.419
   47    HB2  LEU   6           HB2      LEU   6  56.235   5.183   9.599
   48    HB3  LEU   6           HB1      LEU   6  55.526   5.838  11.093
   49    HG   LEU   6           HG       LEU   6  55.048   3.523  11.869
   50   HD11  LEU   6          HD11      LEU   6  56.303   1.671  10.560
   51   HD12  LEU   6          HD12      LEU   6  56.340   2.825   9.205
   52   HD13  LEU   6          HD13      LEU   6  54.783   2.270   9.862
   53   HD21  LEU   6          HD21      LEU   6  57.398   2.900  12.319
   54   HD22  LEU   6          HD22      LEU   6  57.181   4.662  12.460
   55   HD23  LEU   6          HD23      LEU   6  57.941   3.971  11.006
   56    H    GLU   7           HN       GLU   7  54.269   6.336   7.536
   57    HA   GLU   7           HA       GLU   7  52.829   8.706   8.762
   58    HB2  GLU   7           HB2      GLU   7  55.378   8.879   8.185
   59    HB3  GLU   7           HB1      GLU   7  54.840   8.902   6.493
   60    HG2  GLU   7           HG2      GLU   7  54.982  11.201   7.172
   61    HG3  GLU   7           HG1      GLU   7  53.249  10.807   7.169
   62    H    ARG   8           HN       ARG   8  51.605   6.432   7.467
   63    HA   ARG   8           HA       ARG   8  50.972   7.252   4.716
   64    HB2  ARG   8           HB2      ARG   8  51.046   4.859   5.470
   65    HB3  ARG   8           HB1      ARG   8  49.632   5.178   6.498
   66    HG2  ARG   8           HG2      ARG   8  48.883   4.177   4.398
   67    HG3  ARG   8           HG1      ARG   8  48.342   5.868   4.459
   68    HD2  ARG   8           HD2      ARG   8  51.008   5.304   3.151
   69    HD3  ARG   8           HD1      ARG   8  49.530   4.858   2.266
   70    HE   ARG   8           HE       ARG   8  49.383   7.564   3.322
   71   HH11  ARG   8          HH11      ARG   8  49.092   5.793   0.565
   72   HH12  ARG   8          HH12      ARG   8  49.836   6.939  -0.499
   73   HH21  ARG   8          HH21      ARG   8  51.014   8.955   2.065
   74   HH22  ARG   8          HH22      ARG   8  50.925   8.729   0.350
   75    H    ILE   9           HN       ILE   9  50.133   9.364   4.956
   76    HA   ILE   9           HA       ILE   9  48.107  10.149   6.753
   77    HB   ILE   9           HB       ILE   9  49.350  11.709   5.250
   78   HG12  ILE   9          HG12      ILE   9  46.318  11.843   4.885
   79   HG13  ILE   9          HG11      ILE   9  47.179  12.333   6.362
   80   HG21  ILE   9          HG21      ILE   9  48.876  11.881   2.922
   81   HG22  ILE   9          HG22      ILE   9  47.428  10.856   3.048
   82   HG23  ILE   9          HG23      ILE   9  49.047  10.136   3.213
   83   HD11  ILE   9           HD1      ILE   9  47.361  13.570   3.589
   84   HD12  ILE   9           HD2      ILE   9  48.561  13.903   4.862
   85   HD13  ILE   9           HD3      ILE   9  46.855  14.345   5.107
   86    H    GLY  10           HN       GLY  10  47.812   8.674   3.503
   87    HA2  GLY  10           HA1      GLY  10  46.069   7.430   2.618
   88    HA3  GLY  10           HA2      GLY  10  45.334   7.380   4.232
   89    H    LYS  11           HN       LYS  11  44.302   9.494   4.962
   90    HA   LYS  11           HA       LYS  11  42.173  10.137   3.254
   91    HB2  LYS  11           HB2      LYS  11  43.453  11.847   5.422
   92    HB3  LYS  11           HB1      LYS  11  41.846  12.130   4.710
   93    HG2  LYS  11           HG2      LYS  11  41.019  10.015   5.535
   94    HG3  LYS  11           HG1      LYS  11  42.652   9.507   6.032
   95    HD2  LYS  11           HD2      LYS  11  42.742  11.210   7.749
   96    HD3  LYS  11           HD1      LYS  11  41.233  11.953   7.164
   97    HE2  LYS  11           HE2      LYS  11  40.888  10.510   9.188
   98    HE3  LYS  11           HE1      LYS  11  39.960   9.956   7.775
   99    HZ1  LYS  11           HZ1      LYS  11  41.349   8.270   9.140
  100    HZ2  LYS  11           HZ2      LYS  11  42.667   8.891   8.268
  101    HZ3  LYS  11           HZ3      LYS  11  41.362   8.177   7.447
  102    H    ALA  12           HN       ALA  12  42.360  10.858   1.228
  103    HA   ALA  12           HA       ALA  12  44.528  12.653   0.434
  104    HB1  ALA  12           HB1      ALA  12  43.577  12.516  -1.755
  105    HB2  ALA  12           HB2      ALA  12  42.008  11.975  -1.112
  106    HB3  ALA  12           HB3      ALA  12  43.424  10.899  -1.028
  107    H    GLY  13           HN       GLY  13  42.978  13.695   2.593
  108    HA2  GLY  13           HA1      GLY  13  42.156  15.779   3.190
  109    HA3  GLY  13           HA2      GLY  13  42.445  16.325   1.527
  110    H    PHE  14           HN       PHE  14  40.221  14.329   3.498
  111    HA   PHE  14           HA       PHE  14  37.940  13.966   3.273
  112    HB2  PHE  14           HB2      PHE  14  38.046  16.452   3.780
  113    HB3  PHE  14           HB1      PHE  14  37.895  16.743   2.030
  114    HD1  PHE  14           HD1      PHE  14  36.240  15.003   4.922
  115    HD2  PHE  14           HD2      PHE  14  35.748  16.716   0.991
  116    HE1  PHE  14           HE1      PHE  14  33.774  14.712   5.104
  117    HE2  PHE  14           HE2      PHE  14  33.281  16.425   1.173
  118    HZ   PHE  14           HZ       PHE  14  32.302  15.349   3.197
  119    H    ILE  15           HN       ILE  15  39.741  13.246   1.008
  120    HA   ILE  15           HA       ILE  15  39.520  12.417  -1.123
  121    HB   ILE  15           HB       ILE  15  36.502  12.733  -0.840
  122   HG12  ILE  15          HG12      ILE  15  38.308  10.518   0.241
  123   HG13  ILE  15          HG11      ILE  15  37.371  11.674   1.217
  124   HG21  ILE  15          HG21      ILE  15  36.393  10.902  -2.382
  125   HG22  ILE  15          HG22      ILE  15  38.124  10.532  -2.182
  126   HG23  ILE  15          HG23      ILE  15  37.620  12.007  -3.037
  127   HD11  ILE  15           HD1      ILE  15  35.294  10.775  -0.081
  128   HD12  ILE  15           HD2      ILE  15  36.008   9.732   1.172
  129   HD13  ILE  15           HD3      ILE  15  36.352   9.420  -0.545
  130    H    ILE  16           HN       ILE  16  40.411  14.694  -1.316
  131    HA   ILE  16           HA       ILE  16  38.784  16.141  -3.394
  132    HB   ILE  16           HB       ILE  16  40.541  17.315  -1.205
  133   HG12  ILE  16          HG12      ILE  16  38.128  16.498  -0.624
  134   HG13  ILE  16          HG11      ILE  16  38.599  18.136  -0.138
  135   HG21  ILE  16          HG21      ILE  16  40.822  18.654  -3.186
  136   HG22  ILE  16          HG22      ILE  16  39.671  19.528  -2.153
  137   HG23  ILE  16          HG23      ILE  16  39.083  18.599  -3.553
  138   HD11  ILE  16           HD1      ILE  16  36.288  17.921  -1.205
  139   HD12  ILE  16           HD2      ILE  16  37.109  17.562  -2.737
  140   HD13  ILE  16           HD3      ILE  16  37.356  19.132  -1.943
  141    H    ILE  17           HN       ILE  17  42.014  15.698  -1.885
  142    HA   ILE  17           HA       ILE  17  43.458  16.613  -4.219
  143    HB   ILE  17           HB       ILE  17  44.247  14.936  -1.791
  144   HG12  ILE  17          HG12      ILE  17  45.519  16.932  -1.182
  145   HG13  ILE  17          HG11      ILE  17  45.140  17.696  -2.742
  146   HG21  ILE  17          HG21      ILE  17  46.648  15.336  -2.647
  147   HG22  ILE  17          HG22      ILE  17  45.909  15.705  -4.225
  148   HG23  ILE  17          HG23      ILE  17  45.705  14.092  -3.500
  149   HD11  ILE  17           HD1      ILE  17  42.945  16.822  -0.830
  150   HD12  ILE  17           HD2      ILE  17  42.851  17.986  -2.174
  151   HD13  ILE  17           HD3      ILE  17  43.729  18.411  -0.688
  152    H    GLY  18           HN       GLY  18  42.507  13.424  -2.935
  153    HA2  GLY  18           HA1      GLY  18  43.575  12.021  -5.288
  154    HA3  GLY  18           HA2      GLY  18  42.674  11.312  -3.929
  155    H    GLY  19           HN       GLY  19  40.416  12.991  -3.942
  156    HA2  GLY  19           HA1      GLY  19  38.779  11.666  -5.849
  157    HA3  GLY  19           HA2      GLY  19  38.346  13.139  -4.960
  158    H    ALA  20           HN       ALA  20  40.387  14.849  -5.952
  159    HA   ALA  20           HA       ALA  20  39.123  15.586  -8.479
  160    HB1  ALA  20           HB1      ALA  20  39.987  17.204  -6.762
  161    HB2  ALA  20           HB2      ALA  20  40.574  17.503  -8.414
  162    HB3  ALA  20           HB3      ALA  20  41.637  16.722  -7.219
  163    H    LEU  21           HN       LEU  21  40.309  12.979  -8.589
  164    HA   LEU  21           HA       LEU  21  42.882  13.132  -9.909
  165    HB2  LEU  21           HB2      LEU  21  42.238  11.067  -8.840
  166    HB3  LEU  21           HB1      LEU  21  40.729  10.983  -9.773
  167    HG   LEU  21           HG       LEU  21  41.936  10.552 -11.832
  168   HD11  LEU  21          HD11      LEU  21  44.384  11.252 -10.165
  169   HD12  LEU  21          HD12      LEU  21  43.853  11.966 -11.706
  170   HD13  LEU  21          HD13      LEU  21  44.517  10.317 -11.674
  171   HD21  LEU  21          HD21      LEU  21  41.610   8.668 -10.160
  172   HD22  LEU  21          HD22      LEU  21  43.293   8.928  -9.639
  173   HD23  LEU  21          HD23      LEU  21  42.946   8.416 -11.309
  174    H    ASP  22           HN       ASP  22  43.164  14.175 -11.774
  175    HA   ASP  22           HA       ASP  22  42.799  14.889 -13.950
  176    HB2  ASP  22           HB2      ASP  22  42.952  12.424 -14.345
  177    HB3  ASP  22           HB1      ASP  22  41.182  12.322 -14.190
  178    H    HIS  23           HN       HIS  23  41.043  15.912 -11.964
  179    HA   HIS  23           HA       HIS  23  39.017  17.027 -11.761
  180    HB2  HIS  23           HB2      HIS  23  40.018  18.133 -13.799
  181    HB3  HIS  23           HB1      HIS  23  39.054  17.024 -14.805
  182    HD1  HIS  23           HD1      HIS  23  38.215  19.115 -11.674
  183    HD2  HIS  23           HD2      HIS  23  36.784  18.385 -15.562
  184    HE1  HIS  23           HE1      HIS  23  36.078  20.485 -11.969
  185    H    LEU  24           HN       LEU  24  38.674  14.369 -11.398
  186    HA   LEU  24           HA       LEU  24  35.896  14.036 -12.118
  187    HB2  LEU  24           HB2      LEU  24  37.337  13.367 -14.239
  188    HB3  LEU  24           HB1      LEU  24  37.664  11.888 -13.322
  189    HG   LEU  24           HG       LEU  24  35.769  11.422 -14.709
  190   HD11  LEU  24          HD11      LEU  24  34.576  12.082 -11.984
  191   HD12  LEU  24          HD12      LEU  24  35.655  10.700 -12.283
  192   HD13  LEU  24          HD13      LEU  24  34.087  10.800 -13.113
  193   HD21  LEU  24          HD21      LEU  24  33.907  12.813 -15.080
  194   HD22  LEU  24          HD22      LEU  24  35.223  13.997 -14.956
  195   HD23  LEU  24          HD23      LEU  24  34.138  13.727 -13.576
  Start of MODEL   56
    1    H1   GLY   1           HT1      GLY   1  59.708   5.416   6.764
    2    H2   GLY   1           HT2      GLY   1  59.719   4.088   7.824
    3    H3   GLY   1           HT3      GLY   1  58.280   4.949   7.548
    4    HA2  GLY   1           HA1      GLY   1  59.751   3.534   5.434
    5    HA3  GLY   1           HA2      GLY   1  58.478   2.773   6.411
    6    H    LYS   2           HN       LYS   2  59.090   5.757   4.508
    7    HA   LYS   2           HA       LYS   2  56.308   6.294   4.035
    8    HB2  LYS   2           HB2      LYS   2  58.507   7.754   3.665
    9    HB3  LYS   2           HB1      LYS   2  58.455   7.061   2.033
   10    HG2  LYS   2           HG2      LYS   2  57.151   8.984   1.708
   11    HG3  LYS   2           HG1      LYS   2  55.887   7.808   2.128
   12    HD2  LYS   2           HD2      LYS   2  55.334   9.576   3.566
   13    HD3  LYS   2           HD1      LYS   2  56.384   8.612   4.626
   14    HE2  LYS   2           HE2      LYS   2  57.003  10.996   4.736
   15    HE3  LYS   2           HE1      LYS   2  58.319  10.064   3.986
   16    HZ1  LYS   2           HZ1      LYS   2  56.220  11.283   2.306
   17    HZ2  LYS   2           HZ2      LYS   2  57.819  10.876   1.902
   18    HZ3  LYS   2           HZ3      LYS   2  57.505  12.233   2.875
   19    H    GLY   3           HN       GLY   3  56.731   6.624   1.038
   20    HA2  GLY   3           HA1      GLY   3  55.542   5.376  -0.694
   21    HA3  GLY   3           HA2      GLY   3  57.033   4.313  -0.451
   22    H    ARG   4           HN       ARG   4  54.382   5.667   0.472
   23    HA   ARG   4           HA       ARG   4  52.913   4.402  -0.530
   24    HB2  ARG   4           HB2      ARG   4  53.444   2.554   1.737
   25    HB3  ARG   4           HB1      ARG   4  51.707   2.794   1.441
   26    HG2  ARG   4           HG2      ARG   4  51.720   1.692  -0.600
   27    HG3  ARG   4           HG1      ARG   4  53.362   2.197  -1.018
   28    HD2  ARG   4           HD2      ARG   4  54.296   0.549   0.559
   29    HD3  ARG   4           HD1      ARG   4  52.657   0.099   1.082
   30    HE   ARG   4           HE       ARG   4  52.838  -0.222  -1.756
   31   HH11  ARG   4          HH11      ARG   4  53.702  -2.152  -2.654
   32   HH12  ARG   4          HH12      ARG   4  54.042  -3.475  -1.589
   33   HH21  ARG   4          HH21      ARG   4  53.410  -1.662   1.297
   34   HH22  ARG   4          HH22      ARG   4  53.877  -3.198   0.647
   35    H    TRP   5           HN       TRP   5  53.722   6.093   2.069
   36    HA   TRP   5           HA       TRP   5  51.566   6.609   3.734
   37    HB2  TRP   5           HB2      TRP   5  53.782   7.803   3.729
   38    HB3  TRP   5           HB1      TRP   5  53.188   8.769   2.354
   39    HD1  TRP   5           HD1      TRP   5  51.569  10.723   2.859
   40    HE1  TRP   5           HE1      TRP   5  50.548  11.769   5.010
   41    HE3  TRP   5           HE3      TRP   5  52.920   7.115   6.231
   42    HZ2  TRP   5           HZ2      TRP   5  50.362  11.102   7.804
   43    HZ3  TRP   5           HZ3      TRP   5  52.311   7.341   8.635
   44    HH2  TRP   5           HH2      TRP   5  51.035   9.330   9.423
   45    H    LEU   6           HN       LEU   6  51.795   7.087   0.326
   46    HA   LEU   6           HA       LEU   6  49.350   8.799   0.212
   47    HB2  LEU   6           HB2      LEU   6  51.081   7.814  -2.087
   48    HB3  LEU   6           HB1      LEU   6  49.911   9.151  -2.096
   49    HG   LEU   6           HG       LEU   6  52.444   9.092  -0.389
   50   HD11  LEU   6          HD11      LEU   6  52.898   9.145  -2.853
   51   HD12  LEU   6          HD12      LEU   6  53.385  10.645  -2.027
   52   HD13  LEU   6          HD13      LEU   6  51.880  10.600  -2.978
   53   HD21  LEU   6          HD21      LEU   6  50.833  10.566   0.612
   54   HD22  LEU   6          HD22      LEU   6  50.305  11.186  -0.970
   55   HD23  LEU   6          HD23      LEU   6  51.909  11.616  -0.335
   56    H    GLU   7           HN       GLU   7  50.476   5.466  -0.245
   57    HA   GLU   7           HA       GLU   7  48.320   4.686  -2.019
   58    HB2  GLU   7           HB2      GLU   7  50.387   3.344  -1.644
   59    HB3  GLU   7           HB1      GLU   7  49.827   2.987   0.007
   60    HG2  GLU   7           HG2      GLU   7  47.885   1.812  -0.818
   61    HG3  GLU   7           HG1      GLU   7  48.180   2.370  -2.482
   62    H    ARG   8           HN       ARG   8  48.458   5.500   1.321
   63    HA   ARG   8           HA       ARG   8  46.084   3.929   2.087
   64    HB2  ARG   8           HB2      ARG   8  47.273   6.258   3.634
   65    HB3  ARG   8           HB1      ARG   8  46.401   4.836   4.254
   66    HG2  ARG   8           HG2      ARG   8  49.171   4.854   2.974
   67    HG3  ARG   8           HG1      ARG   8  48.797   4.578   4.691
   68    HD2  ARG   8           HD2      ARG   8  48.150   2.794   2.319
   69    HD3  ARG   8           HD1      ARG   8  49.104   2.401   3.768
   70    HE   ARG   8           HE       ARG   8  46.531   3.066   4.695
   71   HH11  ARG   8          HH11      ARG   8  47.022   1.301   1.901
   72   HH12  ARG   8          HH12      ARG   8  46.292  -0.162   2.477
   73   HH21  ARG   8          HH21      ARG   8  46.007   0.955   5.747
   74   HH22  ARG   8          HH22      ARG   8  45.716  -0.356   4.654
   75    H    ILE   9           HN       ILE   9  45.441   5.354  -0.165
   76    HA   ILE   9           HA       ILE   9  44.460   7.953   0.130
   77    HB   ILE   9           HB       ILE   9  44.404   6.834  -2.035
   78   HG12  ILE   9          HG12      ILE   9  42.177   7.446  -2.821
   79   HG13  ILE   9          HG11      ILE   9  41.515   7.357  -1.176
   80   HG21  ILE   9          HG21      ILE   9  43.043   4.941  -2.544
   81   HG22  ILE   9          HG22      ILE   9  42.132   5.082  -1.024
   82   HG23  ILE   9          HG23      ILE   9  43.831   4.554  -0.998
   83   HD11  ILE   9           HD1      ILE   9  42.643   9.322  -0.483
   84   HD12  ILE   9           HD2      ILE   9  42.140   9.708  -2.145
   85   HD13  ILE   9           HD3      ILE   9  43.823   9.229  -1.815
   86    H    GLY  10           HN       GLY  10  43.088   8.879   1.470
   87    HA2  GLY  10           HA1      GLY  10  40.657   8.848   2.170
   88    HA3  GLY  10           HA2      GLY  10  40.927   7.183   2.721
   89    H    LYS  11           HN       LYS  11  43.101  10.000   3.037
   90    HA   LYS  11           HA       LYS  11  43.831   9.487   5.699
   91    HB2  LYS  11           HB2      LYS  11  44.813  11.218   4.088
   92    HB3  LYS  11           HB1      LYS  11  43.470  12.284   4.562
   93    HG2  LYS  11           HG2      LYS  11  44.168  11.968   6.974
   94    HG3  LYS  11           HG1      LYS  11  45.606  11.098   6.385
   95    HD2  LYS  11           HD2      LYS  11  46.251  13.100   5.050
   96    HD3  LYS  11           HD1      LYS  11  44.840  13.970   5.698
   97    HE2  LYS  11           HE2      LYS  11  46.995  12.731   7.458
   98    HE3  LYS  11           HE1      LYS  11  47.030  14.426   6.914
   99    HZ1  LYS  11           HZ1      LYS  11  45.622  14.937   8.527
  100    HZ2  LYS  11           HZ2      LYS  11  45.612  13.325   9.063
  101    HZ3  LYS  11           HZ3      LYS  11  44.470  13.850   7.919
  102    H    ALA  12           HN       ALA  12  40.972  11.102   4.388
  103    HA   ALA  12           HA       ALA  12  39.634  10.834   7.005
  104    HB1  ALA  12           HB1      ALA  12  39.966  13.571   5.743
  105    HB2  ALA  12           HB2      ALA  12  40.870  13.002   7.165
  106    HB3  ALA  12           HB3      ALA  12  39.100  13.183   7.247
  107    H    GLY  13           HN       GLY  13  39.740  11.247   3.599
  108    HA2  GLY  13           HA1      GLY  13  38.091  10.892   2.010
  109    HA3  GLY  13           HA2      GLY  13  37.008  10.360   3.313
  110    H    PHE  14           HN       PHE  14  38.611  13.497   3.285
  111    HA   PHE  14           HA       PHE  14  36.232  14.877   2.211
  112    HB2  PHE  14           HB2      PHE  14  37.031  15.104   5.139
  113    HB3  PHE  14           HB1      PHE  14  35.967  16.259   4.300
  114    HD1  PHE  14           HD1      PHE  14  36.016  13.259   6.221
  115    HD2  PHE  14           HD2      PHE  14  33.978  15.146   2.914
  116    HE1  PHE  14           HE1      PHE  14  34.063  11.752   6.563
  117    HE2  PHE  14           HE2      PHE  14  32.027  13.637   3.259
  118    HZ   PHE  14           HZ       PHE  14  32.101  11.892   5.036
  119    H    ILE  15           HN       ILE  15  39.521  14.597   2.970
  120    HA   ILE  15           HA       ILE  15  40.079  17.155   1.619
  121    HB   ILE  15           HB       ILE  15  41.681  17.903   3.413
  122   HG12  ILE  15          HG12      ILE  15  40.171  15.834   5.077
  123   HG13  ILE  15          HG11      ILE  15  41.862  15.682   4.547
  124   HG21  ILE  15          HG21      ILE  15  39.283  18.779   3.117
  125   HG22  ILE  15          HG22      ILE  15  40.005  19.021   4.721
  126   HG23  ILE  15          HG23      ILE  15  38.828  17.711   4.464
  127   HD11  ILE  15           HD1      ILE  15  42.225  17.980   5.731
  128   HD12  ILE  15           HD2      ILE  15  42.032  16.536   6.754
  129   HD13  ILE  15           HD3      ILE  15  40.665  17.651   6.525
  130    H    ILE  16           HN       ILE  16  40.411  14.539   0.798
  131    HA   ILE  16           HA       ILE  16  43.362  14.519   0.464
  132    HB   ILE  16           HB       ILE  16  42.812  13.045   2.433
  133   HG12  ILE  16          HG12      ILE  16  44.024  11.007   1.514
  134   HG13  ILE  16          HG11      ILE  16  43.878  11.718  -0.108
  135   HG21  ILE  16          HG21      ILE  16  41.483  11.228   0.390
  136   HG22  ILE  16          HG22      ILE  16  40.564  12.336   1.438
  137   HG23  ILE  16          HG23      ILE  16  41.545  11.037   2.158
  138   HD11  ILE  16           HD1      ILE  16  45.420  13.430   0.354
  139   HD12  ILE  16           HD2      ILE  16  46.080  12.116   1.350
  140   HD13  ILE  16           HD3      ILE  16  45.103  13.393   2.105
  141    H    ILE  17           HN       ILE  17  40.189  13.059  -0.282
  142    HA   ILE  17           HA       ILE  17  41.131  12.045  -2.867
  143    HB   ILE  17           HB       ILE  17  39.290  10.865  -1.753
  144   HG12  ILE  17          HG12      ILE  17  37.656  10.780  -3.558
  145   HG13  ILE  17          HG11      ILE  17  38.136  12.386  -4.140
  146   HG21  ILE  17          HG21      ILE  17  38.425  12.889  -0.527
  147   HG22  ILE  17          HG22      ILE  17  37.147  11.922  -1.296
  148   HG23  ILE  17          HG23      ILE  17  37.686  13.440  -2.049
  149   HD11  ILE  17           HD1      ILE  17  40.205  11.599  -4.984
  150   HD12  ILE  17           HD2      ILE  17  39.086  10.270  -5.365
  151   HD13  ILE  17           HD3      ILE  17  40.175  10.140  -3.964
  152    H    GLY  18           HN       GLY  18  39.350  14.829  -1.590
  153    HA2  GLY  18           HA1      GLY  18  38.961  15.968  -4.298
  154    HA3  GLY  18           HA2      GLY  18  38.405  16.648  -2.755
  155    H    GLY  19           HN       GLY  19  40.846  16.539  -1.325
  156    HA2  GLY  19           HA1      GLY  19  42.010  19.012  -2.169
  157    HA3  GLY  19           HA2      GLY  19  42.667  17.910  -0.943
  158    H    ALA  20           HN       ALA  20  42.956  15.609  -2.625
  159    HA   ALA  20           HA       ALA  20  45.571  16.036  -3.617
  160    HB1  ALA  20           HB1      ALA  20  44.838  13.806  -3.178
  161    HB2  ALA  20           HB2      ALA  20  45.130  13.900  -4.931
  162    HB3  ALA  20           HB3      ALA  20  43.467  13.962  -4.300
  163    H    LEU  21           HN       LEU  21  42.796  15.232  -5.740
  164    HA   LEU  21           HA       LEU  21  42.246  16.013  -7.844
  165    HB2  LEU  21           HB2      LEU  21  42.442  18.245  -6.428
  166    HB3  LEU  21           HB1      LEU  21  43.898  18.521  -7.405
  167    HG   LEU  21           HG       LEU  21  41.088  17.999  -8.486
  168   HD11  LEU  21          HD11      LEU  21  42.819  20.513  -8.456
  169   HD12  LEU  21          HD12      LEU  21  41.377  20.233  -7.450
  170   HD13  LEU  21          HD13      LEU  21  41.218  20.362  -9.218
  171   HD21  LEU  21          HD21      LEU  21  43.799  18.404  -9.815
  172   HD22  LEU  21          HD22      LEU  21  42.281  18.779 -10.668
  173   HD23  LEU  21          HD23      LEU  21  42.599  17.122 -10.108
  174    H    ASP  22           HN       ASP  22  43.460  14.361  -8.822
  175    HA   ASP  22           HA       ASP  22  45.521  15.333 -10.612
  176    HB2  ASP  22           HB2      ASP  22  47.347  13.840  -9.776
  177    HB3  ASP  22           HB1      ASP  22  46.945  15.146  -8.635
  178    H    HIS  23           HN       HIS  23  46.411  12.218  -9.900
  179    HA   HIS  23           HA       HIS  23  45.102  11.155 -12.249
  180    HB2  HIS  23           HB2      HIS  23  46.403   9.610  -9.971
  181    HB3  HIS  23           HB1      HIS  23  46.153   9.059 -11.646
  182    HD1  HIS  23           HD1      HIS  23  49.014   9.273 -10.304
  183    HD2  HIS  23           HD2      HIS  23  47.256  12.233 -12.721
  184    HE1  HIS  23           HE1      HIS  23  50.908  10.674 -11.290
  185    H    LEU  24           HN       LEU  24  44.072  11.716  -9.059
  186    HA   LEU  24           HA       LEU  24  42.144   9.469  -8.968
  187    HB2  LEU  24           HB2      LEU  24  42.439  11.902  -7.162
  188    HB3  LEU  24           HB1      LEU  24  41.495  10.436  -6.817
  189    HG   LEU  24           HG       LEU  24  44.508  10.456  -7.312
  190   HD11  LEU  24          HD11      LEU  24  44.741  10.227  -4.874
  191   HD12  LEU  24          HD12      LEU  24  42.974  10.313  -4.678
  192   HD13  LEU  24          HD13      LEU  24  43.875  11.732  -5.266
  193   HD21  LEU  24          HD21      LEU  24  44.209   8.186  -6.043
  194   HD22  LEU  24          HD22      LEU  24  43.713   8.255  -7.745
  195   HD23  LEU  24          HD23      LEU  24  42.486   8.341  -6.460
  Start of MODEL   57
    1    H1   GLY   1           HT1      GLY   1  58.913  -2.302   0.727
    2    H2   GLY   1           HT2      GLY   1  60.301  -1.434   0.269
    3    H3   GLY   1           HT3      GLY   1  58.832  -0.622   0.530
    4    HA2  GLY   1           HA1      GLY   1  59.836  -2.206   2.719
    5    HA3  GLY   1           HA2      GLY   1  60.758  -0.749   2.301
    6    H    LYS   2           HN       LYS   2  59.862  -0.517   4.681
    7    HA   LYS   2           HA       LYS   2  57.098   0.308   4.931
    8    HB2  LYS   2           HB2      LYS   2  59.541   0.843   6.664
    9    HB3  LYS   2           HB1      LYS   2  57.871   1.253   7.121
   10    HG2  LYS   2           HG2      LYS   2  57.204  -1.088   7.004
   11    HG3  LYS   2           HG1      LYS   2  58.800  -1.550   6.367
   12    HD2  LYS   2           HD2      LYS   2  59.859  -0.744   8.471
   13    HD3  LYS   2           HD1      LYS   2  58.248  -0.339   9.112
   14    HE2  LYS   2           HE2      LYS   2  59.100  -3.125   8.205
   15    HE3  LYS   2           HE1      LYS   2  59.078  -2.574   9.898
   16    HZ1  LYS   2           HZ1      LYS   2  56.824  -3.068   8.066
   17    HZ2  LYS   2           HZ2      LYS   2  56.646  -1.924   9.308
   18    HZ3  LYS   2           HZ3      LYS   2  57.020  -3.538   9.682
   19    H    GLY   3           HN       GLY   3  56.961   2.658   6.175
   20    HA2  GLY   3           HA1      GLY   3  57.902   5.031   5.818
   21    HA3  GLY   3           HA2      GLY   3  57.879   4.658   4.033
   22    H    ARG   4           HN       ARG   4  56.449   3.498   3.315
   23    HA   ARG   4           HA       ARG   4  55.608   5.685   2.697
   24    HB2  ARG   4           HB2      ARG   4  54.268   3.097   1.788
   25    HB3  ARG   4           HB1      ARG   4  54.025   4.665   0.984
   26    HG2  ARG   4           HG2      ARG   4  56.442   4.865   0.569
   27    HG3  ARG   4           HG1      ARG   4  56.737   3.342   1.442
   28    HD2  ARG   4           HD2      ARG   4  55.412   2.100  -0.214
   29    HD3  ARG   4           HD1      ARG   4  55.019   3.613  -1.065
   30    HE   ARG   4           HE       ARG   4  57.066   3.293  -2.177
   31   HH11  ARG   4          HH11      ARG   4  57.091   1.186   0.446
   32   HH12  ARG   4          HH12      ARG   4  58.813   1.151   0.624
   33   HH21  ARG   4          HH21      ARG   4  59.370   3.673  -1.691
   34   HH22  ARG   4          HH22      ARG   4  60.103   2.560  -0.584
   35    H    TRP   5           HN       TRP   5  54.432   3.921   5.076
   36    HA   TRP   5           HA       TRP   5  51.656   4.004   5.305
   37    HB2  TRP   5           HB2      TRP   5  53.262   3.224   7.066
   38    HB3  TRP   5           HB1      TRP   5  53.573   4.931   7.469
   39    HD1  TRP   5           HD1      TRP   5  52.110   5.845   9.325
   40    HE1  TRP   5           HE1      TRP   5  49.785   5.307  10.356
   41    HE3  TRP   5           HE3      TRP   5  50.704   2.033   6.206
   42    HZ2  TRP   5           HZ2      TRP   5  47.628   3.464   9.867
   43    HZ3  TRP   5           HZ3      TRP   5  48.507   0.902   6.506
   44    HH2  TRP   5           HH2      TRP   5  46.970   1.613   8.333
   45    H    LEU   6           HN       LEU   6  53.814   6.679   4.995
   46    HA   LEU   6           HA       LEU   6  51.656   8.634   5.755
   47    HB2  LEU   6           HB2      LEU   6  54.598   9.228   5.284
   48    HB3  LEU   6           HB1      LEU   6  53.384  10.237   6.105
   49    HG   LEU   6           HG       LEU   6  54.414   7.535   7.087
   50   HD11  LEU   6          HD11      LEU   6  55.571   8.802   8.795
   51   HD12  LEU   6          HD12      LEU   6  54.812  10.320   8.258
   52   HD13  LEU   6          HD13      LEU   6  56.006   9.506   7.219
   53   HD21  LEU   6          HD21      LEU   6  52.324   9.493   8.133
   54   HD22  LEU   6          HD22      LEU   6  53.153   8.345   9.214
   55   HD23  LEU   6          HD23      LEU   6  52.164   7.739   7.867
   56    H    GLU   7           HN       GLU   7  53.538   7.312   3.071
   57    HA   GLU   7           HA       GLU   7  53.168   9.655   1.368
   58    HB2  GLU   7           HB2      GLU   7  54.868   7.663   1.146
   59    HB3  GLU   7           HB1      GLU   7  53.533   6.835   0.316
   60    HG2  GLU   7           HG2      GLU   7  54.800   7.922  -1.405
   61    HG3  GLU   7           HG1      GLU   7  53.338   8.910  -1.177
   62    H    ARG   8           HN       ARG   8  51.050   7.344   2.603
   63    HA   ARG   8           HA       ARG   8  49.332   6.757   0.439
   64    HB2  ARG   8           HB2      ARG   8  49.261   5.925   2.891
   65    HB3  ARG   8           HB1      ARG   8  48.338   7.403   3.237
   66    HG2  ARG   8           HG2      ARG   8  46.581   5.932   2.758
   67    HG3  ARG   8           HG1      ARG   8  46.872   6.599   1.137
   68    HD2  ARG   8           HD2      ARG   8  48.541   4.592   0.860
   69    HD3  ARG   8           HD1      ARG   8  47.689   3.899   2.259
   70    HE   ARG   8           HE       ARG   8  46.648   4.072  -0.440
   71   HH11  ARG   8          HH11      ARG   8  44.316   4.437  -0.596
   72   HH12  ARG   8          HH12      ARG   8  43.353   3.834   0.712
   73   HH21  ARG   8          HH21      ARG   8  46.072   3.201   2.770
   74   HH22  ARG   8          HH22      ARG   8  44.348   3.134   2.618
   75    H    ILE   9           HN       ILE   9  48.181   7.981  -0.887
   76    HA   ILE   9           HA       ILE   9  47.972  10.834  -0.473
   77    HB   ILE   9           HB       ILE   9  46.432  10.755  -2.486
   78   HG12  ILE   9          HG12      ILE   9  46.437   8.518  -3.720
   79   HG13  ILE   9          HG11      ILE   9  47.022   7.763  -2.225
   80   HG21  ILE   9          HG21      ILE   9  48.233  10.078  -4.036
   81   HG22  ILE   9          HG22      ILE   9  49.077   9.254  -2.702
   82   HG23  ILE   9          HG23      ILE   9  48.884  11.023  -2.676
   83   HD11  ILE   9           HD1      ILE   9  44.395   7.871  -2.804
   84   HD12  ILE   9           HD2      ILE   9  44.531   9.477  -2.054
   85   HD13  ILE   9           HD3      ILE   9  44.969   8.020  -1.130
   86    H    GLY  10           HN       GLY  10  46.368   8.357   1.028
   87    HA2  GLY  10           HA1      GLY  10  43.664   9.444   0.993
   88    HA3  GLY  10           HA2      GLY  10  44.289   8.172   2.061
   89    H    LYS  11           HN       LYS  11  44.457  11.704   1.485
   90    HA   LYS  11           HA       LYS  11  45.520  12.470   3.974
   91    HB2  LYS  11           HB2      LYS  11  44.999  13.978   2.007
   92    HB3  LYS  11           HB1      LYS  11  43.287  13.917   2.494
   93    HG2  LYS  11           HG2      LYS  11  43.765  14.953   4.620
   94    HG3  LYS  11           HG1      LYS  11  45.519  14.780   4.384
   95    HD2  LYS  11           HD2      LYS  11  44.897  17.088   3.909
   96    HD3  LYS  11           HD1      LYS  11  45.357  16.294   2.385
   97    HE2  LYS  11           HE2      LYS  11  43.102  16.117   1.660
   98    HE3  LYS  11           HE1      LYS  11  42.456  16.400   3.295
   99    HZ1  LYS  11           HZ1      LYS  11  42.477  18.312   1.570
  100    HZ2  LYS  11           HZ2      LYS  11  44.116  18.463   1.994
  101    HZ3  LYS  11           HZ3      LYS  11  42.909  18.637   3.177
  102    H    ALA  12           HN       ALA  12  42.294  11.370   3.100
  103    HA   ALA  12           HA       ALA  12  41.650  10.881   5.902
  104    HB1  ALA  12           HB1      ALA  12  41.174  13.267   5.863
  105    HB2  ALA  12           HB2      ALA  12  39.647  12.355   5.942
  106    HB3  ALA  12           HB3      ALA  12  40.180  13.073   4.402
  107    H    GLY  13           HN       GLY  13  41.433  10.344   2.635
  108    HA2  GLY  13           HA1      GLY  13  40.088   8.997   1.317
  109    HA3  GLY  13           HA2      GLY  13  39.905   8.020   2.788
  110    H    PHE  14           HN       PHE  14  38.808  11.365   2.486
  111    HA   PHE  14           HA       PHE  14  35.986  10.467   2.093
  112    HB2  PHE  14           HB2      PHE  14  36.464  10.473   4.577
  113    HB3  PHE  14           HB1      PHE  14  36.809  12.213   4.447
  114    HD1  PHE  14           HD1      PHE  14  35.013  13.708   4.816
  115    HD2  PHE  14           HD2      PHE  14  34.170   9.714   3.402
  116    HE1  PHE  14           HE1      PHE  14  32.572  14.178   4.936
  117    HE2  PHE  14           HE2      PHE  14  31.729  10.190   3.523
  118    HZ   PHE  14           HZ       PHE  14  30.933  12.441   4.230
  119    H    ILE  15           HN       ILE  15  38.561  12.613   1.647
  120    HA   ILE  15           HA       ILE  15  36.879  14.358  -0.020
  121    HB   ILE  15           HB       ILE  15  37.726  16.470   1.056
  122   HG12  ILE  15          HG12      ILE  15  38.563  14.510   3.245
  123   HG13  ILE  15          HG11      ILE  15  39.648  15.513   2.254
  124   HG21  ILE  15          HG21      ILE  15  36.021  16.553   2.732
  125   HG22  ILE  15          HG22      ILE  15  36.136  14.806   3.048
  126   HG23  ILE  15          HG23      ILE  15  35.431  15.391   1.523
  127   HD11  ILE  15           HD1      ILE  15  37.689  16.399   4.398
  128   HD12  ILE  15           HD2      ILE  15  38.302  17.541   3.177
  129   HD13  ILE  15           HD3      ILE  15  39.432  16.726   4.284
  130    H    ILE  16           HN       ILE  16  38.968  12.467  -0.469
  131    HA   ILE  16           HA       ILE  16  40.842  14.264  -1.896
  132    HB   ILE  16           HB       ILE  16  41.831  13.800   0.409
  133   HG12  ILE  16          HG12      ILE  16  44.078  13.079  -0.516
  134   HG13  ILE  16          HG11      ILE  16  43.282  12.751  -2.070
  135   HG21  ILE  16          HG21      ILE  16  42.235  10.981  -0.660
  136   HG22  ILE  16          HG22      ILE  16  40.909  11.412   0.446
  137   HG23  ILE  16          HG23      ILE  16  42.600  11.604   0.966
  138   HD11  ILE  16           HD1      ILE  16  44.454  15.118  -1.589
  139   HD12  ILE  16           HD2      ILE  16  42.897  15.484  -0.816
  140   HD13  ILE  16           HD3      ILE  16  42.953  15.026  -2.534
  141    H    ILE  17           HN       ILE  17  39.230  11.256  -1.337
  142    HA   ILE  17           HA       ILE  17  40.597   9.895  -3.603
  143    HB   ILE  17           HB       ILE  17  38.750   8.093  -3.030
  144   HG12  ILE  17          HG12      ILE  17  37.926   8.212  -0.711
  145   HG13  ILE  17          HG11      ILE  17  38.722   9.781  -0.481
  146   HG21  ILE  17          HG21      ILE  17  40.946   8.823  -1.042
  147   HG22  ILE  17          HG22      ILE  17  41.146   7.837  -2.511
  148   HG23  ILE  17          HG23      ILE  17  40.148   7.237  -1.165
  149   HD11  ILE  17           HD1      ILE  17  36.681   9.356  -2.694
  150   HD12  ILE  17           HD2      ILE  17  37.229  10.887  -1.963
  151   HD13  ILE  17           HD3      ILE  17  36.185   9.784  -1.041
  152    H    GLY  18           HN       GLY  18  38.435  12.302  -3.398
  153    HA2  GLY  18           HA1      GLY  18  37.394  11.793  -6.063
  154    HA3  GLY  18           HA2      GLY  18  36.144  11.621  -4.814
  155    H    GLY  19           HN       GLY  19  37.218  13.612  -3.016
  156    HA2  GLY  19           HA1      GLY  19  36.003  15.949  -4.255
  157    HA3  GLY  19           HA2      GLY  19  36.720  15.852  -2.635
  158    H    ALA  20           HN       ALA  20  39.057  14.609  -4.513
  159    HA   ALA  20           HA       ALA  20  40.697  16.977  -4.336
  160    HB1  ALA  20           HB1      ALA  20  41.460  14.550  -4.314
  161    HB2  ALA  20           HB2      ALA  20  42.404  15.651  -5.344
  162    HB3  ALA  20           HB3      ALA  20  41.213  14.547  -6.075
  163    H    LEU  21           HN       LEU  21  39.421  15.178  -7.178
  164    HA   LEU  21           HA       LEU  21  38.880  15.924  -9.296
  165    HB2  LEU  21           HB2      LEU  21  37.633  17.675  -7.777
  166    HB3  LEU  21           HB1      LEU  21  38.910  18.791  -8.304
  167    HG   LEU  21           HG       LEU  21  38.268  17.905 -10.745
  168   HD11  LEU  21          HD11      LEU  21  35.811  17.447 -10.907
  169   HD12  LEU  21          HD12      LEU  21  35.727  17.375  -9.133
  170   HD13  LEU  21          HD13      LEU  21  36.679  16.169 -10.030
  171   HD21  LEU  21          HD21      LEU  21  36.585  19.732 -10.926
  172   HD22  LEU  21          HD22      LEU  21  38.009  20.239  -9.987
  173   HD23  LEU  21          HD23      LEU  21  36.497  19.814  -9.151
  174    H    ASP  22           HN       ASP  22  41.699  16.584  -7.733
  175    HA   ASP  22           HA       ASP  22  42.949  18.351  -9.706
  176    HB2  ASP  22           HB2      ASP  22  43.672  18.205  -7.314
  177    HB3  ASP  22           HB1      ASP  22  44.246  16.549  -7.624
  178    H    HIS  23           HN       HIS  23  41.631  15.913 -10.735
  179    HA   HIS  23           HA       HIS  23  42.075  14.182 -12.219
  180    HB2  HIS  23           HB2      HIS  23  44.492  15.947 -12.775
  181    HB3  HIS  23           HB1      HIS  23  43.958  14.597 -13.807
  182    HD1  HIS  23           HD1      HIS  23  43.324  18.172 -13.039
  183    HD2  HIS  23           HD2      HIS  23  41.347  15.044 -15.035
  184    HE1  HIS  23           HE1      HIS  23  41.426  19.213 -14.395
  185    H    LEU  24           HN       LEU  24  42.486  13.039 -10.018
  186    HA   LEU  24           HA       LEU  24  44.774  11.310 -10.434
  187    HB2  LEU  24           HB2      LEU  24  45.670  13.514  -9.291
  188    HB3  LEU  24           HB1      LEU  24  44.931  12.846  -7.821
  189    HG   LEU  24           HG       LEU  24  46.998  11.441  -9.580
  190   HD11  LEU  24          HD11      LEU  24  48.519  11.804  -7.689
  191   HD12  LEU  24          HD12      LEU  24  47.221  12.599  -6.766
  192   HD13  LEU  24          HD13      LEU  24  47.866  13.365  -8.237
  193   HD21  LEU  24          HD21      LEU  24  45.689   9.708  -8.616
  194   HD22  LEU  24          HD22      LEU  24  45.442  10.608  -7.099
  195   HD23  LEU  24          HD23      LEU  24  47.032   9.897  -7.467
  Start of MODEL   58
    1    H1   GLY   1           HT1      GLY   1  59.017   1.895  -1.001
    2    H2   GLY   1           HT2      GLY   1  60.494   1.231  -0.485
    3    H3   GLY   1           HT3      GLY   1  60.460   2.348  -1.765
    4    HA2  GLY   1           HA1      GLY   1  60.387   2.755   1.078
    5    HA3  GLY   1           HA2      GLY   1  61.039   3.784  -0.214
    6    H    LYS   2           HN       LYS   2  57.833   2.550  -0.643
    7    HA   LYS   2           HA       LYS   2  56.456   4.715   0.721
    8    HB2  LYS   2           HB2      LYS   2  57.617   5.717  -1.451
    9    HB3  LYS   2           HB1      LYS   2  56.268   4.933  -2.300
   10    HG2  LYS   2           HG2      LYS   2  54.693   6.131  -0.690
   11    HG3  LYS   2           HG1      LYS   2  56.106   7.040  -0.102
   12    HD2  LYS   2           HD2      LYS   2  56.550   7.761  -2.481
   13    HD3  LYS   2           HD1      LYS   2  55.015   6.992  -2.948
   14    HE2  LYS   2           HE2      LYS   2  55.236   9.132  -0.790
   15    HE3  LYS   2           HE1      LYS   2  54.846   9.482  -2.490
   16    HZ1  LYS   2           HZ1      LYS   2  53.317   7.494  -0.909
   17    HZ2  LYS   2           HZ2      LYS   2  52.870   8.266  -2.354
   18    HZ3  LYS   2           HZ3      LYS   2  52.915   9.140  -0.898
   19    H    GLY   3           HN       GLY   3  54.476   4.653  -1.703
   20    HA2  GLY   3           HA1      GLY   3  52.290   3.546  -1.679
   21    HA3  GLY   3           HA2      GLY   3  53.379   2.181  -2.282
   22    H    ARG   4           HN       ARG   4  52.377   4.249  -0.184
   23    HA   ARG   4           HA       ARG   4  50.563   3.271   0.519
   24    HB2  ARG   4           HB2      ARG   4  52.453   1.659   2.149
   25    HB3  ARG   4           HB1      ARG   4  51.082   2.272   3.099
   26    HG2  ARG   4           HG2      ARG   4  49.512   0.938   2.023
   27    HG3  ARG   4           HG1      ARG   4  50.348   0.978   0.466
   28    HD2  ARG   4           HD2      ARG   4  52.091  -0.569   1.414
   29    HD3  ARG   4           HD1      ARG   4  51.143  -0.654   2.917
   30    HE   ARG   4           HE       ARG   4  49.544  -1.327   0.579
   31   HH11  ARG   4          HH11      ARG   4  51.563  -3.258   0.021
   32   HH12  ARG   4          HH12      ARG   4  51.250  -4.562   1.117
   33   HH21  ARG   4          HH21      ARG   4  49.260  -2.664   3.228
   34   HH22  ARG   4          HH22      ARG   4  49.947  -4.225   2.932
   35    H    TRP   5           HN       TRP   5  53.128   5.017   1.171
   36    HA   TRP   5           HA       TRP   5  53.077   6.297   3.605
   37    HB2  TRP   5           HB2      TRP   5  54.503   6.927   1.645
   38    HB3  TRP   5           HB1      TRP   5  53.090   7.753   0.943
   39    HD1  TRP   5           HD1      TRP   5  52.391  10.056   1.943
   40    HE1  TRP   5           HE1      TRP   5  53.448  11.693   3.665
   41    HE3  TRP   5           HE3      TRP   5  55.980   6.969   3.892
   42    HZ2  TRP   5           HZ2      TRP   5  55.568  11.636   5.614
   43    HZ3  TRP   5           HZ3      TRP   5  57.510   7.781   5.683
   44    HH2  TRP   5           HH2      TRP   5  57.306  10.109   6.545
   45    H    LEU   6           HN       LEU   6  50.562   6.251   1.219
   46    HA   LEU   6           HA       LEU   6  49.047   8.451   2.557
   47    HB2  LEU   6           HB2      LEU   6  49.403   7.901  -0.088
   48    HB3  LEU   6           HB1      LEU   6  47.927   6.958   0.189
   49    HG   LEU   6           HG       LEU   6  48.321   9.930   0.784
   50   HD11  LEU   6          HD11      LEU   6  46.515   8.515  -1.226
   51   HD12  LEU   6          HD12      LEU   6  48.080   9.261  -1.632
   52   HD13  LEU   6          HD13      LEU   6  46.739  10.272  -1.041
   53   HD21  LEU   6          HD21      LEU   6  46.798   9.184   2.444
   54   HD22  LEU   6          HD22      LEU   6  46.047   7.991   1.359
   55   HD23  LEU   6          HD23      LEU   6  45.733   9.729   1.131
   56    H    GLU   7           HN       GLU   7  49.166   4.913   2.189
   57    HA   GLU   7           HA       GLU   7  46.420   4.454   2.997
   58    HB2  GLU   7           HB2      GLU   7  48.030   2.789   1.907
   59    HB3  GLU   7           HB1      GLU   7  48.782   2.615   3.511
   60    HG2  GLU   7           HG2      GLU   7  47.149   0.859   3.344
   61    HG3  GLU   7           HG1      GLU   7  46.443   2.092   4.414
   62    H    ARG   8           HN       ARG   8  49.439   5.066   4.708
   63    HA   ARG   8           HA       ARG   8  48.778   4.158   7.290
   64    HB2  ARG   8           HB2      ARG   8  50.990   5.070   6.624
   65    HB3  ARG   8           HB1      ARG   8  50.282   6.701   6.553
   66    HG2  ARG   8           HG2      ARG   8  49.778   6.668   8.918
   67    HG3  ARG   8           HG1      ARG   8  50.210   4.945   9.041
   68    HD2  ARG   8           HD2      ARG   8  52.540   5.430   8.549
   69    HD3  ARG   8           HD1      ARG   8  52.158   7.133   8.199
   70    HE   ARG   8           HE       ARG   8  51.282   6.624  10.842
   71   HH11  ARG   8          HH11      ARG   8  52.573   7.454  12.512
   72   HH12  ARG   8          HH12      ARG   8  54.291   7.517  12.302
   73   HH21  ARG   8          HH21      ARG   8  54.202   6.342   9.041
   74   HH22  ARG   8          HH22      ARG   8  55.214   6.888  10.337
   75    H    ILE   9           HN       ILE   9  48.591   7.610   6.316
   76    HA   ILE   9           HA       ILE   9  46.808   8.262   8.480
   77    HB   ILE   9           HB       ILE   9  48.295   9.911   7.276
   78   HG12  ILE   9          HG12      ILE   9  45.314  10.571   7.298
   79   HG13  ILE   9          HG11      ILE   9  46.386  10.619   8.717
   80   HG21  ILE   9          HG21      ILE   9  47.625   8.985   4.966
   81   HG22  ILE   9          HG22      ILE   9  47.704  10.756   5.119
   82   HG23  ILE   9          HG23      ILE   9  46.126   9.930   5.139
   83   HD11  ILE   9           HD1      ILE   9  47.849  12.252   7.320
   84   HD12  ILE   9           HD2      ILE   9  46.310  12.871   7.962
   85   HD13  ILE   9           HD3      ILE   9  46.432  12.395   6.253
   86    H    GLY  10           HN       GLY  10  46.318   7.475   5.042
   87    HA2  GLY  10           HA1      GLY  10  44.365   7.135   3.838
   88    HA3  GLY  10           HA2      GLY  10  43.845   6.260   5.291
   89    H    LYS  11           HN       LYS  11  44.273   9.683   4.263
   90    HA   LYS  11           HA       LYS  11  41.453  10.254   4.524
   91    HB2  LYS  11           HB2      LYS  11  42.163   9.995   6.961
   92    HB3  LYS  11           HB1      LYS  11  43.185  11.432   6.727
   93    HG2  LYS  11           HG2      LYS  11  41.128  12.673   5.933
   94    HG3  LYS  11           HG1      LYS  11  40.161  11.256   6.410
   95    HD2  LYS  11           HD2      LYS  11  40.945  11.461   8.730
   96    HD3  LYS  11           HD1      LYS  11  41.995  12.824   8.276
   97    HE2  LYS  11           HE2      LYS  11  39.933  13.695   9.265
   98    HE3  LYS  11           HE1      LYS  11  39.963  14.090   7.531
   99    HZ1  LYS  11           HZ1      LYS  11  38.333  12.582   7.068
  100    HZ2  LYS  11           HZ2      LYS  11  37.866  13.006   8.646
  101    HZ3  LYS  11           HZ3      LYS  11  38.720  11.564   8.368
  102    H    ALA  12           HN       ALA  12  42.326  10.939   2.375
  103    HA   ALA  12           HA       ALA  12  44.039  13.327   2.340
  104    HB1  ALA  12           HB1      ALA  12  43.421  13.271  -0.128
  105    HB2  ALA  12           HB2      ALA  12  42.478  11.805   0.229
  106    HB3  ALA  12           HB3      ALA  12  44.239  11.819   0.494
  107    H    GLY  13           HN       GLY  13  42.373  14.297   3.971
  108    HA2  GLY  13           HA1      GLY  13  40.665  15.819   4.364
  109    HA3  GLY  13           HA2      GLY  13  41.130  16.497   2.789
  110    H    PHE  14           HN       PHE  14  39.542  13.457   3.844
  111    HA   PHE  14           HA       PHE  14  37.558  12.488   3.154
  112    HB2  PHE  14           HB2      PHE  14  36.625  15.259   2.325
  113    HB3  PHE  14           HB1      PHE  14  35.644  13.877   2.871
  114    HD1  PHE  14           HD1      PHE  14  35.851  13.069   5.264
  115    HD2  PHE  14           HD2      PHE  14  37.628  16.763   3.909
  116    HE1  PHE  14           HE1      PHE  14  36.068  13.831   7.625
  117    HE2  PHE  14           HE2      PHE  14  37.845  17.525   6.271
  118    HZ   PHE  14           HZ       PHE  14  37.082  16.050   8.129
  119    H    ILE  15           HN       ILE  15  39.743  12.584   1.343
  120    HA   ILE  15           HA       ILE  15  40.192  12.137  -0.876
  121    HB   ILE  15           HB       ILE  15  37.193  11.903  -1.339
  122   HG12  ILE  15          HG12      ILE  15  39.126   9.872  -0.129
  123   HG13  ILE  15          HG11      ILE  15  37.737  10.622   0.689
  124   HG21  ILE  15          HG21      ILE  15  37.817  10.398  -3.096
  125   HG22  ILE  15          HG22      ILE  15  39.498  10.306  -2.519
  126   HG23  ILE  15          HG23      ILE  15  38.889  11.805  -3.256
  127   HD11  ILE  15           HD1      ILE  15  36.904   8.514  -0.002
  128   HD12  ILE  15           HD2      ILE  15  37.735   8.597  -1.572
  129   HD13  ILE  15           HD3      ILE  15  36.314   9.623  -1.261
  130    H    ILE  16           HN       ILE  16  40.730  14.524  -0.724
  131    HA   ILE  16           HA       ILE  16  39.273  15.899  -2.951
  132    HB   ILE  16           HB       ILE  16  38.381  16.797  -0.775
  133   HG12  ILE  16          HG12      ILE  16  38.854  19.217  -1.289
  134   HG13  ILE  16          HG11      ILE  16  40.110  18.702  -2.433
  135   HG21  ILE  16          HG21      ILE  16  41.141  17.986  -0.321
  136   HG22  ILE  16          HG22      ILE  16  40.662  16.433   0.404
  137   HG23  ILE  16          HG23      ILE  16  39.759  17.914   0.795
  138   HD11  ILE  16           HD1      ILE  16  37.629  19.218  -3.282
  139   HD12  ILE  16           HD2      ILE  16  37.319  17.556  -2.734
  140   HD13  ILE  16           HD3      ILE  16  38.551  17.868  -3.980
  141    H    ILE  17           HN       ILE  17  42.071  16.055  -0.684
  142    HA   ILE  17           HA       ILE  17  43.657  17.484  -2.707
  143    HB   ILE  17           HB       ILE  17  44.114  17.925  -0.323
  144   HG12  ILE  17          HG12      ILE  17  46.536  17.614  -0.304
  145   HG13  ILE  17          HG11      ILE  17  46.430  16.311  -1.505
  146   HG21  ILE  17          HG21      ILE  17  45.012  15.022  -0.121
  147   HG22  ILE  17          HG22      ILE  17  43.417  15.596   0.422
  148   HG23  ILE  17          HG23      ILE  17  44.896  16.217   1.191
  149   HD11  ILE  17           HD1      ILE  17  45.342  19.072  -2.155
  150   HD12  ILE  17           HD2      ILE  17  45.912  17.800  -3.265
  151   HD13  ILE  17           HD3      ILE  17  47.083  18.733  -2.304
  152    H    GLY  18           HN       GLY  18  43.006  14.230  -1.653
  153    HA2  GLY  18           HA1      GLY  18  45.285  13.078  -3.147
  154    HA3  GLY  18           HA2      GLY  18  44.053  12.199  -2.218
  155    H    GLY  19           HN       GLY  19  41.687  12.986  -3.247
  156    HA2  GLY  19           HA1      GLY  19  41.530  11.478  -5.660
  157    HA3  GLY  19           HA2      GLY  19  40.268  12.545  -5.018
  158    H    ALA  20           HN       ALA  20  41.633  15.013  -5.083
  159    HA   ALA  20           HA       ALA  20  41.088  15.870  -7.711
  160    HB1  ALA  20           HB1      ALA  20  42.951  16.996  -5.601
  161    HB2  ALA  20           HB2      ALA  20  41.273  17.477  -5.950
  162    HB3  ALA  20           HB3      ALA  20  42.565  17.842  -7.117
  163    H    LEU  21           HN       LEU  21  44.284  15.114  -6.254
  164    HA   LEU  21           HA       LEU  21  45.787  15.539  -8.638
  165    HB2  LEU  21           HB2      LEU  21  46.672  15.275  -6.268
  166    HB3  LEU  21           HB1      LEU  21  46.398  13.528  -6.439
  167    HG   LEU  21           HG       LEU  21  47.849  13.746  -8.630
  168   HD11  LEU  21          HD11      LEU  21  48.574  16.308  -7.133
  169   HD12  LEU  21          HD12      LEU  21  48.012  16.158  -8.815
  170   HD13  LEU  21          HD13      LEU  21  49.618  15.555  -8.359
  171   HD21  LEU  21          HD21      LEU  21  48.563  12.543  -6.590
  172   HD22  LEU  21          HD22      LEU  21  49.095  14.080  -5.863
  173   HD23  LEU  21          HD23      LEU  21  49.924  13.442  -7.303
  174    H    ASP  22           HN       ASP  22  43.965  12.757  -7.431
  175    HA   ASP  22           HA       ASP  22  45.011  10.926  -9.456
  176    HB2  ASP  22           HB2      ASP  22  44.131  10.187  -7.236
  177    HB3  ASP  22           HB1      ASP  22  42.503  10.697  -7.747
  178    H    HIS  23           HN       HIS  23  43.996  13.428 -10.524
  179    HA   HIS  23           HA       HIS  23  42.560  14.202 -12.183
  180    HB2  HIS  23           HB2      HIS  23  42.496  11.259 -12.960
  181    HB3  HIS  23           HB1      HIS  23  42.140  12.646 -14.016
  182    HD1  HIS  23           HD1      HIS  23  45.036  11.558 -11.712
  183    HD2  HIS  23           HD2      HIS  23  44.374  13.297 -15.482
  184    HE1  HIS  23           HE1      HIS  23  47.324  12.021 -12.750
  185    H    LEU  24           HN       LEU  24  41.258  13.838  -9.762
  186    HA   LEU  24           HA       LEU  24  38.515  13.575 -10.689
  187    HB2  LEU  24           HB2      LEU  24  39.263  11.154 -10.363
  188    HB3  LEU  24           HB1      LEU  24  39.446  11.535  -8.638
  189    HG   LEU  24           HG       LEU  24  36.959  12.421  -8.819
  190   HD11  LEU  24          HD11      LEU  24  37.182  10.606 -11.266
  191   HD12  LEU  24          HD12      LEU  24  36.651  12.304 -11.228
  192   HD13  LEU  24          HD13      LEU  24  35.642  11.041 -10.492
  193   HD21  LEU  24          HD21      LEU  24  37.645  10.449  -7.501
  194   HD22  LEU  24          HD22      LEU  24  37.625   9.446  -8.972
  195   HD23  LEU  24          HD23      LEU  24  36.109  10.134  -8.341
  Start of MODEL   59
    1    H1   GLY   1           HT1      GLY   1  59.626   2.163   1.234
    2    H2   GLY   1           HT2      GLY   1  60.391   0.826   0.517
    3    H3   GLY   1           HT3      GLY   1  60.859   1.348   2.064
    4    HA2  GLY   1           HA1      GLY   1  59.040  -0.579   1.437
    5    HA3  GLY   1           HA2      GLY   1  59.370   0.125   3.032
    6    H    LYS   2           HN       LYS   2  57.019  -0.536   3.218
    7    HA   LYS   2           HA       LYS   2  55.076   1.174   1.839
    8    HB2  LYS   2           HB2      LYS   2  54.829  -0.752   4.182
    9    HB3  LYS   2           HB1      LYS   2  53.457   0.085   3.415
   10    HG2  LYS   2           HG2      LYS   2  54.111  -0.928   1.221
   11    HG3  LYS   2           HG1      LYS   2  55.395  -1.836   2.055
   12    HD2  LYS   2           HD2      LYS   2  53.760  -3.002   3.431
   13    HD3  LYS   2           HD1      LYS   2  52.440  -1.999   2.783
   14    HE2  LYS   2           HE2      LYS   2  52.689  -2.951   0.579
   15    HE3  LYS   2           HE1      LYS   2  54.202  -3.768   1.040
   16    HZ1  LYS   2           HZ1      LYS   2  52.945  -5.090   2.635
   17    HZ2  LYS   2           HZ2      LYS   2  52.331  -5.296   1.064
   18    HZ3  LYS   2           HZ3      LYS   2  51.505  -4.319   2.181
   19    H    GLY   3           HN       GLY   3  57.239   2.461   3.446
   20    HA2  GLY   3           HA1      GLY   3  56.536   3.509   5.932
   21    HA3  GLY   3           HA2      GLY   3  57.218   4.578   4.623
   22    H    ARG   4           HN       ARG   4  56.205   4.763   2.923
   23    HA   ARG   4           HA       ARG   4  55.603   6.826   4.046
   24    HB2  ARG   4           HB2      ARG   4  54.775   6.275   1.154
   25    HB3  ARG   4           HB1      ARG   4  54.908   7.903   1.868
   26    HG2  ARG   4           HG2      ARG   4  57.283   7.438   2.455
   27    HG3  ARG   4           HG1      ARG   4  57.148   5.836   1.690
   28    HD2  ARG   4           HD2      ARG   4  56.741   6.822  -0.481
   29    HD3  ARG   4           HD1      ARG   4  56.582   8.447   0.227
   30    HE   ARG   4           HE       ARG   4  58.923   8.595   0.071
   31   HH11  ARG   4          HH11      ARG   4  58.715   5.936  -1.561
   32   HH12  ARG   4          HH12      ARG   4  59.962   5.018  -0.785
   33   HH21  ARG   4          HH21      ARG   4  60.202   7.150   1.939
   34   HH22  ARG   4          HH22      ARG   4  60.804   5.704   1.197
   35    H    TRP   5           HN       TRP   5  53.661   4.324   3.753
   36    HA   TRP   5           HA       TRP   5  51.017   4.950   3.173
   37    HB2  TRP   5           HB2      TRP   5  51.712   2.755   4.039
   38    HB3  TRP   5           HB1      TRP   5  51.978   3.458   5.652
   39    HD1  TRP   5           HD1      TRP   5  49.920   3.805   7.176
   40    HE1  TRP   5           HE1      TRP   5  47.379   3.286   6.995
   41    HE3  TRP   5           HE3      TRP   5  49.692   2.627   2.199
   42    HZ2  TRP   5           HZ2      TRP   5  45.527   2.470   4.947
   43    HZ3  TRP   5           HZ3      TRP   5  47.526   1.981   1.152
   44    HH2  TRP   5           HH2      TRP   5  45.445   1.902   2.521
   45    H    LEU   6           HN       LEU   6  52.982   6.389   5.628
   46    HA   LEU   6           HA       LEU   6  50.587   7.761   6.830
   47    HB2  LEU   6           HB2      LEU   6  51.889   6.494   8.465
   48    HB3  LEU   6           HB1      LEU   6  53.390   7.268   7.919
   49    HG   LEU   6           HG       LEU   6  52.596   9.458   8.708
   50   HD11  LEU   6          HD11      LEU   6  50.026   7.912   9.220
   51   HD12  LEU   6          HD12      LEU   6  50.245   9.471   8.389
   52   HD13  LEU   6          HD13      LEU   6  50.405   9.379  10.155
   53   HD21  LEU   6          HD21      LEU   6  52.550   8.970  11.127
   54   HD22  LEU   6          HD22      LEU   6  53.739   7.935  10.301
   55   HD23  LEU   6          HD23      LEU   6  52.162   7.267  10.785
   56    H    GLU   7           HN       GLU   7  53.570   8.138   4.995
   57    HA   GLU   7           HA       GLU   7  53.580  11.093   5.421
   58    HB2  GLU   7           HB2      GLU   7  55.381   9.308   3.734
   59    HB3  GLU   7           HB1      GLU   7  55.638  11.033   4.090
   60    HG2  GLU   7           HG2      GLU   7  55.422   8.865   6.224
   61    HG3  GLU   7           HG1      GLU   7  56.963   9.472   5.574
   62    H    ARG   8           HN       ARG   8  51.899   8.926   3.552
   63    HA   ARG   8           HA       ARG   8  52.038  10.398   1.003
   64    HB2  ARG   8           HB2      ARG   8  51.612   7.849   1.370
   65    HB3  ARG   8           HB1      ARG   8  49.949   8.329   1.771
   66    HG2  ARG   8           HG2      ARG   8  49.730   7.977  -0.534
   67    HG3  ARG   8           HG1      ARG   8  50.132   9.707  -0.524
   68    HD2  ARG   8           HD2      ARG   8  51.578   8.779  -2.164
   69    HD3  ARG   8           HD1      ARG   8  52.612   8.928  -0.726
   70    HE   ARG   8           HE       ARG   8  51.344   6.335  -0.788
   71   HH11  ARG   8          HH11      ARG   8  53.309   8.040  -2.968
   72   HH12  ARG   8          HH12      ARG   8  54.526   6.812  -3.080
   73   HH21  ARG   8          HH21      ARG   8  53.128   4.830  -0.601
   74   HH22  ARG   8          HH22      ARG   8  54.422   4.995  -1.740
   75    H    ILE   9           HN       ILE   9  48.944   9.691   0.955
   76    HA   ILE   9           HA       ILE   9  47.761  11.706   2.672
   77    HB   ILE   9           HB       ILE   9  48.912  13.186   0.992
   78   HG12  ILE   9          HG12      ILE   9  45.863  13.186   0.781
   79   HG13  ILE   9          HG11      ILE   9  46.774  13.812   2.174
   80   HG21  ILE   9          HG21      ILE   9  48.265  13.175  -1.315
   81   HG22  ILE   9          HG22      ILE   9  46.915  12.057  -1.011
   82   HG23  ILE   9          HG23      ILE   9  48.593  11.478  -0.904
   83   HD11  ILE   9           HD1      ILE   9  48.025  15.307   0.468
   84   HD12  ILE   9           HD2      ILE   9  46.333  15.724   0.824
   85   HD13  ILE   9           HD3      ILE   9  46.737  14.861  -0.678
   86    H    GLY  10           HN       GLY  10  47.703   9.384   0.094
   87    HA2  GLY  10           HA1      GLY  10  45.053   9.406  -0.760
   88    HA3  GLY  10           HA2      GLY  10  46.019   7.932  -0.552
   89    H    LYS  11           HN       LYS  11  43.699  10.134   0.936
   90    HA   LYS  11           HA       LYS  11  42.647   7.891   2.560
   91    HB2  LYS  11           HB2      LYS  11  43.759  10.438   3.811
   92    HB3  LYS  11           HB1      LYS  11  42.689   9.294   4.653
   93    HG2  LYS  11           HG2      LYS  11  44.407   7.471   4.069
   94    HG3  LYS  11           HG1      LYS  11  45.495   8.791   3.582
   95    HD2  LYS  11           HD2      LYS  11  45.386   9.769   5.821
   96    HD3  LYS  11           HD1      LYS  11  44.190   8.551   6.327
   97    HE2  LYS  11           HE2      LYS  11  46.979   7.854   5.319
   98    HE3  LYS  11           HE1      LYS  11  46.574   8.046   7.041
   99    HZ1  LYS  11           HZ1      LYS  11  44.963   6.294   6.857
  100    HZ2  LYS  11           HZ2      LYS  11  46.446   5.725   6.254
  101    HZ3  LYS  11           HZ3      LYS  11  45.203   6.166   5.182
  102    H    ALA  12           HN       ALA  12  42.246  10.483   0.566
  103    HA   ALA  12           HA       ALA  12  40.425  11.804   0.018
  104    HB1  ALA  12           HB1      ALA  12  39.397   9.521  -0.136
  105    HB2  ALA  12           HB2      ALA  12  38.235  10.807   0.271
  106    HB3  ALA  12           HB3      ALA  12  38.833   9.713   1.541
  107    H    GLY  13           HN       GLY  13  41.663  13.101   1.834
  108    HA2  GLY  13           HA1      GLY  13  40.797  13.459   4.419
  109    HA3  GLY  13           HA2      GLY  13  41.269  14.810   3.368
  110    H    PHE  14           HN       PHE  14  38.628  12.956   4.732
  111    HA   PHE  14           HA       PHE  14  36.362  13.417   4.898
  112    HB2  PHE  14           HB2      PHE  14  37.321  16.284   4.508
  113    HB3  PHE  14           HB1      PHE  14  35.719  15.799   5.108
  114    HD1  PHE  14           HD1      PHE  14  39.090  16.583   6.065
  115    HD2  PHE  14           HD2      PHE  14  35.686  14.162   7.161
  116    HE1  PHE  14           HE1      PHE  14  39.993  16.357   8.375
  117    HE2  PHE  14           HE2      PHE  14  36.590  13.939   9.472
  118    HZ   PHE  14           HZ       PHE  14  38.763  15.003  10.067
  119    H    ILE  15           HN       ILE  15  37.112  12.484   2.442
  120    HA   ILE  15           HA       ILE  15  36.350  12.318   0.274
  121    HB   ILE  15           HB       ILE  15  34.134  14.269   1.006
  122   HG12  ILE  15          HG12      ILE  15  34.343  11.278   1.586
  123   HG13  ILE  15          HG11      ILE  15  34.273  12.582   2.793
  124   HG21  ILE  15          HG21      ILE  15  34.491  13.443  -1.390
  125   HG22  ILE  15          HG22      ILE  15  32.887  13.124  -0.695
  126   HG23  ILE  15          HG23      ILE  15  34.090  11.816  -0.795
  127   HD11  ILE  15           HD1      ILE  15  32.040  11.799   2.692
  128   HD12  ILE  15           HD2      ILE  15  32.088  11.609   0.925
  129   HD13  ILE  15           HD3      ILE  15  32.017  13.237   1.645
  130    H    ILE  16           HN       ILE  16  38.337  13.489  -0.265
  131    HA   ILE  16           HA       ILE  16  37.637  15.972  -1.766
  132    HB   ILE  16           HB       ILE  16  38.525  16.821   0.357
  133   HG12  ILE  16          HG12      ILE  16  40.473  18.104  -0.490
  134   HG13  ILE  16          HG11      ILE  16  40.611  17.000  -1.872
  135   HG21  ILE  16          HG21      ILE  16  40.580  16.157   1.322
  136   HG22  ILE  16          HG22      ILE  16  41.133  15.362  -0.165
  137   HG23  ILE  16          HG23      ILE  16  39.838  14.628   0.805
  138   HD11  ILE  16           HD1      ILE  16  38.624  17.791  -2.871
  139   HD12  ILE  16           HD2      ILE  16  39.299  19.273  -2.160
  140   HD13  ILE  16           HD3      ILE  16  37.979  18.415  -1.331
  141    H    ILE  17           HN       ILE  17  40.369  13.756  -0.916
  142    HA   ILE  17           HA       ILE  17  41.403  13.969  -3.674
  143    HB   ILE  17           HB       ILE  17  42.302  12.749  -1.086
  144   HG12  ILE  17          HG12      ILE  17  44.557  13.338  -2.039
  145   HG13  ILE  17          HG11      ILE  17  43.755  13.842  -3.542
  146   HG21  ILE  17          HG21      ILE  17  43.863  11.116  -2.264
  147   HG22  ILE  17          HG22      ILE  17  42.871  11.329  -3.725
  148   HG23  ILE  17          HG23      ILE  17  42.152  10.634  -2.253
  149   HD11  ILE  17           HD1      ILE  17  42.383  15.472  -2.169
  150   HD12  ILE  17           HD2      ILE  17  44.127  15.816  -2.178
  151   HD13  ILE  17           HD3      ILE  17  43.385  15.036  -0.764
  152    H    GLY  18           HN       GLY  18  39.387  11.876  -1.698
  153    HA2  GLY  18           HA1      GLY  18  39.242   9.742  -3.685
  154    HA3  GLY  18           HA2      GLY  18  38.222   9.934  -2.242
  155    H    GLY  19           HN       GLY  19  37.102  12.394  -2.558
  156    HA2  GLY  19           HA1      GLY  19  35.024  11.854  -4.462
  157    HA3  GLY  19           HA2      GLY  19  35.288  13.382  -3.601
  158    H    ALA  20           HN       ALA  20  37.806  14.140  -4.507
  159    HA   ALA  20           HA       ALA  20  37.191  15.453  -6.920
  160    HB1  ALA  20           HB1      ALA  20  39.044  16.190  -5.592
  161    HB2  ALA  20           HB2      ALA  20  39.699  15.686  -7.168
  162    HB3  ALA  20           HB3      ALA  20  39.864  14.618  -5.753
  163    H    LEU  21           HN       LEU  21  39.668  12.867  -6.749
  164    HA   LEU  21           HA       LEU  21  40.305  11.323  -8.351
  165    HB2  LEU  21           HB2      LEU  21  38.266  10.204  -7.680
  166    HB3  LEU  21           HB1      LEU  21  37.280  11.277  -8.698
  167    HG   LEU  21           HG       LEU  21  38.210  10.318 -10.730
  168   HD11  LEU  21          HD11      LEU  21  40.508   9.942 -10.240
  169   HD12  LEU  21          HD12      LEU  21  39.839   8.307 -10.436
  170   HD13  LEU  21          HD13      LEU  21  40.134   8.958  -8.805
  171   HD21  LEU  21          HD21      LEU  21  37.555   8.138  -8.698
  172   HD22  LEU  21          HD22      LEU  21  37.488   7.957 -10.467
  173   HD23  LEU  21          HD23      LEU  21  36.372   9.073  -9.643
  174    H    ASP  22           HN       ASP  22  41.515  12.580  -9.743
  175    HA   ASP  22           HA       ASP  22  40.319  12.989 -12.404
  176    HB2  ASP  22           HB2      ASP  22  41.364  15.355 -10.794
  177    HB3  ASP  22           HB1      ASP  22  40.946  15.388 -12.524
  178    H    HIS  23           HN       HIS  23  42.999  13.063 -10.136
  179    HA   HIS  23           HA       HIS  23  44.810  11.998 -12.139
  180    HB2  HIS  23           HB2      HIS  23  44.861  14.350 -12.866
  181    HB3  HIS  23           HB1      HIS  23  45.262  14.864 -11.210
  182    HD1  HIS  23           HD1      HIS  23  47.690  14.898 -10.570
  183    HD2  HIS  23           HD2      HIS  23  46.975  12.558 -13.992
  184    HE1  HIS  23           HE1      HIS  23  49.964  14.192 -11.498
  185    H    LEU  24           HN       LEU  24  44.099  13.349  -8.986
  186    HA   LEU  24           HA       LEU  24  46.631  12.451  -7.786
  187    HB2  LEU  24           HB2      LEU  24  44.036  13.613  -6.717
  188    HB3  LEU  24           HB1      LEU  24  45.303  13.007  -5.624
  189    HG   LEU  24           HG       LEU  24  46.935  14.561  -6.589
  190   HD11  LEU  24          HD11      LEU  24  45.968  16.349  -8.215
  191   HD12  LEU  24          HD12      LEU  24  44.649  15.186  -8.498
  192   HD13  LEU  24          HD13      LEU  24  46.330  14.741  -8.882
  193   HD21  LEU  24          HD21      LEU  24  44.282  15.916  -5.917
  194   HD22  LEU  24          HD22      LEU  24  45.882  16.695  -5.864
  195   HD23  LEU  24          HD23      LEU  24  45.501  15.366  -4.743
  Start of MODEL   60
    1    H1   GLY   1           HT1      GLY   1  57.887  -4.174  -0.640
    2    H2   GLY   1           HT2      GLY   1  58.368  -3.826   0.953
    3    H3   GLY   1           HT3      GLY   1  58.284  -2.585  -0.205
    4    HA2  GLY   1           HA1      GLY   1  55.913  -2.920  -0.400
    5    HA3  GLY   1           HA2      GLY   1  56.033  -4.145   0.877
    6    H    LYS   2           HN       LYS   2  57.339  -0.839   0.336
    7    HA   LYS   2           HA       LYS   2  55.800   0.247   2.555
    8    HB2  LYS   2           HB2      LYS   2  57.656   0.708   4.082
    9    HB3  LYS   2           HB1      LYS   2  57.533  -1.046   3.809
   10    HG2  LYS   2           HG2      LYS   2  59.288  -0.771   1.973
   11    HG3  LYS   2           HG1      LYS   2  59.527   0.891   2.564
   12    HD2  LYS   2           HD2      LYS   2  59.985  -0.048   4.855
   13    HD3  LYS   2           HD1      LYS   2  59.900  -1.682   4.154
   14    HE2  LYS   2           HE2      LYS   2  61.803   0.502   3.203
   15    HE3  LYS   2           HE1      LYS   2  62.251  -0.802   4.328
   16    HZ1  LYS   2           HZ1      LYS   2  61.155  -2.225   2.382
   17    HZ2  LYS   2           HZ2      LYS   2  62.803  -1.812   2.399
   18    HZ3  LYS   2           HZ3      LYS   2  61.709  -0.914   1.460
   19    H    GLY   3           HN       GLY   3  57.818   2.275   3.219
   20    HA2  GLY   3           HA1      GLY   3  58.113   4.535   2.445
   21    HA3  GLY   3           HA2      GLY   3  58.826   3.683   0.964
   22    H    ARG   4           HN       ARG   4  56.598   4.357   2.997
   23    HA   ARG   4           HA       ARG   4  55.930   6.296   2.335
   24    HB2  ARG   4           HB2      ARG   4  54.415   4.743   0.291
   25    HB3  ARG   4           HB1      ARG   4  53.458   6.032   1.067
   26    HG2  ARG   4           HG2      ARG   4  54.672   7.756   0.093
   27    HG3  ARG   4           HG1      ARG   4  56.199   6.866   0.099
   28    HD2  ARG   4           HD2      ARG   4  55.044   7.338  -2.196
   29    HD3  ARG   4           HD1      ARG   4  55.653   5.695  -1.898
   30    HE   ARG   4           HE       ARG   4  53.421   5.019  -2.196
   31   HH11  ARG   4          HH11      ARG   4  51.604   5.027  -0.522
   32   HH12  ARG   4          HH12      ARG   4  50.755   6.534  -0.427
   33   HH21  ARG   4          HH21      ARG   4  53.179   8.311  -2.159
   34   HH22  ARG   4          HH22      ARG   4  51.648   8.394  -1.354
   35    H    TRP   5           HN       TRP   5  55.209   3.427   3.483
   36    HA   TRP   5           HA       TRP   5  52.682   3.238   4.586
   37    HB2  TRP   5           HB2      TRP   5  54.580   1.666   5.007
   38    HB3  TRP   5           HB1      TRP   5  55.273   2.872   6.120
   39    HD1  TRP   5           HD1      TRP   5  54.590   2.603   8.548
   40    HE1  TRP   5           HE1      TRP   5  52.653   1.469   9.861
   41    HE3  TRP   5           HE3      TRP   5  51.771   0.982   4.592
   42    HZ2  TRP   5           HZ2      TRP   5  50.221   0.056   9.247
   43    HZ3  TRP   5           HZ3      TRP   5  49.646  -0.257   4.980
   44    HH2  TRP   5           HH2      TRP   5  48.869  -0.722   7.301
   45    H    LEU   6           HN       LEU   6  55.114   5.622   5.199
   46    HA   LEU   6           HA       LEU   6  53.762   6.685   7.627
   47    HB2  LEU   6           HB2      LEU   6  56.191   7.785   6.168
   48    HB3  LEU   6           HB1      LEU   6  55.678   8.116   7.837
   49    HG   LEU   6           HG       LEU   6  56.534   5.374   6.796
   50   HD11  LEU   6          HD11      LEU   6  58.596   5.784   8.120
   51   HD12  LEU   6          HD12      LEU   6  58.026   7.432   8.481
   52   HD13  LEU   6          HD13      LEU   6  58.412   6.970   6.806
   53   HD21  LEU   6          HD21      LEU   6  56.725   4.989   9.353
   54   HD22  LEU   6          HD22      LEU   6  55.084   5.056   8.676
   55   HD23  LEU   6          HD23      LEU   6  55.750   6.468   9.532
   56    H    GLU   7           HN       GLU   7  54.113   7.314   4.134
   57    HA   GLU   7           HA       GLU   7  53.093  10.077   4.408
   58    HB2  GLU   7           HB2      GLU   7  53.421   8.268   1.988
   59    HB3  GLU   7           HB1      GLU   7  53.011   9.998   1.933
   60    HG2  GLU   7           HG2      GLU   7  55.154  10.417   3.279
   61    HG3  GLU   7           HG1      GLU   7  55.581   8.719   2.958
   62    H    ARG   8           HN       ARG   8  51.616   7.359   5.169
   63    HA   ARG   8           HA       ARG   8  49.192   7.521   3.531
   64    HB2  ARG   8           HB2      ARG   8  50.019   5.413   4.607
   65    HB3  ARG   8           HB1      ARG   8  49.639   6.120   6.196
   66    HG2  ARG   8           HG2      ARG   8  47.278   6.331   5.587
   67    HG3  ARG   8           HG1      ARG   8  47.622   5.755   3.937
   68    HD2  ARG   8           HD2      ARG   8  46.753   3.882   5.221
   69    HD3  ARG   8           HD1      ARG   8  48.489   3.606   4.944
   70    HE   ARG   8           HE       ARG   8  48.269   4.961   7.417
   71   HH11  ARG   8          HH11      ARG   8  45.894   2.841   6.972
   72   HH12  ARG   8          HH12      ARG   8  46.499   1.576   7.989
   73   HH21  ARG   8          HH21      ARG   8  49.659   2.971   8.297
   74   HH22  ARG   8          HH22      ARG   8  48.630   1.649   8.739
   75    H    ILE   9           HN       ILE   9  48.597   9.744   3.760
   76    HA   ILE   9           HA       ILE   9  48.022  10.839   6.398
   77    HB   ILE   9           HB       ILE   9  48.579  12.240   4.375
   78   HG12  ILE   9          HG12      ILE   9  45.858  12.809   5.642
   79   HG13  ILE   9          HG11      ILE   9  47.426  13.145   6.412
   80   HG21  ILE   9          HG21      ILE   9  46.973  12.589   2.636
   81   HG22  ILE   9          HG22      ILE   9  45.697  11.730   3.533
   82   HG23  ILE   9          HG23      ILE   9  47.065  10.825   2.844
   83   HD11  ILE   9           HD1      ILE   9  47.974  14.528   4.285
   84   HD12  ILE   9           HD2      ILE   9  46.791  15.214   5.423
   85   HD13  ILE   9           HD3      ILE   9  46.233  14.427   3.929
   86    H    GLY  10           HN       GLY  10  46.099   9.412   3.748
   87    HA2  GLY  10           HA1      GLY  10  43.959   8.543   3.751
   88    HA3  GLY  10           HA2      GLY  10  44.150   8.309   5.499
   89    H    LYS  11           HN       LYS  11  43.916  11.193   3.362
   90    HA   LYS  11           HA       LYS  11  41.288  11.899   4.329
   91    HB2  LYS  11           HB2      LYS  11  42.718  12.359   6.385
   92    HB3  LYS  11           HB1      LYS  11  43.536  13.622   5.436
   93    HG2  LYS  11           HG2      LYS  11  41.366  14.744   5.041
   94    HG3  LYS  11           HG1      LYS  11  40.536  13.476   5.975
   95    HD2  LYS  11           HD2      LYS  11  41.840  14.078   7.982
   96    HD3  LYS  11           HD1      LYS  11  42.706  15.327   7.055
   97    HE2  LYS  11           HE2      LYS  11  40.908  16.404   8.297
   98    HE3  LYS  11           HE1      LYS  11  40.484  16.416   6.568
   99    HZ1  LYS  11           HZ1      LYS  11  38.629  15.355   7.102
  100    HZ2  LYS  11           HZ2      LYS  11  39.101  15.225   8.729
  101    HZ3  LYS  11           HZ3      LYS  11  39.542  14.021   7.615
  102    H    ALA  12           HN       ALA  12  41.607  11.809   1.864
  103    HA   ALA  12           HA       ALA  12  42.933  14.156   0.687
  104    HB1  ALA  12           HB1      ALA  12  42.737  11.871  -0.397
  105    HB2  ALA  12           HB2      ALA  12  42.246  13.248  -1.413
  106    HB3  ALA  12           HB3      ALA  12  41.010  12.223  -0.643
  107    H    GLY  13           HN       GLY  13  41.120  15.011   2.601
  108    HA2  GLY  13           HA1      GLY  13  39.465  16.615   2.810
  109    HA3  GLY  13           HA2      GLY  13  39.531  16.835   1.050
  110    H    PHE  14           HN       PHE  14  38.388  14.473   3.500
  111    HA   PHE  14           HA       PHE  14  36.481  13.150   3.520
  112    HB2  PHE  14           HB2      PHE  14  35.501  15.471   3.709
  113    HB3  PHE  14           HB1      PHE  14  35.230  15.436   1.950
  114    HD1  PHE  14           HD1      PHE  14  34.611  13.362   5.039
  115    HD2  PHE  14           HD2      PHE  14  33.188  14.547   1.139
  116    HE1  PHE  14           HE1      PHE  14  32.515  12.066   5.409
  117    HE2  PHE  14           HE2      PHE  14  31.093  13.250   1.511
  118    HZ   PHE  14           HZ       PHE  14  30.791  11.949   3.614
  119    H    ILE  15           HN       ILE  15  38.361  12.848   1.274
  120    HA   ILE  15           HA       ILE  15  38.483  11.663  -0.688
  121    HB   ILE  15           HB       ILE  15  35.582  10.832  -0.272
  122   HG12  ILE  15          HG12      ILE  15  38.115   9.718   1.021
  123   HG13  ILE  15          HG11      ILE  15  36.767  10.520   1.861
  124   HG21  ILE  15          HG21      ILE  15  37.937   9.248  -1.377
  125   HG22  ILE  15          HG22      ILE  15  36.892  10.254  -2.405
  126   HG23  ILE  15          HG23      ILE  15  36.201   8.879  -1.517
  127   HD11  ILE  15           HD1      ILE  15  36.804   7.807   0.498
  128   HD12  ILE  15           HD2      ILE  15  35.271   8.661   0.806
  129   HD13  ILE  15           HD3      ILE  15  36.329   8.209   2.164
  130    H    ILE  16           HN       ILE  16  38.446  14.009  -1.326
  131    HA   ILE  16           HA       ILE  16  36.389  14.349  -3.493
  132    HB   ILE  16           HB       ILE  16  37.556  16.483  -1.661
  133   HG12  ILE  16          HG12      ILE  16  35.644  14.938  -0.773
  134   HG13  ILE  16          HG11      ILE  16  35.447  16.691  -0.612
  135   HG21  ILE  16          HG21      ILE  16  35.904  17.984  -2.910
  136   HG22  ILE  16          HG22      ILE  16  35.705  16.654  -4.078
  137   HG23  ILE  16          HG23      ILE  16  37.292  17.424  -3.868
  138   HD11  ILE  16           HD1      ILE  16  34.291  15.113  -2.953
  139   HD12  ILE  16           HD2      ILE  16  33.918  16.781  -2.472
  140   HD13  ILE  16           HD3      ILE  16  33.396  15.423  -1.451
  141    H    ILE  17           HN       ILE  17  39.539  15.388  -2.128
  142    HA   ILE  17           HA       ILE  17  40.555  16.312  -4.689
  143    HB   ILE  17           HB       ILE  17  41.883  15.620  -2.027
  144   HG12  ILE  17          HG12      ILE  17  42.265  18.032  -1.916
  145   HG13  ILE  17          HG11      ILE  17  41.633  18.247  -3.563
  146   HG21  ILE  17          HG21      ILE  17  43.952  16.734  -3.098
  147   HG22  ILE  17          HG22      ILE  17  43.160  16.447  -4.667
  148   HG23  ILE  17          HG23      ILE  17  43.591  15.072  -3.621
  149   HD11  ILE  17           HD1      ILE  17  40.034  18.759  -1.576
  150   HD12  ILE  17           HD2      ILE  17  39.930  16.994  -1.378
  151   HD13  ILE  17           HD3      ILE  17  39.410  17.754  -2.902
  152    H    GLY  18           HN       GLY  18  40.945  13.374  -2.696
  153    HA2  GLY  18           HA1      GLY  18  42.551  12.021  -4.726
  154    HA3  GLY  18           HA2      GLY  18  41.881  11.312  -3.240
  155    H    GLY  19           HN       GLY  19  39.170  11.932  -3.576
  156    HA2  GLY  19           HA1      GLY  19  38.313   9.744  -5.176
  157    HA3  GLY  19           HA2      GLY  19  37.279  11.059  -4.582
  158    H    ALA  20           HN       ALA  20  38.258  13.269  -5.854
  159    HA   ALA  20           HA       ALA  20  36.995  13.143  -8.373
  160    HB1  ALA  20           HB1      ALA  20  37.468  15.243  -7.217
  161    HB2  ALA  20           HB2      ALA  20  38.166  15.271  -8.854
  162    HB3  ALA  20           HB3      ALA  20  39.215  14.996  -7.442
  163    H    LEU  21           HN       LEU  21  40.484  12.904  -7.579
  164    HA   LEU  21           HA       LEU  21  42.266  12.189  -8.871
  165    HB2  LEU  21           HB2      LEU  21  40.450  10.156  -8.744
  166    HB3  LEU  21           HB1      LEU  21  40.519  10.354 -10.506
  167    HG   LEU  21           HG       LEU  21  42.934   9.929  -8.681
  168   HD11  LEU  21          HD11      LEU  21  41.451   7.935  -8.890
  169   HD12  LEU  21          HD12      LEU  21  43.021   7.688  -9.693
  170   HD13  LEU  21          HD13      LEU  21  41.573   8.052 -10.662
  171   HD21  LEU  21          HD21      LEU  21  42.646  10.051 -11.718
  172   HD22  LEU  21          HD22      LEU  21  44.129   9.588 -10.851
  173   HD23  LEU  21          HD23      LEU  21  43.486  11.239 -10.692
  174    H    ASP  22           HN       ASP  22  40.883  14.521  -9.777
  175    HA   ASP  22           HA       ASP  22  40.616  14.321 -12.700
  176    HB2  ASP  22           HB2      ASP  22  40.617  16.681 -10.778
  177    HB3  ASP  22           HB1      ASP  22  40.325  16.809 -12.530
  178    H    HIS  23           HN       HIS  23  42.408  16.908 -11.076
  179    HA   HIS  23           HA       HIS  23  44.480  16.807 -13.119
  180    HB2  HIS  23           HB2      HIS  23  45.548  18.585 -11.674
  181    HB3  HIS  23           HB1      HIS  23  43.883  18.948 -12.186
  182    HD1  HIS  23           HD1      HIS  23  46.010  18.253  -9.183
  183    HD2  HIS  23           HD2      HIS  23  41.931  18.741 -10.078
  184    HE1  HIS  23           HE1      HIS  23  44.768  18.505  -6.964
  185    H    LEU  24           HN       LEU  24  44.042  15.484  -9.901
  186    HA   LEU  24           HA       LEU  24  46.872  14.972  -9.432
  187    HB2  LEU  24           HB2      LEU  24  44.833  15.110  -7.752
  188    HB3  LEU  24           HB1      LEU  24  44.634  13.387  -8.132
  189    HG   LEU  24           HG       LEU  24  47.162  14.720  -7.052
  190   HD11  LEU  24          HD11      LEU  24  46.688  13.399  -5.029
  191   HD12  LEU  24          HD12      LEU  24  45.237  12.714  -5.797
  192   HD13  LEU  24          HD13      LEU  24  45.304  14.450  -5.411
  193   HD21  LEU  24          HD21      LEU  24  46.550  11.889  -7.990
  194   HD22  LEU  24          HD22      LEU  24  47.830  12.210  -6.795
  195   HD23  LEU  24          HD23      LEU  24  47.931  12.927  -8.417
  Start of MODEL   61
    1    H1   GLY   1           HT1      GLY   1  51.993  -0.170  14.279
    2    H2   GLY   1           HT2      GLY   1  50.872   1.102  14.390
    3    H3   GLY   1           HT3      GLY   1  52.397   1.366  13.688
    4    HA2  GLY   1           HA1      GLY   1  51.547  -0.612  12.180
    5    HA3  GLY   1           HA2      GLY   1  50.011   0.174  12.598
    6    H    LYS   2           HN       LYS   2  53.354   1.242  11.811
    7    HA   LYS   2           HA       LYS   2  52.306   3.564  10.346
    8    HB2  LYS   2           HB2      LYS   2  55.139   2.462  10.486
    9    HB3  LYS   2           HB1      LYS   2  54.652   4.090   9.951
   10    HG2  LYS   2           HG2      LYS   2  53.573   4.362  12.279
   11    HG3  LYS   2           HG1      LYS   2  54.468   2.895  12.745
   12    HD2  LYS   2           HD2      LYS   2  55.698   5.462  11.641
   13    HD3  LYS   2           HD1      LYS   2  55.740   4.935  13.341
   14    HE2  LYS   2           HE2      LYS   2  57.833   4.219  12.506
   15    HE3  LYS   2           HE1      LYS   2  56.840   2.748  12.393
   16    HZ1  LYS   2           HZ1      LYS   2  58.224   3.867  10.353
   17    HZ2  LYS   2           HZ2      LYS   2  56.658   4.466  10.080
   18    HZ3  LYS   2           HZ3      LYS   2  56.926   2.790  10.173
   19    H    GLY   3           HN       GLY   3  51.097   1.499   9.152
   20    HA2  GLY   3           HA1      GLY   3  52.311   0.049   7.076
   21    HA3  GLY   3           HA2      GLY   3  50.680   0.837   6.872
   22    H    ARG   4           HN       ARG   4  50.538   2.803   7.054
   23    HA   ARG   4           HA       ARG   4  50.535   2.572   4.644
   24    HB2  ARG   4           HB2      ARG   4  50.044   5.242   6.043
   25    HB3  ARG   4           HB1      ARG   4  49.575   4.924   4.355
   26    HG2  ARG   4           HG2      ARG   4  48.225   2.977   5.100
   27    HG3  ARG   4           HG1      ARG   4  48.679   3.312   6.789
   28    HD2  ARG   4           HD2      ARG   4  47.662   5.600   6.554
   29    HD3  ARG   4           HD1      ARG   4  47.103   5.143   4.928
   30    HE   ARG   4           HE       ARG   4  46.246   3.231   6.944
   31   HH11  ARG   4          HH11      ARG   4  44.774   4.758   8.460
   32   HH12  ARG   4          HH12      ARG   4  43.474   5.439   7.539
   33   HH21  ARG   4          HH21      ARG   4  44.945   4.774   4.471
   34   HH22  ARG   4          HH22      ARG   4  43.572   5.450   5.282
   35    H    TRP   5           HN       TRP   5  53.022   3.626   6.345
   36    HA   TRP   5           HA       TRP   5  54.403   5.733   5.154
   37    HB2  TRP   5           HB2      TRP   5  55.243   4.255   7.023
   38    HB3  TRP   5           HB1      TRP   5  55.716   3.061   5.790
   39    HD1  TRP   5           HD1      TRP   5  56.228   6.880   6.315
   40    HE1  TRP   5           HE1      TRP   5  58.672   7.495   5.670
   41    HE3  TRP   5           HE3      TRP   5  57.880   2.245   4.903
   42    HZ2  TRP   5           HZ2      TRP   5  61.005   6.131   4.678
   43    HZ3  TRP   5           HZ3      TRP   5  60.218   1.925   4.109
   44    HH2  TRP   5           HH2      TRP   5  61.782   3.861   3.997
   45    H    LEU   6           HN       LEU   6  53.431   2.791   3.654
   46    HA   LEU   6           HA       LEU   6  55.104   3.418   1.224
   47    HB2  LEU   6           HB2      LEU   6  53.912   0.728   1.995
   48    HB3  LEU   6           HB1      LEU   6  55.060   1.071   0.680
   49    HG   LEU   6           HG       LEU   6  55.646   1.474   3.650
   50   HD11  LEU   6          HD11      LEU   6  57.057  -0.538   3.426
   51   HD12  LEU   6          HD12      LEU   6  56.556  -0.714   1.727
   52   HD13  LEU   6          HD13      LEU   6  55.364  -0.918   3.034
   53   HD21  LEU   6          HD21      LEU   6  57.060   2.957   2.431
   54   HD22  LEU   6          HD22      LEU   6  57.268   1.803   1.091
   55   HD23  LEU   6          HD23      LEU   6  58.060   1.506   2.657
   56    H    GLU   7           HN       GLU   7  51.899   3.155   2.595
   57    HA   GLU   7           HA       GLU   7  50.641   2.733  -0.068
   58    HB2  GLU   7           HB2      GLU   7  49.368   3.337   2.629
   59    HB3  GLU   7           HB1      GLU   7  48.542   2.764   1.163
   60    HG2  GLU   7           HG2      GLU   7  50.756   1.242   2.611
   61    HG3  GLU   7           HG1      GLU   7  49.016   0.922   2.806
   62    H    ARG   8           HN       ARG   8  52.089   5.272   1.483
   63    HA   ARG   8           HA       ARG   8  51.947   7.573   1.244
   64    HB2  ARG   8           HB2      ARG   8  52.063   6.840  -1.181
   65    HB3  ARG   8           HB1      ARG   8  50.289   6.973  -1.233
   66    HG2  ARG   8           HG2      ARG   8  50.415   9.344  -0.604
   67    HG3  ARG   8           HG1      ARG   8  52.184   9.231  -0.451
   68    HD2  ARG   8           HD2      ARG   8  50.562   8.811  -2.998
   69    HD3  ARG   8           HD1      ARG   8  51.612  10.199  -2.632
   70    HE   ARG   8           HE       ARG   8  52.507   7.677  -3.675
   71   HH11  ARG   8          HH11      ARG   8  54.086  10.207  -3.827
   72   HH12  ARG   8          HH12      ARG   8  55.419   9.874  -2.771
   73   HH21  ARG   8          HH21      ARG   8  53.868   7.183  -1.230
   74   HH22  ARG   8          HH22      ARG   8  55.295   8.162  -1.301
   75    H    ILE   9           HN       ILE   9  50.797   8.457   2.846
   76    HA   ILE   9           HA       ILE   9  47.795   8.502   2.560
   77    HB   ILE   9           HB       ILE   9  48.440   7.278   4.562
   78   HG12  ILE   9          HG12      ILE   9  47.332   8.615   6.296
   79   HG13  ILE   9          HG11      ILE   9  47.579  10.100   5.361
   80   HG21  ILE   9          HG21      ILE   9  49.891   9.689   5.702
   81   HG22  ILE   9          HG22      ILE   9  50.759   8.534   4.665
   82   HG23  ILE   9          HG23      ILE   9  49.999   7.978   6.171
   83   HD11  ILE   9           HD1      ILE   9  45.252   8.889   5.218
   84   HD12  ILE   9           HD2      ILE   9  46.090   7.752   4.137
   85   HD13  ILE   9           HD3      ILE   9  45.994   9.480   3.715
   86    H    GLY  10           HN       GLY  10  47.799  10.316   1.212
   87    HA2  GLY  10           HA1      GLY  10  49.139  12.770   2.006
   88    HA3  GLY  10           HA2      GLY  10  47.927  12.586   0.721
   89    H    LYS  11           HN       LYS  11  46.596  11.146   3.314
   90    HA   LYS  11           HA       LYS  11  44.627  11.778   4.419
   91    HB2  LYS  11           HB2      LYS  11  45.170  13.284   6.345
   92    HB3  LYS  11           HB1      LYS  11  46.318  11.945   6.126
   93    HG2  LYS  11           HG2      LYS  11  47.952  13.396   5.108
   94    HG3  LYS  11           HG1      LYS  11  46.782  14.732   4.989
   95    HD2  LYS  11           HD2      LYS  11  46.713  14.998   7.385
   96    HD3  LYS  11           HD1      LYS  11  47.634  13.494   7.636
   97    HE2  LYS  11           HE2      LYS  11  48.696  15.961   6.191
   98    HE3  LYS  11           HE1      LYS  11  49.055  15.540   7.883
   99    HZ1  LYS  11           HZ1      LYS  11  50.418  14.684   5.659
  100    HZ2  LYS  11           HZ2      LYS  11  49.491  13.335   6.118
  101    HZ3  LYS  11           HZ3      LYS  11  50.555  14.056   7.229
  102    H    ALA  12           HN       ALA  12  44.785  13.127   1.885
  103    HA   ALA  12           HA       ALA  12  44.006  15.927   2.373
  104    HB1  ALA  12           HB1      ALA  12  43.765  16.060  -0.015
  105    HB2  ALA  12           HB2      ALA  12  43.744  14.286  -0.168
  106    HB3  ALA  12           HB3      ALA  12  45.238  15.120   0.323
  107    H    GLY  13           HN       GLY  13  42.475  13.854   3.734
  108    HA2  GLY  13           HA1      GLY  13  40.226  13.655   4.300
  109    HA3  GLY  13           HA2      GLY  13  39.816  14.801   3.008
  110    H    PHE  14           HN       PHE  14  41.214  11.497   3.290
  111    HA   PHE  14           HA       PHE  14  40.748   9.579   2.073
  112    HB2  PHE  14           HB2      PHE  14  38.547   9.893   3.229
  113    HB3  PHE  14           HB1      PHE  14  37.968  10.791   1.805
  114    HD1  PHE  14           HD1      PHE  14  39.586   7.521   2.758
  115    HD2  PHE  14           HD2      PHE  14  36.969   9.592   0.018
  116    HE1  PHE  14           HE1      PHE  14  39.048   5.363   1.638
  117    HE2  PHE  14           HE2      PHE  14  36.431   7.431  -1.100
  118    HZ   PHE  14           HZ       PHE  14  37.523   5.328  -0.332
  119    H    ILE  15           HN       ILE  15  41.811  11.895   0.687
  120    HA   ILE  15           HA       ILE  15  42.272  12.547  -1.466
  121    HB   ILE  15           HB       ILE  15  40.785  10.070  -2.434
  122   HG12  ILE  15          HG12      ILE  15  42.549   9.614  -0.582
  123   HG13  ILE  15          HG11      ILE  15  42.714   8.723  -2.105
  124   HG21  ILE  15          HG21      ILE  15  42.580  10.218  -4.242
  125   HG22  ILE  15          HG22      ILE  15  42.994  11.818  -3.583
  126   HG23  ILE  15          HG23      ILE  15  41.370  11.520  -4.245
  127   HD11  ILE  15           HD1      ILE  15  44.874   9.707  -1.168
  128   HD12  ILE  15           HD2      ILE  15  44.220  11.314  -1.544
  129   HD13  ILE  15           HD3      ILE  15  44.510  10.144  -2.851
  130    H    ILE  16           HN       ILE  16  40.631  14.133  -0.710
  131    HA   ILE  16           HA       ILE  16  38.472  14.302  -2.794
  132    HB   ILE  16           HB       ILE  16  38.242  15.031   0.154
  133   HG12  ILE  16          HG12      ILE  16  38.032  12.525  -0.566
  134   HG13  ILE  16          HG11      ILE  16  36.758  13.214   0.452
  135   HG21  ILE  16          HG21      ILE  16  37.024  16.665  -1.138
  136   HG22  ILE  16          HG22      ILE  16  35.820  15.523  -0.505
  137   HG23  ILE  16          HG23      ILE  16  36.346  15.414  -2.203
  138   HD11  ILE  16           HD1      ILE  16  36.539  13.080  -2.587
  139   HD12  ILE  16           HD2      ILE  16  35.251  13.422  -1.414
  140   HD13  ILE  16           HD3      ILE  16  35.957  11.794  -1.511
  141    H    ILE  17           HN       ILE  17  40.283  16.025  -0.201
  142    HA   ILE  17           HA       ILE  17  39.922  18.623  -1.448
  143    HB   ILE  17           HB       ILE  17  41.843  17.565   0.678
  144   HG12  ILE  17          HG12      ILE  17  40.539  19.021   2.158
  145   HG13  ILE  17          HG11      ILE  17  39.624  19.659   0.774
  146   HG21  ILE  17          HG21      ILE  17  42.399  20.068   1.012
  147   HG22  ILE  17          HG22      ILE  17  41.733  20.319  -0.619
  148   HG23  ILE  17          HG23      ILE  17  43.151  19.270  -0.389
  149   HD11  ILE  17           HD1      ILE  17  39.658  16.686   1.398
  150   HD12  ILE  17           HD2      ILE  17  38.484  17.609   0.433
  151   HD13  ILE  17           HD3      ILE  17  38.515  17.788   2.200
  152    H    GLY  18           HN       GLY  18  42.537  16.187  -1.372
  153    HA2  GLY  18           HA1      GLY  18  44.219  17.708  -3.214
  154    HA3  GLY  18           HA2      GLY  18  44.488  16.049  -2.638
  155    H    GLY  19           HN       GLY  19  42.221  14.733  -3.409
  156    HA2  GLY  19           HA1      GLY  19  42.749  14.200  -6.157
  157    HA3  GLY  19           HA2      GLY  19  41.314  13.671  -5.254
  158    H    ALA  20           HN       ALA  20  40.191  16.126  -4.576
  159    HA   ALA  20           HA       ALA  20  38.674  17.633  -5.468
  160    HB1  ALA  20           HB1      ALA  20  39.532  19.193  -7.083
  161    HB2  ALA  20           HB2      ALA  20  40.764  18.029  -7.630
  162    HB3  ALA  20           HB3      ALA  20  40.871  18.742  -6.001
  163    H    LEU  21           HN       LEU  21  39.167  14.750  -6.774
  164    HA   LEU  21           HA       LEU  21  38.139  13.513  -8.450
  165    HB2  LEU  21           HB2      LEU  21  36.110  15.711  -7.919
  166    HB3  LEU  21           HB1      LEU  21  35.797  14.446  -9.130
  167    HG   LEU  21           HG       LEU  21  36.042  12.698  -7.444
  168   HD11  LEU  21          HD11      LEU  21  36.281  13.479  -4.988
  169   HD12  LEU  21          HD12      LEU  21  36.853  15.026  -5.658
  170   HD13  LEU  21          HD13      LEU  21  37.748  13.523  -5.991
  171   HD21  LEU  21          HD21      LEU  21  34.071  13.175  -6.121
  172   HD22  LEU  21          HD22      LEU  21  33.852  13.966  -7.700
  173   HD23  LEU  21          HD23      LEU  21  34.323  14.929  -6.279
  174    H    ASP  22           HN       ASP  22  36.527  16.289  -9.803
  175    HA   ASP  22           HA       ASP  22  36.691  17.208 -11.930
  176    HB2  ASP  22           HB2      ASP  22  39.619  17.128 -11.110
  177    HB3  ASP  22           HB1      ASP  22  39.017  17.984 -12.549
  178    H    HIS  23           HN       HIS  23  39.856  15.655 -12.216
  179    HA   HIS  23           HA       HIS  23  38.796  13.455 -13.871
  180    HB2  HIS  23           HB2      HIS  23  40.507  15.652 -15.105
  181    HB3  HIS  23           HB1      HIS  23  40.060  14.120 -15.890
  182    HD1  HIS  23           HD1      HIS  23  38.623  17.427 -14.712
  183    HD2  HIS  23           HD2      HIS  23  37.341  13.969 -16.735
  184    HE1  HIS  23           HE1      HIS  23  36.334  17.940 -15.724
  185    H    LEU  24           HN       LEU  24  40.712  14.413 -11.519
  186    HA   LEU  24           HA       LEU  24  43.246  13.150 -12.401
  187    HB2  LEU  24           HB2      LEU  24  43.082  15.193 -10.866
  188    HB3  LEU  24           HB1      LEU  24  42.471  14.089  -9.616
  189    HG   LEU  24           HG       LEU  24  44.636  12.660 -10.185
  190   HD11  LEU  24          HD11      LEU  24  45.426  13.902 -12.127
  191   HD12  LEU  24          HD12      LEU  24  46.564  14.180 -10.794
  192   HD13  LEU  24          HD13      LEU  24  45.381  15.434 -11.225
  193   HD21  LEU  24          HD21      LEU  24  45.921  13.950  -8.502
  194   HD22  LEU  24          HD22      LEU  24  44.214  13.790  -8.023
  195   HD23  LEU  24          HD23      LEU  24  44.809  15.324  -8.703
  Start of MODEL   62
    1    H1   GLY   1           HT1      GLY   1  61.154   2.521   0.050
    2    H2   GLY   1           HT2      GLY   1  61.819   4.041  -0.321
    3    H3   GLY   1           HT3      GLY   1  62.299   2.661  -1.191
    4    HA2  GLY   1           HA1      GLY   1  60.548   4.363  -2.092
    5    HA3  GLY   1           HA2      GLY   1  60.514   2.632  -2.477
    6    H    LYS   2           HN       LYS   2  59.918   2.622   0.705
    7    HA   LYS   2           HA       LYS   2  57.181   1.926   0.454
    8    HB2  LYS   2           HB2      LYS   2  58.733   2.950   2.865
    9    HB3  LYS   2           HB1      LYS   2  57.115   2.210   2.942
   10    HG2  LYS   2           HG2      LYS   2  57.924   0.100   2.155
   11    HG3  LYS   2           HG1      LYS   2  59.473   0.801   1.630
   12    HD2  LYS   2           HD2      LYS   2  59.679  -0.480   3.770
   13    HD3  LYS   2           HD1      LYS   2  60.112   1.235   3.957
   14    HE2  LYS   2           HE2      LYS   2  58.563   0.191   5.757
   15    HE3  LYS   2           HE1      LYS   2  58.072   1.751   5.059
   16    HZ1  LYS   2           HZ1      LYS   2  56.209   0.253   5.095
   17    HZ2  LYS   2           HZ2      LYS   2  57.082  -0.944   4.263
   18    HZ3  LYS   2           HZ3      LYS   2  56.669   0.508   3.483
   19    H    GLY   3           HN       GLY   3  57.444   4.293   2.913
   20    HA2  GLY   3           HA1      GLY   3  56.808   6.674   2.793
   21    HA3  GLY   3           HA2      GLY   3  55.943   6.370   1.219
   22    H    ARG   4           HN       ARG   4  54.866   4.732   1.003
   23    HA   ARG   4           HA       ARG   4  53.128   6.347   1.495
   24    HB2  ARG   4           HB2      ARG   4  52.355   3.483   0.744
   25    HB3  ARG   4           HB1      ARG   4  51.376   4.941   0.440
   26    HG2  ARG   4           HG2      ARG   4  53.321   5.897  -0.856
   27    HG3  ARG   4           HG1      ARG   4  54.151   4.332  -0.671
   28    HD2  ARG   4           HD2      ARG   4  52.123   3.236  -1.739
   29    HD3  ARG   4           HD1      ARG   4  51.517   4.870  -2.103
   30    HE   ARG   4           HE       ARG   4  54.164   4.741  -3.097
   31   HH11  ARG   4          HH11      ARG   4  53.792   2.056  -3.993
   32   HH12  ARG   4          HH12      ARG   4  52.888   2.200  -5.463
   33   HH21  ARG   4          HH21      ARG   4  51.837   5.440  -4.812
   34   HH22  ARG   4          HH22      ARG   4  51.781   4.116  -5.928
   35    H    TRP   5           HN       TRP   5  54.182   4.182   3.568
   36    HA   TRP   5           HA       TRP   5  52.251   2.967   5.133
   37    HB2  TRP   5           HB2      TRP   5  54.686   3.040   5.662
   38    HB3  TRP   5           HB1      TRP   5  54.484   4.707   6.252
   39    HD1  TRP   5           HD1      TRP   5  53.402   1.099   7.033
   40    HE1  TRP   5           HE1      TRP   5  52.692   0.936   9.529
   41    HE3  TRP   5           HE3      TRP   5  53.685   6.057   8.277
   42    HZ2  TRP   5           HZ2      TRP   5  52.309   2.738  11.743
   43    HZ3  TRP   5           HZ3      TRP   5  53.143   6.812  10.588
   44    HH2  TRP   5           HH2      TRP   5  52.456   5.158  12.320
   45    H    LEU   6           HN       LEU   6  52.577   6.368   4.558
   46    HA   LEU   6           HA       LEU   6  50.554   7.008   6.688
   47    HB2  LEU   6           HB2      LEU   6  52.806   8.225   6.627
   48    HB3  LEU   6           HB1      LEU   6  52.273   8.938   5.090
   49    HG   LEU   6           HG       LEU   6  50.110   9.635   6.448
   50   HD11  LEU   6          HD11      LEU   6  50.515   8.426   8.520
   51   HD12  LEU   6          HD12      LEU   6  50.702  10.159   8.858
   52   HD13  LEU   6          HD13      LEU   6  52.141   9.132   8.673
   53   HD21  LEU   6          HD21      LEU   6  52.817  10.956   6.936
   54   HD22  LEU   6          HD22      LEU   6  51.233  11.736   7.160
   55   HD23  LEU   6          HD23      LEU   6  51.755  11.231   5.534
   56    H    GLU   7           HN       GLU   7  51.214   6.944   3.203
   57    HA   GLU   7           HA       GLU   7  48.630   8.387   2.675
   58    HB2  GLU   7           HB2      GLU   7  50.942   7.567   0.873
   59    HB3  GLU   7           HB1      GLU   7  49.445   8.342   0.301
   60    HG2  GLU   7           HG2      GLU   7  49.885  10.256   1.855
   61    HG3  GLU   7           HG1      GLU   7  51.424   9.493   2.320
   62    H    ARG   8           HN       ARG   8  49.044   5.549   3.731
   63    HA   ARG   8           HA       ARG   8  48.500   3.619   1.755
   64    HB2  ARG   8           HB2      ARG   8  48.942   3.178   4.183
   65    HB3  ARG   8           HB1      ARG   8  47.287   3.724   4.543
   66    HG2  ARG   8           HG2      ARG   8  46.341   1.955   3.159
   67    HG3  ARG   8           HG1      ARG   8  47.963   1.464   2.612
   68    HD2  ARG   8           HD2      ARG   8  48.581   0.826   4.898
   69    HD3  ARG   8           HD1      ARG   8  47.013   1.407   5.511
   70    HE   ARG   8           HE       ARG   8  46.130  -0.670   4.851
   71   HH11  ARG   8          HH11      ARG   8  46.011  -0.669   2.071
   72   HH12  ARG   8          HH12      ARG   8  47.238  -1.766   1.530
   73   HH21  ARG   8          HH21      ARG   8  48.960  -1.741   4.540
   74   HH22  ARG   8          HH22      ARG   8  48.907  -2.373   2.928
   75    H    ILE   9           HN       ILE   9  46.090   5.386   3.765
   76    HA   ILE   9           HA       ILE   9  43.868   4.413   2.174
   77    HB   ILE   9           HB       ILE   9  42.536   6.118   3.430
   78   HG12  ILE   9          HG12      ILE   9  45.295   6.876   4.501
   79   HG13  ILE   9          HG11      ILE   9  44.198   7.911   3.558
   80   HG21  ILE   9          HG21      ILE   9  42.749   5.048   5.570
   81   HG22  ILE   9          HG22      ILE   9  44.468   4.676   5.293
   82   HG23  ILE   9          HG23      ILE   9  43.211   3.822   4.367
   83   HD11  ILE   9           HD1      ILE   9  42.483   7.502   5.480
   84   HD12  ILE   9           HD2      ILE   9  43.844   8.603   5.798
   85   HD13  ILE   9           HD3      ILE   9  43.887   6.936   6.416
   86    H    GLY  10           HN       GLY  10  45.893   7.325   2.160
   87    HA2  GLY  10           HA1      GLY  10  46.171   8.888   0.465
   88    HA3  GLY  10           HA2      GLY  10  45.125   7.902  -0.575
   89    H    LYS  11           HN       LYS  11  43.068   8.036   1.738
   90    HA   LYS  11           HA       LYS  11  41.625  10.309   0.633
   91    HB2  LYS  11           HB2      LYS  11  41.018   8.633   3.100
   92    HB3  LYS  11           HB1      LYS  11  39.880   9.694   2.233
   93    HG2  LYS  11           HG2      LYS  11  40.363   8.281   0.145
   94    HG3  LYS  11           HG1      LYS  11  41.186   7.133   1.228
   95    HD2  LYS  11           HD2      LYS  11  38.284   8.046   1.477
   96    HD3  LYS  11           HD1      LYS  11  38.826   6.471   0.852
   97    HE2  LYS  11           HE2      LYS  11  40.060   6.219   3.139
   98    HE3  LYS  11           HE1      LYS  11  39.005   7.548   3.684
   99    HZ1  LYS  11           HZ1      LYS  11  37.089   6.224   2.941
  100    HZ2  LYS  11           HZ2      LYS  11  37.981   5.441   4.157
  101    HZ3  LYS  11           HZ3      LYS  11  38.127   4.945   2.540
  102    H    ALA  12           HN       ALA  12  42.721  12.209   1.031
  103    HA   ALA  12           HA       ALA  12  43.908  12.925   3.517
  104    HB1  ALA  12           HB1      ALA  12  43.686  15.263   2.685
  105    HB2  ALA  12           HB2      ALA  12  42.659  14.662   1.360
  106    HB3  ALA  12           HB3      ALA  12  44.361  14.154   1.469
  107    H    GLY  13           HN       GLY  13  40.687  12.293   2.831
  108    HA2  GLY  13           HA1      GLY  13  38.746  12.644   4.034
  109    HA3  GLY  13           HA2      GLY  13  39.779  13.051   5.420
  110    H    PHE  14           HN       PHE  14  40.342  14.900   2.608
  111    HA   PHE  14           HA       PHE  14  38.321  16.946   3.081
  112    HB2  PHE  14           HB2      PHE  14  39.855  17.338   5.021
  113    HB3  PHE  14           HB1      PHE  14  41.191  17.590   3.872
  114    HD1  PHE  14           HD1      PHE  14  41.555  19.753   2.957
  115    HD2  PHE  14           HD2      PHE  14  37.712  18.793   4.675
  116    HE1  PHE  14           HE1      PHE  14  40.833  22.120   2.668
  117    HE2  PHE  14           HE2      PHE  14  36.993  21.161   4.385
  118    HZ   PHE  14           HZ       PHE  14  38.546  22.820   3.363
  119    H    ILE  15           HN       ILE  15  41.499  16.028   1.794
  120    HA   ILE  15           HA       ILE  15  40.942  17.688  -0.661
  121    HB   ILE  15           HB       ILE  15  43.636  16.540   0.157
  122   HG12  ILE  15          HG12      ILE  15  42.456  19.278   0.811
  123   HG13  ILE  15          HG11      ILE  15  42.844  17.999   1.985
  124   HG21  ILE  15          HG21      ILE  15  44.522  18.106  -1.427
  125   HG22  ILE  15          HG22      ILE  15  42.969  18.969  -1.548
  126   HG23  ILE  15          HG23      ILE  15  43.137  17.334  -2.229
  127   HD11  ILE  15           HD1      ILE  15  44.744  19.678   0.317
  128   HD12  ILE  15           HD2      ILE  15  45.262  18.121   1.010
  129   HD13  ILE  15           HD3      ILE  15  44.725  19.440   2.079
  130    H    ILE  16           HN       ILE  16  39.467  15.572  -0.710
  131    HA   ILE  16           HA       ILE  16  40.749  13.878  -2.764
  132    HB   ILE  16           HB       ILE  16  41.239  12.696  -0.609
  133   HG12  ILE  16          HG12      ILE  16  40.183  10.502  -1.245
  134   HG13  ILE  16          HG11      ILE  16  39.153  11.360  -2.409
  135   HG21  ILE  16          HG21      ILE  16  39.514  11.912   0.829
  136   HG22  ILE  16          HG22      ILE  16  38.239  12.320  -0.339
  137   HG23  ILE  16          HG23      ILE  16  39.118  13.616   0.508
  138   HD11  ILE  16           HD1      ILE  16  41.439  10.246  -3.207
  139   HD12  ILE  16           HD2      ILE  16  42.160  11.738  -2.561
  140   HD13  ILE  16           HD3      ILE  16  40.944  11.823  -3.860
  141    H    ILE  17           HN       ILE  17  37.907  14.512  -0.684
  142    HA   ILE  17           HA       ILE  17  36.089  13.731  -2.928
  143    HB   ILE  17           HB       ILE  17  34.321  14.541  -1.089
  144   HG12  ILE  17          HG12      ILE  17  35.137  14.259   1.212
  145   HG13  ILE  17          HG11      ILE  17  36.775  13.915   0.618
  146   HG21  ILE  17          HG21      ILE  17  34.510  12.248   0.015
  147   HG22  ILE  17          HG22      ILE  17  35.986  11.995  -0.947
  148   HG23  ILE  17          HG23      ILE  17  34.424  12.236  -1.762
  149   HD11  ILE  17           HD1      ILE  17  36.290  16.325   1.434
  150   HD12  ILE  17           HD2      ILE  17  35.351  16.513  -0.065
  151   HD13  ILE  17           HD3      ILE  17  37.094  16.148  -0.142
  152    H    GLY  18           HN       GLY  18  37.996  16.234  -2.250
  153    HA2  GLY  18           HA1      GLY  18  36.095  18.222  -3.453
  154    HA3  GLY  18           HA2      GLY  18  37.075  18.649  -2.035
  155    H    GLY  19           HN       GLY  19  39.549  17.801  -2.438
  156    HA2  GLY  19           HA1      GLY  19  40.571  19.595  -4.393
  157    HA3  GLY  19           HA2      GLY  19  41.480  18.286  -3.613
  158    H    ALA  20           HN       ALA  20  40.130  16.046  -4.489
  159    HA   ALA  20           HA       ALA  20  40.236  14.574  -6.278
  160    HB1  ALA  20           HB1      ALA  20  38.970  15.193  -8.212
  161    HB2  ALA  20           HB2      ALA  20  39.244  16.927  -7.913
  162    HB3  ALA  20           HB3      ALA  20  38.206  15.986  -6.815
  163    H    LEU  21           HN       LEU  21  42.700  15.700  -5.703
  164    HA   LEU  21           HA       LEU  21  43.983  16.896  -7.973
  165    HB2  LEU  21           HB2      LEU  21  44.969  15.309  -5.584
  166    HB3  LEU  21           HB1      LEU  21  46.096  15.860  -6.838
  167    HG   LEU  21           HG       LEU  21  45.832  17.390  -4.802
  168   HD11  LEU  21          HD11      LEU  21  45.028  18.854  -7.346
  169   HD12  LEU  21          HD12      LEU  21  46.623  18.086  -7.192
  170   HD13  LEU  21          HD13      LEU  21  46.140  19.366  -6.060
  171   HD21  LEU  21          HD21      LEU  21  43.318  17.077  -4.683
  172   HD22  LEU  21          HD22      LEU  21  43.177  18.126  -6.112
  173   HD23  LEU  21          HD23      LEU  21  43.861  18.767  -4.602
  174    H    ASP  22           HN       ASP  22  43.757  15.972  -9.930
  175    HA   ASP  22           HA       ASP  22  43.970  14.386 -11.607
  176    HB2  ASP  22           HB2      ASP  22  46.350  14.481 -10.749
  177    HB3  ASP  22           HB1      ASP  22  45.981  13.049  -9.758
  178    H    HIS  23           HN       HIS  23  41.730  13.954 -10.317
  179    HA   HIS  23           HA       HIS  23  40.222  12.372  -9.497
  180    HB2  HIS  23           HB2      HIS  23  40.186  10.284 -10.890
  181    HB3  HIS  23           HB1      HIS  23  40.262  11.785 -11.843
  182    HD1  HIS  23           HD1      HIS  23  42.351  12.233 -13.248
  183    HD2  HIS  23           HD2      HIS  23  42.632   8.766 -10.886
  184    HE1  HIS  23           HE1      HIS  23  44.460  10.988 -13.973
  185    H    LEU  24           HN       LEU  24  42.502  12.558  -7.812
  186    HA   LEU  24           HA       LEU  24  42.188  10.094  -6.355
  187    HB2  LEU  24           HB2      LEU  24  43.657   9.123  -8.016
  188    HB3  LEU  24           HB1      LEU  24  44.788  10.486  -7.890
  189    HG   LEU  24           HG       LEU  24  45.422   9.845  -5.633
  190   HD11  LEU  24          HD11      LEU  24  43.407   9.102  -4.609
  191   HD12  LEU  24          HD12      LEU  24  44.398   7.630  -4.715
  192   HD13  LEU  24          HD13      LEU  24  43.089   7.908  -5.890
  193   HD21  LEU  24          HD21      LEU  24  46.520   8.638  -7.490
  194   HD22  LEU  24          HD22      LEU  24  45.244   7.398  -7.447
  195   HD23  LEU  24          HD23      LEU  24  46.352   7.584  -6.067
  Start of MODEL   63
    1    H1   GLY   1           HT1      GLY   1  58.653   9.216  -5.048
    2    H2   GLY   1           HT2      GLY   1  59.863   8.456  -4.128
    3    H3   GLY   1           HT3      GLY   1  58.370   8.849  -3.417
    4    HA2  GLY   1           HA1      GLY   1  57.784   7.328  -5.620
    5    HA3  GLY   1           HA2      GLY   1  59.145   6.538  -4.800
    6    H    LYS   2           HN       LYS   2  58.540   5.026  -3.424
    7    HA   LYS   2           HA       LYS   2  55.845   4.734  -2.503
    8    HB2  LYS   2           HB2      LYS   2  58.449   3.589  -1.416
    9    HB3  LYS   2           HB1      LYS   2  56.822   3.047  -0.940
   10    HG2  LYS   2           HG2      LYS   2  56.342   2.570  -3.372
   11    HG3  LYS   2           HG1      LYS   2  58.047   2.940  -3.728
   12    HD2  LYS   2           HD2      LYS   2  58.793   1.137  -2.255
   13    HD3  LYS   2           HD1      LYS   2  57.118   0.816  -1.748
   14    HE2  LYS   2           HE2      LYS   2  56.506   0.152  -4.019
   15    HE3  LYS   2           HE1      LYS   2  58.121   0.600  -4.619
   16    HZ1  LYS   2           HZ1      LYS   2  58.681  -1.493  -4.181
   17    HZ2  LYS   2           HZ2      LYS   2  57.266  -1.791  -3.289
   18    HZ3  LYS   2           HZ3      LYS   2  58.619  -1.094  -2.534
   19    H    GLY   3           HN       GLY   3  55.798   4.235   0.134
   20    HA2  GLY   3           HA1      GLY   3  56.728   5.567   2.217
   21    HA3  GLY   3           HA2      GLY   3  56.098   7.026   1.323
   22    H    ARG   4           HN       ARG   4  54.510   6.827   0.164
   23    HA   ARG   4           HA       ARG   4  53.507   7.811   2.138
   24    HB2  ARG   4           HB2      ARG   4  51.913   7.359  -0.433
   25    HB3  ARG   4           HB1      ARG   4  51.463   8.541   0.821
   26    HG2  ARG   4           HG2      ARG   4  53.730   9.591   0.592
   27    HG3  ARG   4           HG1      ARG   4  54.083   8.467  -0.742
   28    HD2  ARG   4           HD2      ARG   4  52.118   9.349  -1.988
   29    HD3  ARG   4           HD1      ARG   4  51.809  10.497  -0.665
   30    HE   ARG   4           HE       ARG   4  54.503  10.854  -1.508
   31   HH11  ARG   4          HH11      ARG   4  52.405  10.384  -3.912
   32   HH12  ARG   4          HH12      ARG   4  52.276  12.027  -4.445
   33   HH21  ARG   4          HH21      ARG   4  53.859  13.336  -1.651
   34   HH22  ARG   4          HH22      ARG   4  53.098  13.699  -3.165
   35    H    TRP   5           HN       TRP   5  53.228   4.746   1.337
   36    HA   TRP   5           HA       TRP   5  50.731   3.622   1.736
   37    HB2  TRP   5           HB2      TRP   5  52.817   2.321   1.448
   38    HB3  TRP   5           HB1      TRP   5  53.285   2.709   3.120
   39    HD1  TRP   5           HD1      TRP   5  52.428   1.148   4.943
   40    HE1  TRP   5           HE1      TRP   5  50.710  -0.799   5.100
   41    HE3  TRP   5           HE3      TRP   5  50.373   1.506   0.268
   42    HZ2  TRP   5           HZ2      TRP   5  48.726  -2.012   3.403
   43    HZ3  TRP   5           HZ3      TRP   5  48.570  -0.058  -0.442
   44    HH2  TRP   5           HH2      TRP   5  47.745  -1.814   1.119
   45    H    LEU   6           HN       LEU   6  52.474   5.565   4.006
   46    HA   LEU   6           HA       LEU   6  50.439   4.941   6.145
   47    HB2  LEU   6           HB2      LEU   6  53.250   6.013   6.577
   48    HB3  LEU   6           HB1      LEU   6  52.103   5.435   7.805
   49    HG   LEU   6           HG       LEU   6  53.313   3.705   5.597
   50   HD11  LEU   6          HD11      LEU   6  54.988   4.459   7.272
   51   HD12  LEU   6          HD12      LEU   6  54.659   2.715   7.415
   52   HD13  LEU   6          HD13      LEU   6  53.942   3.855   8.579
   53   HD21  LEU   6          HD21      LEU   6  52.418   1.871   7.209
   54   HD22  LEU   6          HD22      LEU   6  51.219   2.737   6.226
   55   HD23  LEU   6          HD23      LEU   6  51.439   3.164   7.940
   56    H    GLU   7           HN       GLU   7  51.794   7.331   3.993
   57    HA   GLU   7           HA       GLU   7  50.947   9.592   5.726
   58    HB2  GLU   7           HB2      GLU   7  52.046   9.515   2.891
   59    HB3  GLU   7           HB1      GLU   7  51.739  10.986   3.840
   60    HG2  GLU   7           HG2      GLU   7  53.559   8.731   4.785
   61    HG3  GLU   7           HG1      GLU   7  54.148  10.156   3.896
   62    H    ARG   8           HN       ARG   8  49.461   7.413   3.633
   63    HA   ARG   8           HA       ARG   8  47.665   9.206   2.242
   64    HB2  ARG   8           HB2      ARG   8  48.125   6.850   1.549
   65    HB3  ARG   8           HB1      ARG   8  47.253   6.284   2.994
   66    HG2  ARG   8           HG2      ARG   8  45.192   7.319   2.241
   67    HG3  ARG   8           HG1      ARG   8  46.032   8.121   0.892
   68    HD2  ARG   8           HD2      ARG   8  45.760   5.106   1.262
   69    HD3  ARG   8           HD1      ARG   8  44.820   6.097   0.122
   70    HE   ARG   8           HE       ARG   8  47.695   6.412  -0.245
   71   HH11  ARG   8          HH11      ARG   8  45.843   6.476  -2.530
   72   HH12  ARG   8          HH12      ARG   8  46.078   4.928  -3.271
   73   HH21  ARG   8          HH21      ARG   8  47.615   3.535  -0.492
   74   HH22  ARG   8          HH22      ARG   8  47.082   3.265  -2.118
   75    H    ILE   9           HN       ILE   9  46.887  10.687   3.776
   76    HA   ILE   9           HA       ILE   9  45.671   9.960   6.248
   77    HB   ILE   9           HB       ILE   9  44.520  12.184   6.099
   78   HG12  ILE   9          HG12      ILE   9  45.768  12.166   3.310
   79   HG13  ILE   9          HG11      ILE   9  44.033  12.206   3.696
   80   HG21  ILE   9          HG21      ILE   9  46.973  11.851   6.790
   81   HG22  ILE   9          HG22      ILE   9  46.534  13.484   6.240
   82   HG23  ILE   9          HG23      ILE   9  47.408  12.382   5.148
   83   HD11  ILE   9           HD1      ILE   9  44.563  14.470   3.230
   84   HD12  ILE   9           HD2      ILE   9  46.111  14.382   4.100
   85   HD13  ILE   9           HD3      ILE   9  44.579  14.392   5.007
   86    H    GLY  10           HN       GLY  10  44.392  10.103   2.940
   87    HA2  GLY  10           HA1      GLY  10  42.302   9.533   2.110
   88    HA3  GLY  10           HA2      GLY  10  42.341   8.253   3.339
   89    H    LYS  11           HN       LYS  11  42.545  11.474   4.521
   90    HA   LYS  11           HA       LYS  11  40.060  11.198   5.981
   91    HB2  LYS  11           HB2      LYS  11  41.998  13.495   5.531
   92    HB3  LYS  11           HB1      LYS  11  40.531  13.682   6.520
   93    HG2  LYS  11           HG2      LYS  11  42.408  11.355   7.085
   94    HG3  LYS  11           HG1      LYS  11  42.848  12.979   7.655
   95    HD2  LYS  11           HD2      LYS  11  40.659  13.155   8.830
   96    HD3  LYS  11           HD1      LYS  11  40.250  11.509   8.296
   97    HE2  LYS  11           HE2      LYS  11  42.606  12.302  10.058
   98    HE3  LYS  11           HE1      LYS  11  41.145  11.429  10.576
   99    HZ1  LYS  11           HZ1      LYS  11  41.740   9.681   8.945
  100    HZ2  LYS  11           HZ2      LYS  11  42.887   9.859  10.186
  101    HZ3  LYS  11           HZ3      LYS  11  43.199  10.488   8.639
  102    H    ALA  12           HN       ALA  12  40.635  11.932   2.747
  103    HA   ALA  12           HA       ALA  12  39.317  12.922   1.118
  104    HB1  ALA  12           HB1      ALA  12  37.039  12.756   3.117
  105    HB2  ALA  12           HB2      ALA  12  37.634  11.346   2.210
  106    HB3  ALA  12           HB3      ALA  12  36.948  12.738   1.341
  107    H    GLY  13           HN       GLY  13  40.876  14.662   2.397
  108    HA2  GLY  13           HA1      GLY  13  39.903  16.759   3.886
  109    HA3  GLY  13           HA2      GLY  13  41.083  16.972   2.578
  110    H    PHE  14           HN       PHE  14  37.686  17.082   3.491
  111    HA   PHE  14           HA       PHE  14  35.868  18.109   2.455
  112    HB2  PHE  14           HB2      PHE  14  38.047  19.890   1.283
  113    HB3  PHE  14           HB1      PHE  14  36.312  20.276   1.373
  114    HD1  PHE  14           HD1      PHE  14  39.467  20.030   3.243
  115    HD2  PHE  14           HD2      PHE  14  35.204  20.612   3.585
  116    HE1  PHE  14           HE1      PHE  14  39.770  20.890   5.562
  117    HE2  PHE  14           HE2      PHE  14  35.508  21.471   5.903
  118    HZ   PHE  14           HZ       PHE  14  37.782  21.524   6.922
  119    H    ILE  15           HN       ILE  15  36.848  15.815   1.203
  120    HA   ILE  15           HA       ILE  15  36.651  14.645  -0.771
  121    HB   ILE  15           HB       ILE  15  35.218  17.065  -1.934
  122   HG12  ILE  15          HG12      ILE  15  34.120  16.720   0.164
  123   HG13  ILE  15          HG11      ILE  15  33.102  15.910  -1.042
  124   HG21  ILE  15          HG21      ILE  15  35.262  14.087  -2.544
  125   HG22  ILE  15          HG22      ILE  15  35.559  15.457  -3.631
  126   HG23  ILE  15          HG23      ILE  15  33.912  15.119  -3.064
  127   HD11  ILE  15           HD1      ILE  15  35.032  14.639   0.941
  128   HD12  ILE  15           HD2      ILE  15  34.361  13.744  -0.443
  129   HD13  ILE  15           HD3      ILE  15  33.276  14.394   0.805
  130    H    ILE  16           HN       ILE  16  39.008  14.950  -0.893
  131    HA   ILE  16           HA       ILE  16  39.679  16.371  -3.443
  132    HB   ILE  16           HB       ILE  16  40.291  17.956  -1.660
  133   HG12  ILE  16          HG12      ILE  16  42.711  18.192  -2.154
  134   HG13  ILE  16          HG11      ILE  16  42.752  16.542  -2.809
  135   HG21  ILE  16          HG21      ILE  16  42.280  15.964  -0.526
  136   HG22  ILE  16          HG22      ILE  16  40.597  15.977   0.056
  137   HG23  ILE  16          HG23      ILE  16  41.608  17.432   0.216
  138   HD11  ILE  16           HD1      ILE  16  40.769  18.550  -3.930
  139   HD12  ILE  16           HD2      ILE  16  41.497  17.128  -4.718
  140   HD13  ILE  16           HD3      ILE  16  42.467  18.594  -4.457
  141    H    ILE  17           HN       ILE  17  41.195  14.441  -0.786
  142    HA   ILE  17           HA       ILE  17  42.869  13.039  -2.732
  143    HB   ILE  17           HB       ILE  17  43.714  13.325  -0.453
  144   HG12  ILE  17          HG12      ILE  17  44.319  11.024   0.106
  145   HG13  ILE  17          HG11      ILE  17  42.959  10.387  -0.840
  146   HG21  ILE  17          HG21      ILE  17  41.582  13.462   0.732
  147   HG22  ILE  17          HG22      ILE  17  42.587  12.187   1.461
  148   HG23  ILE  17          HG23      ILE  17  41.242  11.751   0.381
  149   HD11  ILE  17           HD1      ILE  17  45.344  10.411  -1.930
  150   HD12  ILE  17           HD2      ILE  17  45.058  12.153  -2.151
  151   HD13  ILE  17           HD3      ILE  17  43.967  10.966  -2.907
  152    H    GLY  18           HN       GLY  18  39.775  12.595  -1.138
  153    HA2  GLY  18           HA1      GLY  18  39.492   9.803  -2.042
  154    HA3  GLY  18           HA2      GLY  18  38.286  10.784  -1.182
  155    H    GLY  19           HN       GLY  19  38.010  12.997  -2.752
  156    HA2  GLY  19           HA1      GLY  19  36.281  12.041  -4.813
  157    HA3  GLY  19           HA2      GLY  19  36.838  13.714  -4.609
  158    H    ALA  20           HN       ALA  20  39.590  13.422  -4.925
  159    HA   ALA  20           HA       ALA  20  39.802  13.423  -7.778
  160    HB1  ALA  20           HB1      ALA  20  41.981  13.051  -5.695
  161    HB2  ALA  20           HB2      ALA  20  41.360  14.613  -6.281
  162    HB3  ALA  20           HB3      ALA  20  42.224  13.522  -7.392
  163    H    LEU  21           HN       LEU  21  41.361  11.127  -5.489
  164    HA   LEU  21           HA       LEU  21  41.836   8.885  -5.724
  165    HB2  LEU  21           HB2      LEU  21  39.253   9.010  -6.325
  166    HB3  LEU  21           HB1      LEU  21  39.807   8.629  -7.961
  167    HG   LEU  21           HG       LEU  21  39.262   6.541  -6.917
  168   HD11  LEU  21          HD11      LEU  21  42.291   6.781  -6.675
  169   HD12  LEU  21          HD12      LEU  21  41.421   6.662  -8.221
  170   HD13  LEU  21          HD13      LEU  21  41.338   5.327  -7.049
  171   HD21  LEU  21          HD21      LEU  21  39.548   7.604  -4.503
  172   HD22  LEU  21          HD22      LEU  21  41.203   6.966  -4.614
  173   HD23  LEU  21          HD23      LEU  21  39.817   5.864  -4.735
  174    H    ASP  22           HN       ASP  22  43.904   9.613  -6.558
  175    HA   ASP  22           HA       ASP  22  44.445   8.425  -9.191
  176    HB2  ASP  22           HB2      ASP  22  44.715  11.422  -8.735
  177    HB3  ASP  22           HB1      ASP  22  45.558  10.550 -10.037
  178    H    HIS  23           HN       HIS  23  45.197   7.984  -6.409
  179    HA   HIS  23           HA       HIS  23  47.108   7.572  -5.162
  180    HB2  HIS  23           HB2      HIS  23  47.659   6.330  -7.288
  181    HB3  HIS  23           HB1      HIS  23  48.561   7.766  -7.829
  182    HD1  HIS  23           HD1      HIS  23  50.975   7.802  -7.206
  183    HD2  HIS  23           HD2      HIS  23  48.719   5.353  -4.638
  184    HE1  HIS  23           HE1      HIS  23  52.598   6.750  -5.537
  185    H    LEU  24           HN       LEU  24  46.289  10.416  -5.889
  186    HA   LEU  24           HA       LEU  24  48.462  11.714  -4.515
  187    HB2  LEU  24           HB2      LEU  24  49.676  11.566  -6.597
  188    HB3  LEU  24           HB1      LEU  24  48.266  12.118  -7.527
  189    HG   LEU  24           HG       LEU  24  48.424  14.349  -6.588
  190   HD11  LEU  24          HD11      LEU  24  48.996  13.998  -4.300
  191   HD12  LEU  24          HD12      LEU  24  50.411  14.828  -4.985
  192   HD13  LEU  24          HD13      LEU  24  50.454  13.067  -4.718
  193   HD21  LEU  24          HD21      LEU  24  50.649  15.021  -7.387
  194   HD22  LEU  24          HD22      LEU  24  49.981  13.760  -8.451
  195   HD23  LEU  24          HD23      LEU  24  51.228  13.343  -7.251
  Start of MODEL   64
    1    H1   GLY   1           HT1      GLY   1  63.103   4.166   9.827
    2    H2   GLY   1           HT2      GLY   1  62.808   3.466   8.307
    3    H3   GLY   1           HT3      GLY   1  63.124   2.480   9.654
    4    HA2  GLY   1           HA1      GLY   1  61.063   2.497  10.328
    5    HA3  GLY   1           HA2      GLY   1  60.954   4.253  10.092
    6    H    LYS   2           HN       LYS   2  58.900   2.353   9.512
    7    HA   LYS   2           HA       LYS   2  58.256   3.222   6.831
    8    HB2  LYS   2           HB2      LYS   2  59.958   1.237   6.549
    9    HB3  LYS   2           HB1      LYS   2  58.592   0.209   7.039
   10    HG2  LYS   2           HG2      LYS   2  57.244   1.465   5.190
   11    HG3  LYS   2           HG1      LYS   2  58.828   2.021   4.605
   12    HD2  LYS   2           HD2      LYS   2  59.584  -0.345   4.436
   13    HD3  LYS   2           HD1      LYS   2  57.977  -0.886   4.975
   14    HE2  LYS   2           HE2      LYS   2  56.948   0.255   3.019
   15    HE3  LYS   2           HE1      LYS   2  58.567   0.755   2.472
   16    HZ1  LYS   2           HZ1      LYS   2  58.994  -1.275   1.682
   17    HZ2  LYS   2           HZ2      LYS   2  57.322  -1.556   1.794
   18    HZ3  LYS   2           HZ3      LYS   2  58.356  -2.062   3.043
   19    H    GLY   3           HN       GLY   3  56.760   0.447   6.623
   20    HA2  GLY   3           HA1      GLY   3  54.339   0.163   6.888
   21    HA3  GLY   3           HA2      GLY   3  54.936  -0.086   8.612
   22    H    ARG   4           HN       ARG   4  54.463   1.620   6.029
   23    HA   ARG   4           HA       ARG   4  52.288   1.988   6.287
   24    HB2  ARG   4           HB2      ARG   4  53.278   4.218   8.019
   25    HB3  ARG   4           HB1      ARG   4  51.987   4.706   6.900
   26    HG2  ARG   4           HG2      ARG   4  51.154   2.217   8.200
   27    HG3  ARG   4           HG1      ARG   4  51.688   3.353   9.453
   28    HD2  ARG   4           HD2      ARG   4  50.149   5.058   8.651
   29    HD3  ARG   4           HD1      ARG   4  49.687   4.046   7.264
   30    HE   ARG   4           HE       ARG   4  49.125   2.452   9.466
   31   HH11  ARG   4          HH11      ARG   4  48.073   3.743  11.408
   32   HH12  ARG   4          HH12      ARG   4  46.653   4.597  10.904
   33   HH21  ARG   4          HH21      ARG   4  47.397   4.375   7.524
   34   HH22  ARG   4          HH22      ARG   4  46.271   4.955   8.705
   35    H    TRP   5           HN       TRP   5  55.164   3.007   5.271
   36    HA   TRP   5           HA       TRP   5  54.967   5.201   3.592
   37    HB2  TRP   5           HB2      TRP   5  57.006   3.825   3.806
   38    HB3  TRP   5           HB1      TRP   5  56.224   2.522   2.879
   39    HD1  TRP   5           HD1      TRP   5  56.530   6.354   2.257
   40    HE1  TRP   5           HE1      TRP   5  57.346   6.741  -0.179
   41    HE3  TRP   5           HE3      TRP   5  57.048   1.475   0.796
   42    HZ2  TRP   5           HZ2      TRP   5  58.115   5.126  -2.435
   43    HZ3  TRP   5           HZ3      TRP   5  57.825   0.922  -1.504
   44    HH2  TRP   5           HH2      TRP   5  58.359   2.741  -3.119
   45    H    LEU   6           HN       LEU   6  53.173   2.277   3.436
   46    HA   LEU   6           HA       LEU   6  52.138   2.935   0.686
   47    HB2  LEU   6           HB2      LEU   6  52.576   0.381   2.221
   48    HB3  LEU   6           HB1      LEU   6  51.150   0.444   1.164
   49    HG   LEU   6           HG       LEU   6  52.599   1.086  -0.747
   50   HD11  LEU   6          HD11      LEU   6  54.780   0.862   1.366
   51   HD12  LEU   6          HD12      LEU   6  54.412   2.245   0.307
   52   HD13  LEU   6          HD13      LEU   6  55.121   0.766  -0.380
   53   HD21  LEU   6          HD21      LEU   6  52.120  -1.296  -0.334
   54   HD22  LEU   6          HD22      LEU   6  53.508  -1.398   0.777
   55   HD23  LEU   6          HD23      LEU   6  53.775  -1.105  -0.959
   56    H    GLU   7           HN       GLU   7  51.391   2.840   4.124
   57    HA   GLU   7           HA       GLU   7  48.450   3.123   3.465
   58    HB2  GLU   7           HB2      GLU   7  49.931   2.119   5.925
   59    HB3  GLU   7           HB1      GLU   7  48.214   2.591   5.972
   60    HG2  GLU   7           HG2      GLU   7  48.415   0.168   5.585
   61    HG3  GLU   7           HG1      GLU   7  47.744   0.961   4.139
   62    H    ARG   8           HN       ARG   8  50.962   5.053   3.668
   63    HA   ARG   8           HA       ARG   8  50.598   6.815   5.831
   64    HB2  ARG   8           HB2      ARG   8  52.415   6.941   4.102
   65    HB3  ARG   8           HB1      ARG   8  51.227   7.619   2.964
   66    HG2  ARG   8           HG2      ARG   8  50.813   9.512   4.472
   67    HG3  ARG   8           HG1      ARG   8  51.920   8.820   5.681
   68    HD2  ARG   8           HD2      ARG   8  53.080  10.560   4.386
   69    HD3  ARG   8           HD1      ARG   8  53.781   8.964   4.023
   70    HE   ARG   8           HE       ARG   8  51.661   9.672   2.157
   71   HH11  ARG   8          HH11      ARG   8  54.903   8.934   2.527
   72   HH12  ARG   8          HH12      ARG   8  55.449   9.811   1.138
   73   HH21  ARG   8          HH21      ARG   8  52.384  11.324   0.557
   74   HH22  ARG   8          HH22      ARG   8  54.023  11.164   0.023
   75    H    ILE   9           HN       ILE   9  48.957   8.027   6.508
   76    HA   ILE   9           HA       ILE   9  46.466   8.125   5.186
   77    HB   ILE   9           HB       ILE   9  46.542   8.633   7.534
   78   HG12  ILE   9          HG12      ILE   9  45.250  10.678   7.684
   79   HG13  ILE   9          HG11      ILE   9  45.923  11.290   6.160
   80   HG21  ILE   9          HG21      ILE   9  48.118  11.179   7.005
   81   HG22  ILE   9          HG22      ILE   9  48.915   9.638   7.390
   82   HG23  ILE   9          HG23      ILE   9  47.793  10.373   8.554
   83   HD11  ILE   9           HD1      ILE   9  43.557  10.230   6.084
   84   HD12  ILE   9           HD2      ILE   9  44.389   8.667   6.270
   85   HD13  ILE   9           HD3      ILE   9  44.731   9.698   4.857
   86    H    GLY  10           HN       GLY  10  46.609   8.636   3.035
   87    HA2  GLY  10           HA1      GLY  10  47.817  11.235   2.248
   88    HA3  GLY  10           HA2      GLY  10  47.192   9.973   1.169
   89    H    LYS  11           HN       LYS  11  44.663   9.701   2.673
   90    HA   LYS  11           HA       LYS  11  43.130  11.592   1.183
   91    HB2  LYS  11           HB2      LYS  11  42.207  10.255   3.750
   92    HB3  LYS  11           HB1      LYS  11  41.220  10.780   2.365
   93    HG2  LYS  11           HG2      LYS  11  43.303   8.543   2.347
   94    HG3  LYS  11           HG1      LYS  11  41.535   8.334   2.321
   95    HD2  LYS  11           HD2      LYS  11  41.584   9.803   0.172
   96    HD3  LYS  11           HD1      LYS  11  43.337   9.487   0.158
   97    HE2  LYS  11           HE2      LYS  11  42.328   7.794  -1.222
   98    HE3  LYS  11           HE1      LYS  11  42.774   7.001   0.307
   99    HZ1  LYS  11           HZ1      LYS  11  40.353   7.750   0.949
  100    HZ2  LYS  11           HZ2      LYS  11  40.629   6.307   0.095
  101    HZ3  LYS  11           HZ3      LYS  11  40.119   7.701  -0.730
  102    H    ALA  12           HN       ALA  12  43.437  13.722   1.420
  103    HA   ALA  12           HA       ALA  12  44.129  14.949   3.927
  104    HB1  ALA  12           HB1      ALA  12  42.880  16.098   1.408
  105    HB2  ALA  12           HB2      ALA  12  44.616  16.014   1.795
  106    HB3  ALA  12           HB3      ALA  12  43.538  17.063   2.750
  107    H    GLY  13           HN       GLY  13  41.344  13.428   2.969
  108    HA2  GLY  13           HA1      GLY  13  39.131  13.522   3.650
  109    HA3  GLY  13           HA2      GLY  13  39.835  13.938   5.225
  110    H    PHE  14           HN       PHE  14  40.063  15.919   2.302
  111    HA   PHE  14           HA       PHE  14  37.819  17.619   2.965
  112    HB2  PHE  14           HB2      PHE  14  39.488  18.143   4.837
  113    HB3  PHE  14           HB1      PHE  14  40.535  18.843   3.579
  114    HD1  PHE  14           HD1      PHE  14  36.931  18.941   4.718
  115    HD2  PHE  14           HD2      PHE  14  40.276  21.148   3.109
  116    HE1  PHE  14           HE1      PHE  14  35.593  21.040   4.807
  117    HE2  PHE  14           HE2      PHE  14  38.936  23.244   3.201
  118    HZ   PHE  14           HZ       PHE  14  36.572  23.177   3.985
  119    H    ILE  15           HN       ILE  15  40.633  16.758   1.173
  120    HA   ILE  15           HA       ILE  15  39.604  18.226  -1.161
  121    HB   ILE  15           HB       ILE  15  41.890  19.268  -1.630
  122   HG12  ILE  15          HG12      ILE  15  42.255  18.601   1.330
  123   HG13  ILE  15          HG11      ILE  15  43.212  17.956  -0.023
  124   HG21  ILE  15          HG21      ILE  15  40.585  20.355   0.897
  125   HG22  ILE  15          HG22      ILE  15  39.832  20.501  -0.707
  126   HG23  ILE  15          HG23      ILE  15  41.404  21.265  -0.391
  127   HD11  ILE  15           HD1      ILE  15  43.169  20.777   1.092
  128   HD12  ILE  15           HD2      ILE  15  43.744  20.457  -0.564
  129   HD13  ILE  15           HD3      ILE  15  44.563  19.705   0.826
  130    H    ILE  16           HN       ILE  16  39.488  15.638  -0.976
  131    HA   ILE  16           HA       ILE  16  41.601  14.727  -2.872
  132    HB   ILE  16           HB       ILE  16  42.286  14.053  -0.525
  133   HG12  ILE  16          HG12      ILE  16  42.586  11.601  -1.114
  134   HG13  ILE  16          HG11      ILE  16  41.520  11.852  -2.510
  135   HG21  ILE  16          HG21      ILE  16  40.993  12.478   0.720
  136   HG22  ILE  16          HG22      ILE  16  39.902  12.170  -0.650
  137   HG23  ILE  16          HG23      ILE  16  39.843  13.732   0.203
  138   HD11  ILE  16           HD1      ILE  16  43.908  13.691  -2.176
  139   HD12  ILE  16           HD2      ILE  16  43.109  13.136  -3.666
  140   HD13  ILE  16           HD3      ILE  16  44.179  12.037  -2.770
  141    H    ILE  17           HN       ILE  17  38.555  14.050  -1.135
  142    HA   ILE  17           HA       ILE  17  37.693  12.048  -3.066
  143    HB   ILE  17           HB       ILE  17  35.345  12.629  -1.950
  144   HG12  ILE  17          HG12      ILE  17  35.514  13.693   0.235
  145   HG13  ILE  17          HG11      ILE  17  37.274  13.863   0.071
  146   HG21  ILE  17          HG21      ILE  17  36.662  10.585  -1.497
  147   HG22  ILE  17          HG22      ILE  17  35.929  11.220  -0.005
  148   HG23  ILE  17          HG23      ILE  17  37.659  11.482  -0.328
  149   HD11  ILE  17           HD1      ILE  17  35.864  15.959  -0.423
  150   HD12  ILE  17           HD2      ILE  17  35.330  15.126  -1.901
  151   HD13  ILE  17           HD3      ILE  17  37.055  15.502  -1.661
  152    H    GLY  18           HN       GLY  18  38.306  15.196  -3.531
  153    HA2  GLY  18           HA1      GLY  18  36.789  15.335  -5.959
  154    HA3  GLY  18           HA2      GLY  18  35.985  16.300  -4.705
  155    H    GLY  19           HN       GLY  19  38.741  16.762  -3.456
  156    HA2  GLY  19           HA1      GLY  19  39.204  19.302  -4.712
  157    HA3  GLY  19           HA2      GLY  19  40.244  18.520  -3.504
  158    H    ALA  20           HN       ALA  20  40.621  16.096  -5.121
  159    HA   ALA  20           HA       ALA  20  42.912  17.049  -6.649
  160    HB1  ALA  20           HB1      ALA  20  41.648  14.289  -6.555
  161    HB2  ALA  20           HB2      ALA  20  42.872  14.894  -5.412
  162    HB3  ALA  20           HB3      ALA  20  43.282  14.690  -7.133
  163    H    LEU  21           HN       LEU  21  39.986  15.171  -7.580
  164    HA   LEU  21           HA       LEU  21  38.904  15.015  -9.622
  165    HB2  LEU  21           HB2      LEU  21  38.636  17.520  -8.978
  166    HB3  LEU  21           HB1      LEU  21  39.883  17.829 -10.206
  167    HG   LEU  21           HG       LEU  21  38.291  16.295 -11.742
  168   HD11  LEU  21          HD11      LEU  21  36.314  17.524  -9.766
  169   HD12  LEU  21          HD12      LEU  21  36.715  15.792  -9.841
  170   HD13  LEU  21          HD13      LEU  21  35.918  16.582 -11.221
  171   HD21  LEU  21          HD21      LEU  21  37.663  19.192 -11.011
  172   HD22  LEU  21          HD22      LEU  21  37.114  18.363 -12.486
  173   HD23  LEU  21          HD23      LEU  21  38.849  18.647 -12.220
  174    H    ASP  22           HN       ASP  22  41.589  14.048  -9.509
  175    HA   ASP  22           HA       ASP  22  42.996  14.929 -11.918
  176    HB2  ASP  22           HB2      ASP  22  44.153  13.980  -9.920
  177    HB3  ASP  22           HB1      ASP  22  43.381  12.410 -10.252
  178    H    HIS  23           HN       HIS  23  40.721  12.368 -11.034
  179    HA   HIS  23           HA       HIS  23  40.106  11.898 -13.846
  180    HB2  HIS  23           HB2      HIS  23  42.237  10.569 -13.511
  181    HB3  HIS  23           HB1      HIS  23  41.360   9.588 -12.314
  182    HD1  HIS  23           HD1      HIS  23  41.340  10.512 -16.017
  183    HD2  HIS  23           HD2      HIS  23  39.693   7.639 -13.428
  184    HE1  HIS  23           HE1      HIS  23  40.152   8.776 -17.465
  185    H    LEU  24           HN       LEU  24  39.265  12.183 -10.739
  186    HA   LEU  24           HA       LEU  24  37.430   9.967 -10.392
  187    HB2  LEU  24           HB2      LEU  24  38.225  11.132  -8.439
  188    HB3  LEU  24           HB1      LEU  24  37.681  12.699  -9.077
  189    HG   LEU  24           HG       LEU  24  35.351  12.089  -8.817
  190   HD11  LEU  24          HD11      LEU  24  36.471   9.311  -8.271
  191   HD12  LEU  24          HD12      LEU  24  35.262   9.799  -9.485
  192   HD13  LEU  24          HD13      LEU  24  34.831   9.778  -7.760
  193   HD21  LEU  24          HD21      LEU  24  36.949  11.157  -6.389
  194   HD22  LEU  24          HD22      LEU  24  35.248  11.680  -6.376
  195   HD23  LEU  24          HD23      LEU  24  36.534  12.844  -6.774
  Start of MODEL   65
    1    H1   GLY   1           HT1      GLY   1  57.242   0.444  -3.000
    2    H2   GLY   1           HT2      GLY   1  58.164  -0.980  -3.088
    3    H3   GLY   1           HT3      GLY   1  58.311   0.053  -1.746
    4    HA2  GLY   1           HA1      GLY   1  55.715  -1.092  -2.421
    5    HA3  GLY   1           HA2      GLY   1  56.929  -2.083  -1.589
    6    H    LYS   2           HN       LYS   2  58.017  -0.945   0.328
    7    HA   LYS   2           HA       LYS   2  55.878  -0.187   2.152
    8    HB2  LYS   2           HB2      LYS   2  57.813   0.139   3.763
    9    HB3  LYS   2           HB1      LYS   2  57.700  -1.479   3.029
   10    HG2  LYS   2           HG2      LYS   2  59.474  -1.015   1.483
   11    HG3  LYS   2           HG1      LYS   2  59.432   0.725   1.842
   12    HD2  LYS   2           HD2      LYS   2  61.351  -0.411   2.958
   13    HD3  LYS   2           HD1      LYS   2  60.224   0.310   4.130
   14    HE2  LYS   2           HE2      LYS   2  61.055  -2.107   4.592
   15    HE3  LYS   2           HE1      LYS   2  59.309  -1.799   4.726
   16    HZ1  LYS   2           HZ1      LYS   2  60.349  -3.765   3.266
   17    HZ2  LYS   2           HZ2      LYS   2  60.289  -2.546   2.085
   18    HZ3  LYS   2           HZ3      LYS   2  58.872  -3.018   2.897
   19    H    GLY   3           HN       GLY   3  56.853   1.725   3.785
   20    HA2  GLY   3           HA1      GLY   3  57.787   4.066   3.637
   21    HA3  GLY   3           HA2      GLY   3  57.034   4.214   1.983
   22    H    ARG   4           HN       ARG   4  55.284   3.389   1.634
   23    HA   ARG   4           HA       ARG   4  54.622   5.691   1.995
   24    HB2  ARG   4           HB2      ARG   4  52.643   3.554   1.069
   25    HB3  ARG   4           HB1      ARG   4  52.383   5.302   0.847
   26    HG2  ARG   4           HG2      ARG   4  54.619   5.412  -0.337
   27    HG3  ARG   4           HG1      ARG   4  54.693   3.635  -0.247
   28    HD2  ARG   4           HD2      ARG   4  53.788   4.373  -2.431
   29    HD3  ARG   4           HD1      ARG   4  52.558   3.485  -1.500
   30    HE   ARG   4           HE       ARG   4  52.122   6.144  -0.822
   31   HH11  ARG   4          HH11      ARG   4  52.783   7.446  -3.141
   32   HH12  ARG   4          HH12      ARG   4  51.537   7.102  -4.295
   33   HH21  ARG   4          HH21      ARG   4  50.328   4.352  -2.566
   34   HH22  ARG   4          HH22      ARG   4  50.146   5.352  -3.968
   35    H    TRP   5           HN       TRP   5  54.171   3.349   4.106
   36    HA   TRP   5           HA       TRP   5  51.734   3.457   5.442
   37    HB2  TRP   5           HB2      TRP   5  53.836   2.161   6.099
   38    HB3  TRP   5           HB1      TRP   5  54.387   3.639   6.920
   39    HD1  TRP   5           HD1      TRP   5  52.914   4.507   8.997
   40    HE1  TRP   5           HE1      TRP   5  51.342   3.260  10.651
   41    HE3  TRP   5           HE3      TRP   5  52.173   0.209   6.318
   42    HZ2  TRP   5           HZ2      TRP   5  49.965   0.732  10.765
   43    HZ3  TRP   5           HZ3      TRP   5  50.728  -1.607   7.217
   44    HH2  TRP   5           HH2      TRP   5  49.624  -1.351   9.436
   45    H    LEU   6           HN       LEU   6  53.923   6.066   4.949
   46    HA   LEU   6           HA       LEU   6  52.377   7.787   6.883
   47    HB2  LEU   6           HB2      LEU   6  55.250   8.159   5.952
   48    HB3  LEU   6           HB1      LEU   6  54.383   9.137   7.156
   49    HG   LEU   6           HG       LEU   6  54.858   6.137   7.474
   50   HD11  LEU   6          HD11      LEU   6  57.026   7.311   7.342
   51   HD12  LEU   6          HD12      LEU   6  56.706   6.767   9.006
   52   HD13  LEU   6          HD13      LEU   6  56.479   8.478   8.569
   53   HD21  LEU   6          HD21      LEU   6  54.518   6.828   9.939
   54   HD22  LEU   6          HD22      LEU   6  53.075   6.871   8.908
   55   HD23  LEU   6          HD23      LEU   6  53.919   8.382   9.316
   56    H    GLU   7           HN       GLU   7  53.253   7.168   3.566
   57    HA   GLU   7           HA       GLU   7  52.934   9.991   2.752
   58    HB2  GLU   7           HB2      GLU   7  54.384   8.125   1.622
   59    HB3  GLU   7           HB1      GLU   7  52.857   7.600   0.882
   60    HG2  GLU   7           HG2      GLU   7  52.523   9.872  -0.055
   61    HG3  GLU   7           HG1      GLU   7  54.047  10.405   0.693
   62    H    ARG   8           HN       ARG   8  50.838   7.713   3.872
   63    HA   ARG   8           HA       ARG   8  48.706   7.556   2.062
   64    HB2  ARG   8           HB2      ARG   8  48.592   7.941   5.080
   65    HB3  ARG   8           HB1      ARG   8  47.243   7.374   4.066
   66    HG2  ARG   8           HG2      ARG   8  48.756   5.498   3.262
   67    HG3  ARG   8           HG1      ARG   8  49.929   6.005   4.501
   68    HD2  ARG   8           HD2      ARG   8  48.082   5.750   6.226
   69    HD3  ARG   8           HD1      ARG   8  47.083   5.017   4.947
   70    HE   ARG   8           HE       ARG   8  49.484   3.577   4.912
   71   HH11  ARG   8          HH11      ARG   8  49.686   1.643   6.065
   72   HH12  ARG   8          HH12      ARG   8  48.711   1.384   7.473
   73   HH21  ARG   8          HH21      ARG   8  47.072   4.428   7.223
   74   HH22  ARG   8          HH22      ARG   8  47.232   2.961   8.128
   75    H    ILE   9           HN       ILE   9  46.604   8.703   2.094
   76    HA   ILE   9           HA       ILE   9  46.916  11.428   1.435
   77    HB   ILE   9           HB       ILE   9  44.387  11.577   1.770
   78   HG12  ILE   9          HG12      ILE   9  44.843   8.685   2.657
   79   HG13  ILE   9          HG11      ILE   9  44.132   9.998   3.621
   80   HG21  ILE   9          HG21      ILE   9  45.251   9.096   0.226
   81   HG22  ILE   9          HG22      ILE   9  45.590  10.747  -0.344
   82   HG23  ILE   9          HG23      ILE   9  43.911  10.204  -0.146
   83   HD11  ILE   9           HD1      ILE   9  42.946   8.550   1.232
   84   HD12  ILE   9           HD2      ILE   9  42.345  10.151   1.732
   85   HD13  ILE   9           HD3      ILE   9  42.254   8.773   2.854
   86    H    GLY  10           HN       GLY  10  45.941   9.935   4.532
   87    HA2  GLY  10           HA1      GLY  10  46.172  10.803   6.674
   88    HA3  GLY  10           HA2      GLY  10  46.982  12.224   5.992
   89    H    LYS  11           HN       LYS  11  45.075  13.307   4.332
   90    HA   LYS  11           HA       LYS  11  43.310  14.524   6.307
   91    HB2  LYS  11           HB2      LYS  11  43.549  14.809   3.293
   92    HB3  LYS  11           HB1      LYS  11  42.445  15.775   4.301
   93    HG2  LYS  11           HG2      LYS  11  44.276  16.749   5.524
   94    HG3  LYS  11           HG1      LYS  11  45.439  15.596   4.828
   95    HD2  LYS  11           HD2      LYS  11  45.667  17.749   3.688
   96    HD3  LYS  11           HD1      LYS  11  44.984  16.556   2.559
   97    HE2  LYS  11           HE2      LYS  11  43.143  18.337   4.192
   98    HE3  LYS  11           HE1      LYS  11  43.887  18.939   2.693
   99    HZ1  LYS  11           HZ1      LYS  11  41.601  17.585   2.752
  100    HZ2  LYS  11           HZ2      LYS  11  42.683  16.291   2.552
  101    HZ3  LYS  11           HZ3      LYS  11  42.660  17.563   1.427
  102    H    ALA  12           HN       ALA  12  42.382  13.246   3.081
  103    HA   ALA  12           HA       ALA  12  40.581  11.952   2.453
  104    HB1  ALA  12           HB1      ALA  12  40.174  11.068   5.322
  105    HB2  ALA  12           HB2      ALA  12  41.542  10.465   4.359
  106    HB3  ALA  12           HB3      ALA  12  39.874  10.171   3.815
  107    H    GLY  13           HN       GLY  13  40.373  14.716   3.377
  108    HA2  GLY  13           HA1      GLY  13  38.310  15.495   4.973
  109    HA3  GLY  13           HA2      GLY  13  38.550  16.184   3.351
  110    H    PHE  14           HN       PHE  14  38.000  13.933   1.848
  111    HA   PHE  14           HA       PHE  14  35.558  12.602   2.402
  112    HB2  PHE  14           HB2      PHE  14  34.487  14.829   2.343
  113    HB3  PHE  14           HB1      PHE  14  35.238  15.163   0.764
  114    HD1  PHE  14           HD1      PHE  14  33.112  12.562   2.485
  115    HD2  PHE  14           HD2      PHE  14  33.997  14.654  -1.189
  116    HE1  PHE  14           HE1      PHE  14  31.208  11.408   1.368
  117    HE2  PHE  14           HE2      PHE  14  32.093  13.497  -2.304
  118    HZ   PHE  14           HZ       PHE  14  30.760  11.805  -1.051
  119    H    ILE  15           HN       ILE  15  37.854  11.709   1.465
  120    HA   ILE  15           HA       ILE  15  39.048  10.922  -0.367
  121    HB   ILE  15           HB       ILE  15  37.668   9.493  -1.927
  122   HG12  ILE  15          HG12      ILE  15  35.321  10.420  -0.201
  123   HG13  ILE  15          HG11      ILE  15  35.615  10.984  -1.860
  124   HG21  ILE  15          HG21      ILE  15  36.890   9.116   0.993
  125   HG22  ILE  15          HG22      ILE  15  38.517   8.763   0.366
  126   HG23  ILE  15          HG23      ILE  15  37.115   7.861  -0.246
  127   HD11  ILE  15           HD1      ILE  15  34.884   8.198  -0.909
  128   HD12  ILE  15           HD2      ILE  15  35.644   8.456  -2.497
  129   HD13  ILE  15           HD3      ILE  15  34.075   9.207  -2.128
  130    H    ILE  16           HN       ILE  16  39.050  13.482  -0.644
  131    HA   ILE  16           HA       ILE  16  38.212  14.020  -3.490
  132    HB   ILE  16           HB       ILE  16  37.204  15.411  -1.581
  133   HG12  ILE  16          HG12      ILE  16  37.607  17.599  -2.836
  134   HG13  ILE  16          HG11      ILE  16  38.796  16.733  -3.832
  135   HG21  ILE  16          HG21      ILE  16  38.530  17.093  -0.525
  136   HG22  ILE  16          HG22      ILE  16  39.922  16.762  -1.580
  137   HG23  ILE  16          HG23      ILE  16  39.432  15.571  -0.351
  138   HD11  ILE  16           HD1      ILE  16  37.158  15.492  -4.955
  139   HD12  ILE  16           HD2      ILE  16  36.232  16.968  -4.612
  140   HD13  ILE  16           HD3      ILE  16  36.024  15.535  -3.583
  141    H    ILE  17           HN       ILE  17  40.801  14.651  -1.059
  142    HA   ILE  17           HA       ILE  17  42.624  15.574  -3.183
  143    HB   ILE  17           HB       ILE  17  44.360  15.251  -1.177
  144   HG12  ILE  17          HG12      ILE  17  43.326  15.348   1.025
  145   HG13  ILE  17          HG11      ILE  17  41.700  15.327   0.316
  146   HG21  ILE  17          HG21      ILE  17  42.129  17.322  -0.999
  147   HG22  ILE  17          HG22      ILE  17  43.548  17.437  -2.066
  148   HG23  ILE  17          HG23      ILE  17  43.758  17.457  -0.299
  149   HD11  ILE  17           HD1      ILE  17  41.945  13.065  -0.430
  150   HD12  ILE  17           HD2      ILE  17  42.599  13.085   1.224
  151   HD13  ILE  17           HD3      ILE  17  43.706  13.090  -0.168
  152    H    GLY  18           HN       GLY  18  41.340  12.682  -2.663
  153    HA2  GLY  18           HA1      GLY  18  43.773  11.260  -3.672
  154    HA3  GLY  18           HA2      GLY  18  42.909  10.606  -2.264
  155    H    GLY  19           HN       GLY  19  40.292  10.916  -2.829
  156    HA2  GLY  19           HA1      GLY  19  39.739   8.766  -4.570
  157    HA3  GLY  19           HA2      GLY  19  38.564   9.997  -4.064
  158    H    ALA  20           HN       ALA  20  39.652  12.286  -5.192
  159    HA   ALA  20           HA       ALA  20  38.869  11.874  -7.997
  160    HB1  ALA  20           HB1      ALA  20  39.835  14.350  -6.524
  161    HB2  ALA  20           HB2      ALA  20  38.137  13.859  -6.743
  162    HB3  ALA  20           HB3      ALA  20  39.122  14.317  -8.154
  163    H    LEU  21           HN       LEU  21  41.580  11.022  -6.547
  164    HA   LEU  21           HA       LEU  21  43.794  10.830  -7.184
  165    HB2  LEU  21           HB2      LEU  21  42.876   9.650  -9.086
  166    HB3  LEU  21           HB1      LEU  21  42.463  11.173  -9.901
  167    HG   LEU  21           HG       LEU  21  44.808  11.716 -10.233
  168   HD11  LEU  21          HD11      LEU  21  46.545   9.927  -9.487
  169   HD12  LEU  21          HD12      LEU  21  45.274   9.344  -8.386
  170   HD13  LEU  21          HD13      LEU  21  45.890  11.006  -8.235
  171   HD21  LEU  21          HD21      LEU  21  44.444   8.748 -10.821
  172   HD22  LEU  21          HD22      LEU  21  45.455   9.909 -11.715
  173   HD23  LEU  21          HD23      LEU  21  43.681  10.046 -11.769
  174    H    ASP  22           HN       ASP  22  44.896  12.511  -6.326
  175    HA   ASP  22           HA       ASP  22  45.980  14.553  -6.221
  176    HB2  ASP  22           HB2      ASP  22  45.732  14.459  -9.255
  177    HB3  ASP  22           HB1      ASP  22  46.854  15.476  -8.321
  178    H    HIS  23           HN       HIS  23  44.117  15.298  -9.176
  179    HA   HIS  23           HA       HIS  23  42.143  16.885  -7.711
  180    HB2  HIS  23           HB2      HIS  23  44.175  18.366  -7.648
  181    HB3  HIS  23           HB1      HIS  23  44.172  18.371  -9.428
  182    HD1  HIS  23           HD1      HIS  23  42.899  20.241 -10.465
  183    HD2  HIS  23           HD2      HIS  23  41.442  19.280  -6.637
  184    HE1  HIS  23           HE1      HIS  23  41.016  21.884  -9.932
  185    H    LEU  24           HN       LEU  24  42.357  14.722  -9.729
  186    HA   LEU  24           HA       LEU  24  41.594  15.867 -12.293
  187    HB2  LEU  24           HB2      LEU  24  42.595  13.500 -11.681
  188    HB3  LEU  24           HB1      LEU  24  40.897  13.042 -11.427
  189    HG   LEU  24           HG       LEU  24  42.082  14.229 -13.982
  190   HD11  LEU  24          HD11      LEU  24  41.728  12.023 -14.932
  191   HD12  LEU  24          HD12      LEU  24  40.916  11.462 -13.450
  192   HD13  LEU  24          HD13      LEU  24  42.658  11.825 -13.427
  193   HD21  LEU  24          HD21      LEU  24  39.833  14.998 -13.916
  194   HD22  LEU  24          HD22      LEU  24  39.245  13.506 -13.140
  195   HD23  LEU  24          HD23      LEU  24  39.726  13.492 -14.854
  Start of MODEL   66
    1    H1   GLY   1           HT1      GLY   1  58.322  -3.205   5.720
    2    H2   GLY   1           HT2      GLY   1  59.690  -2.367   5.159
    3    H3   GLY   1           HT3      GLY   1  59.236  -3.841   4.444
    4    HA2  GLY   1           HA1      GLY   1  58.696  -1.807   3.166
    5    HA3  GLY   1           HA2      GLY   1  57.371  -2.951   3.456
    6    H    LYS   2           HN       LYS   2  57.772  -1.864   6.428
    7    HA   LYS   2           HA       LYS   2  55.499  -0.063   6.275
    8    HB2  LYS   2           HB2      LYS   2  57.413  -0.397   8.612
    9    HB3  LYS   2           HB1      LYS   2  55.703   0.098   8.660
   10    HG2  LYS   2           HG2      LYS   2  55.144  -2.179   7.634
   11    HG3  LYS   2           HG1      LYS   2  56.832  -2.642   7.953
   12    HD2  LYS   2           HD2      LYS   2  54.875  -1.632  10.067
   13    HD3  LYS   2           HD1      LYS   2  55.276  -3.343   9.791
   14    HE2  LYS   2           HE2      LYS   2  57.756  -2.607  10.130
   15    HE3  LYS   2           HE1      LYS   2  57.067  -1.122  10.829
   16    HZ1  LYS   2           HZ1      LYS   2  56.849  -2.255  12.706
   17    HZ2  LYS   2           HZ2      LYS   2  57.268  -3.725  11.965
   18    HZ3  LYS   2           HZ3      LYS   2  55.653  -3.197  11.959
   19    H    GLY   3           HN       GLY   3  56.576   1.729   8.421
   20    HA2  GLY   3           HA1      GLY   3  57.154   4.076   8.302
   21    HA3  GLY   3           HA2      GLY   3  58.721   3.368   7.629
   22    H    ARG   4           HN       ARG   4  55.639   3.904   7.593
   23    HA   ARG   4           HA       ARG   4  55.656   5.989   6.891
   24    HB2  ARG   4           HB2      ARG   4  56.026   4.725   4.236
   25    HB3  ARG   4           HB1      ARG   4  54.712   5.916   4.222
   26    HG2  ARG   4           HG2      ARG   4  56.117   7.738   4.514
   27    HG3  ARG   4           HG1      ARG   4  57.270   6.854   5.525
   28    HD2  ARG   4           HD2      ARG   4  58.106   5.665   3.492
   29    HD3  ARG   4           HD1      ARG   4  56.970   6.607   2.499
   30    HE   ARG   4           HE       ARG   4  58.442   8.513   3.927
   31   HH11  ARG   4          HH11      ARG   4  58.973   9.261   1.450
   32   HH12  ARG   4          HH12      ARG   4  60.438   8.502   0.921
   33   HH21  ARG   4          HH21      ARG   4  60.385   6.073   3.395
   34   HH22  ARG   4          HH22      ARG   4  61.238   6.698   2.023
   35    H    TRP   5           HN       TRP   5  54.229   3.118   6.884
   36    HA   TRP   5           HA       TRP   5  51.628   3.237   5.926
   37    HB2  TRP   5           HB2      TRP   5  52.512   1.310   7.192
   38    HB3  TRP   5           HB1      TRP   5  52.454   2.264   8.695
   39    HD1  TRP   5           HD1      TRP   5  49.942   1.427   5.844
   40    HE1  TRP   5           HE1      TRP   5  47.629   0.886   6.899
   41    HE3  TRP   5           HE3      TRP   5  51.130   2.094  10.779
   42    HZ2  TRP   5           HZ2      TRP   5  46.481   0.767   9.538
   43    HZ3  TRP   5           HZ3      TRP   5  49.410   1.760  12.548
   44    HH2  TRP   5           HH2      TRP   5  47.089   1.098  11.933
   45    H    LEU   6           HN       LEU   6  53.111   5.287   8.244
   46    HA   LEU   6           HA       LEU   6  50.465   6.494   9.018
   47    HB2  LEU   6           HB2      LEU   6  53.145   6.792  10.425
   48    HB3  LEU   6           HB1      LEU   6  51.547   7.307  11.012
   49    HG   LEU   6           HG       LEU   6  52.370   4.416  10.468
   50   HD11  LEU   6          HD11      LEU   6  51.907   5.843  13.122
   51   HD12  LEU   6          HD12      LEU   6  53.513   5.529  12.423
   52   HD13  LEU   6          HD13      LEU   6  52.462   4.170  12.885
   53   HD21  LEU   6          HD21      LEU   6  50.008   4.521  10.191
   54   HD22  LEU   6          HD22      LEU   6  49.818   5.745  11.469
   55   HD23  LEU   6          HD23      LEU   6  50.205   4.062  11.896
   56    H    GLU   7           HN       GLU   7  53.431   6.935   7.203
   57    HA   GLU   7           HA       GLU   7  52.866   9.907   7.064
   58    HB2  GLU   7           HB2      GLU   7  55.450   8.342   6.704
   59    HB3  GLU   7           HB1      GLU   7  55.261  10.066   6.308
   60    HG2  GLU   7           HG2      GLU   7  54.509  10.464   8.682
   61    HG3  GLU   7           HG1      GLU   7  54.883   8.762   9.040
   62    H    ARG   8           HN       ARG   8  51.915   7.315   5.571
   63    HA   ARG   8           HA       ARG   8  52.905   7.728   2.851
   64    HB2  ARG   8           HB2      ARG   8  52.066   5.531   3.766
   65    HB3  ARG   8           HB1      ARG   8  50.427   6.225   3.772
   66    HG2  ARG   8           HG2      ARG   8  50.484   6.560   1.369
   67    HG3  ARG   8           HG1      ARG   8  52.201   6.093   1.297
   68    HD2  ARG   8           HD2      ARG   8  49.978   4.253   2.275
   69    HD3  ARG   8           HD1      ARG   8  50.613   4.252   0.611
   70    HE   ARG   8           HE       ARG   8  52.760   3.978   2.531
   71   HH11  ARG   8          HH11      ARG   8  53.555   2.278   0.699
   72   HH12  ARG   8          HH12      ARG   8  52.793   0.743   0.950
   73   HH21  ARG   8          HH21      ARG   8  50.299   2.017   2.995
   74   HH22  ARG   8          HH22      ARG   8  50.950   0.595   2.250
   75    H    ILE   9           HN       ILE   9  52.218   9.162   1.398
   76    HA   ILE   9           HA       ILE   9  50.307  11.154   2.023
   77    HB   ILE   9           HB       ILE   9  51.887  11.597   0.259
   78   HG12  ILE   9          HG12      ILE   9  50.473  12.410  -1.531
   79   HG13  ILE   9          HG11      ILE   9  49.202  11.229  -1.152
   80   HG21  ILE   9          HG21      ILE   9  50.647   9.394  -1.434
   81   HG22  ILE   9          HG22      ILE   9  52.081   9.134  -0.419
   82   HG23  ILE   9          HG23      ILE   9  52.132  10.317  -1.742
   83   HD11  ILE   9           HD1      ILE   9  50.129  13.269   0.904
   84   HD12  ILE   9           HD2      ILE   9  48.609  12.340   0.865
   85   HD13  ILE   9           HD3      ILE   9  48.877  13.659  -0.298
   86    H    GLY  10           HN       GLY  10  48.270  10.777   2.559
   87    HA2  GLY  10           HA1      GLY  10  46.497   9.526   0.579
   88    HA3  GLY  10           HA2      GLY  10  46.671   8.607   2.088
   89    H    LYS  11           HN       LYS  11  46.717  12.146   1.690
   90    HA   LYS  11           HA       LYS  11  44.951  12.611   3.869
   91    HB2  LYS  11           HB2      LYS  11  46.468  14.312   2.826
   92    HB3  LYS  11           HB1      LYS  11  45.367  14.384   1.430
   93    HG2  LYS  11           HG2      LYS  11  43.526  15.122   2.861
   94    HG3  LYS  11           HG1      LYS  11  44.536  14.929   4.313
   95    HD2  LYS  11           HD2      LYS  11  46.021  16.704   3.611
   96    HD3  LYS  11           HD1      LYS  11  45.250  16.789   2.009
   97    HE2  LYS  11           HE2      LYS  11  43.780  17.325   4.623
   98    HE3  LYS  11           HE1      LYS  11  44.507  18.601   3.618
   99    HZ1  LYS  11           HZ1      LYS  11  43.041  17.044   1.884
  100    HZ2  LYS  11           HZ2      LYS  11  42.627  18.587   2.465
  101    HZ3  LYS  11           HZ3      LYS  11  42.053  17.196   3.254
  102    H    ALA  12           HN       ALA  12  44.358  11.786   0.518
  103    HA   ALA  12           HA       ALA  12  41.507  11.398   1.105
  104    HB1  ALA  12           HB1      ALA  12  41.687  13.845   0.540
  105    HB2  ALA  12           HB2      ALA  12  40.650  12.908  -0.564
  106    HB3  ALA  12           HB3      ALA  12  42.294  13.370  -1.064
  107    H    GLY  13           HN       GLY  13  43.870   9.839   0.324
  108    HA2  GLY  13           HA1      GLY  13  44.216   8.011  -1.061
  109    HA3  GLY  13           HA2      GLY  13  42.615   8.292  -1.771
  110    H    PHE  14           HN       PHE  14  45.685  10.152  -1.647
  111    HA   PHE  14           HA       PHE  14  46.920  11.105  -3.357
  112    HB2  PHE  14           HB2      PHE  14  45.661   9.147  -5.305
  113    HB3  PHE  14           HB1      PHE  14  47.309   9.822  -5.301
  114    HD1  PHE  14           HD1      PHE  14  48.901   9.168  -3.410
  115    HD2  PHE  14           HD2      PHE  14  45.166   7.125  -4.130
  116    HE1  PHE  14           HE1      PHE  14  49.702   7.227  -2.068
  117    HE2  PHE  14           HE2      PHE  14  45.969   5.184  -2.790
  118    HZ   PHE  14           HZ       PHE  14  48.199   5.277  -1.683
  119    H    ILE  15           HN       ILE  15  44.259  12.100  -2.722
  120    HA   ILE  15           HA       ILE  15  42.789  13.667  -3.520
  121    HB   ILE  15           HB       ILE  15  44.531  13.941  -6.004
  122   HG12  ILE  15          HG12      ILE  15  44.906  15.176  -3.235
  123   HG13  ILE  15          HG11      ILE  15  46.001  14.020  -4.029
  124   HG21  ILE  15          HG21      ILE  15  42.256  15.111  -5.784
  125   HG22  ILE  15          HG22      ILE  15  43.649  16.167  -6.102
  126   HG23  ILE  15          HG23      ILE  15  42.975  16.052  -4.458
  127   HD11  ILE  15           HD1      ILE  15  46.130  15.781  -5.953
  128   HD12  ILE  15           HD2      ILE  15  47.007  16.127  -4.445
  129   HD13  ILE  15           HD3      ILE  15  45.444  16.914  -4.763
  130    H    ILE  16           HN       ILE  16  41.650  11.541  -3.678
  131    HA   ILE  16           HA       ILE  16  40.473  11.327  -6.438
  132    HB   ILE  16           HB       ILE  16  41.099   9.062  -4.507
  133   HG12  ILE  16          HG12      ILE  16  43.038  10.083  -5.921
  134   HG13  ILE  16          HG11      ILE  16  42.813   8.328  -5.962
  135   HG21  ILE  16          HG21      ILE  16  39.673   9.125  -7.202
  136   HG22  ILE  16          HG22      ILE  16  39.026   8.565  -5.646
  137   HG23  ILE  16          HG23      ILE  16  40.291   7.626  -6.469
  138   HD11  ILE  16           HD1      ILE  16  41.773   8.417  -8.132
  139   HD12  ILE  16           HD2      ILE  16  43.220   9.443  -8.224
  140   HD13  ILE  16           HD3      ILE  16  41.616  10.184  -8.065
  141    H    ILE  17           HN       ILE  17  40.164  10.460  -2.964
  142    HA   ILE  17           HA       ILE  17  37.263  10.275  -3.102
  143    HB   ILE  17           HB       ILE  17  39.232  10.513  -0.778
  144   HG12  ILE  17          HG12      ILE  17  38.522   8.188  -0.346
  145   HG13  ILE  17          HG11      ILE  17  37.377   8.270  -1.703
  146   HG21  ILE  17          HG21      ILE  17  37.253  11.576   0.070
  147   HG22  ILE  17          HG22      ILE  17  37.163   9.893   0.639
  148   HG23  ILE  17          HG23      ILE  17  36.187  10.415  -0.756
  149   HD11  ILE  17           HD1      ILE  17  39.101   8.313  -3.318
  150   HD12  ILE  17           HD2      ILE  17  39.715   7.165  -2.110
  151   HD13  ILE  17           HD3      ILE  17  40.329   8.834  -2.141
  152    H    GLY  18           HN       GLY  18  39.650  12.716  -2.085
  153    HA2  GLY  18           HA1      GLY  18  37.610  14.684  -1.387
  154    HA3  GLY  18           HA2      GLY  18  39.362  14.955  -1.514
  155    H    GLY  19           HN       GLY  19  39.937  14.220  -4.078
  156    HA2  GLY  19           HA1      GLY  19  39.094  16.535  -5.544
  157    HA3  GLY  19           HA2      GLY  19  39.933  15.123  -6.214
  158    H    ALA  20           HN       ALA  20  38.240  13.068  -5.930
  159    HA   ALA  20           HA       ALA  20  36.408  12.083  -6.947
  160    HB1  ALA  20           HB1      ALA  20  34.269  13.079  -6.592
  161    HB2  ALA  20           HB2      ALA  20  34.972  14.711  -6.479
  162    HB3  ALA  20           HB3      ALA  20  35.272  13.520  -5.191
  163    H    LEU  21           HN       LEU  21  38.128  14.479  -8.320
  164    HA   LEU  21           HA       LEU  21  38.230  15.398 -10.454
  165    HB2  LEU  21           HB2      LEU  21  36.918  12.701 -10.937
  166    HB3  LEU  21           HB1      LEU  21  37.312  13.795 -12.284
  167    HG   LEU  21           HG       LEU  21  39.676  13.816 -11.620
  168   HD11  LEU  21          HD11      LEU  21  40.346  12.084  -9.798
  169   HD12  LEU  21          HD12      LEU  21  38.642  12.159  -9.286
  170   HD13  LEU  21          HD13      LEU  21  39.652  13.625  -9.251
  171   HD21  LEU  21          HD21      LEU  21  38.770  11.988 -13.100
  172   HD22  LEU  21          HD22      LEU  21  38.598  10.961 -11.657
  173   HD23  LEU  21          HD23      LEU  21  40.213  11.497 -12.181
  174    H    ASP  22           HN       ASP  22  35.602  15.584  -8.717
  175    HA   ASP  22           HA       ASP  22  33.534  16.062 -10.724
  176    HB2  ASP  22           HB2      ASP  22  33.737  16.829  -7.785
  177    HB3  ASP  22           HB1      ASP  22  32.282  17.030  -8.791
  178    H    HIS  23           HN       HIS  23  35.979  17.464 -11.296
  179    HA   HIS  23           HA       HIS  23  36.742  19.595 -11.816
  180    HB2  HIS  23           HB2      HIS  23  34.621  19.396 -13.193
  181    HB3  HIS  23           HB1      HIS  23  33.784  20.302 -11.910
  182    HD1  HIS  23           HD1      HIS  23  37.368  21.051 -12.908
  183    HD2  HIS  23           HD2      HIS  23  33.529  22.703 -13.376
  184    HE1  HIS  23           HE1      HIS  23  37.658  23.373 -13.934
  185    H    LEU  24           HN       LEU  24  36.553  19.019  -9.020
  186    HA   LEU  24           HA       LEU  24  36.632  21.770  -8.014
  187    HB2  LEU  24           HB2      LEU  24  34.248  21.449  -7.788
  188    HB3  LEU  24           HB1      LEU  24  34.473  19.832  -7.091
  189    HG   LEU  24           HG       LEU  24  35.432  20.757  -5.062
  190   HD11  LEU  24          HD11      LEU  24  36.789  22.570  -5.807
  191   HD12  LEU  24          HD12      LEU  24  35.500  23.349  -4.864
  192   HD13  LEU  24          HD13      LEU  24  35.431  23.358  -6.643
  193   HD21  LEU  24          HD21      LEU  24  33.039  22.455  -5.899
  194   HD22  LEU  24          HD22      LEU  24  33.532  22.068  -4.232
  195   HD23  LEU  24          HD23      LEU  24  32.940  20.779  -5.308
  Start of MODEL   67
    1    H1   GLY   1           HT1      GLY   1  64.325   5.982   5.398
    2    H2   GLY   1           HT2      GLY   1  63.234   6.398   6.634
    3    H3   GLY   1           HT3      GLY   1  62.750   6.470   5.007
    4    HA2  GLY   1           HA1      GLY   1  63.352   4.007   4.963
    5    HA3  GLY   1           HA2      GLY   1  63.197   4.150   6.725
    6    H    LYS   2           HN       LYS   2  61.451   2.581   6.431
    7    HA   LYS   2           HA       LYS   2  59.057   3.305   4.981
    8    HB2  LYS   2           HB2      LYS   2  59.494   1.362   7.288
    9    HB3  LYS   2           HB1      LYS   2  58.015   1.463   6.302
   10    HG2  LYS   2           HG2      LYS   2  59.323   0.958   4.266
   11    HG3  LYS   2           HG1      LYS   2  60.814   0.881   5.236
   12    HD2  LYS   2           HD2      LYS   2  59.765  -0.960   6.597
   13    HD3  LYS   2           HD1      LYS   2  58.380  -0.939   5.479
   14    HE2  LYS   2           HE2      LYS   2  61.285  -1.509   4.746
   15    HE3  LYS   2           HE1      LYS   2  59.957  -2.692   4.798
   16    HZ1  LYS   2           HZ1      LYS   2  60.187  -2.039   2.559
   17    HZ2  LYS   2           HZ2      LYS   2  60.282  -0.388   2.950
   18    HZ3  LYS   2           HZ3      LYS   2  58.812  -1.223   3.126
   19    H    GLY   3           HN       GLY   3  57.868   2.396   7.937
   20    HA2  GLY   3           HA1      GLY   3  56.234   3.648   9.227
   21    HA3  GLY   3           HA2      GLY   3  57.759   4.606   9.641
   22    H    ARG   4           HN       ARG   4  55.595   3.502   7.679
   23    HA   ARG   4           HA       ARG   4  53.927   4.838   8.154
   24    HB2  ARG   4           HB2      ARG   4  55.389   6.740   6.408
   25    HB3  ARG   4           HB1      ARG   4  53.673   6.620   5.971
   26    HG2  ARG   4           HG2      ARG   4  52.917   7.625   7.919
   27    HG3  ARG   4           HG1      ARG   4  54.224   6.972   8.922
   28    HD2  ARG   4           HD2      ARG   4  54.193   9.546   8.390
   29    HD3  ARG   4           HD1      ARG   4  55.738   8.669   8.285
   30    HE   ARG   4           HE       ARG   4  55.733   9.109   5.970
   31   HH11  ARG   4          HH11      ARG   4  53.136  10.724   7.232
   32   HH12  ARG   4          HH12      ARG   4  52.165  10.691   5.798
   33   HH21  ARG   4          HH21      ARG   4  54.239   8.473   4.125
   34   HH22  ARG   4          HH22      ARG   4  52.790   9.418   4.039
   35    H    TRP   5           HN       TRP   5  55.561   3.201   5.953
   36    HA   TRP   5           HA       TRP   5  54.173   2.893   3.578
   37    HB2  TRP   5           HB2      TRP   5  56.162   1.544   4.246
   38    HB3  TRP   5           HB1      TRP   5  55.122   0.583   5.324
   39    HD1  TRP   5           HD1      TRP   5  55.769   1.301   1.616
   40    HE1  TRP   5           HE1      TRP   5  54.699  -0.575   0.168
   41    HE3  TRP   5           HE3      TRP   5  53.266  -1.230   5.295
   42    HZ2  TRP   5           HZ2      TRP   5  52.988  -2.854   0.583
   43    HZ3  TRP   5           HZ3      TRP   5  51.921  -3.253   4.746
   44    HH2  TRP   5           HH2      TRP   5  51.780  -4.066   2.396
   45    H    LEU   6           HN       LEU   6  52.992   2.380   6.762
   46    HA   LEU   6           HA       LEU   6  50.484   1.105   5.689
   47    HB2  LEU   6           HB2      LEU   6  52.193   0.020   7.557
   48    HB3  LEU   6           HB1      LEU   6  51.091   0.910   8.625
   49    HG   LEU   6           HG       LEU   6  50.260  -1.125   6.500
   50   HD11  LEU   6          HD11      LEU   6  49.717  -2.566   8.403
   51   HD12  LEU   6          HD12      LEU   6  50.199  -1.289   9.546
   52   HD13  LEU   6          HD13      LEU   6  51.422  -2.069   8.515
   53   HD21  LEU   6          HD21      LEU   6  48.458   0.427   6.711
   54   HD22  LEU   6          HD22      LEU   6  48.707   0.611   8.464
   55   HD23  LEU   6          HD23      LEU   6  48.028  -0.899   7.813
   56    H    GLU   7           HN       GLU   7  51.934   3.926   7.104
   57    HA   GLU   7           HA       GLU   7  49.188   4.919   7.905
   58    HB2  GLU   7           HB2      GLU   7  51.901   5.665   9.073
   59    HB3  GLU   7           HB1      GLU   7  50.331   6.360   9.541
   60    HG2  GLU   7           HG2      GLU   7  50.978   3.385   9.699
   61    HG3  GLU   7           HG1      GLU   7  51.150   4.508  11.070
   62    H    ARG   8           HN       ARG   8  50.577   4.955   5.274
   63    HA   ARG   8           HA       ARG   8  51.583   7.651   4.873
   64    HB2  ARG   8           HB2      ARG   8  52.095   5.621   3.432
   65    HB3  ARG   8           HB1      ARG   8  50.446   5.761   2.779
   66    HG2  ARG   8           HG2      ARG   8  50.956   8.123   2.105
   67    HG3  ARG   8           HG1      ARG   8  52.632   7.885   2.658
   68    HD2  ARG   8           HD2      ARG   8  52.426   7.518   0.209
   69    HD3  ARG   8           HD1      ARG   8  52.911   6.028   1.053
   70    HE   ARG   8           HE       ARG   8  50.960   5.100   0.123
   71   HH11  ARG   8          HH11      ARG   8  50.664   8.311  -0.603
   72   HH12  ARG   8          HH12      ARG   8  48.941   8.395  -0.446
   73   HH21  ARG   8          HH21      ARG   8  48.650   5.243   0.968
   74   HH22  ARG   8          HH22      ARG   8  47.801   6.658   0.441
   75    H    ILE   9           HN       ILE   9  50.022   9.052   5.756
   76    HA   ILE   9           HA       ILE   9  47.262   8.993   5.158
   77    HB   ILE   9           HB       ILE   9  48.027  10.452   6.913
   78   HG12  ILE   9          HG12      ILE   9  46.935  12.550   6.379
   79   HG13  ILE   9          HG11      ILE   9  47.179  12.305   4.636
   80   HG21  ILE   9          HG21      ILE   9  49.513  12.182   4.902
   81   HG22  ILE   9          HG22      ILE   9  50.307  10.861   5.785
   82   HG23  ILE   9          HG23      ILE   9  49.595  12.222   6.675
   83   HD11  ILE   9           HD1      ILE   9  44.837  11.754   5.612
   84   HD12  ILE   9           HD2      ILE   9  45.608  10.310   6.309
   85   HD13  ILE   9           HD3      ILE   9  45.584  10.545   4.543
   86    H    GLY  10           HN       GLY  10  46.576   8.672   3.129
   87    HA2  GLY  10           HA1      GLY  10  47.808  10.123   0.877
   88    HA3  GLY  10           HA2      GLY  10  46.494   8.933   0.800
   89    H    LYS  11           HN       LYS  11  44.816  10.203   2.787
   90    HA   LYS  11           HA       LYS  11  43.435  12.033   1.038
   91    HB2  LYS  11           HB2      LYS  11  43.065  11.483   4.011
   92    HB3  LYS  11           HB1      LYS  11  41.911  12.337   2.959
   93    HG2  LYS  11           HG2      LYS  11  41.794  10.288   1.506
   94    HG3  LYS  11           HG1      LYS  11  42.831   9.443   2.682
   95    HD2  LYS  11           HD2      LYS  11  41.120  10.013   4.467
   96    HD3  LYS  11           HD1      LYS  11  40.057  10.603   3.167
   97    HE2  LYS  11           HE2      LYS  11  41.226   7.790   3.321
   98    HE3  LYS  11           HE1      LYS  11  39.567   8.232   3.791
   99    HZ1  LYS  11           HZ1      LYS  11  40.657   8.845   1.101
  100    HZ2  LYS  11           HZ2      LYS  11  39.033   8.803   1.599
  101    HZ3  LYS  11           HZ3      LYS  11  39.915   7.359   1.448
  102    H    ALA  12           HN       ALA  12  45.085  13.602   0.578
  103    HA   ALA  12           HA       ALA  12  46.400  15.184   2.526
  104    HB1  ALA  12           HB1      ALA  12  45.360  16.183  -0.146
  105    HB2  ALA  12           HB2      ALA  12  46.798  15.146   0.023
  106    HB3  ALA  12           HB3      ALA  12  46.775  16.765   0.763
  107    H    GLY  13           HN       GLY  13  43.103  14.832   1.979
  108    HA2  GLY  13           HA1      GLY  13  41.274  15.969   2.820
  109    HA3  GLY  13           HA2      GLY  13  42.392  16.810   3.910
  110    H    PHE  14           HN       PHE  14  41.936  16.779   0.344
  111    HA   PHE  14           HA       PHE  14  41.040  19.587   0.395
  112    HB2  PHE  14           HB2      PHE  14  43.737  18.805  -0.778
  113    HB3  PHE  14           HB1      PHE  14  42.891  20.325  -1.148
  114    HD1  PHE  14           HD1      PHE  14  42.004  21.651   1.016
  115    HD2  PHE  14           HD2      PHE  14  45.280  18.835   1.014
  116    HE1  PHE  14           HE1      PHE  14  42.892  22.678   3.103
  117    HE2  PHE  14           HE2      PHE  14  46.164  19.865   3.101
  118    HZ   PHE  14           HZ       PHE  14  44.981  21.800   4.134
  119    H    ILE  15           HN       ILE  15  42.632  17.268  -1.867
  120    HA   ILE  15           HA       ILE  15  40.121  17.002  -3.379
  121    HB   ILE  15           HB       ILE  15  41.271  17.706  -5.560
  122   HG12  ILE  15          HG12      ILE  15  43.177  19.050  -3.586
  123   HG13  ILE  15          HG11      ILE  15  43.594  17.672  -4.628
  124   HG21  ILE  15          HG21      ILE  15  40.649  20.009  -5.319
  125   HG22  ILE  15          HG22      ILE  15  40.989  19.997  -3.573
  126   HG23  ILE  15          HG23      ILE  15  39.585  19.112  -4.215
  127   HD11  ILE  15           HD1      ILE  15  42.805  19.194  -6.601
  128   HD12  ILE  15           HD2      ILE  15  44.376  19.550  -5.844
  129   HD13  ILE  15           HD3      ILE  15  42.949  20.528  -5.430
  130    H    ILE  16           HN       ILE  16  41.111  15.024  -2.100
  131    HA   ILE  16           HA       ILE  16  42.662  13.405  -4.117
  132    HB   ILE  16           HB       ILE  16  42.664  13.363  -1.074
  133   HG12  ILE  16          HG12      ILE  16  44.176  14.973  -2.488
  134   HG13  ILE  16          HG11      ILE  16  44.922  14.031  -1.185
  135   HG21  ILE  16          HG21      ILE  16  43.733  11.299  -3.042
  136   HG22  ILE  16          HG22      ILE  16  42.616  11.046  -1.681
  137   HG23  ILE  16          HG23      ILE  16  44.322  11.424  -1.367
  138   HD11  ILE  16           HD1      ILE  16  44.910  13.062  -4.077
  139   HD12  ILE  16           HD2      ILE  16  45.908  12.481  -2.728
  140   HD13  ILE  16           HD3      ILE  16  46.192  14.094  -3.414
  141    H    ILE  17           HN       ILE  17  40.713  12.791  -1.161
  142    HA   ILE  17           HA       ILE  17  39.498  10.453  -2.399
  143    HB   ILE  17           HB       ILE  17  39.811  10.512   0.041
  144   HG12  ILE  17          HG12      ILE  17  37.582   9.850   0.775
  145   HG13  ILE  17          HG11      ILE  17  36.821  10.738  -0.561
  146   HG21  ILE  17          HG21      ILE  17  38.634  12.116   1.451
  147   HG22  ILE  17          HG22      ILE  17  37.819  12.821   0.035
  148   HG23  ILE  17          HG23      ILE  17  39.577  13.010   0.237
  149   HD11  ILE  17           HD1      ILE  17  37.142   8.138  -0.788
  150   HD12  ILE  17           HD2      ILE  17  38.840   8.541  -1.137
  151   HD13  ILE  17           HD3      ILE  17  37.540   9.170  -2.180
  152    H    GLY  18           HN       GLY  18  38.630  13.835  -1.835
  153    HA2  GLY  18           HA1      GLY  18  35.870  13.503  -2.727
  154    HA3  GLY  18           HA2      GLY  18  36.724  15.032  -2.435
  155    H    GLY  19           HN       GLY  19  38.880  14.857  -4.128
  156    HA2  GLY  19           HA1      GLY  19  37.596  15.453  -6.670
  157    HA3  GLY  19           HA2      GLY  19  39.336  15.486  -6.320
  158    H    ALA  20           HN       ALA  20  39.768  12.876  -5.469
  159    HA   ALA  20           HA       ALA  20  40.296  10.813  -6.380
  160    HB1  ALA  20           HB1      ALA  20  37.625  11.076  -7.798
  161    HB2  ALA  20           HB2      ALA  20  37.817  10.571  -6.101
  162    HB3  ALA  20           HB3      ALA  20  38.498   9.574  -7.410
  163    H    LEU  21           HN       LEU  21  40.352  13.547  -8.112
  164    HA   LEU  21           HA       LEU  21  41.030  14.124 -10.268
  165    HB2  LEU  21           HB2      LEU  21  42.633  11.547 -10.187
  166    HB3  LEU  21           HB1      LEU  21  43.063  13.099 -10.946
  167    HG   LEU  21           HG       LEU  21  42.805  12.553  -7.955
  168   HD11  LEU  21          HD11      LEU  21  45.195  13.236  -9.726
  169   HD12  LEU  21          HD12      LEU  21  44.856  11.646  -9.000
  170   HD13  LEU  21          HD13      LEU  21  45.239  13.037  -7.958
  171   HD21  LEU  21          HD21      LEU  21  43.802  14.946  -7.862
  172   HD22  LEU  21          HD22      LEU  21  42.079  14.809  -8.277
  173   HD23  LEU  21          HD23      LEU  21  43.281  15.101  -9.558
  174    H    ASP  22           HN       ASP  22  38.739  13.564 -10.925
  175    HA   ASP  22           HA       ASP  22  38.903  11.879 -13.329
  176    HB2  ASP  22           HB2      ASP  22  37.125  11.105 -10.984
  177    HB3  ASP  22           HB1      ASP  22  36.886  10.508 -12.645
  178    H    HIS  23           HN       HIS  23  38.613  14.521 -13.345
  179    HA   HIS  23           HA       HIS  23  37.203  16.256 -13.978
  180    HB2  HIS  23           HB2      HIS  23  36.855  14.666 -15.874
  181    HB3  HIS  23           HB1      HIS  23  35.460  13.980 -15.007
  182    HD1  HIS  23           HD1      HIS  23  36.364  17.688 -15.137
  183    HD2  HIS  23           HD2      HIS  23  33.391  15.065 -16.536
  184    HE1  HIS  23           HE1      HIS  23  34.535  19.114 -16.211
  185    H    LEU  24           HN       LEU  24  36.788  14.844 -11.327
  186    HA   LEU  24           HA       LEU  24  34.421  16.350 -10.564
  187    HB2  LEU  24           HB2      LEU  24  33.461  14.233 -11.633
  188    HB3  LEU  24           HB1      LEU  24  34.227  13.327 -10.311
  189    HG   LEU  24           HG       LEU  24  32.959  15.062  -8.744
  190   HD11  LEU  24          HD11      LEU  24  30.736  15.705  -9.742
  191   HD12  LEU  24          HD12      LEU  24  31.344  15.199 -11.334
  192   HD13  LEU  24          HD13      LEU  24  32.107  16.560 -10.480
  193   HD21  LEU  24          HD21      LEU  24  31.529  12.835 -10.264
  194   HD22  LEU  24          HD22      LEU  24  30.954  13.563  -8.744
  195   HD23  LEU  24          HD23      LEU  24  32.485  12.655  -8.773
  Start of MODEL   68
    1    H1   GLY   1           HT1      GLY   1  61.241   2.905   2.968
    2    H2   GLY   1           HT2      GLY   1  62.691   2.059   3.232
    3    H3   GLY   1           HT3      GLY   1  61.495   2.102   4.438
    4    HA2  GLY   1           HA1      GLY   1  61.575   0.615   1.929
    5    HA3  GLY   1           HA2      GLY   1  61.199   0.048   3.567
    6    H    LYS   2           HN       LYS   2  59.468  -0.875   1.922
    7    HA   LYS   2           HA       LYS   2  57.328   0.937   1.193
    8    HB2  LYS   2           HB2      LYS   2  57.848  -1.355   0.175
    9    HB3  LYS   2           HB1      LYS   2  57.100  -2.065   1.624
   10    HG2  LYS   2           HG2      LYS   2  54.993  -0.906   1.156
   11    HG3  LYS   2           HG1      LYS   2  55.728  -0.070  -0.233
   12    HD2  LYS   2           HD2      LYS   2  56.141  -2.261  -1.327
   13    HD3  LYS   2           HD1      LYS   2  55.378  -3.088   0.053
   14    HE2  LYS   2           HE2      LYS   2  54.051  -1.102  -1.844
   15    HE3  LYS   2           HE1      LYS   2  53.729  -2.849  -1.734
   16    HZ1  LYS   2           HZ1      LYS   2  53.179  -0.771   0.320
   17    HZ2  LYS   2           HZ2      LYS   2  53.097  -2.438   0.636
   18    HZ3  LYS   2           HZ3      LYS   2  52.054  -1.735  -0.506
   19    H    GLY   3           HN       GLY   3  55.172   0.983   2.061
   20    HA2  GLY   3           HA1      GLY   3  53.856   0.026   4.165
   21    HA3  GLY   3           HA2      GLY   3  55.207   0.827   5.098
   22    H    ARG   4           HN       ARG   4  56.059   2.437   4.286
   23    HA   ARG   4           HA       ARG   4  54.622   3.455   5.957
   24    HB2  ARG   4           HB2      ARG   4  56.694   4.985   4.321
   25    HB3  ARG   4           HB1      ARG   4  55.959   5.661   5.797
   26    HG2  ARG   4           HG2      ARG   4  56.734   3.730   7.106
   27    HG3  ARG   4           HG1      ARG   4  57.397   2.973   5.638
   28    HD2  ARG   4           HD2      ARG   4  58.999   4.792   5.360
   29    HD3  ARG   4           HD1      ARG   4  58.273   5.687   6.716
   30    HE   ARG   4           HE       ARG   4  59.640   4.384   8.116
   31   HH11  ARG   4          HH11      ARG   4  61.252   3.386   5.775
   32   HH12  ARG   4          HH12      ARG   4  61.111   1.668   5.954
   33   HH21  ARG   4          HH21      ARG   4  58.417   1.849   8.130
   34   HH22  ARG   4          HH22      ARG   4  59.508   0.799   7.287
   35    H    TRP   5           HN       TRP   5  53.998   3.451   2.845
   36    HA   TRP   5           HA       TRP   5  52.985   5.819   1.823
   37    HB2  TRP   5           HB2      TRP   5  52.822   3.549   0.759
   38    HB3  TRP   5           HB1      TRP   5  51.435   3.204   1.820
   39    HD1  TRP   5           HD1      TRP   5  52.503   5.918  -0.742
   40    HE1  TRP   5           HE1      TRP   5  50.397   6.735  -2.029
   41    HE3  TRP   5           HE3      TRP   5  48.947   3.153   1.691
   42    HZ2  TRP   5           HZ2      TRP   5  47.562   6.233  -1.984
   43    HZ3  TRP   5           HZ3      TRP   5  46.547   3.338   1.052
   44    HH2  TRP   5           HH2      TRP   5  45.852   4.875  -0.782
   45    H    LEU   6           HN       LEU   6  51.891   4.171   4.670
   46    HA   LEU   6           HA       LEU   6  49.441   5.905   4.831
   47    HB2  LEU   6           HB2      LEU   6  48.977   3.517   5.004
   48    HB3  LEU   6           HB1      LEU   6  50.214   3.330   6.264
   49    HG   LEU   6           HG       LEU   6  48.913   4.744   7.804
   50   HD11  LEU   6          HD11      LEU   6  47.153   5.124   5.352
   51   HD12  LEU   6          HD12      LEU   6  47.815   6.357   6.452
   52   HD13  LEU   6          HD13      LEU   6  46.485   5.312   6.992
   53   HD21  LEU   6          HD21      LEU   6  48.431   2.293   7.619
   54   HD22  LEU   6          HD22      LEU   6  47.134   2.665   6.457
   55   HD23  LEU   6          HD23      LEU   6  47.015   3.237   8.139
   56    H    GLU   7           HN       GLU   7  52.614   5.245   6.231
   57    HA   GLU   7           HA       GLU   7  52.334   6.125   8.856
   58    HB2  GLU   7           HB2      GLU   7  54.463   5.417   7.620
   59    HB3  GLU   7           HB1      GLU   7  54.573   7.098   7.048
   60    HG2  GLU   7           HG2      GLU   7  55.908   6.984   9.045
   61    HG3  GLU   7           HG1      GLU   7  54.401   7.811   9.504
   62    H    ARG   8           HN       ARG   8  52.581   8.155   5.918
   63    HA   ARG   8           HA       ARG   8  52.604  10.669   7.288
   64    HB2  ARG   8           HB2      ARG   8  51.576   9.915   4.523
   65    HB3  ARG   8           HB1      ARG   8  51.794  11.584   5.091
   66    HG2  ARG   8           HG2      ARG   8  54.116   9.627   5.262
   67    HG3  ARG   8           HG1      ARG   8  53.727  10.391   3.707
   68    HD2  ARG   8           HD2      ARG   8  54.361  11.854   6.312
   69    HD3  ARG   8           HD1      ARG   8  55.424  11.715   4.894
   70    HE   ARG   8           HE       ARG   8  53.025  12.843   3.950
   71   HH11  ARG   8          HH11      ARG   8  55.442  13.520   6.314
   72   HH12  ARG   8          HH12      ARG   8  55.300  15.238   6.161
   73   HH21  ARG   8          HH21      ARG   8  52.844  15.083   3.718
   74   HH22  ARG   8          HH22      ARG   8  53.828  16.124   4.692
   75    H    ILE   9           HN       ILE   9  50.693  12.299   6.685
   76    HA   ILE   9           HA       ILE   9  48.588  11.775   8.450
   77    HB   ILE   9           HB       ILE   9  49.106  14.012   7.441
   78   HG12  ILE   9          HG12      ILE   9  46.214  13.109   7.034
   79   HG13  ILE   9          HG11      ILE   9  46.936  13.500   8.612
   80   HG21  ILE   9          HG21      ILE   9  48.393  14.573   5.221
   81   HG22  ILE   9          HG22      ILE   9  47.495  13.046   5.043
   82   HG23  ILE   9          HG23      ILE   9  49.274  13.035   5.069
   83   HD11  ILE   9           HD1      ILE   9  47.556  15.790   7.564
   84   HD12  ILE   9           HD2      ILE   9  45.839  15.503   7.935
   85   HD13  ILE   9           HD3      ILE   9  46.423  15.356   6.261
   86    H    GLY  10           HN       GLY  10  48.883  10.923   5.020
   87    HA2  GLY  10           HA1      GLY  10  47.499   9.666   3.650
   88    HA3  GLY  10           HA2      GLY  10  47.198   8.705   5.110
   89    H    LYS  11           HN       LYS  11  46.243  11.868   3.696
   90    HA   LYS  11           HA       LYS  11  43.437  11.141   3.716
   91    HB2  LYS  11           HB2      LYS  11  43.972  11.578   6.194
   92    HB3  LYS  11           HB1      LYS  11  44.215  13.276   5.734
   93    HG2  LYS  11           HG2      LYS  11  41.942  13.332   6.300
   94    HG3  LYS  11           HG1      LYS  11  41.826  12.981   4.564
   95    HD2  LYS  11           HD2      LYS  11  40.397  11.337   5.436
   96    HD3  LYS  11           HD1      LYS  11  41.927  10.434   5.376
   97    HE2  LYS  11           HE2      LYS  11  42.338  10.953   7.764
   98    HE3  LYS  11           HE1      LYS  11  40.828  11.893   7.824
   99    HZ1  LYS  11           HZ1      LYS  11  40.408   9.708   8.653
  100    HZ2  LYS  11           HZ2      LYS  11  41.110   8.979   7.288
  101    HZ3  LYS  11           HZ3      LYS  11  39.651   9.839   7.141
  102    H    ALA  12           HN       ALA  12  44.157  11.841   1.517
  103    HA   ALA  12           HA       ALA  12  44.732  14.670   1.104
  104    HB1  ALA  12           HB1      ALA  12  43.729  12.643  -0.919
  105    HB2  ALA  12           HB2      ALA  12  45.431  12.780  -0.418
  106    HB3  ALA  12           HB3      ALA  12  44.630  14.143  -1.237
  107    H    GLY  13           HN       GLY  13  42.833  15.298   2.538
  108    HA2  GLY  13           HA1      GLY  13  40.685  16.143   2.743
  109    HA3  GLY  13           HA2      GLY  13  40.845  16.543   1.021
  110    H    PHE  14           HN       PHE  14  40.327  13.632   3.065
  111    HA   PHE  14           HA       PHE  14  38.869  11.854   2.786
  112    HB2  PHE  14           HB2      PHE  14  37.143  13.936   1.385
  113    HB3  PHE  14           HB1      PHE  14  36.590  12.384   2.057
  114    HD1  PHE  14           HD1      PHE  14  36.653  11.979   4.521
  115    HD2  PHE  14           HD2      PHE  14  37.615  15.830   2.823
  116    HE1  PHE  14           HE1      PHE  14  36.390  13.033   6.762
  117    HE2  PHE  14           HE2      PHE  14  37.351  16.883   5.066
  118    HZ   PHE  14           HZ       PHE  14  36.666  15.496   7.020
  119    H    ILE  15           HN       ILE  15  40.917  12.333   0.761
  120    HA   ILE  15           HA       ILE  15  41.530  11.495  -1.290
  121    HB   ILE  15           HB       ILE  15  38.969   9.847  -1.261
  122   HG12  ILE  15          HG12      ILE  15  40.344   9.698   0.930
  123   HG13  ILE  15          HG11      ILE  15  39.994   8.178   0.089
  124   HG21  ILE  15          HG21      ILE  15  40.520   8.200  -2.449
  125   HG22  ILE  15          HG22      ILE  15  41.687   9.537  -2.580
  126   HG23  ILE  15          HG23      ILE  15  40.090   9.671  -3.353
  127   HD11  ILE  15           HD1      ILE  15  42.389   8.438   0.921
  128   HD12  ILE  15           HD2      ILE  15  42.601   9.715  -0.294
  129   HD13  ILE  15           HD3      ILE  15  42.230   8.054  -0.806
  130    H    ILE  16           HN       ILE  16  40.906  13.776  -1.754
  131    HA   ILE  16           HA       ILE  16  38.995  13.764  -4.074
  132    HB   ILE  16           HB       ILE  16  39.333  15.938  -1.971
  133   HG12  ILE  16          HG12      ILE  16  37.913  13.832  -1.380
  134   HG13  ILE  16          HG11      ILE  16  37.182  15.425  -1.131
  135   HG21  ILE  16          HG21      ILE  16  38.957  16.981  -4.111
  136   HG22  ILE  16          HG22      ILE  16  37.396  17.003  -3.261
  137   HG23  ILE  16          HG23      ILE  16  37.698  15.802  -4.539
  138   HD11  ILE  16           HD1      ILE  16  36.740  13.795  -3.672
  139   HD12  ILE  16           HD2      ILE  16  35.844  15.228  -3.125
  140   HD13  ILE  16           HD3      ILE  16  35.683  13.689  -2.250
  141    H    ILE  17           HN       ILE  17  41.639  15.415  -2.314
  142    HA   ILE  17           HA       ILE  17  42.505  16.880  -4.695
  143    HB   ILE  17           HB       ILE  17  44.114  16.299  -2.167
  144   HG12  ILE  17          HG12      ILE  17  42.078  17.248  -1.353
  145   HG13  ILE  17          HG11      ILE  17  43.224  18.598  -1.421
  146   HG21  ILE  17          HG21      ILE  17  44.310  18.342  -4.412
  147   HG22  ILE  17          HG22      ILE  17  45.550  17.229  -3.801
  148   HG23  ILE  17          HG23      ILE  17  45.062  18.631  -2.827
  149   HD11  ILE  17           HD1      ILE  17  40.940  17.968  -3.325
  150   HD12  ILE  17           HD2      ILE  17  42.232  19.109  -3.754
  151   HD13  ILE  17           HD3      ILE  17  41.190  19.435  -2.354
  152    H    GLY  18           HN       GLY  18  43.642  14.051  -2.829
  153    HA2  GLY  18           HA1      GLY  18  45.802  13.489  -4.705
  154    HA3  GLY  18           HA2      GLY  18  45.249  12.458  -3.368
  155    H    GLY  19           HN       GLY  19  42.647  11.951  -3.915
  156    HA2  GLY  19           HA1      GLY  19  42.858   9.961  -5.973
  157    HA3  GLY  19           HA2      GLY  19  41.367  10.483  -5.165
  158    H    ALA  20           HN       ALA  20  41.531  13.260  -5.918
  159    HA   ALA  20           HA       ALA  20  40.676  14.568  -7.638
  160    HB1  ALA  20           HB1      ALA  20  42.492  12.906  -9.412
  161    HB2  ALA  20           HB2      ALA  20  43.072  14.212  -8.351
  162    HB3  ALA  20           HB3      ALA  20  41.942  14.575  -9.679
  163    H    LEU  21           HN       LEU  21  39.152  12.234  -6.969
  164    HA   LEU  21           HA       LEU  21  38.320  10.691  -9.191
  165    HB2  LEU  21           HB2      LEU  21  36.454  11.737  -7.030
  166    HB3  LEU  21           HB1      LEU  21  36.329  10.216  -7.945
  167    HG   LEU  21           HG       LEU  21  38.470  10.948  -5.898
  168   HD11  LEU  21          HD11      LEU  21  36.289   8.816  -5.953
  169   HD12  LEU  21          HD12      LEU  21  36.290  10.286  -4.948
  170   HD13  LEU  21          HD13      LEU  21  37.505   9.017  -4.670
  171   HD21  LEU  21          HD21      LEU  21  39.119   8.460  -6.324
  172   HD22  LEU  21          HD22      LEU  21  39.626   9.657  -7.535
  173   HD23  LEU  21          HD23      LEU  21  38.212   8.621  -7.847
  174    H    ASP  22           HN       ASP  22  38.079  14.052  -8.704
  175    HA   ASP  22           HA       ASP  22  35.598  14.665  -9.946
  176    HB2  ASP  22           HB2      ASP  22  37.069  16.312  -8.791
  177    HB3  ASP  22           HB1      ASP  22  38.213  16.211 -10.150
  178    H    HIS  23           HN       HIS  23  38.740  15.191 -11.577
  179    HA   HIS  23           HA       HIS  23  37.450  14.691 -14.189
  180    HB2  HIS  23           HB2      HIS  23  40.351  15.325 -13.516
  181    HB3  HIS  23           HB1      HIS  23  39.588  15.406 -15.122
  182    HD1  HIS  23           HD1      HIS  23  40.314  17.426 -12.163
  183    HD2  HIS  23           HD2      HIS  23  37.307  17.387 -15.103
  184    HE1  HIS  23           HE1      HIS  23  39.161  19.706 -12.105
  185    H    LEU  24           HN       LEU  24  39.530  13.040 -11.890
  186    HA   LEU  24           HA       LEU  24  40.563  11.083 -13.754
  187    HB2  LEU  24           HB2      LEU  24  41.482  11.694 -11.433
  188    HB3  LEU  24           HB1      LEU  24  40.164  10.705 -10.766
  189    HG   LEU  24           HG       LEU  24  41.064   8.848 -12.441
  190   HD11  LEU  24          HD11      LEU  24  42.704  10.191 -13.650
  191   HD12  LEU  24          HD12      LEU  24  43.578   9.000 -12.662
  192   HD13  LEU  24          HD13      LEU  24  43.480  10.693 -12.130
  193   HD21  LEU  24          HD21      LEU  24  41.124   8.645  -9.987
  194   HD22  LEU  24          HD22      LEU  24  42.582   9.662  -9.920
  195   HD23  LEU  24          HD23      LEU  24  42.650   8.057 -10.688
  Start of MODEL   69
    1    H1   GLY   1           HT1      GLY   1  61.902   5.113  -0.369
    2    H2   GLY   1           HT2      GLY   1  62.723   4.143  -1.498
    3    H3   GLY   1           HT3      GLY   1  63.595   5.043  -0.351
    4    HA2  GLY   1           HA1      GLY   1  63.104   2.502  -0.083
    5    HA3  GLY   1           HA2      GLY   1  63.257   3.619   1.288
    6    H    LYS   2           HN       LYS   2  61.800   1.154   1.276
    7    HA   LYS   2           HA       LYS   2  58.995   1.576   0.863
    8    HB2  LYS   2           HB2      LYS   2  58.707  -0.397   2.326
    9    HB3  LYS   2           HB1      LYS   2  59.986  -0.663   1.117
   10    HG2  LYS   2           HG2      LYS   2  61.647   0.142   2.916
   11    HG3  LYS   2           HG1      LYS   2  60.306  -0.016   4.075
   12    HD2  LYS   2           HD2      LYS   2  61.332  -2.252   2.267
   13    HD3  LYS   2           HD1      LYS   2  61.734  -2.066   3.990
   14    HE2  LYS   2           HE2      LYS   2  59.168  -2.073   4.399
   15    HE3  LYS   2           HE1      LYS   2  59.040  -2.699   2.737
   16    HZ1  LYS   2           HZ1      LYS   2  59.663  -4.109   5.066
   17    HZ2  LYS   2           HZ2      LYS   2  61.059  -4.108   4.099
   18    HZ3  LYS   2           HZ3      LYS   2  59.592  -4.695   3.477
   19    H    GLY   3           HN       GLY   3  57.542   1.098   2.990
   20    HA2  GLY   3           HA1      GLY   3  57.427   1.887   5.439
   21    HA3  GLY   3           HA2      GLY   3  58.104   3.475   4.851
   22    H    ARG   4           HN       ARG   4  57.612   4.128   3.061
   23    HA   ARG   4           HA       ARG   4  56.117   5.447   4.440
   24    HB2  ARG   4           HB2      ARG   4  56.308   5.951   1.430
   25    HB3  ARG   4           HB1      ARG   4  55.831   7.161   2.646
   26    HG2  ARG   4           HG2      ARG   4  58.025   6.716   3.836
   27    HG3  ARG   4           HG1      ARG   4  58.501   5.701   2.452
   28    HD2  ARG   4           HD2      ARG   4  59.411   7.941   2.125
   29    HD3  ARG   4           HD1      ARG   4  58.108   7.677   0.941
   30    HE   ARG   4           HE       ARG   4  56.823   8.869   3.098
   31   HH11  ARG   4          HH11      ARG   4  56.549  10.559   0.945
   32   HH12  ARG   4          HH12      ARG   4  57.693  11.841   1.157
   33   HH21  ARG   4          HH21      ARG   4  59.612  10.105   3.466
   34   HH22  ARG   4          HH22      ARG   4  59.428  11.584   2.584
   35    H    TRP   5           HN       TRP   5  55.193   2.959   2.695
   36    HA   TRP   5           HA       TRP   5  52.773   3.254   1.376
   37    HB2  TRP   5           HB2      TRP   5  53.905   1.085   1.853
   38    HB3  TRP   5           HB1      TRP   5  53.309   1.178   3.528
   39    HD1  TRP   5           HD1      TRP   5  51.724   1.491  -0.009
   40    HE1  TRP   5           HE1      TRP   5  49.455   0.218  -0.026
   41    HE3  TRP   5           HE3      TRP   5  51.667  -0.118   4.850
   42    HZ2  TRP   5           HZ2      TRP   5  47.859  -1.287   1.841
   43    HZ3  TRP   5           HZ3      TRP   5  49.762  -1.471   5.711
   44    HH2  TRP   5           HH2      TRP   5  47.860  -2.055   4.213
   45    H    LEU   6           HN       LEU   6  53.412   3.931   4.718
   46    HA   LEU   6           HA       LEU   6  50.485   4.173   5.332
   47    HB2  LEU   6           HB2      LEU   6  51.771   2.806   6.898
   48    HB3  LEU   6           HB1      LEU   6  52.954   4.113   7.119
   49    HG   LEU   6           HG       LEU   6  51.234   5.543   8.148
   50   HD11  LEU   6          HD11      LEU   6  48.982   4.310   8.712
   51   HD12  LEU   6          HD12      LEU   6  49.401   3.253   7.344
   52   HD13  LEU   6          HD13      LEU   6  49.183   5.001   7.088
   53   HD21  LEU   6          HD21      LEU   6  51.146   2.735   9.334
   54   HD22  LEU   6          HD22      LEU   6  50.920   4.271  10.205
   55   HD23  LEU   6          HD23      LEU   6  52.511   3.862   9.519
   56    H    GLU   7           HN       GLU   7  53.475   6.004   4.826
   57    HA   GLU   7           HA       GLU   7  52.885   8.367   6.233
   58    HB2  GLU   7           HB2      GLU   7  54.935   7.761   4.759
   59    HB3  GLU   7           HB1      GLU   7  53.984   8.401   3.399
   60    HG2  GLU   7           HG2      GLU   7  54.563   9.971   5.954
   61    HG3  GLU   7           HG1      GLU   7  55.530  10.095   4.467
   62    H    ARG   8           HN       ARG   8  51.535   7.161   3.187
   63    HA   ARG   8           HA       ARG   8  50.285   9.449   2.181
   64    HB2  ARG   8           HB2      ARG   8  50.263   7.136   1.174
   65    HB3  ARG   8           HB1      ARG   8  48.993   6.700   2.344
   66    HG2  ARG   8           HG2      ARG   8  47.525   8.452   1.467
   67    HG3  ARG   8           HG1      ARG   8  48.806   9.015   0.366
   68    HD2  ARG   8           HD2      ARG   8  47.119   7.534  -0.765
   69    HD3  ARG   8           HD1      ARG   8  48.776   6.885  -0.834
   70    HE   ARG   8           HE       ARG   8  48.037   5.073   0.486
   71   HH11  ARG   8          HH11      ARG   8  45.272   5.385  -0.487
   72   HH12  ARG   8          HH12      ARG   8  44.363   5.577   0.975
   73   HH21  ARG   8          HH21      ARG   8  47.136   6.343   2.912
   74   HH22  ARG   8          HH22      ARG   8  45.418   6.119   2.899
   75    H    ILE   9           HN       ILE   9  48.747  10.812   2.832
   76    HA   ILE   9           HA       ILE   9  47.624  10.575   5.471
   77    HB   ILE   9           HB       ILE   9  48.016  12.750   4.290
   78   HG12  ILE   9          HG12      ILE   9  45.135  12.223   5.149
   79   HG13  ILE   9          HG11      ILE   9  46.491  12.574   6.242
   80   HG21  ILE   9          HG21      ILE   9  47.027  11.815   2.070
   81   HG22  ILE   9          HG22      ILE   9  46.646  13.495   2.507
   82   HG23  ILE   9          HG23      ILE   9  45.438  12.217   2.767
   83   HD11  ILE   9           HD1      ILE   9  46.821  14.743   4.887
   84   HD12  ILE   9           HD2      ILE   9  45.377  14.665   5.923
   85   HD13  ILE   9           HD3      ILE   9  45.227  14.406   4.169
   86    H    GLY  10           HN       GLY  10  46.139  10.251   2.207
   87    HA2  GLY  10           HA1      GLY  10  44.062   9.382   1.622
   88    HA3  GLY  10           HA2      GLY  10  44.604   8.023   2.624
   89    H    LYS  11           HN       LYS  11  42.910  11.169   2.728
   90    HA   LYS  11           HA       LYS  11  40.977  10.001   4.672
   91    HB2  LYS  11           HB2      LYS  11  42.786  12.374   5.246
   92    HB3  LYS  11           HB1      LYS  11  41.189  12.235   6.018
   93    HG2  LYS  11           HG2      LYS  11  41.808  10.023   6.930
   94    HG3  LYS  11           HG1      LYS  11  43.398  10.133   6.142
   95    HD2  LYS  11           HD2      LYS  11  43.860  12.224   7.442
   96    HD3  LYS  11           HD1      LYS  11  42.311  12.000   8.291
   97    HE2  LYS  11           HE2      LYS  11  43.066   9.827   9.157
   98    HE3  LYS  11           HE1      LYS  11  44.592   9.976   8.254
   99    HZ1  LYS  11           HZ1      LYS  11  45.170  11.897   9.542
  100    HZ2  LYS  11           HZ2      LYS  11  44.768  10.640  10.612
  101    HZ3  LYS  11           HZ3      LYS  11  43.667  11.903  10.327
  102    H    ALA  12           HN       ALA  12  41.811  11.939   2.014
  103    HA   ALA  12           HA       ALA  12  40.557  13.355   0.671
  104    HB1  ALA  12           HB1      ALA  12  38.239  12.827   0.397
  105    HB2  ALA  12           HB2      ALA  12  38.138  12.130   2.032
  106    HB3  ALA  12           HB3      ALA  12  39.070  11.298   0.764
  107    H    GLY  13           HN       GLY  13  41.592  14.839   2.455
  108    HA2  GLY  13           HA1      GLY  13  40.203  16.021   4.529
  109    HA3  GLY  13           HA2      GLY  13  41.301  16.914   3.458
  110    H    PHE  14           HN       PHE  14  37.971  15.988   4.103
  111    HA   PHE  14           HA       PHE  14  35.982  17.025   3.554
  112    HB2  PHE  14           HB2      PHE  14  37.351  19.101   4.243
  113    HB3  PHE  14           HB1      PHE  14  37.563  19.401   2.504
  114    HD1  PHE  14           HD1      PHE  14  34.939  18.789   5.125
  115    HD2  PHE  14           HD2      PHE  14  35.842  20.475   1.255
  116    HE1  PHE  14           HE1      PHE  14  32.668  19.811   5.040
  117    HE2  PHE  14           HE2      PHE  14  33.571  21.497   1.170
  118    HZ   PHE  14           HZ       PHE  14  31.993  21.184   3.073
  119    H    ILE  15           HN       ILE  15  37.018  15.208   1.756
  120    HA   ILE  15           HA       ILE  15  36.734  14.473  -0.404
  121    HB   ILE  15           HB       ILE  15  34.908  16.877  -0.796
  122   HG12  ILE  15          HG12      ILE  15  34.214  15.780   1.250
  123   HG13  ILE  15          HG11      ILE  15  33.070  15.318  -0.026
  124   HG21  ILE  15          HG21      ILE  15  33.721  14.948  -2.236
  125   HG22  ILE  15          HG22      ILE  15  35.367  14.278  -2.278
  126   HG23  ILE  15          HG23      ILE  15  35.054  15.908  -2.907
  127   HD11  ILE  15           HD1      ILE  15  35.271  13.658   1.245
  128   HD12  ILE  15           HD2      ILE  15  34.606  13.227  -0.347
  129   HD13  ILE  15           HD3      ILE  15  33.544  13.275   1.076
  130    H    ILE  16           HN       ILE  16  38.979  15.069  -0.666
  131    HA   ILE  16           HA       ILE  16  39.255  17.037  -2.917
  132    HB   ILE  16           HB       ILE  16  41.189  16.743  -0.582
  133   HG12  ILE  16          HG12      ILE  16  38.987  18.082  -0.189
  134   HG13  ILE  16          HG11      ILE  16  40.517  18.868   0.219
  135   HG21  ILE  16          HG21      ILE  16  42.307  18.732  -1.735
  136   HG22  ILE  16          HG22      ILE  16  41.247  18.414  -3.130
  137   HG23  ILE  16          HG23      ILE  16  42.420  17.188  -2.607
  138   HD11  ILE  16           HD1      ILE  16  39.125  19.273  -2.466
  139   HD12  ILE  16           HD2      ILE  16  40.462  20.218  -1.775
  140   HD13  ILE  16           HD3      ILE  16  38.840  20.312  -1.055
  141    H    ILE  17           HN       ILE  17  40.997  14.562  -0.953
  142    HA   ILE  17           HA       ILE  17  42.606  13.712  -3.224
  143    HB   ILE  17           HB       ILE  17  41.944  12.074  -0.735
  144   HG12  ILE  17          HG12      ILE  17  42.715  14.180   0.115
  145   HG13  ILE  17          HG11      ILE  17  44.110  13.087   0.185
  146   HG21  ILE  17          HG21      ILE  17  43.069  10.674  -2.262
  147   HG22  ILE  17          HG22      ILE  17  44.388  11.282  -1.241
  148   HG23  ILE  17          HG23      ILE  17  44.120  11.975  -2.855
  149   HD11  ILE  17           HD1      ILE  17  43.560  15.310  -1.812
  150   HD12  ILE  17           HD2      ILE  17  44.783  14.058  -2.113
  151   HD13  ILE  17           HD3      ILE  17  44.944  15.139  -0.714
  152    H    GLY  18           HN       GLY  18  39.755  12.400  -1.511
  153    HA2  GLY  18           HA1      GLY  18  39.396  10.240  -3.425
  154    HA3  GLY  18           HA2      GLY  18  38.249  10.755  -2.169
  155    H    GLY  19           HN       GLY  19  37.908  13.436  -2.835
  156    HA2  GLY  19           HA1      GLY  19  35.907  13.265  -4.844
  157    HA3  GLY  19           HA2      GLY  19  36.636  14.763  -4.232
  158    H    ALA  20           HN       ALA  20  39.249  14.577  -5.001
  159    HA   ALA  20           HA       ALA  20  39.178  15.442  -7.687
  160    HB1  ALA  20           HB1      ALA  20  41.655  15.013  -7.653
  161    HB2  ALA  20           HB2      ALA  20  41.442  14.227  -6.070
  162    HB3  ALA  20           HB3      ALA  20  41.058  15.954  -6.266
  163    H    LEU  21           HN       LEU  21  38.883  12.284  -6.424
  164    HA   LEU  21           HA       LEU  21  38.783  10.209  -7.438
  165    HB2  LEU  21           HB2      LEU  21  37.220  11.607  -8.940
  166    HB3  LEU  21           HB1      LEU  21  38.574  11.678 -10.088
  167    HG   LEU  21           HG       LEU  21  38.623   9.034  -9.772
  168   HD11  LEU  21          HD11      LEU  21  36.970   8.863  -7.971
  169   HD12  LEU  21          HD12      LEU  21  36.291   8.136  -9.443
  170   HD13  LEU  21          HD13      LEU  21  35.774   9.759  -8.936
  171   HD21  LEU  21          HD21      LEU  21  36.449  10.495 -11.339
  172   HD22  LEU  21          HD22      LEU  21  36.946   8.809 -11.622
  173   HD23  LEU  21          HD23      LEU  21  38.100  10.137 -11.898
  174    H    ASP  22           HN       ASP  22  40.582   9.048  -7.356
  175    HA   ASP  22           HA       ASP  22  42.692   8.255  -7.878
  176    HB2  ASP  22           HB2      ASP  22  42.128   9.478 -10.611
  177    HB3  ASP  22           HB1      ASP  22  43.351   8.243 -10.239
  178    H    HIS  23           HN       HIS  23  42.792  11.088 -10.057
  179    HA   HIS  23           HA       HIS  23  44.338  12.706  -8.218
  180    HB2  HIS  23           HB2      HIS  23  46.024  10.933  -8.811
  181    HB3  HIS  23           HB1      HIS  23  45.895  11.449 -10.509
  182    HD1  HIS  23           HD1      HIS  23  45.565  14.142  -7.950
  183    HD2  HIS  23           HD2      HIS  23  48.666  12.381 -10.178
  184    HE1  HIS  23           HE1      HIS  23  47.572  15.717  -7.839
  185    H    LEU  24           HN       LEU  24  42.085  12.675 -10.245
  186    HA   LEU  24           HA       LEU  24  43.060  14.548 -12.331
  187    HB2  LEU  24           HB2      LEU  24  40.178  13.774 -11.763
  188    HB3  LEU  24           HB1      LEU  24  40.899  14.328 -13.293
  189    HG   LEU  24           HG       LEU  24  41.464  11.683 -11.877
  190   HD11  LEU  24          HD11      LEU  24  39.265  11.867 -13.065
  191   HD12  LEU  24          HD12      LEU  24  40.360  10.689 -13.827
  192   HD13  LEU  24          HD13      LEU  24  40.137  12.298 -14.555
  193   HD21  LEU  24          HD21      LEU  24  43.515  12.321 -12.931
  194   HD22  LEU  24          HD22      LEU  24  42.673  13.011 -14.340
  195   HD23  LEU  24          HD23      LEU  24  42.720  11.247 -14.104
  Start of MODEL   70
    1    H1   GLY   1           HT1      GLY   1  61.014  -2.118   1.849
    2    H2   GLY   1           HT2      GLY   1  60.252  -2.611   3.285
    3    H3   GLY   1           HT3      GLY   1  61.007  -1.091   3.198
    4    HA2  GLY   1           HA1      GLY   1  59.424  -0.543   1.376
    5    HA3  GLY   1           HA2      GLY   1  58.548  -2.003   1.876
    6    H    LYS   2           HN       LYS   2  60.221  -0.483   4.435
    7    HA   LYS   2           HA       LYS   2  57.751   0.149   5.798
    8    HB2  LYS   2           HB2      LYS   2  60.529   1.161   6.498
    9    HB3  LYS   2           HB1      LYS   2  59.148   0.908   7.593
   10    HG2  LYS   2           HG2      LYS   2  59.240  -1.571   6.901
   11    HG3  LYS   2           HG1      LYS   2  60.815  -1.199   6.159
   12    HD2  LYS   2           HD2      LYS   2  60.077  -0.737   9.085
   13    HD3  LYS   2           HD1      LYS   2  61.089  -2.065   8.470
   14    HE2  LYS   2           HE2      LYS   2  62.573  -0.190   7.435
   15    HE3  LYS   2           HE1      LYS   2  61.701   0.908   8.532
   16    HZ1  LYS   2           HZ1      LYS   2  62.306  -0.960  10.254
   17    HZ2  LYS   2           HZ2      LYS   2  63.412   0.269   9.864
   18    HZ3  LYS   2           HZ3      LYS   2  63.564  -1.269   9.160
   19    H    GLY   3           HN       GLY   3  58.129   2.533   7.059
   20    HA2  GLY   3           HA1      GLY   3  58.381   4.938   6.610
   21    HA3  GLY   3           HA2      GLY   3  58.240   4.627   4.820
   22    H    ARG   4           HN       ARG   4  56.889   3.330   4.170
   23    HA   ARG   4           HA       ARG   4  55.747   5.421   3.745
   24    HB2  ARG   4           HB2      ARG   4  54.611   2.740   2.823
   25    HB3  ARG   4           HB1      ARG   4  54.139   4.309   2.123
   26    HG2  ARG   4           HG2      ARG   4  56.405   4.765   1.414
   27    HG3  ARG   4           HG1      ARG   4  57.032   3.371   2.327
   28    HD2  ARG   4           HD2      ARG   4  55.904   1.808   0.864
   29    HD3  ARG   4           HD1      ARG   4  55.018   3.123   0.055
   30    HE   ARG   4           HE       ARG   4  56.906   3.360  -1.325
   31   HH11  ARG   4          HH11      ARG   4  59.155   4.120  -1.181
   32   HH12  ARG   4          HH12      ARG   4  60.239   3.116  -0.278
   33   HH21  ARG   4          HH21      ARG   4  57.716   1.189   1.116
   34   HH22  ARG   4          HH22      ARG   4  59.426   1.457   1.023
   35    H    TRP   5           HN       TRP   5  55.012   3.429   6.124
   36    HA   TRP   5           HA       TRP   5  52.261   3.222   6.592
   37    HB2  TRP   5           HB2      TRP   5  54.444   3.997   8.567
   38    HB3  TRP   5           HB1      TRP   5  52.799   3.506   9.037
   39    HD1  TRP   5           HD1      TRP   5  56.112   2.147   7.862
   40    HE1  TRP   5           HE1      TRP   5  56.046  -0.450   7.769
   41    HE3  TRP   5           HE3      TRP   5  51.089   1.443   8.560
   42    HZ2  TRP   5           HZ2      TRP   5  54.060  -2.525   7.973
   43    HZ3  TRP   5           HZ3      TRP   5  50.131  -0.855   8.607
   44    HH2  TRP   5           HH2      TRP   5  51.611  -2.837   8.314
   45    H    LEU   6           HN       LEU   6  54.075   6.104   6.169
   46    HA   LEU   6           HA       LEU   6  51.701   7.740   7.018
   47    HB2  LEU   6           HB2      LEU   6  54.104   7.714   8.384
   48    HB3  LEU   6           HB1      LEU   6  54.403   9.027   7.229
   49    HG   LEU   6           HG       LEU   6  51.996   8.829   9.105
   50   HD11  LEU   6          HD11      LEU   6  54.375  10.733   9.183
   51   HD12  LEU   6          HD12      LEU   6  54.249   9.266  10.184
   52   HD13  LEU   6          HD13      LEU   6  53.071  10.586  10.384
   53   HD21  LEU   6          HD21      LEU   6  51.790  11.303   8.369
   54   HD22  LEU   6          HD22      LEU   6  51.319  10.074   7.175
   55   HD23  LEU   6          HD23      LEU   6  52.899  10.883   7.042
   56    H    GLU   7           HN       GLU   7  53.785   6.747   4.484
   57    HA   GLU   7           HA       GLU   7  53.737   9.354   3.079
   58    HB2  GLU   7           HB2      GLU   7  55.607   7.627   2.901
   59    HB3  GLU   7           HB1      GLU   7  54.480   6.631   1.954
   60    HG2  GLU   7           HG2      GLU   7  55.764   7.898   0.364
   61    HG3  GLU   7           HG1      GLU   7  54.158   8.659   0.428
   62    H    ARG   8           HN       ARG   8  51.842   6.422   3.304
   63    HA   ARG   8           HA       ARG   8  50.497   6.362   0.851
   64    HB2  ARG   8           HB2      ARG   8  49.414   5.918   3.659
   65    HB3  ARG   8           HB1      ARG   8  48.532   5.496   2.172
   66    HG2  ARG   8           HG2      ARG   8  50.391   4.014   1.482
   67    HG3  ARG   8           HG1      ARG   8  51.281   4.436   2.965
   68    HD2  ARG   8           HD2      ARG   8  48.597   3.003   2.778
   69    HD3  ARG   8           HD1      ARG   8  50.141   2.321   3.344
   70    HE   ARG   8           HE       ARG   8  49.781   4.427   5.065
   71   HH11  ARG   8          HH11      ARG   8  46.825   4.129   4.377
   72   HH12  ARG   8          HH12      ARG   8  46.292   3.071   5.642
   73   HH21  ARG   8          HH21      ARG   8  49.497   2.088   6.530
   74   HH22  ARG   8          HH22      ARG   8  47.806   1.916   6.861
   75    H    ILE   9           HN       ILE   9  48.432   7.180   0.155
   76    HA   ILE   9           HA       ILE   9  47.159   9.361   1.560
   77    HB   ILE   9           HB       ILE   9  49.150  10.620   0.824
   78   HG12  ILE   9          HG12      ILE   9  48.040  12.409  -0.462
   79   HG13  ILE   9          HG11      ILE   9  46.715  11.310  -0.899
   80   HG21  ILE   9          HG21      ILE   9  48.354   9.994  -2.043
   81   HG22  ILE   9          HG22      ILE   9  49.564   9.032  -1.158
   82   HG23  ILE   9          HG23      ILE   9  49.844  10.765  -1.452
   83   HD11  ILE   9           HD1      ILE   9  45.841  11.286   1.295
   84   HD12  ILE   9           HD2      ILE   9  46.410  12.963   1.140
   85   HD13  ILE   9           HD3      ILE   9  47.391  11.772   2.027
   86    H    GLY  10           HN       GLY  10  45.098   9.331   0.968
   87    HA2  GLY  10           HA1      GLY  10  43.897   9.525  -1.447
   88    HA3  GLY  10           HA2      GLY  10  44.336   7.804  -1.450
   89    H    LYS  11           HN       LYS  11  43.683   9.308   1.606
   90    HA   LYS  11           HA       LYS  11  41.460   7.492   2.082
   91    HB2  LYS  11           HB2      LYS  11  42.526   9.867   3.660
   92    HB3  LYS  11           HB1      LYS  11  41.270   8.747   4.240
   93    HG2  LYS  11           HG2      LYS  11  42.780   6.885   4.243
   94    HG3  LYS  11           HG1      LYS  11  43.991   7.767   3.282
   95    HD2  LYS  11           HD2      LYS  11  44.704   7.705   5.626
   96    HD3  LYS  11           HD1      LYS  11  44.280   9.374   5.181
   97    HE2  LYS  11           HE2      LYS  11  42.202   9.274   6.348
   98    HE3  LYS  11           HE1      LYS  11  42.263   7.499   6.475
   99    HZ1  LYS  11           HZ1      LYS  11  43.719   7.586   8.187
  100    HZ2  LYS  11           HZ2      LYS  11  42.989   9.097   8.445
  101    HZ3  LYS  11           HZ3      LYS  11  44.483   8.998   7.644
  102    H    ALA  12           HN       ALA  12  41.563  10.165   0.170
  103    HA   ALA  12           HA       ALA  12  39.949  11.656  -0.560
  104    HB1  ALA  12           HB1      ALA  12  37.941   9.801   0.760
  105    HB2  ALA  12           HB2      ALA  12  38.707   9.453  -0.808
  106    HB3  ALA  12           HB3      ALA  12  37.680  10.894  -0.619
  107    H    GLY  13           HN       GLY  13  41.240  12.091   1.948
  108    HA2  GLY  13           HA1      GLY  13  39.903  12.686   4.217
  109    HA3  GLY  13           HA2      GLY  13  41.048  13.840   3.504
  110    H    PHE  14           HN       PHE  14  37.689  12.927   3.902
  111    HA   PHE  14           HA       PHE  14  35.734  14.152   3.615
  112    HB2  PHE  14           HB2      PHE  14  36.967  15.721   5.175
  113    HB3  PHE  14           HB1      PHE  14  37.532  16.609   3.741
  114    HD1  PHE  14           HD1      PHE  14  34.377  15.294   5.330
  115    HD2  PHE  14           HD2      PHE  14  36.173  18.335   2.844
  116    HE1  PHE  14           HE1      PHE  14  32.207  16.517   5.253
  117    HE2  PHE  14           HE2      PHE  14  34.004  19.556   2.771
  118    HZ   PHE  14           HZ       PHE  14  32.014  18.633   3.955
  119    H    ILE  15           HN       ILE  15  36.451  13.065   1.393
  120    HA   ILE  15           HA       ILE  15  36.757  13.260  -0.916
  121    HB   ILE  15           HB       ILE  15  34.830  14.676  -1.949
  122   HG12  ILE  15          HG12      ILE  15  34.034  14.821   1.001
  123   HG13  ILE  15          HG11      ILE  15  34.618  16.203   0.049
  124   HG21  ILE  15          HG21      ILE  15  34.056  12.586   0.134
  125   HG22  ILE  15          HG22      ILE  15  34.764  12.192  -1.451
  126   HG23  ILE  15          HG23      ILE  15  33.182  12.991  -1.360
  127   HD11  ILE  15           HD1      ILE  15  32.278  16.427  -0.111
  128   HD12  ILE  15           HD2      ILE  15  32.017  14.672  -0.218
  129   HD13  ILE  15           HD3      ILE  15  32.675  15.561  -1.614
  130    H    ILE  16           HN       ILE  16  38.864  14.253  -0.842
  131    HA   ILE  16           HA       ILE  16  38.758  17.009  -2.038
  132    HB   ILE  16           HB       ILE  16  39.398  17.215   0.382
  133   HG12  ILE  16          HG12      ILE  16  41.582  18.429  -0.013
  134   HG13  ILE  16          HG11      ILE  16  41.605  17.776  -1.663
  135   HG21  ILE  16          HG21      ILE  16  40.539  14.879   0.356
  136   HG22  ILE  16          HG22      ILE  16  41.316  16.174   1.294
  137   HG23  ILE  16          HG23      ILE  16  41.958  15.730  -0.303
  138   HD11  ILE  16           HD1      ILE  16  40.589  20.183  -1.218
  139   HD12  ILE  16           HD2      ILE  16  39.152  19.281  -0.690
  140   HD13  ILE  16           HD3      ILE  16  39.768  19.087  -2.349
  141    H    ILE  17           HN       ILE  17  40.884  14.192  -1.294
  142    HA   ILE  17           HA       ILE  17  42.410  14.745  -3.787
  143    HB   ILE  17           HB       ILE  17  43.739  14.075  -1.849
  144   HG12  ILE  17          HG12      ILE  17  44.928  12.141  -2.749
  145   HG13  ILE  17          HG11      ILE  17  43.526  11.675  -3.733
  146   HG21  ILE  17          HG21      ILE  17  42.005  11.569  -1.790
  147   HG22  ILE  17          HG22      ILE  17  41.958  12.899  -0.606
  148   HG23  ILE  17          HG23      ILE  17  43.413  11.886  -0.752
  149   HD11  ILE  17           HD1      ILE  17  43.807  13.503  -5.216
  150   HD12  ILE  17           HD2      ILE  17  45.478  13.002  -4.877
  151   HD13  ILE  17           HD3      ILE  17  44.791  14.422  -4.052
  152    H    GLY  18           HN       GLY  18  40.097  12.464  -2.381
  153    HA2  GLY  18           HA1      GLY  18  40.125  10.755  -4.799
  154    HA3  GLY  18           HA2      GLY  18  39.142  10.534  -3.335
  155    H    GLY  19           HN       GLY  19  38.227  13.303  -3.275
  156    HA2  GLY  19           HA1      GLY  19  35.928  12.977  -5.030
  157    HA3  GLY  19           HA2      GLY  19  36.258  14.342  -3.944
  158    H    ALA  20           HN       ALA  20  38.688  15.268  -4.843
  159    HA   ALA  20           HA       ALA  20  37.965  16.941  -6.988
  160    HB1  ALA  20           HB1      ALA  20  40.691  15.957  -6.085
  161    HB2  ALA  20           HB2      ALA  20  39.868  17.466  -5.621
  162    HB3  ALA  20           HB3      ALA  20  40.455  17.248  -7.287
  163    H    LEU  21           HN       LEU  21  39.164  13.646  -6.997
  164    HA   LEU  21           HA       LEU  21  39.535  12.156  -8.728
  165    HB2  LEU  21           HB2      LEU  21  37.108  12.876  -9.138
  166    HB3  LEU  21           HB1      LEU  21  37.746  13.959 -10.394
  167    HG   LEU  21           HG       LEU  21  38.983  11.746 -11.255
  168   HD11  LEU  21          HD11      LEU  21  36.593  10.642  -9.701
  169   HD12  LEU  21          HD12      LEU  21  38.307  10.286  -9.389
  170   HD13  LEU  21          HD13      LEU  21  37.543   9.729 -10.894
  171   HD21  LEU  21          HD21      LEU  21  35.996  12.267 -11.610
  172   HD22  LEU  21          HD22      LEU  21  36.982  11.230 -12.668
  173   HD23  LEU  21          HD23      LEU  21  37.317  12.976 -12.570
  174    H    ASP  22           HN       ASP  22  41.762  13.178  -8.654
  175    HA   ASP  22           HA       ASP  22  43.615  14.009  -9.778
  176    HB2  ASP  22           HB2      ASP  22  41.961  13.071 -12.154
  177    HB3  ASP  22           HB1      ASP  22  43.683  13.516 -12.231
  178    H    HIS  23           HN       HIS  23  41.896  16.014  -8.987
  179    HA   HIS  23           HA       HIS  23  41.287  18.209  -9.444
  180    HB2  HIS  23           HB2      HIS  23  43.558  18.095 -11.463
  181    HB3  HIS  23           HB1      HIS  23  42.938  19.527 -10.605
  182    HD1  HIS  23           HD1      HIS  23  42.651  18.014  -7.779
  183    HD2  HIS  23           HD2      HIS  23  46.086  18.078 -10.205
  184    HE1  HIS  23           HE1      HIS  23  44.664  17.591  -6.262
  185    H    LEU  24           HN       LEU  24  39.552  16.583 -10.671
  186    HA   LEU  24           HA       LEU  24  38.701  18.193 -12.927
  187    HB2  LEU  24           HB2      LEU  24  40.317  16.932 -14.192
  188    HB3  LEU  24           HB1      LEU  24  39.801  15.404 -13.445
  189    HG   LEU  24           HG       LEU  24  37.671  15.467 -14.598
  190   HD11  LEU  24          HD11      LEU  24  37.264  17.423 -16.254
  191   HD12  LEU  24          HD12      LEU  24  38.517  18.296 -15.338
  192   HD13  LEU  24          HD13      LEU  24  37.026  17.763 -14.525
  193   HD21  LEU  24          HD21      LEU  24  38.415  15.404 -16.940
  194   HD22  LEU  24          HD22      LEU  24  39.664  14.691 -15.891
  195   HD23  LEU  24          HD23      LEU  24  39.870  16.341 -16.525
  Start of MODEL   71
    1    H1   GLY   1           HT1      GLY   1  61.700   2.343  -0.408
    2    H2   GLY   1           HT2      GLY   1  60.158   2.799  -0.958
    3    H3   GLY   1           HT3      GLY   1  61.069   1.655  -1.823
    4    HA2  GLY   1           HA1      GLY   1  59.659   0.300  -0.751
    5    HA3  GLY   1           HA2      GLY   1  61.032   0.359   0.371
    6    H    LYS   2           HN       LYS   2  60.898   1.564   2.287
    7    HA   LYS   2           HA       LYS   2  58.332   1.552   3.530
    8    HB2  LYS   2           HB2      LYS   2  59.491   2.979   5.288
    9    HB3  LYS   2           HB1      LYS   2  60.305   1.446   4.893
   10    HG2  LYS   2           HG2      LYS   2  61.933   2.558   3.512
   11    HG3  LYS   2           HG1      LYS   2  61.015   4.082   3.543
   12    HD2  LYS   2           HD2      LYS   2  62.971   4.141   5.089
   13    HD3  LYS   2           HD1      LYS   2  61.427   4.322   5.954
   14    HE2  LYS   2           HE2      LYS   2  63.191   2.671   6.934
   15    HE3  LYS   2           HE1      LYS   2  61.509   2.111   6.809
   16    HZ1  LYS   2           HZ1      LYS   2  63.698   1.564   4.864
   17    HZ2  LYS   2           HZ2      LYS   2  62.084   1.068   4.683
   18    HZ3  LYS   2           HZ3      LYS   2  63.028   0.452   5.955
   19    H    GLY   3           HN       GLY   3  57.728   3.769   4.798
   20    HA2  GLY   3           HA1      GLY   3  57.740   6.325   3.990
   21    HA3  GLY   3           HA2      GLY   3  56.849   5.618   2.564
   22    H    ARG   4           HN       ARG   4  55.735   3.987   2.869
   23    HA   ARG   4           HA       ARG   4  54.034   5.718   2.809
   24    HB2  ARG   4           HB2      ARG   4  53.348   2.745   2.925
   25    HB3  ARG   4           HB1      ARG   4  52.202   4.002   2.393
   26    HG2  ARG   4           HG2      ARG   4  53.792   4.720   0.637
   27    HG3  ARG   4           HG1      ARG   4  54.955   3.484   1.175
   28    HD2  ARG   4           HD2      ARG   4  53.122   1.750   0.742
   29    HD3  ARG   4           HD1      ARG   4  52.209   3.048  -0.065
   30    HE   ARG   4           HE       ARG   4  53.669   2.812  -1.899
   31   HH11  ARG   4          HH11      ARG   4  54.471   0.401   0.208
   32   HH12  ARG   4          HH12      ARG   4  56.142   0.292  -0.234
   33   HH21  ARG   4          HH21      ARG   4  56.100   3.182  -2.149
   34   HH22  ARG   4          HH22      ARG   4  57.064   1.867  -1.567
   35    H    TRP   5           HN       TRP   5  55.036   4.301   5.469
   36    HA   TRP   5           HA       TRP   5  53.035   3.696   7.303
   37    HB2  TRP   5           HB2      TRP   5  55.531   3.912   7.744
   38    HB3  TRP   5           HB1      TRP   5  55.265   5.663   7.921
   39    HD1  TRP   5           HD1      TRP   5  54.714   6.434  10.280
   40    HE1  TRP   5           HE1      TRP   5  53.820   5.352  12.469
   41    HE3  TRP   5           HE3      TRP   5  53.806   1.710   8.531
   42    HZ2  TRP   5           HZ2      TRP   5  52.847   2.775  13.313
   43    HZ3  TRP   5           HZ3      TRP   5  52.896  -0.044  10.045
   44    HH2  TRP   5           HH2      TRP   5  52.415   0.482  12.431
   45    H    LEU   6           HN       LEU   6  53.663   6.762   5.771
   46    HA   LEU   6           HA       LEU   6  51.786   8.234   7.558
   47    HB2  LEU   6           HB2      LEU   6  53.651   9.033   5.298
   48    HB3  LEU   6           HB1      LEU   6  52.446  10.158   5.949
   49    HG   LEU   6           HG       LEU   6  54.776  10.353   6.943
   50   HD11  LEU   6          HD11      LEU   6  52.528  11.011   8.110
   51   HD12  LEU   6          HD12      LEU   6  53.996  10.895   9.102
   52   HD13  LEU   6          HD13      LEU   6  52.806   9.580   9.127
   53   HD21  LEU   6          HD21      LEU   6  54.078   7.777   8.409
   54   HD22  LEU   6          HD22      LEU   6  55.606   8.684   8.444
   55   HD23  LEU   6          HD23      LEU   6  55.117   7.822   6.966
   56    H    GLU   7           HN       GLU   7  52.021   6.816   4.295
   57    HA   GLU   7           HA       GLU   7  49.479   8.140   3.476
   58    HB2  GLU   7           HB2      GLU   7  51.500   7.669   1.943
   59    HB3  GLU   7           HB1      GLU   7  50.993   5.968   1.983
   60    HG2  GLU   7           HG2      GLU   7  48.813   6.535   1.048
   61    HG3  GLU   7           HG1      GLU   7  49.179   8.275   1.148
   62    H    ARG   8           HN       ARG   8  50.358   5.516   5.356
   63    HA   ARG   8           HA       ARG   8  48.490   3.525   4.441
   64    HB2  ARG   8           HB2      ARG   8  50.484   3.252   6.054
   65    HB3  ARG   8           HB1      ARG   8  49.416   3.912   7.309
   66    HG2  ARG   8           HG2      ARG   8  49.012   1.616   7.570
   67    HG3  ARG   8           HG1      ARG   8  47.720   2.042   6.429
   68    HD2  ARG   8           HD2      ARG   8  49.100   1.268   4.538
   69    HD3  ARG   8           HD1      ARG   8  50.453   0.926   5.643
   70    HE   ARG   8           HE       ARG   8  48.253  -0.835   5.147
   71   HH11  ARG   8          HH11      ARG   8  47.184  -0.644   7.678
   72   HH12  ARG   8          HH12      ARG   8  48.260  -1.484   8.745
   73   HH21  ARG   8          HH21      ARG   8  50.927  -1.426   6.531
   74   HH22  ARG   8          HH22      ARG   8  50.379  -1.927   8.095
   75    H    ILE   9           HN       ILE   9  48.180   6.454   6.310
   76    HA   ILE   9           HA       ILE   9  45.893   5.961   7.849
   77    HB   ILE   9           HB       ILE   9  45.337   8.385   7.530
   78   HG12  ILE   9          HG12      ILE   9  47.616   8.218   5.501
   79   HG13  ILE   9          HG11      ILE   9  45.910   8.578   5.144
   80   HG21  ILE   9          HG21      ILE   9  47.184   7.501   9.086
   81   HG22  ILE   9          HG22      ILE   9  47.307   9.212   8.620
   82   HG23  ILE   9          HG23      ILE   9  48.343   7.997   7.830
   83   HD11  ILE   9           HD1      ILE   9  47.939  10.291   6.618
   84   HD12  ILE   9           HD2      ILE   9  46.189  10.561   6.815
   85   HD13  ILE   9           HD3      ILE   9  46.939  10.713   5.210
   86    H    GLY  10           HN       GLY  10  46.178   6.406   4.357
   87    HA2  GLY  10           HA1      GLY  10  44.611   6.152   2.677
   88    HA3  GLY  10           HA2      GLY  10  43.700   5.134   3.811
   89    H    LYS  11           HN       LYS  11  44.468   8.591   3.232
   90    HA   LYS  11           HA       LYS  11  41.600   9.247   3.205
   91    HB2  LYS  11           HB2      LYS  11  42.273   9.141   5.676
   92    HB3  LYS  11           HB1      LYS  11  43.348  10.514   5.346
   93    HG2  LYS  11           HG2      LYS  11  41.405  11.625   6.060
   94    HG3  LYS  11           HG1      LYS  11  41.170  11.622   4.299
   95    HD2  LYS  11           HD2      LYS  11  39.671   9.699   4.449
   96    HD3  LYS  11           HD1      LYS  11  40.020   9.509   6.183
   97    HE2  LYS  11           HE2      LYS  11  37.875  10.671   5.878
   98    HE3  LYS  11           HE1      LYS  11  39.070  11.772   6.605
   99    HZ1  LYS  11           HZ1      LYS  11  39.386  12.032   3.881
  100    HZ2  LYS  11           HZ2      LYS  11  38.638  13.140   4.929
  101    HZ3  LYS  11           HZ3      LYS  11  37.707  11.980   4.109
  102    H    ALA  12           HN       ALA  12  42.248   9.874   1.072
  103    HA   ALA  12           HA       ALA  12  44.240  12.009   0.765
  104    HB1  ALA  12           HB1      ALA  12  42.250  10.715  -1.127
  105    HB2  ALA  12           HB2      ALA  12  43.996  10.388  -1.004
  106    HB3  ALA  12           HB3      ALA  12  43.424  11.959  -1.609
  107    H    GLY  13           HN       GLY  13  42.845  13.206   2.535
  108    HA2  GLY  13           HA1      GLY  13  41.373  14.933   3.029
  109    HA3  GLY  13           HA2      GLY  13  41.843  15.552   1.432
  110    H    PHE  14           HN       PHE  14  39.837  12.859   2.703
  111    HA   PHE  14           HA       PHE  14  37.699  12.185   2.132
  112    HB2  PHE  14           HB2      PHE  14  37.243  15.056   1.232
  113    HB3  PHE  14           HB1      PHE  14  36.021  13.872   1.750
  114    HD1  PHE  14           HD1      PHE  14  35.925  13.118   4.131
  115    HD2  PHE  14           HD2      PHE  14  38.565  16.282   2.851
  116    HE1  PHE  14           HE1      PHE  14  36.212  13.835   6.500
  117    HE2  PHE  14           HE2      PHE  14  38.854  17.000   5.220
  118    HZ   PHE  14           HZ       PHE  14  37.596  15.838   7.031
  119    H    ILE  15           HN       ILE  15  39.789  11.844   0.200
  120    HA   ILE  15           HA       ILE  15  40.027  11.250  -2.017
  121    HB   ILE  15           HB       ILE  15  36.993  11.402  -2.244
  122   HG12  ILE  15          HG12      ILE  15  38.757   9.181  -1.114
  123   HG13  ILE  15          HG11      ILE  15  37.558  10.136  -0.211
  124   HG21  ILE  15          HG21      ILE  15  37.275   9.752  -3.969
  125   HG22  ILE  15          HG22      ILE  15  38.984   9.498  -3.538
  126   HG23  ILE  15          HG23      ILE  15  38.470  11.025  -4.292
  127   HD11  ILE  15           HD1      ILE  15  37.088   8.042  -2.358
  128   HD12  ILE  15           HD2      ILE  15  35.844   9.263  -1.989
  129   HD13  ILE  15           HD3      ILE  15  36.394   8.138  -0.724
  130    H    ILE  16           HN       ILE  16  40.884  13.555  -2.026
  131    HA   ILE  16           HA       ILE  16  39.464  15.016  -4.220
  132    HB   ILE  16           HB       ILE  16  38.885  16.093  -1.988
  133   HG12  ILE  16          HG12      ILE  16  39.648  18.438  -2.740
  134   HG13  ILE  16          HG11      ILE  16  40.510  17.633  -4.067
  135   HG21  ILE  16          HG21      ILE  16  41.786  16.998  -1.944
  136   HG22  ILE  16          HG22      ILE  16  41.226  15.573  -1.033
  137   HG23  ILE  16          HG23      ILE  16  40.546  17.178  -0.682
  138   HD11  ILE  16           HD1      ILE  16  38.064  18.527  -4.475
  139   HD12  ILE  16           HD2      ILE  16  37.559  17.058  -3.613
  140   HD13  ILE  16           HD3      ILE  16  38.510  16.930  -5.111
  141    H    ILE  17           HN       ILE  17  42.420  14.841  -2.171
  142    HA   ILE  17           HA       ILE  17  44.033  15.997  -4.349
  143    HB   ILE  17           HB       ILE  17  44.702  16.456  -2.018
  144   HG12  ILE  17          HG12      ILE  17  47.060  15.825  -2.130
  145   HG13  ILE  17          HG11      ILE  17  46.707  14.520  -3.280
  146   HG21  ILE  17          HG21      ILE  17  45.361  14.716  -0.483
  147   HG22  ILE  17          HG22      ILE  17  45.239  13.471  -1.750
  148   HG23  ILE  17          HG23      ILE  17  43.770  14.261  -1.134
  149   HD11  ILE  17           HD1      ILE  17  46.275  16.025  -5.051
  150   HD12  ILE  17           HD2      ILE  17  47.616  16.817  -4.192
  151   HD13  ILE  17           HD3      ILE  17  45.946  17.384  -3.948
  152    H    GLY  18           HN       GLY  18  43.035  12.897  -3.129
  153    HA2  GLY  18           HA1      GLY  18  45.049  11.403  -4.702
  154    HA3  GLY  18           HA2      GLY  18  43.780  10.728  -3.658
  155    H    GLY  19           HN       GLY  19  41.449  11.549  -4.509
  156    HA2  GLY  19           HA1      GLY  19  41.054  10.116  -6.956
  157    HA3  GLY  19           HA2      GLY  19  39.874  11.182  -6.172
  158    H    ALA  20           HN       ALA  20  41.612  13.530  -6.238
  159    HA   ALA  20           HA       ALA  20  41.910  15.348  -7.643
  160    HB1  ALA  20           HB1      ALA  20  43.190  14.971  -9.646
  161    HB2  ALA  20           HB2      ALA  20  42.680  13.267  -9.712
  162    HB3  ALA  20           HB3      ALA  20  43.756  13.825  -8.409
  163    H    LEU  21           HN       LEU  21  39.333  13.572  -7.789
  164    HA   LEU  21           HA       LEU  21  38.301  13.926 -10.458
  165    HB2  LEU  21           HB2      LEU  21  36.661  13.818  -7.901
  166    HB3  LEU  21           HB1      LEU  21  36.176  13.317  -9.536
  167    HG   LEU  21           HG       LEU  21  38.380  12.013  -7.874
  168   HD11  LEU  21          HD11      LEU  21  36.060  11.637  -7.015
  169   HD12  LEU  21          HD12      LEU  21  36.805  10.146  -7.641
  170   HD13  LEU  21          HD13      LEU  21  35.594  11.015  -8.616
  171   HD21  LEU  21          HD21      LEU  21  37.239  11.495 -10.653
  172   HD22  LEU  21          HD22      LEU  21  38.056  10.212  -9.726
  173   HD23  LEU  21          HD23      LEU  21  38.942  11.688 -10.172
  174    H    ASP  22           HN       ASP  22  39.341  16.254  -8.436
  175    HA   ASP  22           HA       ASP  22  37.144  18.114  -8.397
  176    HB2  ASP  22           HB2      ASP  22  39.242  18.203  -6.972
  177    HB3  ASP  22           HB1      ASP  22  40.110  18.784  -8.412
  178    H    HIS  23           HN       HIS  23  39.459  17.167 -10.850
  179    HA   HIS  23           HA       HIS  23  38.026  18.683 -12.863
  180    HB2  HIS  23           HB2      HIS  23  39.335  20.519 -11.764
  181    HB3  HIS  23           HB1      HIS  23  40.831  19.660 -12.203
  182    HD1  HIS  23           HD1      HIS  23  37.615  20.367 -14.205
  183    HD2  HIS  23           HD2      HIS  23  41.760  21.030 -14.417
  184    HE1  HIS  23           HE1      HIS  23  38.100  21.440 -16.473
  185    H    LEU  24           HN       LEU  24  40.232  16.358 -11.786
  186    HA   LEU  24           HA       LEU  24  41.721  15.948 -14.226
  187    HB2  LEU  24           HB2      LEU  24  42.415  15.078 -11.990
  188    HB3  LEU  24           HB1      LEU  24  41.038  13.956 -12.025
  189    HG   LEU  24           HG       LEU  24  41.954  12.931 -14.120
  190   HD11  LEU  24          HD11      LEU  24  43.294  14.546 -15.196
  191   HD12  LEU  24          HD12      LEU  24  44.526  13.513 -14.443
  192   HD13  LEU  24          HD13      LEU  24  44.078  15.059 -13.682
  193   HD21  LEU  24          HD21      LEU  24  42.463  12.001 -11.874
  194   HD22  LEU  24          HD22      LEU  24  43.904  13.041 -11.774
  195   HD23  LEU  24          HD23      LEU  24  43.817  11.754 -13.001
  Start of MODEL   72
    1    H1   GLY   1           HT1      GLY   1  56.002  -0.079  11.490
    2    H2   GLY   1           HT2      GLY   1  54.530  -0.916  11.336
    3    H3   GLY   1           HT3      GLY   1  54.672   0.676  10.757
    4    HA2  GLY   1           HA1      GLY   1  56.593  -1.154   9.689
    5    HA3  GLY   1           HA2      GLY   1  54.907  -1.526   9.283
    6    H    LYS   2           HN       LYS   2  57.517  -0.148   8.040
    7    HA   LYS   2           HA       LYS   2  56.633   2.459   7.215
    8    HB2  LYS   2           HB2      LYS   2  58.378   2.232   5.457
    9    HB3  LYS   2           HB1      LYS   2  58.981   1.772   7.068
   10    HG2  LYS   2           HG2      LYS   2  58.430  -0.639   6.482
   11    HG3  LYS   2           HG1      LYS   2  58.104  -0.089   4.821
   12    HD2  LYS   2           HD2      LYS   2  60.400   0.808   4.652
   13    HD3  LYS   2           HD1      LYS   2  60.732   0.292   6.324
   14    HE2  LYS   2           HE2      LYS   2  61.593  -1.337   4.628
   15    HE3  LYS   2           HE1      LYS   2  60.377  -2.054   5.712
   16    HZ1  LYS   2           HZ1      LYS   2  59.427  -0.806   3.239
   17    HZ2  LYS   2           HZ2      LYS   2  58.843  -2.172   4.062
   18    HZ3  LYS   2           HZ3      LYS   2  60.237  -2.289   3.098
   19    H    GLY   3           HN       GLY   3  56.471   2.915   4.723
   20    HA2  GLY   3           HA1      GLY   3  55.487   1.579   2.646
   21    HA3  GLY   3           HA2      GLY   3  54.074   1.305   3.769
   22    H    ARG   4           HN       ARG   4  53.686   2.697   5.138
   23    HA   ARG   4           HA       ARG   4  51.992   3.194   3.474
   24    HB2  ARG   4           HB2      ARG   4  52.056   4.616   6.180
   25    HB3  ARG   4           HB1      ARG   4  50.601   4.463   5.162
   26    HG2  ARG   4           HG2      ARG   4  50.740   2.022   5.248
   27    HG3  ARG   4           HG1      ARG   4  52.276   2.109   6.144
   28    HD2  ARG   4           HD2      ARG   4  50.161   1.701   7.550
   29    HD3  ARG   4           HD1      ARG   4  51.217   3.035   8.077
   30    HE   ARG   4           HE       ARG   4  49.108   3.901   6.242
   31   HH11  ARG   4          HH11      ARG   4  49.947   5.795   8.230
   32   HH12  ARG   4          HH12      ARG   4  48.757   5.667   9.481
   33   HH21  ARG   4          HH21      ARG   4  47.567   2.593   8.403
   34   HH22  ARG   4          HH22      ARG   4  47.409   3.856   9.579
   35    H    TRP   5           HN       TRP   5  54.618   4.930   3.916
   36    HA   TRP   5           HA       TRP   5  54.256   7.678   3.783
   37    HB2  TRP   5           HB2      TRP   5  56.454   6.546   3.578
   38    HB3  TRP   5           HB1      TRP   5  56.052   6.090   1.905
   39    HD1  TRP   5           HD1      TRP   5  55.670   8.147   0.157
   40    HE1  TRP   5           HE1      TRP   5  56.750  10.510   0.049
   41    HE3  TRP   5           HE3      TRP   5  57.423   8.450   4.958
   42    HZ2  TRP   5           HZ2      TRP   5  58.178  12.266   1.828
   43    HZ3  TRP   5           HZ3      TRP   5  58.642  10.480   5.730
   44    HH2  TRP   5           HH2      TRP   5  59.020  12.387   4.172
   45    H    LEU   6           HN       LEU   6  53.069   5.346   1.528
   46    HA   LEU   6           HA       LEU   6  52.287   7.522  -0.402
   47    HB2  LEU   6           HB2      LEU   6  53.703   5.821  -1.434
   48    HB3  LEU   6           HB1      LEU   6  52.671   4.524  -0.797
   49    HG   LEU   6           HG       LEU   6  50.790   5.280  -2.192
   50   HD11  LEU   6          HD11      LEU   6  50.977   7.642  -2.337
   51   HD12  LEU   6          HD12      LEU   6  51.406   7.106  -3.976
   52   HD13  LEU   6          HD13      LEU   6  52.686   7.573  -2.830
   53   HD21  LEU   6          HD21      LEU   6  53.330   5.196  -3.873
   54   HD22  LEU   6          HD22      LEU   6  51.698   4.671  -4.351
   55   HD23  LEU   6          HD23      LEU   6  52.601   3.761  -3.115
   56    H    GLU   7           HN       GLU   7  51.191   5.057   1.857
   57    HA   GLU   7           HA       GLU   7  48.380   5.295   0.815
   58    HB2  GLU   7           HB2      GLU   7  49.521   3.442   2.943
   59    HB3  GLU   7           HB1      GLU   7  47.907   3.356   2.198
   60    HG2  GLU   7           HG2      GLU   7  49.013   3.029  -0.037
   61    HG3  GLU   7           HG1      GLU   7  50.588   2.976   0.792
   62    H    ARG   8           HN       ARG   8  50.205   7.170   2.608
   63    HA   ARG   8           HA       ARG   8  48.739   7.264   5.128
   64    HB2  ARG   8           HB2      ARG   8  51.105   8.044   4.832
   65    HB3  ARG   8           HB1      ARG   8  50.492   9.399   3.856
   66    HG2  ARG   8           HG2      ARG   8  49.174  10.229   5.733
   67    HG3  ARG   8           HG1      ARG   8  49.608   8.808   6.713
   68    HD2  ARG   8           HD2      ARG   8  52.041   9.492   6.466
   69    HD3  ARG   8           HD1      ARG   8  51.472  11.001   5.714
   70    HE   ARG   8           HE       ARG   8  50.079  10.786   8.148
   71   HH11  ARG   8          HH11      ARG   8  52.294  12.784   7.128
   72   HH12  ARG   8          HH12      ARG   8  53.346  12.760   8.504
   73   HH21  ARG   8          HH21      ARG   8  51.886   9.945   9.904
   74   HH22  ARG   8          HH22      ARG   8  53.116  11.152  10.075
   75    H    ILE   9           HN       ILE   9  49.127   9.907   2.741
   76    HA   ILE   9           HA       ILE   9  46.561  11.049   3.529
   77    HB   ILE   9           HB       ILE   9  48.536  12.417   2.771
   78   HG12  ILE   9          HG12      ILE   9  46.024  12.704   1.057
   79   HG13  ILE   9          HG11      ILE   9  46.189  13.285   2.729
   80   HG21  ILE   9          HG21      ILE   9  47.779  11.515  -0.037
   81   HG22  ILE   9          HG22      ILE   9  49.101  10.759   0.885
   82   HG23  ILE   9          HG23      ILE   9  49.182  12.486   0.467
   83   HD11  ILE   9           HD1      ILE   9  46.658  15.195   1.393
   84   HD12  ILE   9           HD2      ILE   9  47.635  14.257   0.241
   85   HD13  ILE   9           HD3      ILE   9  48.263  14.597   1.872
   86    H    GLY  10           HN       GLY  10  47.687   8.834   1.070
   87    HA2  GLY  10           HA1      GLY  10  45.772   9.169  -0.945
   88    HA3  GLY  10           HA2      GLY  10  46.500   7.615  -0.497
   89    H    LYS  11           HN       LYS  11  45.154   8.469   2.300
   90    HA   LYS  11           HA       LYS  11  42.855   6.707   1.900
   91    HB2  LYS  11           HB2      LYS  11  43.585   8.442   4.291
   92    HB3  LYS  11           HB1      LYS  11  42.437   7.084   4.273
   93    HG2  LYS  11           HG2      LYS  11  44.215   5.496   3.757
   94    HG3  LYS  11           HG1      LYS  11  45.386   6.814   3.538
   95    HD2  LYS  11           HD2      LYS  11  45.874   6.070   5.723
   96    HD3  LYS  11           HD1      LYS  11  44.792   7.444   6.030
   97    HE2  LYS  11           HE2      LYS  11  44.149   5.495   7.405
   98    HE3  LYS  11           HE1      LYS  11  42.871   5.867   6.228
   99    HZ1  LYS  11           HZ1      LYS  11  44.030   3.445   6.570
  100    HZ2  LYS  11           HZ2      LYS  11  44.880   4.055   5.231
  101    HZ3  LYS  11           HZ3      LYS  11  43.186   3.934   5.182
  102    H    ALA  12           HN       ALA  12  43.017   9.434   0.468
  103    HA   ALA  12           HA       ALA  12  41.532  11.130  -0.047
  104    HB1  ALA  12           HB1      ALA  12  40.046   9.038  -0.233
  105    HB2  ALA  12           HB2      ALA  12  39.218  10.597  -0.019
  106    HB3  ALA  12           HB3      ALA  12  39.403   9.490   1.363
  107    H    GLY  13           HN       GLY  13  43.079  11.363   2.282
  108    HA2  GLY  13           HA1      GLY  13  42.078  11.939   4.719
  109    HA3  GLY  13           HA2      GLY  13  43.209  13.042   3.913
  110    H    PHE  14           HN       PHE  14  39.869  12.356   4.708
  111    HA   PHE  14           HA       PHE  14  38.042  13.764   4.907
  112    HB2  PHE  14           HB2      PHE  14  39.805  15.325   5.962
  113    HB3  PHE  14           HB1      PHE  14  39.870  16.144   4.385
  114    HD1  PHE  14           HD1      PHE  14  37.537  15.115   7.138
  115    HD2  PHE  14           HD2      PHE  14  38.181  17.708   3.746
  116    HE1  PHE  14           HE1      PHE  14  35.477  16.391   7.721
  117    HE2  PHE  14           HE2      PHE  14  36.124  18.984   4.331
  118    HZ   PHE  14           HZ       PHE  14  34.733  18.281   6.276
  119    H    ILE  15           HN       ILE  15  38.231  12.501   2.629
  120    HA   ILE  15           HA       ILE  15  37.951  12.555   0.330
  121    HB   ILE  15           HB       ILE  15  35.883  13.982  -0.324
  122   HG12  ILE  15          HG12      ILE  15  35.811  14.394   2.703
  123   HG13  ILE  15          HG11      ILE  15  36.187  15.668   1.522
  124   HG21  ILE  15          HG21      ILE  15  35.862  11.548   0.395
  125   HG22  ILE  15          HG22      ILE  15  34.367  12.434   0.757
  126   HG23  ILE  15          HG23      ILE  15  35.541  12.106   2.053
  127   HD11  ILE  15           HD1      ILE  15  33.888  14.982   0.427
  128   HD12  ILE  15           HD2      ILE  15  33.883  15.982   1.897
  129   HD13  ILE  15           HD3      ILE  15  33.560  14.239   2.012
  130    H    ILE  16           HN       ILE  16  39.981  13.344  -0.247
  131    HA   ILE  16           HA       ILE  16  39.796  16.063  -1.533
  132    HB   ILE  16           HB       ILE  16  42.306  14.955  -0.211
  133   HG12  ILE  16          HG12      ILE  16  40.393  15.641   1.403
  134   HG13  ILE  16          HG11      ILE  16  41.986  16.365   1.664
  135   HG21  ILE  16          HG21      ILE  16  42.831  16.439  -2.033
  136   HG22  ILE  16          HG22      ILE  16  43.049  17.374  -0.536
  137   HG23  ILE  16          HG23      ILE  16  41.590  17.607  -1.529
  138   HD11  ILE  16           HD1      ILE  16  39.789  17.738   0.053
  139   HD12  ILE  16           HD2      ILE  16  41.297  18.451   0.670
  140   HD13  ILE  16           HD3      ILE  16  40.011  17.974   1.800
  141    H    ILE  17           HN       ILE  17  41.946  13.181  -1.246
  142    HA   ILE  17           HA       ILE  17  42.754  13.375  -4.033
  143    HB   ILE  17           HB       ILE  17  43.005  11.167  -1.936
  144   HG12  ILE  17          HG12      ILE  17  45.403  11.730  -2.091
  145   HG13  ILE  17          HG11      ILE  17  45.057  12.920  -3.367
  146   HG21  ILE  17          HG21      ILE  17  42.867   9.937  -3.992
  147   HG22  ILE  17          HG22      ILE  17  44.608  10.114  -3.668
  148   HG23  ILE  17          HG23      ILE  17  43.815  11.158  -4.873
  149   HD11  ILE  17           HD1      ILE  17  45.323  13.791  -0.927
  150   HD12  ILE  17           HD2      ILE  17  43.706  13.101  -0.652
  151   HD13  ILE  17           HD3      ILE  17  43.939  14.377  -1.872
  152    H    GLY  18           HN       GLY  18  40.659  11.091  -2.219
  153    HA2  GLY  18           HA1      GLY  18  39.611   9.904  -4.658
  154    HA3  GLY  18           HA2      GLY  18  39.014   9.649  -3.004
  155    H    GLY  19           HN       GLY  19  38.586  12.405  -2.358
  156    HA2  GLY  19           HA1      GLY  19  35.920  12.709  -3.339
  157    HA3  GLY  19           HA2      GLY  19  36.861  13.936  -2.469
  158    H    ALA  20           HN       ALA  20  38.924  14.537  -4.096
  159    HA   ALA  20           HA       ALA  20  37.787  16.319  -5.967
  160    HB1  ALA  20           HB1      ALA  20  40.071  16.558  -5.180
  161    HB2  ALA  20           HB2      ALA  20  40.077  16.416  -6.955
  162    HB3  ALA  20           HB3      ALA  20  40.533  15.021  -5.948
  163    H    LEU  21           HN       LEU  21  39.705  13.419  -6.870
  164    HA   LEU  21           HA       LEU  21  39.589  12.114  -8.786
  165    HB2  LEU  21           HB2      LEU  21  37.520  11.432  -7.453
  166    HB3  LEU  21           HB1      LEU  21  36.588  12.501  -8.521
  167    HG   LEU  21           HG       LEU  21  37.744  11.146 -10.480
  168   HD11  LEU  21          HD11      LEU  21  38.075   9.259  -8.100
  169   HD12  LEU  21          HD12      LEU  21  39.348   9.846  -9.196
  170   HD13  LEU  21          HD13      LEU  21  38.105   8.728  -9.795
  171   HD21  LEU  21          HD21      LEU  21  35.916   9.470 -10.401
  172   HD22  LEU  21          HD22      LEU  21  35.324  11.090  -9.961
  173   HD23  LEU  21          HD23      LEU  21  35.619   9.874  -8.694
  174    H    ASP  22           HN       ASP  22  40.521  13.394 -10.350
  175    HA   ASP  22           HA       ASP  22  38.756  14.243 -12.490
  176    HB2  ASP  22           HB2      ASP  22  38.503  16.169 -10.902
  177    HB3  ASP  22           HB1      ASP  22  40.256  16.449 -11.024
  178    H    HIS  23           HN       HIS  23  41.919  14.173 -10.934
  179    HA   HIS  23           HA       HIS  23  43.196  13.268 -13.360
  180    HB2  HIS  23           HB2      HIS  23  42.960  15.663 -13.970
  181    HB3  HIS  23           HB1      HIS  23  43.843  16.114 -12.493
  182    HD1  HIS  23           HD1      HIS  23  44.465  13.519 -15.279
  183    HD2  HIS  23           HD2      HIS  23  46.492  16.502 -13.119
  184    HE1  HIS  23           HE1      HIS  23  46.865  13.592 -16.151
  185    H    LEU  24           HN       LEU  24  43.109  14.192 -10.055
  186    HA   LEU  24           HA       LEU  24  45.913  13.851  -9.434
  187    HB2  LEU  24           HB2      LEU  24  43.349  13.762  -7.808
  188    HB3  LEU  24           HB1      LEU  24  44.929  13.423  -7.065
  189    HG   LEU  24           HG       LEU  24  45.769  15.622  -7.754
  190   HD11  LEU  24          HD11      LEU  24  43.073  15.796  -9.155
  191   HD12  LEU  24          HD12      LEU  24  44.698  16.058  -9.834
  192   HD13  LEU  24          HD13      LEU  24  43.996  17.256  -8.724
  193   HD21  LEU  24          HD21      LEU  24  44.276  17.035  -6.362
  194   HD22  LEU  24          HD22      LEU  24  44.532  15.440  -5.613
  195   HD23  LEU  24          HD23      LEU  24  43.007  15.791  -6.462
  Start of MODEL   73
    1    H1   GLY   1           HT1      GLY   1  61.056   4.678  -1.710
    2    H2   GLY   1           HT2      GLY   1  59.416   5.127  -1.703
    3    H3   GLY   1           HT3      GLY   1  59.853   3.484  -1.658
    4    HA2  GLY   1           HA1      GLY   1  61.005   3.945   0.468
    5    HA3  GLY   1           HA2      GLY   1  60.200   5.526   0.427
    6    H    LYS   2           HN       LYS   2  59.919   2.166   1.125
    7    HA   LYS   2           HA       LYS   2  57.088   1.850   1.050
    8    HB2  LYS   2           HB2      LYS   2  57.512   0.073   2.806
    9    HB3  LYS   2           HB1      LYS   2  58.503  -0.078   1.335
   10    HG2  LYS   2           HG2      LYS   2  60.401   0.989   2.449
   11    HG3  LYS   2           HG1      LYS   2  59.417   1.297   3.901
   12    HD2  LYS   2           HD2      LYS   2  59.162  -1.098   4.297
   13    HD3  LYS   2           HD1      LYS   2  59.999  -1.476   2.772
   14    HE2  LYS   2           HE2      LYS   2  61.569  -1.715   4.638
   15    HE3  LYS   2           HE1      LYS   2  62.039  -0.314   3.647
   16    HZ1  LYS   2           HZ1      LYS   2  60.163   0.315   5.746
   17    HZ2  LYS   2           HZ2      LYS   2  61.614   1.088   5.315
   18    HZ3  LYS   2           HZ3      LYS   2  61.642  -0.277   6.327
   19    H    GLY   3           HN       GLY   3  55.937   1.282   3.294
   20    HA2  GLY   3           HA1      GLY   3  55.602   2.117   5.626
   21    HA3  GLY   3           HA2      GLY   3  56.277   3.734   5.123
   22    H    ARG   4           HN       ARG   4  55.830   4.454   3.343
   23    HA   ARG   4           HA       ARG   4  54.283   5.700   4.729
   24    HB2  ARG   4           HB2      ARG   4  54.607   6.295   1.749
   25    HB3  ARG   4           HB1      ARG   4  53.969   7.457   2.937
   26    HG2  ARG   4           HG2      ARG   4  56.039   7.362   4.225
   27    HG3  ARG   4           HG1      ARG   4  56.675   6.071   3.177
   28    HD2  ARG   4           HD2      ARG   4  57.476   8.492   2.702
   29    HD3  ARG   4           HD1      ARG   4  56.900   7.535   1.316
   30    HE   ARG   4           HE       ARG   4  54.756   9.079   2.531
   31   HH11  ARG   4          HH11      ARG   4  55.003   8.645  -0.399
   32   HH12  ARG   4          HH12      ARG   4  55.505  10.202  -0.969
   33   HH21  ARG   4          HH21      ARG   4  56.477  11.329   2.163
   34   HH22  ARG   4          HH22      ARG   4  56.339  11.720   0.482
   35    H    TRP   5           HN       TRP   5  53.439   3.279   2.840
   36    HA   TRP   5           HA       TRP   5  51.029   3.636   1.497
   37    HB2  TRP   5           HB2      TRP   5  51.619   1.390   3.464
   38    HB3  TRP   5           HB1      TRP   5  50.426   1.337   2.144
   39    HD1  TRP   5           HD1      TRP   5  53.893   0.444   2.867
   40    HE1  TRP   5           HE1      TRP   5  55.267   0.019   0.700
   41    HE3  TRP   5           HE3      TRP   5  50.669   2.485  -0.549
   42    HZ2  TRP   5           HZ2      TRP   5  54.977   0.512  -2.120
   43    HZ3  TRP   5           HZ3      TRP   5  51.240   2.497  -2.973
   44    HH2  TRP   5           HH2      TRP   5  53.388   1.513  -3.761
   45    H    LEU   6           HN       LEU   6  51.619   4.162   4.855
   46    HA   LEU   6           HA       LEU   6  48.663   4.387   5.406
   47    HB2  LEU   6           HB2      LEU   6  50.876   4.162   7.475
   48    HB3  LEU   6           HB1      LEU   6  49.127   3.930   7.696
   49    HG   LEU   6           HG       LEU   6  50.960   2.154   6.020
   50   HD11  LEU   6          HD11      LEU   6  51.325   1.910   8.446
   51   HD12  LEU   6          HD12      LEU   6  50.492   0.477   7.797
   52   HD13  LEU   6          HD13      LEU   6  49.575   1.705   8.701
   53   HD21  LEU   6          HD21      LEU   6  48.840   0.664   6.096
   54   HD22  LEU   6          HD22      LEU   6  48.789   2.074   5.016
   55   HD23  LEU   6          HD23      LEU   6  47.967   2.132   6.594
   56    H    GLU   7           HN       GLU   7  51.704   6.114   5.102
   57    HA   GLU   7           HA       GLU   7  51.346   8.248   6.882
   58    HB2  GLU   7           HB2      GLU   7  53.260   7.838   5.221
   59    HB3  GLU   7           HB1      GLU   7  52.236   8.635   4.003
   60    HG2  GLU   7           HG2      GLU   7  52.089  10.651   5.434
   61    HG3  GLU   7           HG1      GLU   7  53.102   9.855   6.664
   62    H    ARG   8           HN       ARG   8  49.403   7.366   4.159
   63    HA   ARG   8           HA       ARG   8  48.323   9.876   3.405
   64    HB2  ARG   8           HB2      ARG   8  46.717   7.303   3.592
   65    HB3  ARG   8           HB1      ARG   8  46.506   8.651   2.451
   66    HG2  ARG   8           HG2      ARG   8  48.851   6.704   2.573
   67    HG3  ARG   8           HG1      ARG   8  47.627   6.824   1.291
   68    HD2  ARG   8           HD2      ARG   8  48.431   9.286   1.022
   69    HD3  ARG   8           HD1      ARG   8  49.850   8.778   1.972
   70    HE   ARG   8           HE       ARG   8  49.382   6.935  -0.201
   71   HH11  ARG   8          HH11      ARG   8  51.757   8.791   0.964
   72   HH12  ARG   8          HH12      ARG   8  52.299   9.457  -0.540
   73   HH21  ARG   8          HH21      ARG   8  49.542   8.350  -2.328
   74   HH22  ARG   8          HH22      ARG   8  51.046   9.207  -2.405
   75    H    ILE   9           HN       ILE   9  46.598  11.112   4.075
   76    HA   ILE   9           HA       ILE   9  46.081  11.107   6.917
   77    HB   ILE   9           HB       ILE   9  46.016  13.167   5.509
   78   HG12  ILE   9          HG12      ILE   9  43.322  12.553   6.818
   79   HG13  ILE   9          HG11      ILE   9  44.796  12.967   7.719
   80   HG21  ILE   9          HG21      ILE   9  43.336  12.131   4.497
   81   HG22  ILE   9          HG22      ILE   9  44.847  11.957   3.572
   82   HG23  ILE   9          HG23      ILE   9  44.226  13.577   3.963
   83   HD11  ILE   9           HD1      ILE   9  43.228  14.705   5.780
   84   HD12  ILE   9           HD2      ILE   9  44.898  15.098   6.258
   85   HD13  ILE   9           HD3      ILE   9  43.613  15.024   7.486
   86    H    GLY  10           HN       GLY  10  44.312   9.949   4.061
   87    HA2  GLY  10           HA1      GLY  10  42.656   8.304   3.995
   88    HA3  GLY  10           HA2      GLY  10  42.695   8.195   5.765
   89    H    LYS  11           HN       LYS  11  42.298  11.083   6.152
   90    HA   LYS  11           HA       LYS  11  39.374  11.041   6.026
   91    HB2  LYS  11           HB2      LYS  11  40.976  12.092   7.833
   92    HB3  LYS  11           HB1      LYS  11  41.028  13.490   6.733
   93    HG2  LYS  11           HG2      LYS  11  38.442  13.384   6.746
   94    HG3  LYS  11           HG1      LYS  11  38.606  12.275   8.125
   95    HD2  LYS  11           HD2      LYS  11  39.797  15.083   7.991
   96    HD3  LYS  11           HD1      LYS  11  38.293  14.656   8.838
   97    HE2  LYS  11           HE2      LYS  11  39.915  14.594  10.559
   98    HE3  LYS  11           HE1      LYS  11  39.774  12.883  10.090
   99    HZ1  LYS  11           HZ1      LYS  11  41.877  12.873   9.420
  100    HZ2  LYS  11           HZ2      LYS  11  42.062  14.415  10.111
  101    HZ3  LYS  11           HZ3      LYS  11  41.672  14.259   8.465
  102    H    ALA  12           HN       ALA  12  41.033  11.088   3.475
  103    HA   ALA  12           HA       ALA  12  41.033  12.199   1.438
  104    HB1  ALA  12           HB1      ALA  12  38.853  12.997   0.697
  105    HB2  ALA  12           HB2      ALA  12  38.280  13.066   2.382
  106    HB3  ALA  12           HB3      ALA  12  38.658  11.496   1.633
  107    H    GLY  13           HN       GLY  13  42.695  13.596   2.652
  108    HA2  GLY  13           HA1      GLY  13  42.320  16.064   3.762
  109    HA3  GLY  13           HA2      GLY  13  43.626  15.733   2.610
  110    H    PHE  14           HN       PHE  14  40.366  16.993   3.037
  111    HA   PHE  14           HA       PHE  14  39.174  18.542   1.805
  112    HB2  PHE  14           HB2      PHE  14  41.715  19.157   0.259
  113    HB3  PHE  14           HB1      PHE  14  40.340  20.232   0.607
  114    HD1  PHE  14           HD1      PHE  14  39.899  20.975   2.978
  115    HD2  PHE  14           HD2      PHE  14  43.491  18.859   1.859
  116    HE1  PHE  14           HE1      PHE  14  40.993  21.715   5.090
  117    HE2  PHE  14           HE2      PHE  14  44.585  19.600   3.971
  118    HZ   PHE  14           HZ       PHE  14  43.354  21.074   5.559
  119    H    ILE  15           HN       ILE  15  38.721  16.050   0.996
  120    HA   ILE  15           HA       ILE  15  37.888  14.837  -0.774
  121    HB   ILE  15           HB       ILE  15  38.140  17.346  -2.479
  122   HG12  ILE  15          HG12      ILE  15  35.981  16.556  -0.468
  123   HG13  ILE  15          HG11      ILE  15  37.062  17.963  -0.357
  124   HG21  ILE  15          HG21      ILE  15  37.496  15.100  -3.504
  125   HG22  ILE  15          HG22      ILE  15  36.309  16.403  -3.719
  126   HG23  ILE  15          HG23      ILE  15  36.038  15.145  -2.487
  127   HD11  ILE  15           HD1      ILE  15  35.066  18.880  -1.236
  128   HD12  ILE  15           HD2      ILE  15  34.773  17.477  -2.289
  129   HD13  ILE  15           HD3      ILE  15  36.068  18.635  -2.687
  130    H    ILE  16           HN       ILE  16  39.961  13.691  -0.658
  131    HA   ILE  16           HA       ILE  16  41.381  13.903  -3.299
  132    HB   ILE  16           HB       ILE  16  42.701  13.491  -0.576
  133   HG12  ILE  16          HG12      ILE  16  42.062  15.899  -1.369
  134   HG13  ILE  16          HG11      ILE  16  43.721  15.611  -0.821
  135   HG21  ILE  16          HG21      ILE  16  44.832  13.500  -1.987
  136   HG22  ILE  16          HG22      ILE  16  43.784  13.301  -3.414
  137   HG23  ILE  16          HG23      ILE  16  43.809  12.058  -2.146
  138   HD11  ILE  16           HD1      ILE  16  43.478  16.974  -2.972
  139   HD12  ILE  16           HD2      ILE  16  42.924  15.486  -3.765
  140   HD13  ILE  16           HD3      ILE  16  44.559  15.570  -3.075
  141    H    ILE  17           HN       ILE  17  41.399  11.907  -0.304
  142    HA   ILE  17           HA       ILE  17  41.527   9.447  -1.918
  143    HB   ILE  17           HB       ILE  17  41.057   9.852   1.073
  144   HG12  ILE  17          HG12      ILE  17  43.250  10.707   0.420
  145   HG13  ILE  17          HG11      ILE  17  43.462   9.172   1.284
  146   HG21  ILE  17          HG21      ILE  17  42.017   7.340   0.952
  147   HG22  ILE  17          HG22      ILE  17  41.296   7.393  -0.675
  148   HG23  ILE  17          HG23      ILE  17  40.284   7.679   0.756
  149   HD11  ILE  17           HD1      ILE  17  43.446   8.107  -1.135
  150   HD12  ILE  17           HD2      ILE  17  44.911   8.925  -0.560
  151   HD13  ILE  17           HD3      ILE  17  43.808   9.761  -1.672
  152    H    GLY  18           HN       GLY  18  39.146  11.391  -0.202
  153    HA2  GLY  18           HA1      GLY  18  37.028   9.428  -0.314
  154    HA3  GLY  18           HA2      GLY  18  36.840  11.178  -0.060
  155    H    GLY  19           HN       GLY  19  37.766  12.365  -2.249
  156    HA2  GLY  19           HA1      GLY  19  35.723  11.713  -4.221
  157    HA3  GLY  19           HA2      GLY  19  36.961  12.976  -4.348
  158    H    ALA  20           HN       ALA  20  39.320  11.576  -4.159
  159    HA   ALA  20           HA       ALA  20  40.785  10.519  -5.627
  160    HB1  ALA  20           HB1      ALA  20  38.539   8.476  -5.553
  161    HB2  ALA  20           HB2      ALA  20  39.917   8.583  -4.431
  162    HB3  ALA  20           HB3      ALA  20  40.189   8.163  -6.140
  163    H    LEU  21           HN       LEU  21  38.727  12.341  -6.815
  164    HA   LEU  21           HA       LEU  21  37.798  11.240  -9.288
  165    HB2  LEU  21           HB2      LEU  21  36.847  13.294  -8.461
  166    HB3  LEU  21           HB1      LEU  21  38.436  14.084  -8.414
  167    HG   LEU  21           HG       LEU  21  38.580  14.115 -10.834
  168   HD11  LEU  21          HD11      LEU  21  36.134  12.310 -10.681
  169   HD12  LEU  21          HD12      LEU  21  37.680  12.010 -11.510
  170   HD13  LEU  21          HD13      LEU  21  36.542  13.210 -12.162
  171   HD21  LEU  21          HD21      LEU  21  36.718  15.567 -11.368
  172   HD22  LEU  21          HD22      LEU  21  37.118  15.823  -9.652
  173   HD23  LEU  21          HD23      LEU  21  35.710  14.830 -10.100
  174    H    ASP  22           HN       ASP  22  39.326  10.085 -10.408
  175    HA   ASP  22           HA       ASP  22  41.164   9.738 -11.781
  176    HB2  ASP  22           HB2      ASP  22  41.022  12.749 -12.199
  177    HB3  ASP  22           HB1      ASP  22  41.789  11.558 -13.276
  178    H    HIS  23           HN       HIS  23  41.806   9.835  -9.120
  179    HA   HIS  23           HA       HIS  23  43.499  10.363  -7.600
  180    HB2  HIS  23           HB2      HIS  23  45.754   9.907  -8.485
  181    HB3  HIS  23           HB1      HIS  23  44.573   8.724  -9.094
  182    HD1  HIS  23           HD1      HIS  23  43.817   8.922 -11.602
  183    HD2  HIS  23           HD2      HIS  23  46.929  11.513 -10.471
  184    HE1  HIS  23           HE1      HIS  23  44.810   9.901 -13.743
  185    H    LEU  24           HN       LEU  24  42.296  12.689  -8.103
  186    HA   LEU  24           HA       LEU  24  44.464  14.589  -7.743
  187    HB2  LEU  24           HB2      LEU  24  44.180  14.178 -10.340
  188    HB3  LEU  24           HB1      LEU  24  42.737  15.199 -10.165
  189    HG   LEU  24           HG       LEU  24  45.595  15.951  -9.388
  190   HD11  LEU  24          HD11      LEU  24  43.762  17.125 -11.520
  191   HD12  LEU  24          HD12      LEU  24  44.998  15.890 -11.854
  192   HD13  LEU  24          HD13      LEU  24  45.481  17.493 -11.251
  193   HD21  LEU  24          HD21      LEU  24  42.915  17.352  -9.029
  194   HD22  LEU  24          HD22      LEU  24  44.435  18.273  -9.129
  195   HD23  LEU  24          HD23      LEU  24  44.202  17.087  -7.827
  Start of MODEL   74
    1    H1   GLY   1           HT1      GLY   1  57.398  -2.174   2.465
    2    H2   GLY   1           HT2      GLY   1  56.402  -1.484   3.656
    3    H3   GLY   1           HT3      GLY   1  57.631  -2.573   4.096
    4    HA2  GLY   1           HA1      GLY   1  58.704  -0.713   4.588
    5    HA3  GLY   1           HA2      GLY   1  59.109  -0.837   2.866
    6    H    LYS   2           HN       LYS   2  57.380   0.146   1.364
    7    HA   LYS   2           HA       LYS   2  57.035   2.937   2.248
    8    HB2  LYS   2           HB2      LYS   2  56.028   1.752  -0.360
    9    HB3  LYS   2           HB1      LYS   2  56.567   3.415  -0.021
   10    HG2  LYS   2           HG2      LYS   2  58.314   0.914  -0.106
   11    HG3  LYS   2           HG1      LYS   2  58.301   2.245  -1.287
   12    HD2  LYS   2           HD2      LYS   2  58.900   3.799   0.677
   13    HD3  LYS   2           HD1      LYS   2  59.227   2.320   1.612
   14    HE2  LYS   2           HE2      LYS   2  61.325   3.045   0.647
   15    HE3  LYS   2           HE1      LYS   2  60.798   1.598  -0.244
   16    HZ1  LYS   2           HZ1      LYS   2  59.624   3.714  -1.546
   17    HZ2  LYS   2           HZ2      LYS   2  60.977   2.828  -2.068
   18    HZ3  LYS   2           HZ3      LYS   2  61.187   4.265  -1.187
   19    H    GLY   3           HN       GLY   3  55.507   1.131   3.810
   20    HA2  GLY   3           HA1      GLY   3  52.843   0.617   3.157
   21    HA3  GLY   3           HA2      GLY   3  53.288   1.342   4.769
   22    H    ARG   4           HN       ARG   4  54.177   3.102   4.821
   23    HA   ARG   4           HA       ARG   4  51.892   3.738   5.333
   24    HB2  ARG   4           HB2      ARG   4  54.169   5.777   5.462
   25    HB3  ARG   4           HB1      ARG   4  52.638   5.908   6.366
   26    HG2  ARG   4           HG2      ARG   4  53.133   3.596   7.327
   27    HG3  ARG   4           HG1      ARG   4  54.752   3.723   6.599
   28    HD2  ARG   4           HD2      ARG   4  55.076   5.888   7.849
   29    HD3  ARG   4           HD1      ARG   4  53.524   5.593   8.669
   30    HE   ARG   4           HE       ARG   4  55.303   3.317   8.931
   31   HH11  ARG   4          HH11      ARG   4  56.589   3.165  10.808
   32   HH12  ARG   4          HH12      ARG   4  56.412   4.366  12.043
   33   HH21  ARG   4          HH21      ARG   4  54.214   6.317  10.203
   34   HH22  ARG   4          HH22      ARG   4  55.068   6.150  11.700
   35    H    TRP   5           HN       TRP   5  53.296   4.236   2.521
   36    HA   TRP   5           HA       TRP   5  52.732   6.694   1.355
   37    HB2  TRP   5           HB2      TRP   5  53.692   4.785   0.123
   38    HB3  TRP   5           HB1      TRP   5  52.107   3.973   0.141
   39    HD1  TRP   5           HD1      TRP   5  53.190   7.598  -0.779
   40    HE1  TRP   5           HE1      TRP   5  52.137   8.228  -3.071
   41    HE3  TRP   5           HE3      TRP   5  50.793   3.191  -1.805
   42    HZ2  TRP   5           HZ2      TRP   5  50.483   6.964  -5.059
   43    HZ3  TRP   5           HZ3      TRP   5  49.484   2.925  -3.907
   44    HH2  TRP   5           HH2      TRP   5  49.327   4.806  -5.533
   45    H    LEU   6           HN       LEU   6  50.464   4.477   2.706
   46    HA   LEU   6           HA       LEU   6  48.142   5.968   1.499
   47    HB2  LEU   6           HB2      LEU   6  48.036   3.332   3.010
   48    HB3  LEU   6           HB1      LEU   6  46.809   4.044   1.936
   49    HG   LEU   6           HG       LEU   6  49.569   3.056   1.079
   50   HD11  LEU   6          HD11      LEU   6  46.782   1.935   0.548
   51   HD12  LEU   6          HD12      LEU   6  47.953   1.258   1.706
   52   HD13  LEU   6          HD13      LEU   6  48.321   1.258  -0.036
   53   HD21  LEU   6          HD21      LEU   6  48.464   3.360  -1.244
   54   HD22  LEU   6          HD22      LEU   6  48.961   4.842  -0.396
   55   HD23  LEU   6          HD23      LEU   6  47.248   4.356  -0.408
   56    H    GLU   7           HN       GLU   7  49.901   5.186   4.462
   57    HA   GLU   7           HA       GLU   7  47.690   6.273   6.152
   58    HB2  GLU   7           HB2      GLU   7  50.413   5.092   6.827
   59    HB3  GLU   7           HB1      GLU   7  49.224   5.660   8.024
   60    HG2  GLU   7           HG2      GLU   7  47.583   4.029   7.238
   61    HG3  GLU   7           HG1      GLU   7  48.666   3.522   5.920
   62    H    ARG   8           HN       ARG   8  49.248   7.913   4.166
   63    HA   ARG   8           HA       ARG   8  51.118   9.575   5.558
   64    HB2  ARG   8           HB2      ARG   8  49.279  10.431   3.292
   65    HB3  ARG   8           HB1      ARG   8  50.876  11.098   3.711
   66    HG2  ARG   8           HG2      ARG   8  51.898   8.863   3.228
   67    HG3  ARG   8           HG1      ARG   8  50.300   8.275   2.710
   68    HD2  ARG   8           HD2      ARG   8  51.849  10.595   1.477
   69    HD3  ARG   8           HD1      ARG   8  51.607   8.988   0.751
   70    HE   ARG   8           HE       ARG   8  49.042  10.072   1.344
   71   HH11  ARG   8          HH11      ARG   8  49.233  12.540   0.365
   72   HH12  ARG   8          HH12      ARG   8  49.448  12.449  -1.352
   73   HH21  ARG   8          HH21      ARG   8  50.419   9.120  -1.321
   74   HH22  ARG   8          HH22      ARG   8  50.119  10.513  -2.306
   75    H    ILE   9           HN       ILE   9  49.699  12.125   4.705
   76    HA   ILE   9           HA       ILE   9  48.854  13.018   7.225
   77    HB   ILE   9           HB       ILE   9  47.566  14.801   5.965
   78   HG12  ILE   9          HG12      ILE   9  48.535  13.216   3.539
   79   HG13  ILE   9          HG11      ILE   9  46.846  13.310   4.087
   80   HG21  ILE   9          HG21      ILE   9  50.093  14.837   6.415
   81   HG22  ILE   9          HG22      ILE   9  49.536  15.843   5.059
   82   HG23  ILE   9          HG23      ILE   9  50.307  14.269   4.742
   83   HD11  ILE   9           HD1      ILE   9  47.148  15.899   3.900
   84   HD12  ILE   9           HD2      ILE   9  46.980  14.965   2.395
   85   HD13  ILE   9           HD3      ILE   9  48.587  15.510   2.926
   86    H    GLY  10           HN       GLY  10  47.164  11.034   4.910
   87    HA2  GLY  10           HA1      GLY  10  45.005  10.187   4.892
   88    HA3  GLY  10           HA2      GLY  10  45.227  10.082   6.650
   89    H    LYS  11           HN       LYS  11  45.416  13.239   5.275
   90    HA   LYS  11           HA       LYS  11  42.534  13.788   5.953
   91    HB2  LYS  11           HB2      LYS  11  45.008  15.280   6.911
   92    HB3  LYS  11           HB1      LYS  11  43.374  15.978   6.964
   93    HG2  LYS  11           HG2      LYS  11  43.867  13.238   8.190
   94    HG3  LYS  11           HG1      LYS  11  44.347  14.694   9.086
   95    HD2  LYS  11           HD2      LYS  11  42.014  15.577   8.852
   96    HD3  LYS  11           HD1      LYS  11  41.545  14.059   8.052
   97    HE2  LYS  11           HE2      LYS  11  40.966  13.885  10.406
   98    HE3  LYS  11           HE1      LYS  11  42.351  12.811  10.091
   99    HZ1  LYS  11           HZ1      LYS  11  42.235  14.735  12.011
  100    HZ2  LYS  11           HZ2      LYS  11  43.126  15.495  10.779
  101    HZ3  LYS  11           HZ3      LYS  11  43.653  14.014  11.422
  102    H    ALA  12           HN       ALA  12  43.467  13.339   3.375
  103    HA   ALA  12           HA       ALA  12  44.149  15.917   2.134
  104    HB1  ALA  12           HB1      ALA  12  44.116  14.701   0.071
  105    HB2  ALA  12           HB2      ALA  12  43.165  13.379   0.790
  106    HB3  ALA  12           HB3      ALA  12  44.857  13.632   1.285
  107    H    GLY  13           HN       GLY  13  42.000  16.469   3.613
  108    HA2  GLY  13           HA1      GLY  13  39.930  17.490   3.414
  109    HA3  GLY  13           HA2      GLY  13  40.073  17.335   1.649
  110    H    PHE  14           HN       PHE  14  40.327  14.609   3.850
  111    HA   PHE  14           HA       PHE  14  38.940  12.797   4.219
  112    HB2  PHE  14           HB2      PHE  14  36.592  14.243   2.952
  113    HB3  PHE  14           HB1      PHE  14  36.602  13.057   4.276
  114    HD1  PHE  14           HD1      PHE  14  38.226  13.807   6.334
  115    HD2  PHE  14           HD2      PHE  14  36.230  16.488   3.598
  116    HE1  PHE  14           HE1      PHE  14  38.375  15.639   8.015
  117    HE2  PHE  14           HE2      PHE  14  36.381  18.316   5.282
  118    HZ   PHE  14           HZ       PHE  14  37.459  17.894   7.487
  119    H    ILE  15           HN       ILE  15  40.455  12.117   2.438
  120    HA   ILE  15           HA       ILE  15  40.866  11.283   0.297
  121    HB   ILE  15           HB       ILE  15  39.297   9.346  -0.249
  122   HG12  ILE  15          HG12      ILE  15  38.009  10.158   2.402
  123   HG13  ILE  15          HG11      ILE  15  37.265  10.432   0.810
  124   HG21  ILE  15          HG21      ILE  15  41.342   9.210   1.254
  125   HG22  ILE  15          HG22      ILE  15  40.090   8.000   1.602
  126   HG23  ILE  15          HG23      ILE  15  40.255   9.432   2.644
  127   HD11  ILE  15           HD1      ILE  15  37.620   7.860   0.450
  128   HD12  ILE  15           HD2      ILE  15  36.306   8.389   1.524
  129   HD13  ILE  15           HD3      ILE  15  37.834   7.802   2.216
  130    H    ILE  16           HN       ILE  16  40.194  13.613  -0.396
  131    HA   ILE  16           HA       ILE  16  38.331  13.203  -2.699
  132    HB   ILE  16           HB       ILE  16  37.106  14.393  -0.797
  133   HG12  ILE  16          HG12      ILE  16  36.304  16.283  -2.325
  134   HG13  ILE  16          HG11      ILE  16  37.586  15.811  -3.462
  135   HG21  ILE  16          HG21      ILE  16  37.696  16.627  -0.207
  136   HG22  ILE  16          HG22      ILE  16  38.880  16.742  -1.526
  137   HG23  ILE  16          HG23      ILE  16  39.213  15.700  -0.126
  138   HD11  ILE  16           HD1      ILE  16  36.522  13.799  -4.038
  139   HD12  ILE  16           HD2      ILE  16  35.111  14.822  -3.706
  140   HD13  ILE  16           HD3      ILE  16  35.676  13.669  -2.478
  141    H    ILE  17           HN       ILE  17  40.732  15.363  -1.095
  142    HA   ILE  17           HA       ILE  17  41.507  16.564  -3.660
  143    HB   ILE  17           HB       ILE  17  42.978  16.498  -0.979
  144   HG12  ILE  17          HG12      ILE  17  40.868  17.673  -0.720
  145   HG13  ILE  17          HG11      ILE  17  42.164  18.878  -0.776
  146   HG21  ILE  17          HG21      ILE  17  44.039  18.663  -2.151
  147   HG22  ILE  17          HG22      ILE  17  43.588  17.805  -3.642
  148   HG23  ILE  17          HG23      ILE  17  44.684  17.039  -2.476
  149   HD11  ILE  17           HD1      ILE  17  40.084  18.224  -2.886
  150   HD12  ILE  17           HD2      ILE  17  41.622  18.977  -3.355
  151   HD13  ILE  17           HD3      ILE  17  40.541  19.804  -2.215
  152    H    GLY  18           HN       GLY  18  42.988  14.260  -1.355
  153    HA2  GLY  18           HA1      GLY  18  45.071  13.515  -3.263
  154    HA3  GLY  18           HA2      GLY  18  44.717  12.737  -1.702
  155    H    GLY  19           HN       GLY  19  41.857  12.449  -2.351
  156    HA2  GLY  19           HA1      GLY  19  42.032   9.847  -3.613
  157    HA3  GLY  19           HA2      GLY  19  40.552  10.690  -3.112
  158    H    ALA  20           HN       ALA  20  40.970  13.095  -4.657
  159    HA   ALA  20           HA       ALA  20  39.949  12.092  -7.215
  160    HB1  ALA  20           HB1      ALA  20  39.776  14.489  -7.787
  161    HB2  ALA  20           HB2      ALA  20  40.648  14.902  -6.291
  162    HB3  ALA  20           HB3      ALA  20  39.045  14.132  -6.205
  163    H    LEU  21           HN       LEU  21  42.642  11.245  -6.598
  164    HA   LEU  21           HA       LEU  21  44.651  12.773  -7.859
  165    HB2  LEU  21           HB2      LEU  21  45.203  10.814  -6.548
  166    HB3  LEU  21           HB1      LEU  21  44.268   9.761  -7.630
  167    HG   LEU  21           HG       LEU  21  45.846  10.115  -9.450
  168   HD11  LEU  21          HD11      LEU  21  47.973  11.511  -8.888
  169   HD12  LEU  21          HD12      LEU  21  46.995  12.226  -7.584
  170   HD13  LEU  21          HD13      LEU  21  46.485  12.401  -9.281
  171   HD21  LEU  21          HD21      LEU  21  46.439   8.417  -7.751
  172   HD22  LEU  21          HD22      LEU  21  47.305   9.654  -6.808
  173   HD23  LEU  21          HD23      LEU  21  47.900   9.180  -8.418
  174    H    ASP  22           HN       ASP  22  44.817  13.515  -9.867
  175    HA   ASP  22           HA       ASP  22  44.454  13.722 -12.152
  176    HB2  ASP  22           HB2      ASP  22  44.577  10.681 -12.045
  177    HB3  ASP  22           HB1      ASP  22  44.828  11.696 -13.486
  178    H    HIS  23           HN       HIS  23  42.108  13.326 -10.287
  179    HA   HIS  23           HA       HIS  23  39.811  13.026 -10.453
  180    HB2  HIS  23           HB2      HIS  23  40.472  13.717 -13.342
  181    HB3  HIS  23           HB1      HIS  23  38.821  13.650 -12.680
  182    HD1  HIS  23           HD1      HIS  23  38.172  15.414 -10.826
  183    HD2  HIS  23           HD2      HIS  23  41.930  16.015 -12.620
  184    HE1  HIS  23           HE1      HIS  23  38.951  17.764 -10.195
  185    H    LEU  24           HN       LEU  24  41.158  10.633 -10.377
  186    HA   LEU  24           HA       LEU  24  40.680   8.833 -12.502
  187    HB2  LEU  24           HB2      LEU  24  42.083   8.189 -10.650
  188    HB3  LEU  24           HB1      LEU  24  40.761   8.422  -9.488
  189    HG   LEU  24           HG       LEU  24  39.553   6.509 -10.358
  190   HD11  LEU  24          HD11      LEU  24  39.860   6.638 -12.722
  191   HD12  LEU  24          HD12      LEU  24  40.688   5.138 -12.246
  192   HD13  LEU  24          HD13      LEU  24  41.634   6.610 -12.577
  193   HD21  LEU  24          HD21      LEU  24  41.395   6.019  -8.786
  194   HD22  LEU  24          HD22      LEU  24  42.531   5.879 -10.150
  195   HD23  LEU  24          HD23      LEU  24  41.210   4.701  -9.968
  Start of MODEL   75
    1    H1   GLY   1           HT1      GLY   1  58.370  -1.194   7.795
    2    H2   GLY   1           HT2      GLY   1  59.053  -2.696   7.389
    3    H3   GLY   1           HT3      GLY   1  57.570  -2.221   6.711
    4    HA2  GLY   1           HA1      GLY   1  60.083  -0.751   6.312
    5    HA3  GLY   1           HA2      GLY   1  59.531  -2.051   5.236
    6    H    LYS   2           HN       LYS   2  58.866  -1.136   3.409
    7    HA   LYS   2           HA       LYS   2  57.809   1.520   3.229
    8    HB2  LYS   2           HB2      LYS   2  57.419  -0.827   1.327
    9    HB3  LYS   2           HB1      LYS   2  57.181   0.894   0.938
   10    HG2  LYS   2           HG2      LYS   2  59.554   1.354   1.406
   11    HG3  LYS   2           HG1      LYS   2  59.809  -0.348   1.861
   12    HD2  LYS   2           HD2      LYS   2  59.033  -1.006  -0.456
   13    HD3  LYS   2           HD1      LYS   2  59.017   0.723  -0.881
   14    HE2  LYS   2           HE2      LYS   2  61.460  -0.748   0.199
   15    HE3  LYS   2           HE1      LYS   2  61.151  -0.459  -1.530
   16    HZ1  LYS   2           HZ1      LYS   2  61.491   1.774  -1.309
   17    HZ2  LYS   2           HZ2      LYS   2  62.554   1.215  -0.108
   18    HZ3  LYS   2           HZ3      LYS   2  61.025   1.820   0.321
   19    H    GLY   3           HN       GLY   3  55.567   1.645   1.864
   20    HA2  GLY   3           HA1      GLY   3  53.256   0.345   2.098
   21    HA3  GLY   3           HA2      GLY   3  53.480   0.721   3.869
   22    H    ARG   4           HN       ARG   4  54.447   2.360   4.387
   23    HA   ARG   4           HA       ARG   4  52.150   3.079   4.688
   24    HB2  ARG   4           HB2      ARG   4  54.541   4.778   5.534
   25    HB3  ARG   4           HB1      ARG   4  52.888   5.040   6.147
   26    HG2  ARG   4           HG2      ARG   4  52.800   2.790   7.062
   27    HG3  ARG   4           HG1      ARG   4  54.348   2.365   6.292
   28    HD2  ARG   4           HD2      ARG   4  54.520   2.941   8.760
   29    HD3  ARG   4           HD1      ARG   4  55.559   3.921   7.696
   30    HE   ARG   4           HE       ARG   4  52.979   5.184   8.135
   31   HH11  ARG   4          HH11      ARG   4  53.100   7.149   9.257
   32   HH12  ARG   4          HH12      ARG   4  54.413   7.421  10.354
   33   HH21  ARG   4          HH21      ARG   4  55.973   4.406   9.649
   34   HH22  ARG   4          HH22      ARG   4  56.040   5.867  10.575
   35    H    TRP   5           HN       TRP   5  53.999   3.973   2.256
   36    HA   TRP   5           HA       TRP   5  53.738   6.651   1.540
   37    HB2  TRP   5           HB2      TRP   5  54.690   4.684   0.172
   38    HB3  TRP   5           HB1      TRP   5  53.027   4.426  -0.407
   39    HD1  TRP   5           HD1      TRP   5  51.870   6.642  -1.625
   40    HE1  TRP   5           HE1      TRP   5  52.944   8.421  -3.189
   41    HE3  TRP   5           HE3      TRP   5  56.788   5.927  -0.401
   42    HZ2  TRP   5           HZ2      TRP   5  55.591   9.380  -3.799
   43    HZ3  TRP   5           HZ3      TRP   5  58.571   7.284  -1.486
   44    HH2  TRP   5           HH2      TRP   5  57.977   9.008  -3.183
   45    H    LEU   6           HN       LEU   6  51.226   4.287   1.934
   46    HA   LEU   6           HA       LEU   6  49.149   6.070   0.721
   47    HB2  LEU   6           HB2      LEU   6  49.242   3.165   1.600
   48    HB3  LEU   6           HB1      LEU   6  47.684   3.990   1.365
   49    HG   LEU   6           HG       LEU   6  48.351   4.574  -0.957
   50   HD11  LEU   6          HD11      LEU   6  50.724   4.704  -0.881
   51   HD12  LEU   6          HD12      LEU   6  50.398   3.254  -1.853
   52   HD13  LEU   6          HD13      LEU   6  50.882   3.092  -0.147
   53   HD21  LEU   6          HD21      LEU   6  48.737   1.600  -0.404
   54   HD22  LEU   6          HD22      LEU   6  48.075   2.347  -1.878
   55   HD23  LEU   6          HD23      LEU   6  47.155   2.415  -0.355
   56    H    GLU   7           HN       GLU   7  50.401   4.858   3.828
   57    HA   GLU   7           HA       GLU   7  47.998   5.871   5.266
   58    HB2  GLU   7           HB2      GLU   7  49.423   3.758   5.853
   59    HB3  GLU   7           HB1      GLU   7  50.575   4.912   6.557
   60    HG2  GLU   7           HG2      GLU   7  48.625   5.876   7.895
   61    HG3  GLU   7           HG1      GLU   7  47.656   4.497   7.326
   62    H    ARG   8           HN       ARG   8  49.390   7.811   3.717
   63    HA   ARG   8           HA       ARG   8  51.248   9.332   5.289
   64    HB2  ARG   8           HB2      ARG   8  50.797   9.555   2.799
   65    HB3  ARG   8           HB1      ARG   8  49.302  10.424   3.225
   66    HG2  ARG   8           HG2      ARG   8  50.602  12.108   4.461
   67    HG3  ARG   8           HG1      ARG   8  52.108  11.224   4.116
   68    HD2  ARG   8           HD2      ARG   8  50.245  12.482   2.054
   69    HD3  ARG   8           HD1      ARG   8  51.852  13.083   2.528
   70    HE   ARG   8           HE       ARG   8  52.199  10.406   1.680
   71   HH11  ARG   8          HH11      ARG   8  51.971   9.798  -0.567
   72   HH12  ARG   8          HH12      ARG   8  52.108  11.060  -1.745
   73   HH21  ARG   8          HH21      ARG   8  52.016  13.618   0.595
   74   HH22  ARG   8          HH22      ARG   8  52.133  13.223  -1.087
   75    H    ILE   9           HN       ILE   9  47.725   9.171   5.174
   76    HA   ILE   9           HA       ILE   9  47.515  10.503   7.742
   77    HB   ILE   9           HB       ILE   9  47.863  12.505   6.282
   78   HG12  ILE   9          HG12      ILE   9  44.995  12.251   7.311
   79   HG13  ILE   9          HG11      ILE   9  46.409  12.529   8.352
   80   HG21  ILE   9          HG21      ILE   9  46.312  13.071   4.541
   81   HG22  ILE   9          HG22      ILE   9  45.195  11.766   5.009
   82   HG23  ILE   9          HG23      ILE   9  46.759  11.373   4.258
   83   HD11  ILE   9           HD1      ILE   9  46.907  14.579   6.858
   84   HD12  ILE   9           HD2      ILE   9  45.503  14.698   7.944
   85   HD13  ILE   9           HD3      ILE   9  45.263  14.362   6.214
   86    H    GLY  10           HN       GLY  10  46.064   9.312   4.755
   87    HA2  GLY  10           HA1      GLY  10  44.028   8.285   4.355
   88    HA3  GLY  10           HA2      GLY  10  44.245   7.584   5.971
   89    H    LYS  11           HN       LYS  11  42.799  10.195   4.092
   90    HA   LYS  11           HA       LYS  11  40.531  10.308   5.886
   91    HB2  LYS  11           HB2      LYS  11  42.351  11.621   7.152
   92    HB3  LYS  11           HB1      LYS  11  42.221  12.836   5.858
   93    HG2  LYS  11           HG2      LYS  11  39.790  13.061   6.316
   94    HG3  LYS  11           HG1      LYS  11  39.928  11.855   7.619
   95    HD2  LYS  11           HD2      LYS  11  41.667  13.362   8.697
   96    HD3  LYS  11           HD1      LYS  11  41.244  14.599   7.488
   97    HE2  LYS  11           HE2      LYS  11  39.496  13.416   9.669
   98    HE3  LYS  11           HE1      LYS  11  39.879  15.127   9.360
   99    HZ1  LYS  11           HZ1      LYS  11  38.757  14.553   7.067
  100    HZ2  LYS  11           HZ2      LYS  11  37.825  14.991   8.418
  101    HZ3  LYS  11           HZ3      LYS  11  37.984  13.356   7.986
  102    H    ALA  12           HN       ALA  12  42.363  11.224   3.124
  103    HA   ALA  12           HA       ALA  12  41.673  11.927   1.041
  104    HB1  ALA  12           HB1      ALA  12  38.794  12.133   1.949
  105    HB2  ALA  12           HB2      ALA  12  39.560  10.540   1.752
  106    HB3  ALA  12           HB3      ALA  12  39.450  11.651   0.367
  107    H    GLY  13           HN       GLY  13  41.124  13.604   3.942
  108    HA2  GLY  13           HA1      GLY  13  40.620  15.847   4.410
  109    HA3  GLY  13           HA2      GLY  13  41.908  16.097   3.215
  110    H    PHE  14           HN       PHE  14  38.469  15.086   3.088
  111    HA   PHE  14           HA       PHE  14  36.701  15.954   1.879
  112    HB2  PHE  14           HB2      PHE  14  37.722  18.190   2.841
  113    HB3  PHE  14           HB1      PHE  14  38.301  18.443   1.179
  114    HD1  PHE  14           HD1      PHE  14  35.258  17.900   3.282
  115    HD2  PHE  14           HD2      PHE  14  36.777  19.056  -0.590
  116    HE1  PHE  14           HE1      PHE  14  32.987  18.687   2.626
  117    HE2  PHE  14           HE2      PHE  14  34.505  19.843  -1.245
  118    HZ   PHE  14           HZ       PHE  14  32.595  19.583   0.333
  119    H    ILE  15           HN       ILE  15  38.567  14.219   0.755
  120    HA   ILE  15           HA       ILE  15  39.124  13.320  -1.291
  121    HB   ILE  15           HB       ILE  15  37.433  15.474  -2.621
  122   HG12  ILE  15          HG12      ILE  15  36.547  12.818  -1.399
  123   HG13  ILE  15          HG11      ILE  15  36.143  14.430  -0.769
  124   HG21  ILE  15          HG21      ILE  15  37.875  12.564  -3.395
  125   HG22  ILE  15          HG22      ILE  15  38.923  13.880  -3.973
  126   HG23  ILE  15          HG23      ILE  15  37.196  13.873  -4.391
  127   HD11  ILE  15           HD1      ILE  15  34.239  13.839  -2.050
  128   HD12  ILE  15           HD2      ILE  15  35.221  13.118  -3.345
  129   HD13  ILE  15           HD3      ILE  15  35.167  14.887  -3.149
  130    H    ILE  16           HN       ILE  16  41.292  14.112  -0.816
  131    HA   ILE  16           HA       ILE  16  42.210  15.870  -3.019
  132    HB   ILE  16           HB       ILE  16  41.753  17.358  -0.966
  133   HG12  ILE  16          HG12      ILE  16  44.203  18.381  -1.138
  134   HG13  ILE  16          HG11      ILE  16  44.442  17.133  -2.377
  135   HG21  ILE  16          HG21      ILE  16  43.098  17.211   0.960
  136   HG22  ILE  16          HG22      ILE  16  44.326  16.213   0.152
  137   HG23  ILE  16          HG23      ILE  16  42.756  15.505   0.595
  138   HD11  ILE  16           HD1      ILE  16  42.130  19.128  -2.425
  139   HD12  ILE  16           HD2      ILE  16  42.641  18.034  -3.732
  140   HD13  ILE  16           HD3      ILE  16  43.679  19.392  -3.255
  141    H    ILE  17           HN       ILE  17  42.583  13.383  -0.682
  142    HA   ILE  17           HA       ILE  17  45.348  12.757  -1.736
  143    HB   ILE  17           HB       ILE  17  44.048  11.802   0.861
  144   HG12  ILE  17          HG12      ILE  17  44.581  14.122   1.176
  145   HG13  ILE  17          HG11      ILE  17  45.883  13.209   1.952
  146   HG21  ILE  17          HG21      ILE  17  45.534  10.100   0.214
  147   HG22  ILE  17          HG22      ILE  17  46.564  11.109   1.249
  148   HG23  ILE  17          HG23      ILE  17  46.692  11.228  -0.521
  149   HD11  ILE  17           HD1      ILE  17  47.008  14.906   0.736
  150   HD12  ILE  17           HD2      ILE  17  45.945  14.733  -0.676
  151   HD13  ILE  17           HD3      ILE  17  47.150  13.481  -0.312
  152    H    GLY  18           HN       GLY  18  42.114  11.583  -0.876
  153    HA2  GLY  18           HA1      GLY  18  42.637   8.882  -1.855
  154    HA3  GLY  18           HA2      GLY  18  41.066   9.565  -1.385
  155    H    GLY  19           HN       GLY  19  40.619  11.637  -2.993
  156    HA2  GLY  19           HA1      GLY  19  40.215  10.315  -5.592
  157    HA3  GLY  19           HA2      GLY  19  39.604  11.902  -5.087
  158    H    ALA  20           HN       ALA  20  42.307  12.786  -4.190
  159    HA   ALA  20           HA       ALA  20  43.970  14.093  -5.153
  160    HB1  ALA  20           HB1      ALA  20  45.482  12.932  -6.605
  161    HB2  ALA  20           HB2      ALA  20  44.206  11.808  -7.134
  162    HB3  ALA  20           HB3      ALA  20  44.826  11.733  -5.466
  163    H    LEU  21           HN       LEU  21  41.119  14.099  -6.323
  164    HA   LEU  21           HA       LEU  21  40.022  15.204  -8.040
  165    HB2  LEU  21           HB2      LEU  21  42.657  16.572  -8.672
  166    HB3  LEU  21           HB1      LEU  21  41.006  17.203  -8.870
  167    HG   LEU  21           HG       LEU  21  42.406  16.599  -6.227
  168   HD11  LEU  21          HD11      LEU  21  41.438  19.236  -7.413
  169   HD12  LEU  21          HD12      LEU  21  43.124  18.670  -7.481
  170   HD13  LEU  21          HD13      LEU  21  42.362  19.012  -5.909
  171   HD21  LEU  21          HD21      LEU  21  40.290  17.796  -5.324
  172   HD22  LEU  21          HD22      LEU  21  40.090  16.117  -5.875
  173   HD23  LEU  21          HD23      LEU  21  39.567  17.464  -6.916
  174    H    ASP  22           HN       ASP  22  42.218  12.888  -8.524
  175    HA   ASP  22           HA       ASP  22  42.619  13.158 -11.427
  176    HB2  ASP  22           HB2      ASP  22  43.129  10.888  -9.466
  177    HB3  ASP  22           HB1      ASP  22  43.553  10.837 -11.194
  178    H    HIS  23           HN       HIS  23  39.852  12.985 -10.058
  179    HA   HIS  23           HA       HIS  23  37.808  11.986 -10.520
  180    HB2  HIS  23           HB2      HIS  23  39.206  11.308 -13.138
  181    HB3  HIS  23           HB1      HIS  23  37.450  11.260 -12.856
  182    HD1  HIS  23           HD1      HIS  23  40.249  13.835 -12.204
  183    HD2  HIS  23           HD2      HIS  23  36.297  13.636 -13.627
  184    HE1  HIS  23           HE1      HIS  23  39.565  16.201 -12.885
  185    H    LEU  24           HN       LEU  24  39.498  10.439  -8.947
  186    HA   LEU  24           HA       LEU  24  38.308   7.832  -9.327
  187    HB2  LEU  24           HB2      LEU  24  39.958   7.505 -11.052
  188    HB3  LEU  24           HB1      LEU  24  41.247   8.186 -10.036
  189    HG   LEU  24           HG       LEU  24  41.185   6.279  -8.542
  190   HD11  LEU  24          HD11      LEU  24  39.556   4.348  -9.131
  191   HD12  LEU  24          HD12      LEU  24  38.659   5.557 -10.080
  192   HD13  LEU  24          HD13      LEU  24  38.862   5.773  -8.325
  193   HD21  LEU  24          HD21      LEU  24  42.346   6.058 -10.791
  194   HD22  LEU  24          HD22      LEU  24  40.903   5.193 -11.374
  195   HD23  LEU  24          HD23      LEU  24  41.872   4.513 -10.045
  Start of MODEL   76
    1    H1   GLY   1           HT1      GLY   1  61.008   2.904   2.294
    2    H2   GLY   1           HT2      GLY   1  60.624   3.688   0.835
    3    H3   GLY   1           HT3      GLY   1  62.226   3.218   1.158
    4    HA2  GLY   1           HA1      GLY   1  61.054   1.787  -0.427
    5    HA3  GLY   1           HA2      GLY   1  61.725   0.965   0.995
    6    H    LYS   2           HN       LYS   2  59.728   1.956   2.855
    7    HA   LYS   2           HA       LYS   2  57.094   1.224   1.908
    8    HB2  LYS   2           HB2      LYS   2  56.884  -0.897   3.221
    9    HB3  LYS   2           HB1      LYS   2  58.005  -1.036   1.846
   10    HG2  LYS   2           HG2      LYS   2  59.909  -0.560   3.426
   11    HG3  LYS   2           HG1      LYS   2  58.745  -0.613   4.773
   12    HD2  LYS   2           HD2      LYS   2  58.153  -2.927   4.219
   13    HD3  LYS   2           HD1      LYS   2  59.220  -2.885   2.794
   14    HE2  LYS   2           HE2      LYS   2  60.341  -4.006   4.691
   15    HE3  LYS   2           HE1      LYS   2  61.173  -2.488   4.274
   16    HZ1  LYS   2           HZ1      LYS   2  60.784  -2.808   6.691
   17    HZ2  LYS   2           HZ2      LYS   2  59.111  -2.727   6.407
   18    HZ3  LYS   2           HZ3      LYS   2  60.099  -1.385   6.077
   19    H    GLY   3           HN       GLY   3  55.560   0.894   3.808
   20    HA2  GLY   3           HA1      GLY   3  55.691   1.312   6.441
   21    HA3  GLY   3           HA2      GLY   3  56.295   2.952   5.915
   22    H    ARG   4           HN       ARG   4  55.652   3.673   4.175
   23    HA   ARG   4           HA       ARG   4  54.272   4.918   5.733
   24    HB2  ARG   4           HB2      ARG   4  54.310   5.489   2.732
   25    HB3  ARG   4           HB1      ARG   4  53.733   6.660   3.945
   26    HG2  ARG   4           HG2      ARG   4  55.901   6.624   5.079
   27    HG3  ARG   4           HG1      ARG   4  56.487   5.348   3.985
   28    HD2  ARG   4           HD2      ARG   4  57.321   7.567   3.274
   29    HD3  ARG   4           HD1      ARG   4  56.221   6.882   2.054
   30    HE   ARG   4           HE       ARG   4  54.727   8.519   3.884
   31   HH11  ARG   4          HH11      ARG   4  53.678   9.384   1.672
   32   HH12  ARG   4          HH12      ARG   4  54.666  10.624   0.976
   33   HH21  ARG   4          HH21      ARG   4  57.468   9.810   2.847
   34   HH22  ARG   4          HH22      ARG   4  56.812  10.867   1.641
   35    H    TRP   5           HN       TRP   5  53.221   2.493   3.963
   36    HA   TRP   5           HA       TRP   5  50.672   2.850   2.902
   37    HB2  TRP   5           HB2      TRP   5  51.839   0.666   3.044
   38    HB3  TRP   5           HB1      TRP   5  51.481   0.602   4.787
   39    HD1  TRP   5           HD1      TRP   5  49.337   1.346   1.628
   40    HE1  TRP   5           HE1      TRP   5  47.123  -0.010   1.782
   41    HE3  TRP   5           HE3      TRP   5  50.158  -1.035   6.085
   42    HZ2  TRP   5           HZ2      TRP   5  45.903  -1.872   3.611
   43    HZ3  TRP   5           HZ3      TRP   5  48.457  -2.596   7.015
   44    HH2  TRP   5           HH2      TRP   5  46.332  -3.016   5.784
   45    H    LEU   6           HN       LEU   6  51.645   3.396   6.164
   46    HA   LEU   6           HA       LEU   6  48.770   3.636   7.047
   47    HB2  LEU   6           HB2      LEU   6  51.223   3.356   8.819
   48    HB3  LEU   6           HB1      LEU   6  49.513   3.225   9.289
   49    HG   LEU   6           HG       LEU   6  50.982   1.334   7.397
   50   HD11  LEU   6          HD11      LEU   6  49.994   0.977  10.262
   51   HD12  LEU   6          HD12      LEU   6  51.695   1.105   9.753
   52   HD13  LEU   6          HD13      LEU   6  50.719  -0.297   9.251
   53   HD21  LEU   6          HD21      LEU   6  48.704   1.312   6.716
   54   HD22  LEU   6          HD22      LEU   6  48.106   1.520   8.380
   55   HD23  LEU   6          HD23      LEU   6  48.801  -0.036   7.869
   56    H    GLU   7           HN       GLU   7  51.764   5.331   6.386
   57    HA   GLU   7           HA       GLU   7  51.704   7.467   8.176
   58    HB2  GLU   7           HB2      GLU   7  53.317   7.072   6.243
   59    HB3  GLU   7           HB1      GLU   7  52.097   7.820   5.183
   60    HG2  GLU   7           HG2      GLU   7  52.159   9.883   6.515
   61    HG3  GLU   7           HG1      GLU   7  53.306   9.139   7.655
   62    H    ARG   8           HN       ARG   8  49.538   6.829   5.451
   63    HA   ARG   8           HA       ARG   8  47.637   7.944   4.723
   64    HB2  ARG   8           HB2      ARG   8  46.918   7.163   6.990
   65    HB3  ARG   8           HB1      ARG   8  47.422   8.736   7.655
   66    HG2  ARG   8           HG2      ARG   8  45.801   9.917   6.306
   67    HG3  ARG   8           HG1      ARG   8  45.417   8.445   5.379
   68    HD2  ARG   8           HD2      ARG   8  43.667   8.814   7.046
   69    HD3  ARG   8           HD1      ARG   8  44.609   7.373   7.500
   70    HE   ARG   8           HE       ARG   8  45.811   9.576   8.806
   71   HH11  ARG   8          HH11      ARG   8  43.343  10.802   9.417
   72   HH12  ARG   8          HH12      ARG   8  42.687   9.892  10.738
   73   HH21  ARG   8          HH21      ARG   8  44.734   7.143  10.206
   74   HH22  ARG   8          HH22      ARG   8  43.477   7.820  11.185
   75    H    ILE   9           HN       ILE   9  48.777   9.469   3.440
   76    HA   ILE   9           HA       ILE   9  49.923  11.865   4.252
   77    HB   ILE   9           HB       ILE   9  49.435  12.791   2.061
   78   HG12  ILE   9          HG12      ILE   9  47.054  12.276   1.841
   79   HG13  ILE   9          HG11      ILE   9  47.921  11.603   0.455
   80   HG21  ILE   9          HG21      ILE   9  51.189  11.272   1.824
   81   HG22  ILE   9          HG22      ILE   9  50.033  10.598   0.656
   82   HG23  ILE   9          HG23      ILE   9  50.199   9.868   2.269
   83   HD11  ILE   9           HD1      ILE   9  47.979   9.386   1.843
   84   HD12  ILE   9           HD2      ILE   9  46.449   9.869   1.089
   85   HD13  ILE   9           HD3      ILE   9  46.705  10.146   2.823
   86    H    GLY  10           HN       GLY  10  46.589  10.966   4.439
   87    HA2  GLY  10           HA1      GLY  10  44.660  12.233   4.852
   88    HA3  GLY  10           HA2      GLY  10  45.671  12.785   6.199
   89    H    LYS  11           HN       LYS  11  46.441  13.574   2.859
   90    HA   LYS  11           HA       LYS  11  46.702  16.333   3.296
   91    HB2  LYS  11           HB2      LYS  11  47.406  14.962   1.249
   92    HB3  LYS  11           HB1      LYS  11  45.725  15.099   0.694
   93    HG2  LYS  11           HG2      LYS  11  46.701  16.949  -0.375
   94    HG3  LYS  11           HG1      LYS  11  46.083  17.700   1.111
   95    HD2  LYS  11           HD2      LYS  11  48.298  17.596   2.145
   96    HD3  LYS  11           HD1      LYS  11  48.939  16.668   0.769
   97    HE2  LYS  11           HE2      LYS  11  49.589  18.998   0.502
   98    HE3  LYS  11           HE1      LYS  11  48.365  18.607  -0.730
   99    HZ1  LYS  11           HZ1      LYS  11  46.682  19.632   0.601
  100    HZ2  LYS  11           HZ2      LYS  11  47.965  20.734   0.444
  101    HZ3  LYS  11           HZ3      LYS  11  47.754  19.873   1.894
  102    H    ALA  12           HN       ALA  12  43.838  14.394   2.668
  103    HA   ALA  12           HA       ALA  12  42.119  16.659   3.448
  104    HB1  ALA  12           HB1      ALA  12  42.348  17.136   1.082
  105    HB2  ALA  12           HB2      ALA  12  40.727  16.460   1.382
  106    HB3  ALA  12           HB3      ALA  12  42.002  15.437   0.669
  107    H    GLY  13           HN       GLY  13  42.402  13.389   2.082
  108    HA2  GLY  13           HA1      GLY  13  40.850  12.198   4.183
  109    HA3  GLY  13           HA2      GLY  13  39.847  12.413   2.730
  110    H    PHE  14           HN       PHE  14  41.681  12.055   0.736
  111    HA   PHE  14           HA       PHE  14  43.320   9.716   1.025
  112    HB2  PHE  14           HB2      PHE  14  41.041   8.654   1.311
  113    HB3  PHE  14           HB1      PHE  14  40.635   9.217  -0.328
  114    HD1  PHE  14           HD1      PHE  14  43.212   7.243   1.580
  115    HD2  PHE  14           HD2      PHE  14  41.253   7.905  -2.210
  116    HE1  PHE  14           HE1      PHE  14  44.380   5.258   0.629
  117    HE2  PHE  14           HE2      PHE  14  42.422   5.920  -3.160
  118    HZ   PHE  14           HZ       PHE  14  43.915   4.547  -1.714
  119    H    ILE  15           HN       ILE  15  43.291  12.386  -0.098
  120    HA   ILE  15           HA       ILE  15  44.021  13.454  -1.992
  121    HB   ILE  15           HB       ILE  15  44.444  10.743  -3.321
  122   HG12  ILE  15          HG12      ILE  15  46.252  12.238  -1.363
  123   HG13  ILE  15          HG11      ILE  15  45.493  10.653  -1.097
  124   HG21  ILE  15          HG21      ILE  15  46.076  11.896  -4.639
  125   HG22  ILE  15          HG22      ILE  15  46.059  13.312  -3.560
  126   HG23  ILE  15          HG23      ILE  15  44.657  12.967  -4.600
  127   HD11  ILE  15           HD1      ILE  15  47.704  10.120  -1.773
  128   HD12  ILE  15           HD2      ILE  15  47.721  11.383  -3.025
  129   HD13  ILE  15           HD3      ILE  15  46.746   9.911  -3.259
  130    H    ILE  16           HN       ILE  16  41.567  13.627  -1.721
  131    HA   ILE  16           HA       ILE  16  40.285  12.913  -4.359
  132    HB   ILE  16           HB       ILE  16  39.029  13.410  -1.637
  133   HG12  ILE  16          HG12      ILE  16  40.205  11.285  -1.605
  134   HG13  ILE  16          HG11      ILE  16  38.463  10.962  -1.706
  135   HG21  ILE  16          HG21      ILE  16  37.908  12.969  -4.416
  136   HG22  ILE  16          HG22      ILE  16  37.313  14.007  -3.108
  137   HG23  ILE  16          HG23      ILE  16  37.026  12.257  -3.043
  138   HD11  ILE  16           HD1      ILE  16  40.591  10.642  -3.845
  139   HD12  ILE  16           HD2      ILE  16  38.891  10.871  -4.310
  140   HD13  ILE  16           HD3      ILE  16  39.357   9.481  -3.309
  141    H    ILE  17           HN       ILE  17  40.129  15.241  -1.604
  142    HA   ILE  17           HA       ILE  17  39.014  17.328  -3.329
  143    HB   ILE  17           HB       ILE  17  40.367  17.656  -0.615
  144   HG12  ILE  17          HG12      ILE  17  38.630  15.966  -0.386
  145   HG13  ILE  17          HG11      ILE  17  38.042  17.479   0.334
  146   HG21  ILE  17          HG21      ILE  17  38.641  19.425  -2.371
  147   HG22  ILE  17          HG22      ILE  17  40.075  19.833  -1.410
  148   HG23  ILE  17          HG23      ILE  17  38.513  19.583  -0.603
  149   HD11  ILE  17           HD1      ILE  17  36.933  17.926  -1.974
  150   HD12  ILE  17           HD2      ILE  17  36.212  16.670  -0.948
  151   HD13  ILE  17           HD3      ILE  17  37.253  16.212  -2.312
  152    H    GLY  18           HN       GLY  18  42.171  16.738  -1.737
  153    HA2  GLY  18           HA1      GLY  18  43.504  18.993  -2.852
  154    HA3  GLY  18           HA2      GLY  18  44.285  17.498  -2.289
  155    H    GLY  19           HN       GLY  19  43.338  15.579  -3.946
  156    HA2  GLY  19           HA1      GLY  19  44.883  16.036  -6.329
  157    HA3  GLY  19           HA2      GLY  19  43.800  14.661  -6.024
  158    H    ALA  20           HN       ALA  20  41.345  15.679  -5.812
  159    HA   ALA  20           HA       ALA  20  39.574  16.300  -7.179
  160    HB1  ALA  20           HB1      ALA  20  39.689  18.584  -8.070
  161    HB2  ALA  20           HB2      ALA  20  41.451  18.601  -7.815
  162    HB3  ALA  20           HB3      ALA  20  40.349  18.510  -6.419
  163    H    LEU  21           HN       LEU  21  41.461  14.450  -8.350
  164    HA   LEU  21           HA       LEU  21  41.955  15.266 -11.106
  165    HB2  LEU  21           HB2      LEU  21  41.813  12.423 -10.040
  166    HB3  LEU  21           HB1      LEU  21  42.729  13.025 -11.441
  167    HG   LEU  21           HG       LEU  21  43.237  13.813  -8.536
  168   HD11  LEU  21          HD11      LEU  21  43.842  11.462  -9.029
  169   HD12  LEU  21          HD12      LEU  21  45.296  12.461  -8.790
  170   HD13  LEU  21          HD13      LEU  21  44.792  11.999 -10.434
  171   HD21  LEU  21          HD21      LEU  21  45.416  14.691  -9.646
  172   HD22  LEU  21          HD22      LEU  21  43.936  15.639  -9.912
  173   HD23  LEU  21          HD23      LEU  21  44.538  14.555 -11.190
  174    H    ASP  22           HN       ASP  22  39.888  16.052 -11.769
  175    HA   ASP  22           HA       ASP  22  37.778  15.835 -12.715
  176    HB2  ASP  22           HB2      ASP  22  39.003  13.147 -13.438
  177    HB3  ASP  22           HB1      ASP  22  37.452  13.730 -14.088
  178    H    HIS  23           HN       HIS  23  37.389  15.698 -10.160
  179    HA   HIS  23           HA       HIS  23  36.060  14.818  -8.472
  180    HB2  HIS  23           HB2      HIS  23  34.633  13.595 -10.868
  181    HB3  HIS  23           HB1      HIS  23  33.976  13.673  -9.215
  182    HD1  HIS  23           HD1      HIS  23  33.270  15.290 -12.134
  183    HD2  HIS  23           HD2      HIS  23  34.749  16.801  -8.498
  184    HE1  HIS  23           HE1      HIS  23  32.681  17.774 -12.046
  185    H    LEU  24           HN       LEU  24  38.338  13.502  -8.473
  186    HA   LEU  24           HA       LEU  24  37.565  10.856  -7.551
  187    HB2  LEU  24           HB2      LEU  24  37.789  10.759 -10.183
  188    HB3  LEU  24           HB1      LEU  24  39.534  10.788  -9.858
  189    HG   LEU  24           HG       LEU  24  37.539   8.775  -8.717
  190   HD11  LEU  24          HD11      LEU  24  38.679   7.170 -10.197
  191   HD12  LEU  24          HD12      LEU  24  39.755   8.457 -10.792
  192   HD13  LEU  24          HD13      LEU  24  38.014   8.516 -11.152
  193   HD21  LEU  24          HD21      LEU  24  39.263   8.970  -7.093
  194   HD22  LEU  24          HD22      LEU  24  40.525   9.219  -8.324
  195   HD23  LEU  24          HD23      LEU  24  39.798   7.610  -8.104
  Start of MODEL   77
    1    H1   GLY   1           HT1      GLY   1  64.324   5.558   4.862
    2    H2   GLY   1           HT2      GLY   1  63.662   3.993   4.876
    3    H3   GLY   1           HT3      GLY   1  63.345   5.066   6.156
    4    HA2  GLY   1           HA1      GLY   1  62.306   6.566   4.485
    5    HA3  GLY   1           HA2      GLY   1  62.386   5.178   3.383
    6    H    LYS   2           HN       LYS   2  62.043   4.365   6.699
    7    HA   LYS   2           HA       LYS   2  59.550   3.040   6.284
    8    HB2  LYS   2           HB2      LYS   2  59.485   2.988   8.829
    9    HB3  LYS   2           HB1      LYS   2  60.964   2.332   8.088
   10    HG2  LYS   2           HG2      LYS   2  62.218   4.312   8.584
   11    HG3  LYS   2           HG1      LYS   2  60.750   5.233   8.986
   12    HD2  LYS   2           HD2      LYS   2  62.018   4.502  11.020
   13    HD3  LYS   2           HD1      LYS   2  60.366   3.842  10.966
   14    HE2  LYS   2           HE2      LYS   2  62.305   2.213  11.575
   15    HE3  LYS   2           HE1      LYS   2  61.122   1.677  10.359
   16    HZ1  LYS   2           HZ1      LYS   2  62.631   1.818   8.706
   17    HZ2  LYS   2           HZ2      LYS   2  63.747   1.614   9.971
   18    HZ3  LYS   2           HZ3      LYS   2  63.422   3.166   9.363
   19    H    GLY   3           HN       GLY   3  57.825   3.620   8.262
   20    HA2  GLY   3           HA1      GLY   3  56.808   5.868   9.163
   21    HA3  GLY   3           HA2      GLY   3  56.736   6.340   7.403
   22    H    ARG   4           HN       ARG   4  56.441   4.944   6.043
   23    HA   ARG   4           HA       ARG   4  54.206   5.867   6.229
   24    HB2  ARG   4           HB2      ARG   4  54.931   3.792   4.107
   25    HB3  ARG   4           HB1      ARG   4  53.540   4.897   3.982
   26    HG2  ARG   4           HG2      ARG   4  55.085   6.839   4.244
   27    HG3  ARG   4           HG1      ARG   4  56.465   5.715   4.291
   28    HD2  ARG   4           HD2      ARG   4  56.000   4.946   2.034
   29    HD3  ARG   4           HD1      ARG   4  54.481   5.873   1.983
   30    HE   ARG   4           HE       ARG   4  55.795   7.699   1.302
   31   HH11  ARG   4          HH11      ARG   4  58.064   5.393   1.631
   32   HH12  ARG   4          HH12      ARG   4  59.314   6.394   2.289
   33   HH21  ARG   4          HH21      ARG   4  57.212   9.088   2.881
   34   HH22  ARG   4          HH22      ARG   4  58.832   8.487   2.996
   35    H    TRP   5           HN       TRP   5  55.088   3.068   7.457
   36    HA   TRP   5           HA       TRP   5  53.227   1.026   7.194
   37    HB2  TRP   5           HB2      TRP   5  55.159   1.095   8.817
   38    HB3  TRP   5           HB1      TRP   5  54.142   2.069   9.904
   39    HD1  TRP   5           HD1      TRP   5  51.993   0.887  10.966
   40    HE1  TRP   5           HE1      TRP   5  51.398  -1.608  11.399
   41    HE3  TRP   5           HE3      TRP   5  55.447  -1.309   7.892
   42    HZ2  TRP   5           HZ2      TRP   5  52.321  -4.188  10.511
   43    HZ3  TRP   5           HZ3      TRP   5  55.573  -3.789   7.702
   44    HH2  TRP   5           HH2      TRP   5  54.014  -5.228   9.006
   45    H    LEU   6           HN       LEU   6  52.613   4.234   8.310
   46    HA   LEU   6           HA       LEU   6  49.826   3.464   9.158
   47    HB2  LEU   6           HB2      LEU   6  51.439   4.544  10.871
   48    HB3  LEU   6           HB1      LEU   6  51.293   6.020   9.894
   49    HG   LEU   6           HG       LEU   6  48.677   5.599  10.135
   50   HD11  LEU   6          HD11      LEU   6  49.826   4.016  12.480
   51   HD12  LEU   6          HD12      LEU   6  48.738   3.410  11.209
   52   HD13  LEU   6          HD13      LEU   6  48.148   4.597  12.392
   53   HD21  LEU   6          HD21      LEU   6  50.394   6.542  12.476
   54   HD22  LEU   6          HD22      LEU   6  48.671   6.922  12.236
   55   HD23  LEU   6          HD23      LEU   6  49.886   7.533  11.087
   56    H    GLU   7           HN       GLU   7  51.842   5.255   6.918
   57    HA   GLU   7           HA       GLU   7  49.563   6.973   6.053
   58    HB2  GLU   7           HB2      GLU   7  52.350   6.750   4.861
   59    HB3  GLU   7           HB1      GLU   7  51.171   8.064   4.640
   60    HG2  GLU   7           HG2      GLU   7  51.287   8.512   7.112
   61    HG3  GLU   7           HG1      GLU   7  52.574   7.289   7.235
   62    H    ARG   8           HN       ARG   8  49.735   3.915   5.770
   63    HA   ARG   8           HA       ARG   8  50.166   3.133   3.110
   64    HB2  ARG   8           HB2      ARG   8  48.014   2.241   5.065
   65    HB3  ARG   8           HB1      ARG   8  48.371   1.414   3.531
   66    HG2  ARG   8           HG2      ARG   8  50.670   0.983   4.242
   67    HG3  ARG   8           HG1      ARG   8  50.422   1.930   5.729
   68    HD2  ARG   8           HD2      ARG   8  48.790   0.337   6.555
   69    HD3  ARG   8           HD1      ARG   8  48.793  -0.542   5.007
   70    HE   ARG   8           HE       ARG   8  51.459  -0.550   5.956
   71   HH11  ARG   8          HH11      ARG   8  48.379  -1.989   6.377
   72   HH12  ARG   8          HH12      ARG   8  48.942  -3.217   7.461
   73   HH21  ARG   8          HH21      ARG   8  52.186  -1.997   7.581
   74   HH22  ARG   8          HH22      ARG   8  51.097  -3.222   8.143
   75    H    ILE   9           HN       ILE   9  47.477   4.932   4.528
   76    HA   ILE   9           HA       ILE   9  45.521   4.668   2.561
   77    HB   ILE   9           HB       ILE   9  44.990   7.166   3.076
   78   HG12  ILE   9          HG12      ILE   9  46.941   6.825   5.389
   79   HG13  ILE   9          HG11      ILE   9  47.562   7.419   3.837
   80   HG21  ILE   9          HG21      ILE   9  43.907   5.235   4.198
   81   HG22  ILE   9          HG22      ILE   9  44.164   6.577   5.335
   82   HG23  ILE   9          HG23      ILE   9  45.244   5.163   5.370
   83   HD11  ILE   9           HD1      ILE   9  46.920   9.309   5.267
   84   HD12  ILE   9           HD2      ILE   9  45.276   8.652   5.432
   85   HD13  ILE   9           HD3      ILE   9  45.850   9.223   3.848
   86    H    GLY  10           HN       GLY  10  45.516   4.876   0.475
   87    HA2  GLY  10           HA1      GLY  10  47.687   6.136  -0.959
   88    HA3  GLY  10           HA2      GLY  10  46.192   5.487  -1.661
   89    H    LYS  11           HN       LYS  11  45.029   7.441   0.632
   90    HA   LYS  11           HA       LYS  11  44.154   9.448  -1.199
   91    HB2  LYS  11           HB2      LYS  11  44.348   9.560   1.836
   92    HB3  LYS  11           HB1      LYS  11  43.393  10.665   0.814
   93    HG2  LYS  11           HG2      LYS  11  42.208   8.591  -0.106
   94    HG3  LYS  11           HG1      LYS  11  43.003   7.666   1.190
   95    HD2  LYS  11           HD2      LYS  11  41.208  10.098   1.616
   96    HD3  LYS  11           HD1      LYS  11  40.707   8.405   1.832
   97    HE2  LYS  11           HE2      LYS  11  41.277   9.049   4.028
   98    HE3  LYS  11           HE1      LYS  11  42.778   8.273   3.468
   99    HZ1  LYS  11           HZ1      LYS  11  43.857  10.192   3.638
  100    HZ2  LYS  11           HZ2      LYS  11  42.495  10.839   4.421
  101    HZ3  LYS  11           HZ3      LYS  11  42.686  11.032   2.744
  102    H    ALA  12           HN       ALA  12  45.737  10.500  -2.315
  103    HA   ALA  12           HA       ALA  12  48.198  11.420  -1.278
  104    HB1  ALA  12           HB1      ALA  12  47.440  11.351  -3.697
  105    HB2  ALA  12           HB2      ALA  12  48.316  12.823  -3.212
  106    HB3  ALA  12           HB3      ALA  12  46.543  12.854  -3.377
  107    H    GLY  13           HN       GLY  13  45.081  12.338  -0.376
  108    HA2  GLY  13           HA1      GLY  13  44.304  14.045   0.976
  109    HA3  GLY  13           HA2      GLY  13  45.993  14.329   1.446
  110    H    PHE  14           HN       PHE  14  45.793  14.475  -1.868
  111    HA   PHE  14           HA       PHE  14  46.038  17.416  -1.815
  112    HB2  PHE  14           HB2      PHE  14  47.229  15.441  -3.310
  113    HB3  PHE  14           HB1      PHE  14  45.961  15.947  -4.441
  114    HD1  PHE  14           HD1      PHE  14  45.782  18.889  -3.650
  115    HD2  PHE  14           HD2      PHE  14  49.185  16.328  -4.361
  116    HE1  PHE  14           HE1      PHE  14  47.147  20.875  -4.278
  117    HE2  PHE  14           HE2      PHE  14  50.548  18.316  -4.987
  118    HZ   PHE  14           HZ       PHE  14  49.514  20.583  -4.996
  119    H    ILE  15           HN       ILE  15  44.184  15.236  -3.998
  120    HA   ILE  15           HA       ILE  15  41.666  16.599  -3.380
  121    HB   ILE  15           HB       ILE  15  41.260  17.296  -5.790
  122   HG12  ILE  15          HG12      ILE  15  44.276  16.842  -5.951
  123   HG13  ILE  15          HG11      ILE  15  43.025  15.937  -6.834
  124   HG21  ILE  15          HG21      ILE  15  42.265  19.441  -5.539
  125   HG22  ILE  15          HG22      ILE  15  43.636  18.787  -4.616
  126   HG23  ILE  15          HG23      ILE  15  42.020  18.863  -3.876
  127   HD11  ILE  15           HD1      ILE  15  43.853  18.839  -7.182
  128   HD12  ILE  15           HD2      ILE  15  42.290  18.236  -7.789
  129   HD13  ILE  15           HD3      ILE  15  43.810  17.545  -8.401
  130    H    ILE  16           HN       ILE  16  42.402  14.022  -3.036
  131    HA   ILE  16           HA       ILE  16  41.552  12.397  -5.336
  132    HB   ILE  16           HB       ILE  16  41.983  11.703  -2.405
  133   HG12  ILE  16          HG12      ILE  16  44.052  12.526  -3.377
  134   HG13  ILE  16          HG11      ILE  16  44.173  10.765  -3.209
  135   HG21  ILE  16          HG21      ILE  16  41.275  10.055  -4.847
  136   HG22  ILE  16          HG22      ILE  16  40.732   9.883  -3.166
  137   HG23  ILE  16          HG23      ILE  16  42.358   9.335  -3.630
  138   HD11  ILE  16           HD1      ILE  16  45.013  11.119  -5.379
  139   HD12  ILE  16           HD2      ILE  16  43.858  12.424  -5.726
  140   HD13  ILE  16           HD3      ILE  16  43.311  10.734  -5.709
  141    H    ILE  17           HN       ILE  17  40.346  12.583  -1.963
  142    HA   ILE  17           HA       ILE  17  37.670  11.732  -2.867
  143    HB   ILE  17           HB       ILE  17  37.175  12.232  -0.296
  144   HG12  ILE  17          HG12      ILE  17  39.151  12.140   1.130
  145   HG13  ILE  17          HG11      ILE  17  40.222  11.999  -0.280
  146   HG21  ILE  17          HG21      ILE  17  38.204  10.015   0.297
  147   HG22  ILE  17          HG22      ILE  17  39.045  10.028  -1.272
  148   HG23  ILE  17          HG23      ILE  17  37.267   9.976  -1.215
  149   HD11  ILE  17           HD1      ILE  17  40.012  14.334   0.795
  150   HD12  ILE  17           HD2      ILE  17  38.371  14.383   0.111
  151   HD13  ILE  17           HD3      ILE  17  39.784  14.245  -0.964
  152    H    GLY  18           HN       GLY  18  39.269  14.577  -3.068
  153    HA2  GLY  18           HA1      GLY  18  36.912  16.282  -2.332
  154    HA3  GLY  18           HA2      GLY  18  38.569  16.842  -2.636
  155    H    GLY  19           HN       GLY  19  39.406  16.337  -4.909
  156    HA2  GLY  19           HA1      GLY  19  37.467  17.508  -6.780
  157    HA3  GLY  19           HA2      GLY  19  39.173  17.132  -7.096
  158    H    ALA  20           HN       ALA  20  39.117  14.398  -6.279
  159    HA   ALA  20           HA       ALA  20  38.834  12.349  -7.332
  160    HB1  ALA  20           HB1      ALA  20  36.710  12.373  -6.227
  161    HB2  ALA  20           HB2      ALA  20  36.427  11.793  -7.886
  162    HB3  ALA  20           HB3      ALA  20  36.018  13.469  -7.444
  163    H    LEU  21           HN       LEU  21  39.119  15.032  -9.007
  164    HA   LEU  21           HA       LEU  21  39.223  15.588 -11.264
  165    HB2  LEU  21           HB2      LEU  21  39.696  12.612 -11.659
  166    HB3  LEU  21           HB1      LEU  21  40.275  13.945 -12.680
  167    HG   LEU  21           HG       LEU  21  41.070  13.531  -9.760
  168   HD11  LEU  21          HD11      LEU  21  41.889  11.732 -11.305
  169   HD12  LEU  21          HD12      LEU  21  43.205  12.725 -10.634
  170   HD13  LEU  21          HD13      LEU  21  42.657  12.987 -12.307
  171   HD21  LEU  21          HD21      LEU  21  41.331  15.848 -10.284
  172   HD22  LEU  21          HD22      LEU  21  41.889  15.500 -11.938
  173   HD23  LEU  21          HD23      LEU  21  42.945  15.151 -10.549
  174    H    ASP  22           HN       ASP  22  36.901  16.061 -11.206
  175    HA   ASP  22           HA       ASP  22  35.582  14.896 -13.472
  176    HB2  ASP  22           HB2      ASP  22  33.624  13.897 -12.209
  177    HB3  ASP  22           HB1      ASP  22  35.136  12.964 -12.103
  178    H    HIS  23           HN       HIS  23  36.314  17.411 -11.954
  179    HA   HIS  23           HA       HIS  23  35.390  19.503 -11.601
  180    HB2  HIS  23           HB2      HIS  23  34.615  19.066 -13.969
  181    HB3  HIS  23           HB1      HIS  23  33.068  18.503 -13.294
  182    HD1  HIS  23           HD1      HIS  23  35.354  21.588 -12.941
  183    HD2  HIS  23           HD2      HIS  23  31.275  20.569 -12.921
  184    HE1  HIS  23           HE1      HIS  23  34.026  23.765 -12.770
  185    H    LEU  24           HN       LEU  24  34.798  17.333  -9.722
  186    HA   LEU  24           HA       LEU  24  32.049  17.441  -8.907
  187    HB2  LEU  24           HB2      LEU  24  34.051  15.852  -8.200
  188    HB3  LEU  24           HB1      LEU  24  34.306  17.053  -6.917
  189    HG   LEU  24           HG       LEU  24  31.741  15.490  -7.475
  190   HD11  LEU  24          HD11      LEU  24  33.700  15.482  -5.134
  191   HD12  LEU  24          HD12      LEU  24  33.530  14.200  -6.357
  192   HD13  LEU  24          HD13      LEU  24  32.196  14.536  -5.227
  193   HD21  LEU  24          HD21      LEU  24  31.017  17.635  -6.708
  194   HD22  LEU  24          HD22      LEU  24  32.373  17.775  -5.562
  195   HD23  LEU  24          HD23      LEU  24  31.052  16.626  -5.244
  Start of MODEL   78
    1    H1   GLY   1           HT1      GLY   1  60.227  -2.995   6.520
    2    H2   GLY   1           HT2      GLY   1  58.580  -2.786   6.885
    3    H3   GLY   1           HT3      GLY   1  59.757  -2.559   8.090
    4    HA2  GLY   1           HA1      GLY   1  60.466  -0.592   7.269
    5    HA3  GLY   1           HA2      GLY   1  59.845  -0.965   5.649
    6    H    LYS   2           HN       LYS   2  58.334  -1.096   8.899
    7    HA   LYS   2           HA       LYS   2  55.802  -0.175   8.073
    8    HB2  LYS   2           HB2      LYS   2  55.511   0.516  10.476
    9    HB3  LYS   2           HB1      LYS   2  56.133  -1.140  10.272
   10    HG2  LYS   2           HG2      LYS   2  58.441  -0.326  10.640
   11    HG3  LYS   2           HG1      LYS   2  57.827   1.333  10.837
   12    HD2  LYS   2           HD2      LYS   2  56.372   0.466  12.734
   13    HD3  LYS   2           HD1      LYS   2  57.258  -1.074  12.615
   14    HE2  LYS   2           HE2      LYS   2  58.318   1.664  13.388
   15    HE3  LYS   2           HE1      LYS   2  58.430   0.133  14.290
   16    HZ1  LYS   2           HZ1      LYS   2  59.750   0.668  11.674
   17    HZ2  LYS   2           HZ2      LYS   2  59.915  -0.731  12.624
   18    HZ3  LYS   2           HZ3      LYS   2  60.521   0.754  13.182
   19    H    GLY   3           HN       GLY   3  54.973   1.989   9.394
   20    HA2  GLY   3           HA1      GLY   3  55.696   4.409   9.730
   21    HA3  GLY   3           HA2      GLY   3  56.600   4.285   8.152
   22    H    ARG   4           HN       ARG   4  55.837   3.193   6.691
   23    HA   ARG   4           HA       ARG   4  55.201   5.419   5.971
   24    HB2  ARG   4           HB2      ARG   4  54.726   2.972   4.201
   25    HB3  ARG   4           HB1      ARG   4  54.856   4.642   3.595
   26    HG2  ARG   4           HG2      ARG   4  57.109   4.846   4.574
   27    HG3  ARG   4           HG1      ARG   4  56.985   3.199   5.239
   28    HD2  ARG   4           HD2      ARG   4  56.882   2.235   3.012
   29    HD3  ARG   4           HD1      ARG   4  56.767   3.849   2.269
   30    HE   ARG   4           HE       ARG   4  59.111   4.062   2.516
   31   HH11  ARG   4          HH11      ARG   4  59.515   1.189   2.233
   32   HH12  ARG   4          HH12      ARG   4  60.338   0.745   3.690
   33   HH21  ARG   4          HH21      ARG   4  59.462   3.644   5.382
   34   HH22  ARG   4          HH22      ARG   4  60.307   2.134   5.474
   35    H    TRP   5           HN       TRP   5  53.183   3.305   7.237
   36    HA   TRP   5           HA       TRP   5  50.675   3.236   6.038
   37    HB2  TRP   5           HB2      TRP   5  51.203   2.276   8.269
   38    HB3  TRP   5           HB1      TRP   5  51.170   3.913   8.964
   39    HD1  TRP   5           HD1      TRP   5  48.896   4.806   9.705
   40    HE1  TRP   5           HE1      TRP   5  46.417   4.061   9.466
   41    HE3  TRP   5           HE3      TRP   5  49.535   0.914   6.442
   42    HZ2  TRP   5           HZ2      TRP   5  44.942   2.043   8.037
   43    HZ3  TRP   5           HZ3      TRP   5  47.578  -0.409   5.654
   44    HH2  TRP   5           HH2      TRP   5  45.283   0.151   6.448
   45    H    LEU   6           HN       LEU   6  52.393   6.053   7.051
   46    HA   LEU   6           HA       LEU   6  49.936   7.762   6.679
   47    HB2  LEU   6           HB2      LEU   6  52.546   8.358   8.141
   48    HB3  LEU   6           HB1      LEU   6  51.210   9.504   7.899
   49    HG   LEU   6           HG       LEU   6  49.782   7.468   9.018
   50   HD11  LEU   6          HD11      LEU   6  51.981   6.120   9.197
   51   HD12  LEU   6          HD12      LEU   6  50.994   6.243  10.669
   52   HD13  LEU   6          HD13      LEU   6  52.445   7.256  10.481
   53   HD21  LEU   6          HD21      LEU   6  49.837   9.760   9.891
   54   HD22  LEU   6          HD22      LEU   6  51.475   9.504  10.540
   55   HD23  LEU   6          HD23      LEU   6  50.096   8.612  11.227
   56    H    GLU   7           HN       GLU   7  53.132   6.907   5.472
   57    HA   GLU   7           HA       GLU   7  53.282   9.391   3.828
   58    HB2  GLU   7           HB2      GLU   7  55.294   8.331   4.972
   59    HB3  GLU   7           HB1      GLU   7  55.138   6.979   3.827
   60    HG2  GLU   7           HG2      GLU   7  55.549   8.410   1.935
   61    HG3  GLU   7           HG1      GLU   7  55.381   9.881   2.924
   62    H    ARG   8           HN       ARG   8  51.752   6.417   3.687
   63    HA   ARG   8           HA       ARG   8  52.210   5.762   0.895
   64    HB2  ARG   8           HB2      ARG   8  51.432   4.099   2.555
   65    HB3  ARG   8           HB1      ARG   8  49.911   5.004   2.743
   66    HG2  ARG   8           HG2      ARG   8  49.289   4.595   0.447
   67    HG3  ARG   8           HG1      ARG   8  50.897   3.933   0.067
   68    HD2  ARG   8           HD2      ARG   8  48.920   2.720   2.048
   69    HD3  ARG   8           HD1      ARG   8  49.210   2.131   0.394
   70    HE   ARG   8           HE       ARG   8  51.691   2.268   1.863
   71   HH11  ARG   8          HH11      ARG   8  48.776   0.491   1.383
   72   HH12  ARG   8          HH12      ARG   8  49.434  -1.002   1.965
   73   HH21  ARG   8          HH21      ARG   8  52.551   0.341   2.677
   74   HH22  ARG   8          HH22      ARG   8  51.571  -1.087   2.698
   75    H    ILE   9           HN       ILE   9  50.859   6.071  -0.888
   76    HA   ILE   9           HA       ILE   9  49.720   8.628  -1.156
   77    HB   ILE   9           HB       ILE   9  50.279   7.392  -3.145
   78   HG12  ILE   9          HG12      ILE   9  48.279   7.630  -4.500
   79   HG13  ILE   9          HG11      ILE   9  47.226   7.504  -3.075
   80   HG21  ILE   9          HG21      ILE   9  49.756   5.112  -2.041
   81   HG22  ILE   9          HG22      ILE   9  49.400   5.279  -3.773
   82   HG23  ILE   9          HG23      ILE   9  48.083   5.364  -2.586
   83   HD11  ILE   9           HD1      ILE   9  49.334   9.686  -3.288
   84   HD12  ILE   9           HD2      ILE   9  47.885   9.634  -2.254
   85   HD13  ILE   9           HD3      ILE   9  47.718   9.881  -4.007
   86    H    GLY  10           HN       GLY  10  48.319   9.298   0.386
   87    HA2  GLY  10           HA1      GLY  10  45.571   8.641   0.111
   88    HA3  GLY  10           HA2      GLY  10  46.214   7.706   1.476
   89    H    LYS  11           HN       LYS  11  47.478  10.855   0.554
   90    HA   LYS  11           HA       LYS  11  47.400  11.973   3.115
   91    HB2  LYS  11           HB2      LYS  11  48.569  12.938   1.132
   92    HB3  LYS  11           HB1      LYS  11  46.992  13.464   0.492
   93    HG2  LYS  11           HG2      LYS  11  46.623  14.924   2.382
   94    HG3  LYS  11           HG1      LYS  11  48.032  14.259   3.243
   95    HD2  LYS  11           HD2      LYS  11  49.526  15.125   1.455
   96    HD3  LYS  11           HD1      LYS  11  48.113  15.814   0.618
   97    HE2  LYS  11           HE2      LYS  11  48.857  16.506   3.490
   98    HE3  LYS  11           HE1      LYS  11  49.396  17.454   2.084
   99    HZ1  LYS  11           HZ1      LYS  11  46.587  16.926   2.915
  100    HZ2  LYS  11           HZ2      LYS  11  47.027  17.688   1.461
  101    HZ3  LYS  11           HZ3      LYS  11  47.399  18.414   2.951
  102    H    ALA  12           HN       ALA  12  44.773  11.332   0.971
  103    HA   ALA  12           HA       ALA  12  42.852  12.308   2.960
  104    HB1  ALA  12           HB1      ALA  12  42.885  13.593   0.207
  105    HB2  ALA  12           HB2      ALA  12  43.452  14.387   1.697
  106    HB3  ALA  12           HB3      ALA  12  41.741  13.921   1.532
  107    H    GLY  13           HN       GLY  13  43.878  10.452   0.335
  108    HA2  GLY  13           HA1      GLY  13  42.497   8.325   0.144
  109    HA3  GLY  13           HA2      GLY  13  41.101   9.382  -0.151
  110    H    PHE  14           HN       PHE  14  44.492   9.127  -1.296
  111    HA   PHE  14           HA       PHE  14  45.343   9.004  -3.438
  112    HB2  PHE  14           HB2      PHE  14  43.390   7.290  -3.687
  113    HB3  PHE  14           HB1      PHE  14  42.551   8.586  -4.566
  114    HD1  PHE  14           HD1      PHE  14  45.636   6.473  -4.512
  115    HD2  PHE  14           HD2      PHE  14  43.183   9.182  -6.811
  116    HE1  PHE  14           HE1      PHE  14  46.945   5.922  -6.558
  117    HE2  PHE  14           HE2      PHE  14  44.493   8.629  -8.858
  118    HZ   PHE  14           HZ       PHE  14  46.367   6.991  -8.733
  119    H    ILE  15           HN       ILE  15  44.075  11.445  -2.157
  120    HA   ILE  15           HA       ILE  15  43.798  13.653  -2.716
  121    HB   ILE  15           HB       ILE  15  44.885  13.006  -5.486
  122   HG12  ILE  15          HG12      ILE  15  46.418  13.494  -2.889
  123   HG13  ILE  15          HG11      ILE  15  46.354  11.961  -3.788
  124   HG21  ILE  15          HG21      ILE  15  45.289  15.466  -3.738
  125   HG22  ILE  15          HG22      ILE  15  43.945  15.313  -4.893
  126   HG23  ILE  15          HG23      ILE  15  45.622  15.289  -5.478
  127   HD11  ILE  15           HD1      ILE  15  47.682  14.572  -4.584
  128   HD12  ILE  15           HD2      ILE  15  47.255  13.351  -5.809
  129   HD13  ILE  15           HD3      ILE  15  48.391  12.943  -4.500
  130    H    ILE  16           HN       ILE  16  41.564  12.734  -2.599
  131    HA   ILE  16           HA       ILE  16  40.088  13.547  -5.087
  132    HB   ILE  16           HB       ILE  16  39.441  11.242  -3.209
  133   HG12  ILE  16          HG12      ILE  16  41.330  10.925  -4.977
  134   HG13  ILE  16          HG11      ILE  16  40.039   9.716  -4.913
  135   HG21  ILE  16          HG21      ILE  16  37.969  12.410  -5.610
  136   HG22  ILE  16          HG22      ILE  16  37.376  12.255  -3.941
  137   HG23  ILE  16          HG23      ILE  16  37.606  10.803  -4.938
  138   HD11  ILE  16           HD1      ILE  16  38.963  10.622  -6.867
  139   HD12  ILE  16           HD2      ILE  16  40.694  10.505  -7.250
  140   HD13  ILE  16           HD3      ILE  16  39.981  12.078  -6.843
  141    H    ILE  17           HN       ILE  17  39.904  12.784  -1.589
  142    HA   ILE  17           HA       ILE  17  37.572  14.479  -1.174
  143    HB   ILE  17           HB       ILE  17  39.596  13.212   0.734
  144   HG12  ILE  17          HG12      ILE  17  37.649  11.818   1.365
  145   HG13  ILE  17          HG11      ILE  17  36.631  12.703   0.208
  146   HG21  ILE  17          HG21      ILE  17  37.220  15.029   1.313
  147   HG22  ILE  17          HG22      ILE  17  38.895  15.193   1.893
  148   HG23  ILE  17          HG23      ILE  17  37.861  13.890   2.521
  149   HD11  ILE  17           HD1      ILE  17  37.725  11.774  -1.664
  150   HD12  ILE  17           HD2      ILE  17  37.683  10.410  -0.526
  151   HD13  ILE  17           HD3      ILE  17  39.180  11.348  -0.733
  152    H    GLY  18           HN       GLY  18  41.090  14.741  -0.628
  153    HA2  GLY  18           HA1      GLY  18  40.926  17.478   0.339
  154    HA3  GLY  18           HA2      GLY  18  42.397  16.596  -0.123
  155    H    GLY  19           HN       GLY  19  41.869  15.896  -2.738
  156    HA2  GLY  19           HA1      GLY  19  42.462  18.375  -4.083
  157    HA3  GLY  19           HA2      GLY  19  42.138  16.810  -4.852
  158    H    ALA  20           HN       ALA  20  39.636  16.161  -4.368
  159    HA   ALA  20           HA       ALA  20  37.509  16.584  -5.210
  160    HB1  ALA  20           HB1      ALA  20  36.416  18.608  -4.303
  161    HB2  ALA  20           HB2      ALA  20  38.005  19.225  -3.791
  162    HB3  ALA  20           HB3      ALA  20  37.347  17.743  -3.057
  163    H    LEU  21           HN       LEU  21  40.048  17.671  -6.670
  164    HA   LEU  21           HA       LEU  21  38.916  19.878  -8.268
  165    HB2  LEU  21           HB2      LEU  21  41.406  19.503  -7.589
  166    HB3  LEU  21           HB1      LEU  21  41.434  18.300  -8.894
  167    HG   LEU  21           HG       LEU  21  40.383  20.266 -10.354
  168   HD11  LEU  21          HD11      LEU  21  41.731  21.776  -8.065
  169   HD12  LEU  21          HD12      LEU  21  40.028  21.896  -8.566
  170   HD13  LEU  21          HD13      LEU  21  41.314  22.496  -9.635
  171   HD21  LEU  21          HD21      LEU  21  43.300  20.250  -9.456
  172   HD22  LEU  21          HD22      LEU  21  42.682  21.041 -10.927
  173   HD23  LEU  21          HD23      LEU  21  42.596  19.271 -10.765
  174    H    ASP  22           HN       ASP  22  38.794  16.467  -8.256
  175    HA   ASP  22           HA       ASP  22  38.640  16.080 -11.143
  176    HB2  ASP  22           HB2      ASP  22  37.875  13.817 -10.559
  177    HB3  ASP  22           HB1      ASP  22  39.295  14.268  -9.586
  178    H    HIS  23           HN       HIS  23  36.949  18.220 -10.201
  179    HA   HIS  23           HA       HIS  23  34.766  18.976 -10.401
  180    HB2  HIS  23           HB2      HIS  23  35.241  18.151 -12.741
  181    HB3  HIS  23           HB1      HIS  23  34.443  16.622 -12.303
  182    HD1  HIS  23           HD1      HIS  23  33.743  20.366 -12.630
  183    HD2  HIS  23           HD2      HIS  23  31.633  16.751 -12.229
  184    HE1  HIS  23           HE1      HIS  23  31.274  20.877 -13.036
  185    H    LEU  24           HN       LEU  24  35.399  16.912  -8.346
  186    HA   LEU  24           HA       LEU  24  33.261  15.029  -8.149
  187    HB2  LEU  24           HB2      LEU  24  35.501  15.352  -6.757
  188    HB3  LEU  24           HB1      LEU  24  34.467  16.319  -5.683
  189    HG   LEU  24           HG       LEU  24  34.054  13.403  -6.493
  190   HD11  LEU  24          HD11      LEU  24  35.792  13.830  -4.767
  191   HD12  LEU  24          HD12      LEU  24  34.381  12.991  -4.081
  192   HD13  LEU  24          HD13      LEU  24  34.603  14.735  -3.802
  193   HD21  LEU  24          HD21      LEU  24  31.854  14.335  -6.342
  194   HD22  LEU  24          HD22      LEU  24  32.296  15.361  -4.955
  195   HD23  LEU  24          HD23      LEU  24  32.149  13.600  -4.751
  Start of MODEL   79
    1    H1   GLY   1           HT1      GLY   1  60.069   4.647  -1.993
    2    H2   GLY   1           HT2      GLY   1  58.487   4.360  -2.543
    3    H3   GLY   1           HT3      GLY   1  59.775   4.438  -3.649
    4    HA2  GLY   1           HA1      GLY   1  59.128   2.191  -3.319
    5    HA3  GLY   1           HA2      GLY   1  60.759   2.491  -2.688
    6    H    LYS   2           HN       LYS   2  59.127   4.123  -0.515
    7    HA   LYS   2           HA       LYS   2  57.825   2.008   1.014
    8    HB2  LYS   2           HB2      LYS   2  59.481   2.074   2.909
    9    HB3  LYS   2           HB1      LYS   2  60.097   1.280   1.439
   10    HG2  LYS   2           HG2      LYS   2  61.244   3.369   0.779
   11    HG3  LYS   2           HG1      LYS   2  60.618   4.179   2.236
   12    HD2  LYS   2           HD2      LYS   2  61.817   2.565   3.669
   13    HD3  LYS   2           HD1      LYS   2  62.424   1.720   2.224
   14    HE2  LYS   2           HE2      LYS   2  63.597   3.772   1.500
   15    HE3  LYS   2           HE1      LYS   2  62.981   4.635   2.930
   16    HZ1  LYS   2           HZ1      LYS   2  64.686   2.196   3.012
   17    HZ2  LYS   2           HZ2      LYS   2  64.152   3.099   4.349
   18    HZ3  LYS   2           HZ3      LYS   2  65.246   3.781   3.240
   19    H    GLY   3           HN       GLY   3  57.702   2.868   3.465
   20    HA2  GLY   3           HA1      GLY   3  57.670   5.172   4.666
   21    HA3  GLY   3           HA2      GLY   3  56.738   5.766   3.214
   22    H    ARG   4           HN       ARG   4  55.520   4.502   2.288
   23    HA   ARG   4           HA       ARG   4  53.937   5.787   3.604
   24    HB2  ARG   4           HB2      ARG   4  53.017   3.726   1.540
   25    HB3  ARG   4           HB1      ARG   4  52.015   5.083   2.117
   26    HG2  ARG   4           HG2      ARG   4  53.687   6.700   1.343
   27    HG3  ARG   4           HG1      ARG   4  54.777   5.380   0.853
   28    HD2  ARG   4           HD2      ARG   4  53.246   4.640  -0.860
   29    HD3  ARG   4           HD1      ARG   4  51.964   5.718  -0.261
   30    HE   ARG   4           HE       ARG   4  54.337   7.211  -1.010
   31   HH11  ARG   4          HH11      ARG   4  51.977   8.565  -1.668
   32   HH12  ARG   4          HH12      ARG   4  51.662   8.197  -3.331
   33   HH21  ARG   4          HH21      ARG   4  53.753   5.430  -3.388
   34   HH22  ARG   4          HH22      ARG   4  52.669   6.422  -4.304
   35    H    TRP   5           HN       TRP   5  54.845   2.821   4.305
   36    HA   TRP   5           HA       TRP   5  52.811   1.149   5.186
   37    HB2  TRP   5           HB2      TRP   5  55.221   0.681   5.502
   38    HB3  TRP   5           HB1      TRP   5  55.281   1.886   6.810
   39    HD1  TRP   5           HD1      TRP   5  52.852  -1.056   6.030
   40    HE1  TRP   5           HE1      TRP   5  52.514  -2.454   8.195
   41    HE3  TRP   5           HE3      TRP   5  55.938   1.558   9.173
   42    HZ2  TRP   5           HZ2      TRP   5  53.471  -2.419  10.908
   43    HZ3  TRP   5           HZ3      TRP   5  56.211   0.855  11.546
   44    HH2  TRP   5           HH2      TRP   5  54.980  -1.130  12.415
   45    H    LEU   6           HN       LEU   6  53.456   4.350   6.291
   46    HA   LEU   6           HA       LEU   6  51.494   4.028   8.560
   47    HB2  LEU   6           HB2      LEU   6  53.544   6.244   8.200
   48    HB3  LEU   6           HB1      LEU   6  52.564   5.888   9.639
   49    HG   LEU   6           HG       LEU   6  54.671   4.017   8.460
   50   HD11  LEU   6          HD11      LEU   6  55.677   6.065   9.402
   51   HD12  LEU   6          HD12      LEU   6  56.007   4.666  10.453
   52   HD13  LEU   6          HD13      LEU   6  54.748   5.842  10.905
   53   HD21  LEU   6          HD21      LEU   6  53.078   2.684   9.646
   54   HD22  LEU   6          HD22      LEU   6  52.865   3.916  10.914
   55   HD23  LEU   6          HD23      LEU   6  54.375   2.978  10.826
   56    H    GLU   7           HN       GLU   7  52.235   5.554   5.488
   57    HA   GLU   7           HA       GLU   7  50.124   7.625   5.887
   58    HB2  GLU   7           HB2      GLU   7  52.433   7.939   4.686
   59    HB3  GLU   7           HB1      GLU   7  51.665   7.104   3.317
   60    HG2  GLU   7           HG2      GLU   7  49.855   8.799   3.295
   61    HG3  GLU   7           HG1      GLU   7  50.596   9.617   4.689
   62    H    ARG   8           HN       ARG   8  49.442   4.770   5.921
   63    HA   ARG   8           HA       ARG   8  48.429   3.774   3.503
   64    HB2  ARG   8           HB2      ARG   8  47.203   3.599   6.283
   65    HB3  ARG   8           HB1      ARG   8  46.767   2.564   4.902
   66    HG2  ARG   8           HG2      ARG   8  49.187   1.867   4.745
   67    HG3  ARG   8           HG1      ARG   8  49.495   2.773   6.246
   68    HD2  ARG   8           HD2      ARG   8  47.468   0.513   5.955
   69    HD3  ARG   8           HD1      ARG   8  49.087   0.347   6.677
   70    HE   ARG   8           HE       ARG   8  47.732   2.472   8.012
   71   HH11  ARG   8          HH11      ARG   8  48.681   1.008  10.027
   72   HH12  ARG   8          HH12      ARG   8  47.489  -0.164  10.479
   73   HH21  ARG   8          HH21      ARG   8  45.705   0.120   7.519
   74   HH22  ARG   8          HH22      ARG   8  45.803  -0.667   9.059
   75    H    ILE   9           HN       ILE   9  46.467   5.539   5.956
   76    HA   ILE   9           HA       ILE   9  44.197   5.887   4.352
   77    HB   ILE   9           HB       ILE   9  44.094   6.443   6.699
   78   HG12  ILE   9          HG12      ILE   9  42.968   8.603   6.664
   79   HG13  ILE   9          HG11      ILE   9  43.798   9.072   5.167
   80   HG21  ILE   9          HG21      ILE   9  45.384   8.095   7.798
   81   HG22  ILE   9          HG22      ILE   9  45.868   8.876   6.279
   82   HG23  ILE   9          HG23      ILE   9  46.550   7.297   6.724
   83   HD11  ILE   9           HD1      ILE   9  42.076   6.569   5.278
   84   HD12  ILE   9           HD2      ILE   9  42.568   7.523   3.857
   85   HD13  ILE   9           HD3      ILE   9  41.357   8.171   4.986
   86    H    GLY  10           HN       GLY  10  44.403   6.442   2.257
   87    HA2  GLY  10           HA1      GLY  10  46.160   8.658   1.447
   88    HA3  GLY  10           HA2      GLY  10  45.128   7.668   0.398
   89    H    LYS  11           HN       LYS  11  42.639   8.025   1.625
   90    HA   LYS  11           HA       LYS  11  41.803  10.456   0.433
   91    HB2  LYS  11           HB2      LYS  11  40.477   8.879   2.674
   92    HB3  LYS  11           HB1      LYS  11  39.687  10.116   1.668
   93    HG2  LYS  11           HG2      LYS  11  40.079   8.784  -0.350
   94    HG3  LYS  11           HG1      LYS  11  40.989   7.577   0.592
   95    HD2  LYS  11           HD2      LYS  11  38.969   7.080   1.928
   96    HD3  LYS  11           HD1      LYS  11  38.053   8.298   1.005
   97    HE2  LYS  11           HE2      LYS  11  37.555   6.150   0.023
   98    HE3  LYS  11           HE1      LYS  11  38.645   6.997  -1.102
   99    HZ1  LYS  11           HZ1      LYS  11  40.456   5.711  -0.412
  100    HZ2  LYS  11           HZ2      LYS  11  39.183   4.591  -0.540
  101    HZ3  LYS  11           HZ3      LYS  11  39.671   5.157   0.985
  102    H    ALA  12           HN       ALA  12  42.596  12.390   0.993
  103    HA   ALA  12           HA       ALA  12  43.408  13.009   3.704
  104    HB1  ALA  12           HB1      ALA  12  42.770  14.884   1.402
  105    HB2  ALA  12           HB2      ALA  12  44.342  14.090   1.666
  106    HB3  ALA  12           HB3      ALA  12  43.726  15.268   2.853
  107    H    GLY  13           HN       GLY  13  40.430  12.431   2.473
  108    HA2  GLY  13           HA1      GLY  13  38.275  13.149   2.988
  109    HA3  GLY  13           HA2      GLY  13  38.917  13.174   4.641
  110    H    PHE  14           HN       PHE  14  39.952  15.302   1.993
  111    HA   PHE  14           HA       PHE  14  38.249  17.506   2.801
  112    HB2  PHE  14           HB2      PHE  14  39.740  17.465   4.769
  113    HB3  PHE  14           HB1      PHE  14  41.157  17.598   3.701
  114    HD1  PHE  14           HD1      PHE  14  37.822  19.315   4.237
  115    HD2  PHE  14           HD2      PHE  14  42.036  19.768   3.388
  116    HE1  PHE  14           HE1      PHE  14  37.559  21.790   4.223
  117    HE2  PHE  14           HE2      PHE  14  41.763  22.242   3.373
  118    HZ   PHE  14           HZ       PHE  14  39.513  23.249   3.722
  119    H    ILE  15           HN       ILE  15  40.661  16.008   0.891
  120    HA   ILE  15           HA       ILE  15  40.239  17.978  -1.236
  121    HB   ILE  15           HB       ILE  15  42.737  18.313  -1.612
  122   HG12  ILE  15          HG12      ILE  15  42.836  17.250   1.250
  123   HG13  ILE  15          HG11      ILE  15  43.531  16.462  -0.184
  124   HG21  ILE  15          HG21      ILE  15  42.869  20.213  -0.171
  125   HG22  ILE  15          HG22      ILE  15  41.830  19.456   1.058
  126   HG23  ILE  15          HG23      ILE  15  41.134  19.997  -0.487
  127   HD11  ILE  15           HD1      ILE  15  44.869  18.673  -0.509
  128   HD12  ILE  15           HD2      ILE  15  45.374  17.584   0.804
  129   HD13  ILE  15           HD3      ILE  15  44.409  19.031   1.174
  130    H    ILE  16           HN       ILE  16  39.364  15.484  -1.242
  131    HA   ILE  16           HA       ILE  16  41.114  14.214  -3.296
  132    HB   ILE  16           HB       ILE  16  41.614  13.173  -1.042
  133   HG12  ILE  16          HG12      ILE  16  41.238  10.794  -1.848
  134   HG13  ILE  16          HG11      ILE  16  40.266  11.450  -3.182
  135   HG21  ILE  16          HG21      ILE  16  39.956  11.886   0.103
  136   HG22  ILE  16          HG22      ILE  16  38.810  12.017  -1.251
  137   HG23  ILE  16          HG23      ILE  16  39.184  13.448  -0.259
  138   HD11  ILE  16           HD1      ILE  16  42.130  12.359  -4.278
  139   HD12  ILE  16           HD2      ILE  16  42.876  10.941  -3.510
  140   HD13  ILE  16           HD3      ILE  16  43.063  12.547  -2.774
  141    H    ILE  17           HN       ILE  17  38.006  14.222  -1.516
  142    HA   ILE  17           HA       ILE  17  36.585  12.667  -3.458
  143    HB   ILE  17           HB       ILE  17  34.548  13.415  -2.445
  144   HG12  ILE  17          HG12      ILE  17  34.783  15.818  -2.446
  145   HG13  ILE  17          HG11      ILE  17  34.537  15.329  -0.762
  146   HG21  ILE  17          HG21      ILE  17  36.849  13.092  -0.492
  147   HG22  ILE  17          HG22      ILE  17  35.627  11.907  -0.986
  148   HG23  ILE  17          HG23      ILE  17  35.174  13.257   0.075
  149   HD11  ILE  17           HD1      ILE  17  37.143  16.160  -2.100
  150   HD12  ILE  17           HD2      ILE  17  37.086  15.387  -0.499
  151   HD13  ILE  17           HD3      ILE  17  36.300  16.955  -0.756
  152    H    GLY  18           HN       GLY  18  38.127  15.555  -3.865
  153    HA2  GLY  18           HA1      GLY  18  37.062  16.013  -6.454
  154    HA3  GLY  18           HA2      GLY  18  36.243  17.113  -5.330
  155    H    GLY  19           HN       GLY  19  39.017  16.760  -3.773
  156    HA2  GLY  19           HA1      GLY  19  40.039  19.312  -4.601
  157    HA3  GLY  19           HA2      GLY  19  40.843  18.158  -3.521
  158    H    ALA  20           HN       ALA  20  40.897  15.969  -5.421
  159    HA   ALA  20           HA       ALA  20  43.366  16.695  -6.768
  160    HB1  ALA  20           HB1      ALA  20  43.220  14.389  -7.689
  161    HB2  ALA  20           HB2      ALA  20  41.599  14.234  -6.970
  162    HB3  ALA  20           HB3      ALA  20  43.023  14.443  -5.922
  163    H    LEU  21           HN       LEU  21  40.073  17.082  -7.544
  164    HA   LEU  21           HA       LEU  21  39.014  17.753  -9.488
  165    HB2  LEU  21           HB2      LEU  21  41.174  19.286  -9.396
  166    HB3  LEU  21           HB1      LEU  21  41.697  18.317 -10.790
  167    HG   LEU  21           HG       LEU  21  39.065  19.857 -10.585
  168   HD11  LEU  21          HD11      LEU  21  40.102  21.337 -12.287
  169   HD12  LEU  21          HD12      LEU  21  41.609  20.396 -12.182
  170   HD13  LEU  21          HD13      LEU  21  41.043  21.330 -10.776
  171   HD21  LEU  21          HD21      LEU  21  39.118  19.344 -13.142
  172   HD22  LEU  21          HD22      LEU  21  38.667  18.020 -12.047
  173   HD23  LEU  21          HD23      LEU  21  40.311  18.087 -12.728
  174    H    ASP  22           HN       ASP  22  38.055  16.116 -10.505
  175    HA   ASP  22           HA       ASP  22  37.750  14.314 -11.927
  176    HB2  ASP  22           HB2      ASP  22  38.708  15.992 -13.551
  177    HB3  ASP  22           HB1      ASP  22  40.304  15.251 -13.283
  178    H    HIS  23           HN       HIS  23  39.563  14.126  -9.502
  179    HA   HIS  23           HA       HIS  23  40.972  12.551  -8.533
  180    HB2  HIS  23           HB2      HIS  23  38.981  11.149  -9.108
  181    HB3  HIS  23           HB1      HIS  23  39.768  10.720 -10.645
  182    HD1  HIS  23           HD1      HIS  23  39.462   8.235  -9.352
  183    HD2  HIS  23           HD2      HIS  23  42.531  10.816  -8.088
  184    HE1  HIS  23           HE1      HIS  23  41.137   6.836  -8.026
  185    H    LEU  24           HN       LEU  24  42.164  14.174 -10.576
  186    HA   LEU  24           HA       LEU  24  44.546  12.584 -11.040
  187    HB2  LEU  24           HB2      LEU  24  42.769  11.952 -12.907
  188    HB3  LEU  24           HB1      LEU  24  43.247  13.506 -13.621
  189    HG   LEU  24           HG       LEU  24  45.083  11.159 -12.953
  190   HD11  LEU  24          HD11      LEU  24  44.324  12.472 -15.601
  191   HD12  LEU  24          HD12      LEU  24  43.680  10.924 -15.003
  192   HD13  LEU  24          HD13      LEU  24  45.410  11.077 -15.392
  193   HD21  LEU  24          HD21      LEU  24  46.790  12.664 -14.194
  194   HD22  LEU  24          HD22      LEU  24  46.383  13.118 -12.524
  195   HD23  LEU  24          HD23      LEU  24  45.654  14.001 -13.888
  Start of MODEL   80
    1    H1   GLY   1           HT1      GLY   1  60.096  -2.865   1.544
    2    H2   GLY   1           HT2      GLY   1  58.660  -3.053   0.653
    3    H3   GLY   1           HT3      GLY   1  59.648  -4.397   0.977
    4    HA2  GLY   1           HA1      GLY   1  57.669  -4.320   2.355
    5    HA3  GLY   1           HA2      GLY   1  59.192  -4.305   3.264
    6    H    LYS   2           HN       LYS   2  59.268  -1.381   1.933
    7    HA   LYS   2           HA       LYS   2  58.491  -0.046   4.376
    8    HB2  LYS   2           HB2      LYS   2  60.248   0.715   2.685
    9    HB3  LYS   2           HB1      LYS   2  58.902   1.219   1.641
   10    HG2  LYS   2           HG2      LYS   2  59.355   3.218   2.793
   11    HG3  LYS   2           HG1      LYS   2  58.065   2.525   3.798
   12    HD2  LYS   2           HD2      LYS   2  59.705   1.670   5.399
   13    HD3  LYS   2           HD1      LYS   2  61.049   2.166   4.344
   14    HE2  LYS   2           HE2      LYS   2  60.329   4.535   4.562
   15    HE3  LYS   2           HE1      LYS   2  59.018   4.024   5.652
   16    HZ1  LYS   2           HZ1      LYS   2  61.113   4.807   6.759
   17    HZ2  LYS   2           HZ2      LYS   2  61.882   3.415   6.161
   18    HZ3  LYS   2           HZ3      LYS   2  60.577   3.271   7.239
   19    H    GLY   3           HN       GLY   3  56.286  -0.998   4.494
   20    HA2  GLY   3           HA1      GLY   3  54.117  -0.564   2.783
   21    HA3  GLY   3           HA2      GLY   3  53.963  -0.341   4.587
   22    H    ARG   4           HN       ARG   4  55.103   1.024   5.468
   23    HA   ARG   4           HA       ARG   4  52.991   2.202   5.350
   24    HB2  ARG   4           HB2      ARG   4  55.429   3.313   6.813
   25    HB3  ARG   4           HB1      ARG   4  53.768   3.883   7.109
   26    HG2  ARG   4           HG2      ARG   4  53.049   1.711   7.843
   27    HG3  ARG   4           HG1      ARG   4  54.538   0.940   7.244
   28    HD2  ARG   4           HD2      ARG   4  54.533   1.268   9.736
   29    HD3  ARG   4           HD1      ARG   4  55.877   2.104   8.922
   30    HE   ARG   4           HE       ARG   4  54.978   4.081   9.820
   31   HH11  ARG   4          HH11      ARG   4  53.040   5.400   9.037
   32   HH12  ARG   4          HH12      ARG   4  51.524   4.840   9.660
   33   HH21  ARG   4          HH21      ARG   4  52.783   1.784  10.710
   34   HH22  ARG   4          HH22      ARG   4  51.379   2.793  10.607
   35    H    TRP   5           HN       TRP   5  55.503   2.817   3.475
   36    HA   TRP   5           HA       TRP   5  55.897   5.530   2.962
   37    HB2  TRP   5           HB2      TRP   5  56.902   3.600   1.690
   38    HB3  TRP   5           HB1      TRP   5  55.370   3.469   0.792
   39    HD1  TRP   5           HD1      TRP   5  57.717   6.426   1.730
   40    HE1  TRP   5           HE1      TRP   5  58.058   7.923  -0.369
   41    HE3  TRP   5           HE3      TRP   5  54.859   3.800  -1.605
   42    HZ2  TRP   5           HZ2      TRP   5  57.190   7.946  -3.115
   43    HZ3  TRP   5           HZ3      TRP   5  54.628   4.576  -3.959
   44    HH2  TRP   5           HH2      TRP   5  55.791   6.645  -4.717
   45    H    LEU   6           HN       LEU   6  52.949   3.769   2.718
   46    HA   LEU   6           HA       LEU   6  51.625   6.069   1.284
   47    HB2  LEU   6           HB2      LEU   6  50.622   3.208   1.486
   48    HB3  LEU   6           HB1      LEU   6  49.999   4.514   0.452
   49    HG   LEU   6           HG       LEU   6  52.776   3.261   0.250
   50   HD11  LEU   6          HD11      LEU   6  50.961   1.753  -0.496
   51   HD12  LEU   6          HD12      LEU   6  51.910   2.334  -1.884
   52   HD13  LEU   6          HD13      LEU   6  50.313   3.039  -1.539
   53   HD21  LEU   6          HD21      LEU   6  53.012   5.497  -0.521
   54   HD22  LEU   6          HD22      LEU   6  51.374   5.530  -1.219
   55   HD23  LEU   6          HD23      LEU   6  52.661   4.589  -2.009
   56    H    GLU   7           HN       GLU   7  51.897   4.303   4.292
   57    HA   GLU   7           HA       GLU   7  49.183   4.644   5.181
   58    HB2  GLU   7           HB2      GLU   7  51.073   3.254   6.260
   59    HB3  GLU   7           HB1      GLU   7  51.618   4.779   6.991
   60    HG2  GLU   7           HG2      GLU   7  50.169   3.749   8.606
   61    HG3  GLU   7           HG1      GLU   7  49.231   5.068   7.869
   62    H    ARG   8           HN       ARG   8  51.833   6.852   4.759
   63    HA   ARG   8           HA       ARG   8  51.341   8.873   6.610
   64    HB2  ARG   8           HB2      ARG   8  53.117   8.848   4.821
   65    HB3  ARG   8           HB1      ARG   8  51.870   9.347   3.653
   66    HG2  ARG   8           HG2      ARG   8  51.408  11.373   4.985
   67    HG3  ARG   8           HG1      ARG   8  52.621  10.869   6.188
   68    HD2  ARG   8           HD2      ARG   8  54.395  10.982   4.487
   69    HD3  ARG   8           HD1      ARG   8  53.197  11.411   3.242
   70    HE   ARG   8           HE       ARG   8  53.488  13.620   3.990
   71   HH11  ARG   8          HH11      ARG   8  52.038  14.199   6.138
   72   HH12  ARG   8          HH12      ARG   8  53.063  14.189   7.534
   73   HH21  ARG   8          HH21      ARG   8  55.596  12.393   5.990
   74   HH22  ARG   8          HH22      ARG   8  55.077  13.166   7.451
   75    H    ILE   9           HN       ILE   9  49.400   9.567   7.254
   76    HA   ILE   9           HA       ILE   9  47.027   9.552   5.775
   77    HB   ILE   9           HB       ILE   9  46.908   9.951   8.141
   78   HG12  ILE   9          HG12      ILE   9  45.424  11.861   8.296
   79   HG13  ILE   9          HG11      ILE   9  46.129  12.607   6.845
   80   HG21  ILE   9          HG21      ILE   9  48.276  12.648   7.811
   81   HG22  ILE   9          HG22      ILE   9  49.176  11.168   8.207
   82   HG23  ILE   9          HG23      ILE   9  47.915  11.763   9.308
   83   HD11  ILE   9           HD1      ILE   9  44.841   9.854   6.745
   84   HD12  ILE   9           HD2      ILE   9  45.172  10.975   5.402
   85   HD13  ILE   9           HD3      ILE   9  43.881  11.341   6.568
   86    H    GLY  10           HN       GLY  10  47.038  10.228   3.706
   87    HA2  GLY  10           HA1      GLY  10  47.970  13.026   3.134
   88    HA3  GLY  10           HA2      GLY  10  47.768  11.724   1.946
   89    H    LYS  11           HN       LYS  11  45.169  11.035   3.489
   90    HA   LYS  11           HA       LYS  11  43.411  12.408   1.685
   91    HB2  LYS  11           HB2      LYS  11  42.669  11.108   4.331
   92    HB3  LYS  11           HB1      LYS  11  41.613  11.378   2.923
   93    HG2  LYS  11           HG2      LYS  11  43.013   9.863   1.564
   94    HG3  LYS  11           HG1      LYS  11  44.100   9.610   2.950
   95    HD2  LYS  11           HD2      LYS  11  42.163   8.710   4.258
   96    HD3  LYS  11           HD1      LYS  11  41.145   8.872   2.807
   97    HE2  LYS  11           HE2      LYS  11  43.729   7.263   2.863
   98    HE3  LYS  11           HE1      LYS  11  42.126   6.552   3.171
   99    HZ1  LYS  11           HZ1      LYS  11  41.462   6.898   1.021
  100    HZ2  LYS  11           HZ2      LYS  11  43.117   6.602   0.774
  101    HZ3  LYS  11           HZ3      LYS  11  42.525   8.194   0.761
  102    H    ALA  12           HN       ALA  12  43.430  14.602   1.743
  103    HA   ALA  12           HA       ALA  12  43.630  16.175   4.113
  104    HB1  ALA  12           HB1      ALA  12  43.896  16.889   1.664
  105    HB2  ALA  12           HB2      ALA  12  43.046  18.021   2.743
  106    HB3  ALA  12           HB3      ALA  12  42.119  16.999   1.617
  107    H    GLY  13           HN       GLY  13  41.215  14.057   3.206
  108    HA2  GLY  13           HA1      GLY  13  39.053  13.725   3.954
  109    HA3  GLY  13           HA2      GLY  13  39.496  14.727   5.351
  110    H    PHE  14           HN       PHE  14  40.016  16.388   2.470
  111    HA   PHE  14           HA       PHE  14  37.642  18.088   2.994
  112    HB2  PHE  14           HB2      PHE  14  40.120  18.829   2.436
  113    HB3  PHE  14           HB1      PHE  14  39.632  18.557   0.750
  114    HD1  PHE  14           HD1      PHE  14  38.315  20.176   3.900
  115    HD2  PHE  14           HD2      PHE  14  38.662  20.390  -0.399
  116    HE1  PHE  14           HE1      PHE  14  37.161  22.383   3.915
  117    HE2  PHE  14           HE2      PHE  14  37.506  22.596  -0.381
  118    HZ   PHE  14           HZ       PHE  14  36.701  23.562   1.769
  119    H    ILE  15           HN       ILE  15  39.127  16.611   0.045
  120    HA   ILE  15           HA       ILE  15  36.481  15.661  -0.821
  121    HB   ILE  15           HB       ILE  15  36.610  16.825  -3.043
  122   HG12  ILE  15          HG12      ILE  15  38.830  18.372  -1.629
  123   HG13  ILE  15          HG11      ILE  15  39.009  17.331  -3.059
  124   HG21  ILE  15          HG21      ILE  15  36.564  18.857  -0.775
  125   HG22  ILE  15          HG22      ILE  15  35.256  17.678  -1.030
  126   HG23  ILE  15          HG23      ILE  15  35.629  18.877  -2.288
  127   HD11  ILE  15           HD1      ILE  15  38.914  19.526  -3.956
  128   HD12  ILE  15           HD2      ILE  15  37.620  20.022  -2.841
  129   HD13  ILE  15           HD3      ILE  15  37.261  18.903  -4.180
  130    H    ILE  16           HN       ILE  16  38.823  14.367  -0.064
  131    HA   ILE  16           HA       ILE  16  40.162  13.516  -2.582
  132    HB   ILE  16           HB       ILE  16  40.541  12.999   0.387
  133   HG12  ILE  16          HG12      ILE  16  42.785  13.879  -0.061
  134   HG13  ILE  16          HG11      ILE  16  42.465  13.892  -1.810
  135   HG21  ILE  16          HG21      ILE  16  42.500  11.477  -0.358
  136   HG22  ILE  16          HG22      ILE  16  41.686  11.394  -1.940
  137   HG23  ILE  16          HG23      ILE  16  40.867  10.783  -0.482
  138   HD11  ILE  16           HD1      ILE  16  42.213  16.138  -0.584
  139   HD12  ILE  16           HD2      ILE  16  40.751  15.449   0.163
  140   HD13  ILE  16           HD3      ILE  16  40.846  15.639  -1.605
  141    H    ILE  17           HN       ILE  17  38.094  12.216   0.035
  142    HA   ILE  17           HA       ILE  17  37.821   9.625  -1.281
  143    HB   ILE  17           HB       ILE  17  36.307   9.027   0.457
  144   HG12  ILE  17          HG12      ILE  17  34.728  10.847   0.488
  145   HG13  ILE  17          HG11      ILE  17  35.427  10.766   2.112
  146   HG21  ILE  17          HG21      ILE  17  37.538   9.908   2.552
  147   HG22  ILE  17          HG22      ILE  17  38.543  10.843   1.426
  148   HG23  ILE  17          HG23      ILE  17  38.509   9.073   1.323
  149   HD11  ILE  17           HD1      ILE  17  37.038  12.604   1.421
  150   HD12  ILE  17           HD2      ILE  17  35.333  13.090   1.455
  151   HD13  ILE  17           HD3      ILE  17  36.121  12.750  -0.098
  152    H    GLY  18           HN       GLY  18  37.023  12.306  -2.614
  153    HA2  GLY  18           HA1      GLY  18  34.611  11.195  -3.889
  154    HA3  GLY  18           HA2      GLY  18  34.356  12.703  -2.991
  155    H    GLY  19           HN       GLY  19  36.874  13.956  -3.545
  156    HA2  GLY  19           HA1      GLY  19  36.292  14.789  -6.340
  157    HA3  GLY  19           HA2      GLY  19  37.337  15.619  -5.175
  158    H    ALA  20           HN       ALA  20  38.243  12.484  -4.892
  159    HA   ALA  20           HA       ALA  20  40.658  12.940  -6.494
  160    HB1  ALA  20           HB1      ALA  20  39.715  10.497  -4.953
  161    HB2  ALA  20           HB2      ALA  20  40.764  11.794  -4.327
  162    HB3  ALA  20           HB3      ALA  20  41.339  10.736  -5.637
  163    H    LEU  21           HN       LEU  21  38.486  13.047  -8.190
  164    HA   LEU  21           HA       LEU  21  38.962  10.592  -9.861
  165    HB2  LEU  21           HB2      LEU  21  36.433  10.943 -10.548
  166    HB3  LEU  21           HB1      LEU  21  36.825  10.048  -9.062
  167    HG   LEU  21           HG       LEU  21  36.455  12.059  -7.705
  168   HD11  LEU  21          HD11      LEU  21  36.066  13.365 -10.426
  169   HD12  LEU  21          HD12      LEU  21  37.135  13.871  -9.095
  170   HD13  LEU  21          HD13      LEU  21  35.376  14.071  -8.945
  171   HD21  LEU  21          HD21      LEU  21  34.021  12.291  -8.084
  172   HD22  LEU  21          HD22      LEU  21  34.527  10.594  -8.256
  173   HD23  LEU  21          HD23      LEU  21  34.200  11.576  -9.703
  174    H    ASP  22           HN       ASP  22  39.449  13.765  -9.568
  175    HA   ASP  22           HA       ASP  22  38.460  14.723 -12.149
  176    HB2  ASP  22           HB2      ASP  22  40.585  15.874 -10.294
  177    HB3  ASP  22           HB1      ASP  22  39.796  16.723 -11.645
  178    H    HIS  23           HN       HIS  23  41.267  13.032 -10.963
  179    HA   HIS  23           HA       HIS  23  42.226  12.604 -13.675
  180    HB2  HIS  23           HB2      HIS  23  43.103  14.891 -13.317
  181    HB3  HIS  23           HB1      HIS  23  43.925  14.339 -11.837
  182    HD1  HIS  23           HD1      HIS  23  46.325  13.816 -12.213
  183    HD2  HIS  23           HD2      HIS  23  44.003  13.066 -15.638
  184    HE1  HIS  23           HE1      HIS  23  47.898  12.931 -14.021
  185    H    LEU  24           HN       LEU  24  42.921  12.588 -10.179
  186    HA   LEU  24           HA       LEU  24  44.911  10.531 -10.267
  187    HB2  LEU  24           HB2      LEU  24  44.678  11.908  -8.295
  188    HB3  LEU  24           HB1      LEU  24  42.980  11.425  -8.090
  189    HG   LEU  24           HG       LEU  24  43.616   9.155  -7.512
  190   HD11  LEU  24          HD11      LEU  24  46.383  10.052  -8.410
  191   HD12  LEU  24          HD12      LEU  24  45.438   8.647  -8.962
  192   HD13  LEU  24          HD13      LEU  24  46.161   8.648  -7.337
  193   HD21  LEU  24          HD21      LEU  24  44.862   9.561  -5.457
  194   HD22  LEU  24          HD22      LEU  24  43.800  10.958  -5.758
  195   HD23  LEU  24          HD23      LEU  24  45.540  11.068  -6.118
  Start of MODEL   81
    1    H1   GLY   1           HT1      GLY   1  61.315  -3.576   3.654
    2    H2   GLY   1           HT2      GLY   1  60.716  -2.126   4.308
    3    H3   GLY   1           HT3      GLY   1  61.166  -2.204   2.671
    4    HA2  GLY   1           HA1      GLY   1  59.428  -3.747   2.211
    5    HA3  GLY   1           HA2      GLY   1  58.972  -3.714   3.926
    6    H    LYS   2           HN       LYS   2  60.078  -0.681   3.122
    7    HA   LYS   2           HA       LYS   2  58.959   1.340   2.898
    8    HB2  LYS   2           HB2      LYS   2  57.277  -0.304   0.964
    9    HB3  LYS   2           HB1      LYS   2  57.328   1.474   1.042
   10    HG2  LYS   2           HG2      LYS   2  59.811   1.361   0.632
   11    HG3  LYS   2           HG1      LYS   2  59.646  -0.395   0.391
   12    HD2  LYS   2           HD2      LYS   2  57.979   0.056  -1.431
   13    HD3  LYS   2           HD1      LYS   2  58.293   1.798  -1.238
   14    HE2  LYS   2           HE2      LYS   2  59.673   0.970  -3.064
   15    HE3  LYS   2           HE1      LYS   2  60.733   1.344  -1.683
   16    HZ1  LYS   2           HZ1      LYS   2  59.662  -1.362  -2.317
   17    HZ2  LYS   2           HZ2      LYS   2  60.768  -0.972  -1.088
   18    HZ3  LYS   2           HZ3      LYS   2  61.218  -0.822  -2.721
   19    H    GLY   3           HN       GLY   3  58.278   0.472   5.221
   20    HA2  GLY   3           HA1      GLY   3  55.638  -0.342   5.847
   21    HA3  GLY   3           HA2      GLY   3  56.576   0.843   6.870
   22    H    ARG   4           HN       ARG   4  57.201   2.529   6.021
   23    HA   ARG   4           HA       ARG   4  55.261   3.318   7.242
   24    HB2  ARG   4           HB2      ARG   4  57.175   5.212   5.800
   25    HB3  ARG   4           HB1      ARG   4  56.071   5.726   7.099
   26    HG2  ARG   4           HG2      ARG   4  57.080   4.077   8.635
   27    HG3  ARG   4           HG1      ARG   4  58.166   3.519   7.339
   28    HD2  ARG   4           HD2      ARG   4  59.087   5.854   7.179
   29    HD3  ARG   4           HD1      ARG   4  58.085   6.304   8.579
   30    HE   ARG   4           HE       ARG   4  59.776   3.981   9.102
   31   HH11  ARG   4          HH11      ARG   4  59.297   5.675  11.342
   32   HH12  ARG   4          HH12      ARG   4  60.693   6.695  11.439
   33   HH21  ARG   4          HH21      ARG   4  61.716   6.049   8.189
   34   HH22  ARG   4          HH22      ARG   4  62.063   6.908   9.654
   35    H    TRP   5           HN       TRP   5  55.325   2.894   4.097
   36    HA   TRP   5           HA       TRP   5  54.066   4.820   2.573
   37    HB2  TRP   5           HB2      TRP   5  54.570   2.508   1.812
   38    HB3  TRP   5           HB1      TRP   5  53.167   1.924   2.744
   39    HD1  TRP   5           HD1      TRP   5  50.960   1.863   1.485
   40    HE1  TRP   5           HE1      TRP   5  49.987   2.912  -0.687
   41    HE3  TRP   5           HE3      TRP   5  54.885   4.899   0.225
   42    HZ2  TRP   5           HZ2      TRP   5  50.828   4.812  -2.680
   43    HZ3  TRP   5           HZ3      TRP   5  54.778   6.320  -1.815
   44    HH2  TRP   5           HH2      TRP   5  52.755   6.280  -3.268
   45    H    LEU   6           HN       LEU   6  52.727   3.203   5.357
   46    HA   LEU   6           HA       LEU   6  49.997   4.303   4.803
   47    HB2  LEU   6           HB2      LEU   6  50.091   1.929   5.364
   48    HB3  LEU   6           HB1      LEU   6  51.026   2.279   6.833
   49    HG   LEU   6           HG       LEU   6  49.122   3.488   7.809
   50   HD11  LEU   6          HD11      LEU   6  47.908   3.030   5.058
   51   HD12  LEU   6          HD12      LEU   6  48.001   4.538   5.999
   52   HD13  LEU   6          HD13      LEU   6  46.869   3.260   6.485
   53   HD21  LEU   6          HD21      LEU   6  47.557   1.584   8.025
   54   HD22  LEU   6          HD22      LEU   6  49.248   1.030   8.085
   55   HD23  LEU   6          HD23      LEU   6  48.293   0.813   6.598
   56    H    GLU   7           HN       GLU   7  52.840   4.682   6.903
   57    HA   GLU   7           HA       GLU   7  51.531   5.989   9.078
   58    HB2  GLU   7           HB2      GLU   7  54.014   5.256   8.833
   59    HB3  GLU   7           HB1      GLU   7  54.254   6.827   8.034
   60    HG2  GLU   7           HG2      GLU   7  54.753   7.184  10.353
   61    HG3  GLU   7           HG1      GLU   7  53.147   7.900  10.077
   62    H    ARG   8           HN       ARG   8  52.552   7.147   5.894
   63    HA   ARG   8           HA       ARG   8  52.148   9.953   6.459
   64    HB2  ARG   8           HB2      ARG   8  52.143   8.393   3.846
   65    HB3  ARG   8           HB1      ARG   8  52.131  10.169   3.964
   66    HG2  ARG   8           HG2      ARG   8  54.248  10.050   5.307
   67    HG3  ARG   8           HG1      ARG   8  54.279   8.290   5.038
   68    HD2  ARG   8           HD2      ARG   8  54.198  10.344   2.789
   69    HD3  ARG   8           HD1      ARG   8  55.698   9.612   3.408
   70    HE   ARG   8           HE       ARG   8  54.021   7.452   2.793
   71   HH11  ARG   8          HH11      ARG   8  55.986   6.779   1.237
   72   HH12  ARG   8          HH12      ARG   8  55.795   7.495  -0.328
   73   HH21  ARG   8          HH21      ARG   8  53.490   9.855   0.742
   74   HH22  ARG   8          HH22      ARG   8  54.380   9.236  -0.608
   75    H    ILE   9           HN       ILE   9  50.539  11.182   4.922
   76    HA   ILE   9           HA       ILE   9  48.006   9.962   4.357
   77    HB   ILE   9           HB       ILE   9  47.732   9.809   6.790
   78   HG12  ILE   9          HG12      ILE   9  45.694  11.129   7.092
   79   HG13  ILE   9          HG11      ILE   9  46.150  12.221   5.769
   80   HG21  ILE   9          HG21      ILE   9  48.153  12.823   6.894
   81   HG22  ILE   9          HG22      ILE   9  49.434  11.642   7.262
   82   HG23  ILE   9          HG23      ILE   9  47.963  11.702   8.262
   83   HD11  ILE   9           HD1      ILE   9  45.875   9.236   5.271
   84   HD12  ILE   9           HD2      ILE   9  45.746  10.581   4.111
   85   HD13  ILE   9           HD3      ILE   9  44.440  10.289   5.281
   86    H    GLY  10           HN       GLY  10  46.974  11.229   2.933
   87    HA2  GLY  10           HA1      GLY  10  47.418  14.187   3.036
   88    HA3  GLY  10           HA2      GLY  10  47.840  13.306   1.554
   89    H    LYS  11           HN       LYS  11  45.547  11.378   2.141
   90    HA   LYS  11           HA       LYS  11  43.616  12.685   0.486
   91    HB2  LYS  11           HB2      LYS  11  43.366  10.291   2.345
   92    HB3  LYS  11           HB1      LYS  11  42.095  10.811   1.211
   93    HG2  LYS  11           HG2      LYS  11  43.628  10.521  -0.687
   94    HG3  LYS  11           HG1      LYS  11  44.953  10.089   0.419
   95    HD2  LYS  11           HD2      LYS  11  43.526   8.166   1.247
   96    HD3  LYS  11           HD1      LYS  11  42.370   8.543  -0.054
   97    HE2  LYS  11           HE2      LYS  11  44.270   8.303  -1.709
   98    HE3  LYS  11           HE1      LYS  11  45.290   7.726  -0.368
   99    HZ1  LYS  11           HZ1      LYS  11  44.450   5.723  -0.760
  100    HZ2  LYS  11           HZ2      LYS  11  43.303   6.326  -1.857
  101    HZ3  LYS  11           HZ3      LYS  11  42.952   6.280  -0.196
  102    H    ALA  12           HN       ALA  12  42.548  14.469   1.038
  103    HA   ALA  12           HA       ALA  12  41.975  15.096   3.828
  104    HB1  ALA  12           HB1      ALA  12  40.632  16.969   2.759
  105    HB2  ALA  12           HB2      ALA  12  41.137  16.315   1.181
  106    HB3  ALA  12           HB3      ALA  12  42.358  16.916   2.327
  107    H    GLY  13           HN       GLY  13  40.759  12.796   1.880
  108    HA2  GLY  13           HA1      GLY  13  38.688  11.763   1.630
  109    HA3  GLY  13           HA2      GLY  13  38.655  11.946   3.393
  110    H    PHE  14           HN       PHE  14  38.602  14.644   1.132
  111    HA   PHE  14           HA       PHE  14  35.686  14.928   1.210
  112    HB2  PHE  14           HB2      PHE  14  36.311  15.683   3.504
  113    HB3  PHE  14           HB1      PHE  14  37.373  16.916   2.783
  114    HD1  PHE  14           HD1      PHE  14  33.848  15.806   3.212
  115    HD2  PHE  14           HD2      PHE  14  36.458  18.891   1.693
  116    HE1  PHE  14           HE1      PHE  14  31.892  17.326   2.936
  117    HE2  PHE  14           HE2      PHE  14  34.502  20.410   1.418
  118    HZ   PHE  14           HZ       PHE  14  32.216  19.619   2.018
  119    H    ILE  15           HN       ILE  15  38.808  15.612   0.088
  120    HA   ILE  15           HA       ILE  15  37.731  17.041  -2.214
  121    HB   ILE  15           HB       ILE  15  37.859  18.952  -0.718
  122   HG12  ILE  15          HG12      ILE  15  40.425  19.375  -2.271
  123   HG13  ILE  15          HG11      ILE  15  38.983  18.924  -3.209
  124   HG21  ILE  15          HG21      ILE  15  40.771  18.184  -0.243
  125   HG22  ILE  15          HG22      ILE  15  39.439  17.948   0.911
  126   HG23  ILE  15          HG23      ILE  15  39.925  19.592   0.436
  127   HD11  ILE  15           HD1      ILE  15  37.748  20.825  -2.343
  128   HD12  ILE  15           HD2      ILE  15  39.317  21.414  -2.941
  129   HD13  ILE  15           HD3      ILE  15  39.051  21.210  -1.193
  130    H    ILE  16           HN       ILE  16  38.807  14.663  -2.276
  131    HA   ILE  16           HA       ILE  16  41.380  15.137  -3.680
  132    HB   ILE  16           HB       ILE  16  41.987  14.573  -1.312
  133   HG12  ILE  16          HG12      ILE  16  43.480  12.626  -1.870
  134   HG13  ILE  16          HG11      ILE  16  42.600  12.412  -3.395
  135   HG21  ILE  16          HG21      ILE  16  41.410  12.458  -0.349
  136   HG22  ILE  16          HG22      ILE  16  40.734  11.869  -1.882
  137   HG23  ILE  16          HG23      ILE  16  39.897  13.150  -0.978
  138   HD11  ILE  16           HD1      ILE  16  44.849  13.842  -3.327
  139   HD12  ILE  16           HD2      ILE  16  43.772  15.136  -2.757
  140   HD13  ILE  16           HD3      ILE  16  43.489  14.372  -4.340
  141    H    ILE  17           HN       ILE  17  38.768  12.906  -2.703
  142    HA   ILE  17           HA       ILE  17  39.330  11.170  -5.068
  143    HB   ILE  17           HB       ILE  17  37.149   9.984  -4.034
  144   HG12  ILE  17          HG12      ILE  17  36.983  10.309  -1.605
  145   HG13  ILE  17          HG11      ILE  17  38.269  11.535  -1.651
  146   HG21  ILE  17          HG21      ILE  17  39.976   9.928  -2.929
  147   HG22  ILE  17          HG22      ILE  17  39.207   8.798  -4.062
  148   HG23  ILE  17          HG23      ILE  17  38.718   8.813  -2.351
  149   HD11  ILE  17           HD1      ILE  17  36.899  13.072  -2.871
  150   HD12  ILE  17           HD2      ILE  17  35.838  12.401  -1.611
  151   HD13  ILE  17           HD3      ILE  17  35.715  11.809  -3.285
  152    H    GLY  18           HN       GLY  18  38.167  14.074  -5.009
  153    HA2  GLY  18           HA1      GLY  18  36.471  13.711  -7.284
  154    HA3  GLY  18           HA2      GLY  18  35.460  13.956  -5.847
  155    H    GLY  19           HN       GLY  19  36.558  15.821  -4.372
  156    HA2  GLY  19           HA1      GLY  19  35.961  18.234  -5.640
  157    HA3  GLY  19           HA2      GLY  19  37.000  18.088  -4.210
  158    H    ALA  20           HN       ALA  20  39.098  16.569  -5.409
  159    HA   ALA  20           HA       ALA  20  40.592  18.760  -6.584
  160    HB1  ALA  20           HB1      ALA  20  41.238  15.793  -6.449
  161    HB2  ALA  20           HB2      ALA  20  41.629  16.998  -5.197
  162    HB3  ALA  20           HB3      ALA  20  42.387  17.104  -6.804
  163    H    LEU  21           HN       LEU  21  40.047  15.481  -7.936
  164    HA   LEU  21           HA       LEU  21  38.914  16.463 -10.400
  165    HB2  LEU  21           HB2      LEU  21  41.481  17.129 -10.450
  166    HB3  LEU  21           HB1      LEU  21  41.729  15.409 -10.820
  167    HG   LEU  21           HG       LEU  21  39.949  17.346 -12.375
  168   HD11  LEU  21          HD11      LEU  21  42.575  15.979 -13.117
  169   HD12  LEU  21          HD12      LEU  21  42.403  17.692 -12.664
  170   HD13  LEU  21          HD13      LEU  21  41.635  17.082 -14.149
  171   HD21  LEU  21          HD21      LEU  21  39.981  15.323 -14.024
  172   HD22  LEU  21          HD22      LEU  21  38.926  15.208 -12.598
  173   HD23  LEU  21          HD23      LEU  21  40.491  14.359 -12.615
  174    H    ASP  22           HN       ASP  22  37.449  14.822 -10.185
  175    HA   ASP  22           HA       ASP  22  36.626  12.660 -10.278
  176    HB2  ASP  22           HB2      ASP  22  37.674  12.700 -12.497
  177    HB3  ASP  22           HB1      ASP  22  39.224  12.182 -11.795
  178    H    HIS  23           HN       HIS  23  40.022  11.595 -10.272
  179    HA   HIS  23           HA       HIS  23  39.950  10.936  -7.401
  180    HB2  HIS  23           HB2      HIS  23  40.009   8.702  -9.471
  181    HB3  HIS  23           HB1      HIS  23  40.187   8.514  -7.711
  182    HD1  HIS  23           HD1      HIS  23  38.039   9.685  -6.305
  183    HD2  HIS  23           HD2      HIS  23  37.382   8.460 -10.275
  184    HE1  HIS  23           HE1      HIS  23  35.517   9.416  -6.613
  185    H    LEU  24           HN       LEU  24  41.597  12.564  -9.125
  186    HA   LEU  24           HA       LEU  24  44.021  11.098  -9.763
  187    HB2  LEU  24           HB2      LEU  24  43.554  13.143 -10.956
  188    HB3  LEU  24           HB1      LEU  24  43.396  14.059  -9.443
  189    HG   LEU  24           HG       LEU  24  45.764  13.857  -8.976
  190   HD11  LEU  24          HD11      LEU  24  45.725  11.876 -11.286
  191   HD12  LEU  24          HD12      LEU  24  46.311  11.627  -9.624
  192   HD13  LEU  24          HD13      LEU  24  47.233  12.653 -10.746
  193   HD21  LEU  24          HD21      LEU  24  45.318  14.455 -11.935
  194   HD22  LEU  24          HD22      LEU  24  46.730  14.965 -10.978
  195   HD23  LEU  24          HD23      LEU  24  45.114  15.608 -10.595
  Start of MODEL   82
    1    H1   GLY   1           HT1      GLY   1  57.920  -3.447   2.827
    2    H2   GLY   1           HT2      GLY   1  57.794  -2.920   1.217
    3    H3   GLY   1           HT3      GLY   1  58.586  -4.379   1.579
    4    HA2  GLY   1           HA1      GLY   1  56.319  -4.588   0.645
    5    HA3  GLY   1           HA2      GLY   1  56.647  -5.453   2.159
    6    H    LYS   2           HN       LYS   2  56.651  -2.206   2.859
    7    HA   LYS   2           HA       LYS   2  53.790  -1.709   2.951
    8    HB2  LYS   2           HB2      LYS   2  53.656  -1.728   5.482
    9    HB3  LYS   2           HB1      LYS   2  53.760  -3.337   4.727
   10    HG2  LYS   2           HG2      LYS   2  56.161  -3.448   5.190
   11    HG3  LYS   2           HG1      LYS   2  56.142  -1.790   5.838
   12    HD2  LYS   2           HD2      LYS   2  54.605  -2.492   7.637
   13    HD3  LYS   2           HD1      LYS   2  54.576  -4.147   6.981
   14    HE2  LYS   2           HE2      LYS   2  56.183  -3.830   8.913
   15    HE3  LYS   2           HE1      LYS   2  56.944  -4.438   7.423
   16    HZ1  LYS   2           HZ1      LYS   2  56.810  -1.535   7.956
   17    HZ2  LYS   2           HZ2      LYS   2  57.904  -2.398   6.984
   18    HZ3  LYS   2           HZ3      LYS   2  58.022  -2.475   8.678
   19    H    GLY   3           HN       GLY   3  55.839  -0.228   1.907
   20    HA2  GLY   3           HA1      GLY   3  57.247   1.651   3.401
   21    HA3  GLY   3           HA2      GLY   3  56.313   2.150   1.917
   22    H    ARG   4           HN       ARG   4  54.345   1.896   1.892
   23    HA   ARG   4           HA       ARG   4  54.496   4.263   2.399
   24    HB2  ARG   4           HB2      ARG   4  51.801   2.921   1.858
   25    HB3  ARG   4           HB1      ARG   4  52.106   4.662   1.668
   26    HG2  ARG   4           HG2      ARG   4  53.937   2.663   0.285
   27    HG3  ARG   4           HG1      ARG   4  52.354   3.032  -0.427
   28    HD2  ARG   4           HD2      ARG   4  52.955   5.483  -0.358
   29    HD3  ARG   4           HD1      ARG   4  54.584   5.023   0.189
   30    HE   ARG   4           HE       ARG   4  54.061   3.544  -2.164
   31   HH11  ARG   4          HH11      ARG   4  56.157   5.789  -1.413
   32   HH12  ARG   4          HH12      ARG   4  55.964   6.817  -2.794
   33   HH21  ARG   4          HH21      ARG   4  53.021   5.310  -3.837
   34   HH22  ARG   4          HH22      ARG   4  54.189   6.546  -4.165
   35    H    TRP   5           HN       TRP   5  53.749   2.031   4.534
   36    HA   TRP   5           HA       TRP   5  51.730   2.759   6.311
   37    HB2  TRP   5           HB2      TRP   5  53.281   0.865   6.676
   38    HB3  TRP   5           HB1      TRP   5  54.579   2.018   7.070
   39    HD1  TRP   5           HD1      TRP   5  51.203   0.735   8.389
   40    HE1  TRP   5           HE1      TRP   5  51.016   1.250  10.931
   41    HE3  TRP   5           HE3      TRP   5  55.462   3.516   8.963
   42    HZ2  TRP   5           HZ2      TRP   5  52.531   2.682  12.917
   43    HZ3  TRP   5           HZ3      TRP   5  56.072   4.447  11.190
   44    HH2  TRP   5           HH2      TRP   5  54.612   4.033  13.166
   45    H    LEU   6           HN       LEU   6  54.588   4.548   5.496
   46    HA   LEU   6           HA       LEU   6  54.201   6.447   7.775
   47    HB2  LEU   6           HB2      LEU   6  56.484   5.656   7.415
   48    HB3  LEU   6           HB1      LEU   6  56.416   6.131   5.706
   49    HG   LEU   6           HG       LEU   6  56.241   8.502   6.325
   50   HD11  LEU   6          HD11      LEU   6  54.990   8.575   8.340
   51   HD12  LEU   6          HD12      LEU   6  56.627   9.012   8.872
   52   HD13  LEU   6          HD13      LEU   6  56.019   7.360   9.136
   53   HD21  LEU   6          HD21      LEU   6  58.431   7.059   7.885
   54   HD22  LEU   6          HD22      LEU   6  58.465   8.767   7.384
   55   HD23  LEU   6          HD23      LEU   6  58.489   7.477   6.156
   56    H    GLU   7           HN       GLU   7  53.780   6.086   4.274
   57    HA   GLU   7           HA       GLU   7  53.786   8.776   3.452
   58    HB2  GLU   7           HB2      GLU   7  53.354   6.674   2.050
   59    HB3  GLU   7           HB1      GLU   7  51.665   6.771   2.604
   60    HG2  GLU   7           HG2      GLU   7  51.635   9.174   1.756
   61    HG3  GLU   7           HG1      GLU   7  53.214   8.847   1.001
   62    H    ARG   8           HN       ARG   8  51.435   7.024   5.401
   63    HA   ARG   8           HA       ARG   8  49.555   7.746   6.541
   64    HB2  ARG   8           HB2      ARG   8  51.306   9.402   7.390
   65    HB3  ARG   8           HB1      ARG   8  50.652  10.562   6.208
   66    HG2  ARG   8           HG2      ARG   8  48.396  10.313   7.223
   67    HG3  ARG   8           HG1      ARG   8  49.068   9.180   8.421
   68    HD2  ARG   8           HD2      ARG   8  50.530  10.910   9.320
   69    HD3  ARG   8           HD1      ARG   8  50.040  12.044   8.038
   70    HE   ARG   8           HE       ARG   8  48.175  12.554   9.378
   71   HH11  ARG   8          HH11      ARG   8  46.562  10.227   9.210
   72   HH12  ARG   8          HH12      ARG   8  46.601   9.531  10.796
   73   HH21  ARG   8          HH21      ARG   8  49.420  11.290  11.787
   74   HH22  ARG   8          HH22      ARG   8  48.220  10.132  12.255
   75    H    ILE   9           HN       ILE   9  48.687   7.106   4.254
   76    HA   ILE   9           HA       ILE   9  47.830   9.095   2.434
   77    HB   ILE   9           HB       ILE   9  47.660   6.781   1.781
   78   HG12  ILE   9          HG12      ILE   9  45.397   6.637   0.924
   79   HG13  ILE   9          HG11      ILE   9  44.781   7.721   2.190
   80   HG21  ILE   9          HG21      ILE   9  47.270   5.953   4.172
   81   HG22  ILE   9          HG22      ILE   9  46.353   5.120   2.900
   82   HG23  ILE   9          HG23      ILE   9  45.548   6.326   3.925
   83   HD11  ILE   9           HD1      ILE   9  45.856   9.620   1.245
   84   HD12  ILE   9           HD2      ILE   9  45.211   8.740  -0.159
   85   HD13  ILE   9           HD3      ILE   9  46.940   8.622   0.247
   86    H    GLY  10           HN       GLY  10  46.732  10.872   2.886
   87    HA2  GLY  10           HA1      GLY  10  44.067  10.950   3.674
   88    HA3  GLY  10           HA2      GLY  10  44.978  11.053   5.194
   89    H    LYS  11           HN       LYS  11  46.048  12.316   2.065
   90    HA   LYS  11           HA       LYS  11  46.878  14.813   3.016
   91    HB2  LYS  11           HB2      LYS  11  47.348  13.867   0.749
   92    HB3  LYS  11           HB1      LYS  11  45.675  14.252   0.277
   93    HG2  LYS  11           HG2      LYS  11  46.044  16.621   0.615
   94    HG3  LYS  11           HG1      LYS  11  47.639  16.321   1.347
   95    HD2  LYS  11           HD2      LYS  11  48.401  15.316  -0.820
   96    HD3  LYS  11           HD1      LYS  11  46.833  15.754  -1.539
   97    HE2  LYS  11           HE2      LYS  11  47.250  18.126  -1.118
   98    HE3  LYS  11           HE1      LYS  11  48.756  17.740  -0.253
   99    HZ1  LYS  11           HZ1      LYS  11  48.166  17.320  -3.137
  100    HZ2  LYS  11           HZ2      LYS  11  49.529  16.670  -2.356
  101    HZ3  LYS  11           HZ3      LYS  11  49.327  18.354  -2.458
  102    H    ALA  12           HN       ALA  12  43.666  13.840   1.806
  103    HA   ALA  12           HA       ALA  12  42.539  16.377   2.992
  104    HB1  ALA  12           HB1      ALA  12  40.948  16.440   1.109
  105    HB2  ALA  12           HB2      ALA  12  41.760  15.034   0.376
  106    HB3  ALA  12           HB3      ALA  12  42.628  16.581   0.539
  107    H    GLY  13           HN       GLY  13  42.072  13.024   1.938
  108    HA2  GLY  13           HA1      GLY  13  40.818  11.988   4.135
  109    HA3  GLY  13           HA2      GLY  13  39.476  12.788   3.285
  110    H    PHE  14           HN       PHE  14  42.329  10.781   2.472
  111    HA   PHE  14           HA       PHE  14  42.504   8.860   1.208
  112    HB2  PHE  14           HB2      PHE  14  40.402   8.207   2.592
  113    HB3  PHE  14           HB1      PHE  14  39.473   8.611   1.132
  114    HD1  PHE  14           HD1      PHE  14  39.434   7.136  -0.765
  115    HD2  PHE  14           HD2      PHE  14  42.215   6.440   2.463
  116    HE1  PHE  14           HE1      PHE  14  40.001   4.912  -1.732
  117    HE2  PHE  14           HE2      PHE  14  42.781   4.216   1.495
  118    HZ   PHE  14           HZ       PHE  14  41.683   3.457  -0.610
  119    H    ILE  15           HN       ILE  15  41.972  11.645   0.148
  120    HA   ILE  15           HA       ILE  15  41.797  12.627  -1.919
  121    HB   ILE  15           HB       ILE  15  41.924   9.839  -3.141
  122   HG12  ILE  15          HG12      ILE  15  44.173  11.639  -2.125
  123   HG13  ILE  15          HG11      ILE  15  43.722  10.045  -1.476
  124   HG21  ILE  15          HG21      ILE  15  43.035  12.494  -4.135
  125   HG22  ILE  15          HG22      ILE  15  41.423  11.885  -4.577
  126   HG23  ILE  15          HG23      ILE  15  42.873  10.972  -5.043
  127   HD11  ILE  15           HD1      ILE  15  44.152   9.180  -3.914
  128   HD12  ILE  15           HD2      ILE  15  45.557   9.557  -2.889
  129   HD13  ILE  15           HD3      ILE  15  45.030  10.714  -4.133
  130    H    ILE  16           HN       ILE  16  39.649  13.029  -1.060
  131    HA   ILE  16           HA       ILE  16  37.577  11.988  -2.974
  132    HB   ILE  16           HB       ILE  16  37.169  12.576  -0.017
  133   HG12  ILE  16          HG12      ILE  16  38.481  10.414  -0.603
  134   HG13  ILE  16          HG11      ILE  16  37.059  10.251   0.438
  135   HG21  ILE  16          HG21      ILE  16  35.165  13.058  -1.254
  136   HG22  ILE  16          HG22      ILE  16  34.917  11.465  -0.505
  137   HG23  ILE  16          HG23      ILE  16  35.331  11.585  -2.233
  138   HD11  ILE  16           HD1      ILE  16  35.714   9.404  -1.374
  139   HD12  ILE  16           HD2      ILE  16  37.254   8.518  -1.421
  140   HD13  ILE  16           HD3      ILE  16  36.949   9.826  -2.581
  141    H    ILE  17           HN       ILE  17  38.351  14.415  -0.449
  142    HA   ILE  17           HA       ILE  17  36.651  16.437  -1.781
  143    HB   ILE  17           HB       ILE  17  38.635  16.783   0.513
  144   HG12  ILE  17          HG12      ILE  17  37.044  15.090   1.188
  145   HG13  ILE  17          HG11      ILE  17  36.583  16.603   1.990
  146   HG21  ILE  17          HG21      ILE  17  38.138  18.956  -0.193
  147   HG22  ILE  17          HG22      ILE  17  36.841  18.700   0.993
  148   HG23  ILE  17          HG23      ILE  17  36.504  18.537  -0.745
  149   HD11  ILE  17           HD1      ILE  17  35.258  15.225  -0.369
  150   HD12  ILE  17           HD2      ILE  17  34.983  16.949  -0.043
  151   HD13  ILE  17           HD3      ILE  17  34.533  15.734   1.171
  152    H    GLY  18           HN       GLY  18  40.094  15.706  -1.247
  153    HA2  GLY  18           HA1      GLY  18  41.077  18.068  -2.570
  154    HA3  GLY  18           HA2      GLY  18  41.989  16.575  -2.257
  155    H    GLY  19           HN       GLY  19  40.677  14.657  -3.628
  156    HA2  GLY  19           HA1      GLY  19  41.444  15.288  -6.363
  157    HA3  GLY  19           HA2      GLY  19  40.727  13.775  -5.781
  158    H    ALA  20           HN       ALA  20  38.314  14.497  -4.767
  159    HA   ALA  20           HA       ALA  20  36.147  14.948  -5.441
  160    HB1  ALA  20           HB1      ALA  20  37.148  17.291  -5.449
  161    HB2  ALA  20           HB2      ALA  20  35.696  17.053  -6.450
  162    HB3  ALA  20           HB3      ALA  20  37.302  17.119  -7.213
  163    H    LEU  21           HN       LEU  21  38.438  13.703  -7.454
  164    HA   LEU  21           HA       LEU  21  38.359  12.641  -9.513
  165    HB2  LEU  21           HB2      LEU  21  35.497  12.393  -8.538
  166    HB3  LEU  21           HB1      LEU  21  36.009  11.669 -10.074
  167    HG   LEU  21           HG       LEU  21  36.065  10.143  -8.013
  168   HD11  LEU  21          HD11      LEU  21  37.422   9.841 -10.210
  169   HD12  LEU  21          HD12      LEU  21  37.945   8.930  -8.779
  170   HD13  LEU  21          HD13      LEU  21  38.825  10.392  -9.268
  171   HD21  LEU  21          HD21      LEU  21  38.597  11.704  -7.341
  172   HD22  LEU  21          HD22      LEU  21  37.866  10.366  -6.427
  173   HD23  LEU  21          HD23      LEU  21  37.043  11.941  -6.509
  174    H    ASP  22           HN       ASP  22  38.936  14.242 -10.928
  175    HA   ASP  22           HA       ASP  22  36.932  15.049 -12.840
  176    HB2  ASP  22           HB2      ASP  22  36.363  16.639 -10.995
  177    HB3  ASP  22           HB1      ASP  22  38.024  17.272 -11.070
  178    H    HIS  23           HN       HIS  23  39.988  16.213 -11.350
  179    HA   HIS  23           HA       HIS  23  41.563  15.451 -13.644
  180    HB2  HIS  23           HB2      HIS  23  40.379  17.386 -14.660
  181    HB3  HIS  23           HB1      HIS  23  40.990  18.427 -13.353
  182    HD1  HIS  23           HD1      HIS  23  43.242  19.473 -13.693
  183    HD2  HIS  23           HD2      HIS  23  42.650  16.128 -16.176
  184    HE1  HIS  23           HE1      HIS  23  45.252  19.325 -15.266
  185    H    LEU  24           HN       LEU  24  41.047  16.663 -10.526
  186    HA   LEU  24           HA       LEU  24  43.878  17.465 -10.076
  187    HB2  LEU  24           HB2      LEU  24  41.684  17.176  -7.996
  188    HB3  LEU  24           HB1      LEU  24  43.154  18.176  -7.924
  189    HG   LEU  24           HG       LEU  24  40.787  18.574  -9.809
  190   HD11  LEU  24          HD11      LEU  24  40.347  19.258  -7.480
  191   HD12  LEU  24          HD12      LEU  24  40.509  20.688  -8.525
  192   HD13  LEU  24          HD13      LEU  24  41.852  20.207  -7.461
  193   HD21  LEU  24          HD21      LEU  24  43.503  19.936  -9.575
  194   HD22  LEU  24          HD22      LEU  24  42.100  20.766 -10.290
  195   HD23  LEU  24          HD23      LEU  24  42.719  19.273 -11.028
  Start of MODEL   83
    1    H1   GLY   1           HT1      GLY   1  54.464  -1.845  14.084
    2    H2   GLY   1           HT2      GLY   1  55.874  -2.771  13.887
    3    H3   GLY   1           HT3      GLY   1  54.449  -3.496  14.462
    4    HA2  GLY   1           HA1      GLY   1  55.077  -3.891  12.078
    5    HA3  GLY   1           HA2      GLY   1  53.406  -3.423  12.452
    6    H    LYS   2           HN       LYS   2  56.603  -2.060  11.589
    7    HA   LYS   2           HA       LYS   2  55.467   0.458  10.687
    8    HB2  LYS   2           HB2      LYS   2  58.152  -0.805  10.005
    9    HB3  LYS   2           HB1      LYS   2  57.708   0.910   9.830
   10    HG2  LYS   2           HG2      LYS   2  57.240   0.961  12.318
   11    HG3  LYS   2           HG1      LYS   2  57.921  -0.681  12.420
   12    HD2  LYS   2           HD2      LYS   2  60.051   0.157  11.437
   13    HD3  LYS   2           HD1      LYS   2  59.369   1.801  11.398
   14    HE2  LYS   2           HE2      LYS   2  59.687   0.109  13.916
   15    HE3  LYS   2           HE1      LYS   2  60.799   1.406  13.414
   16    HZ1  LYS   2           HZ1      LYS   2  59.247   2.326  14.941
   17    HZ2  LYS   2           HZ2      LYS   2  57.919   1.662  14.115
   18    HZ3  LYS   2           HZ3      LYS   2  58.827   2.910  13.406
   19    H    GLY   3           HN       GLY   3  56.752   0.887   8.253
   20    HA2  GLY   3           HA1      GLY   3  56.671  -0.592   6.035
   21    HA3  GLY   3           HA2      GLY   3  54.885  -0.636   6.408
   22    H    ARG   4           HN       ARG   4  54.083   0.908   7.364
   23    HA   ARG   4           HA       ARG   4  53.397   1.370   5.084
   24    HB2  ARG   4           HB2      ARG   4  52.399   3.048   7.437
   25    HB3  ARG   4           HB1      ARG   4  51.555   2.910   5.874
   26    HG2  ARG   4           HG2      ARG   4  51.381   0.476   6.143
   27    HG3  ARG   4           HG1      ARG   4  52.309   0.554   7.660
   28    HD2  ARG   4           HD2      ARG   4  49.634   1.936   7.174
   29    HD3  ARG   4           HD1      ARG   4  49.852   0.416   8.075
   30    HE   ARG   4           HE       ARG   4  51.563   2.409   9.210
   31   HH11  ARG   4          HH11      ARG   4  50.104   4.416   9.824
   32   HH12  ARG   4          HH12      ARG   4  48.784   3.949  10.846
   33   HH21  ARG   4          HH21      ARG   4  49.055   0.573  10.100
   34   HH22  ARG   4          HH22      ARG   4  48.191   1.774  11.001
   35    H    TRP   5           HN       TRP   5  55.719   2.932   6.604
   36    HA   TRP   5           HA       TRP   5  55.789   5.673   6.149
   37    HB2  TRP   5           HB2      TRP   5  57.675   4.359   7.083
   38    HB3  TRP   5           HB1      TRP   5  58.038   3.738   5.455
   39    HD1  TRP   5           HD1      TRP   5  57.719   7.149   7.270
   40    HE1  TRP   5           HE1      TRP   5  59.401   8.826   6.213
   41    HE3  TRP   5           HE3      TRP   5  59.584   4.178   3.542
   42    HZ2  TRP   5           HZ2      TRP   5  61.289   8.843   4.039
   43    HZ3  TRP   5           HZ3      TRP   5  61.324   5.045   1.988
   44    HH2  TRP   5           HH2      TRP   5  62.179   7.372   2.232
   45    H    LEU   6           HN       LEU   6  55.507   3.188   3.775
   46    HA   LEU   6           HA       LEU   6  55.843   5.203   1.562
   47    HB2  LEU   6           HB2      LEU   6  57.579   3.487   1.437
   48    HB3  LEU   6           HB1      LEU   6  56.366   2.199   1.594
   49    HG   LEU   6           HG       LEU   6  55.377   2.807  -0.570
   50   HD11  LEU   6          HD11      LEU   6  56.755   4.549  -1.969
   51   HD12  LEU   6          HD12      LEU   6  57.341   5.124  -0.389
   52   HD13  LEU   6          HD13      LEU   6  55.601   5.163  -0.764
   53   HD21  LEU   6          HD21      LEU   6  57.414   1.303  -0.425
   54   HD22  LEU   6          HD22      LEU   6  58.412   2.719  -0.835
   55   HD23  LEU   6          HD23      LEU   6  57.207   2.111  -1.996
   56    H    GLU   7           HN       GLU   7  53.766   2.984   3.270
   57    HA   GLU   7           HA       GLU   7  51.856   2.796   0.987
   58    HB2  GLU   7           HB2      GLU   7  52.479   0.910   2.714
   59    HB3  GLU   7           HB1      GLU   7  51.361   1.763   3.801
   60    HG2  GLU   7           HG2      GLU   7  49.584   1.601   2.029
   61    HG3  GLU   7           HG1      GLU   7  50.713   0.657   1.029
   62    H    ARG   8           HN       ARG   8  52.606   5.348   2.469
   63    HA   ARG   8           HA       ARG   8  50.561   6.213   4.193
   64    HB2  ARG   8           HB2      ARG   8  52.014   7.787   2.031
   65    HB3  ARG   8           HB1      ARG   8  51.082   8.501   3.370
   66    HG2  ARG   8           HG2      ARG   8  52.570   7.440   5.013
   67    HG3  ARG   8           HG1      ARG   8  53.475   6.639   3.706
   68    HD2  ARG   8           HD2      ARG   8  54.002   8.928   2.770
   69    HD3  ARG   8           HD1      ARG   8  53.256   9.635   4.223
   70    HE   ARG   8           HE       ARG   8  55.157   7.801   5.174
   71   HH11  ARG   8          HH11      ARG   8  56.829   8.469   2.855
   72   HH12  ARG   8          HH12      ARG   8  57.661   9.900   3.364
   73   HH21  ARG   8          HH21      ARG   8  55.469  10.570   5.965
   74   HH22  ARG   8          HH22      ARG   8  56.890  11.090   5.123
   75    H    ILE   9           HN       ILE   9  48.470   6.750   4.010
   76    HA   ILE   9           HA       ILE   9  47.092   6.136   1.524
   77    HB   ILE   9           HB       ILE   9  46.057   5.801   3.774
   78   HG12  ILE   9          HG12      ILE   9  44.573   7.809   2.014
   79   HG13  ILE   9          HG11      ILE   9  44.678   6.059   1.706
   80   HG21  ILE   9          HG21      ILE   9  45.615   8.806   3.898
   81   HG22  ILE   9          HG22      ILE   9  47.055   8.064   4.635
   82   HG23  ILE   9          HG23      ILE   9  45.431   7.593   5.185
   83   HD11  ILE   9           HD1      ILE   9  43.348   7.465   4.054
   84   HD12  ILE   9           HD2      ILE   9  43.698   5.720   4.051
   85   HD13  ILE   9           HD3      ILE   9  42.591   6.409   2.840
   86    H    GLY  10           HN       GLY  10  46.879   7.391  -0.187
   87    HA2  GLY  10           HA1      GLY  10  47.675  10.204  -0.066
   88    HA3  GLY  10           HA2      GLY  10  47.120   9.309  -1.494
   89    H    LYS  11           HN       LYS  11  44.671   8.390  -0.009
   90    HA   LYS  11           HA       LYS  11  42.958  10.542  -0.861
   91    HB2  LYS  11           HB2      LYS  11  42.397   8.150   0.932
   92    HB3  LYS  11           HB1      LYS  11  41.155   9.222   0.238
   93    HG2  LYS  11           HG2      LYS  11  42.143   8.669  -2.061
   94    HG3  LYS  11           HG1      LYS  11  43.088   7.398  -1.253
   95    HD2  LYS  11           HD2      LYS  11  40.047   7.650  -1.272
   96    HD3  LYS  11           HD1      LYS  11  41.007   6.454  -2.174
   97    HE2  LYS  11           HE2      LYS  11  40.574   6.663   0.823
   98    HE3  LYS  11           HE1      LYS  11  40.304   5.269  -0.246
   99    HZ1  LYS  11           HZ1      LYS  11  42.305   4.903   0.963
  100    HZ2  LYS  11           HZ2      LYS  11  42.919   6.435   0.563
  101    HZ3  LYS  11           HZ3      LYS  11  42.745   5.247  -0.638
  102    H    ALA  12           HN       ALA  12  43.143  12.475   0.115
  103    HA   ALA  12           HA       ALA  12  43.704  12.783   2.926
  104    HB1  ALA  12           HB1      ALA  12  42.468  14.670   0.894
  105    HB2  ALA  12           HB2      ALA  12  44.188  14.557   1.336
  106    HB3  ALA  12           HB3      ALA  12  42.998  15.144   2.525
  107    H    GLY  13           HN       GLY  13  41.044  11.534   1.394
  108    HA2  GLY  13           HA1      GLY  13  38.811  11.288   1.980
  109    HA3  GLY  13           HA2      GLY  13  39.441  11.242   3.640
  110    H    PHE  14           HN       PHE  14  39.779  14.058   1.566
  111    HA   PHE  14           HA       PHE  14  37.395  15.393   2.621
  112    HB2  PHE  14           HB2      PHE  14  39.046  15.429   4.560
  113    HB3  PHE  14           HB1      PHE  14  40.093  16.448   3.546
  114    HD1  PHE  14           HD1      PHE  14  36.477  16.225   4.633
  115    HD2  PHE  14           HD2      PHE  14  39.834  18.791   3.728
  116    HE1  PHE  14           HE1      PHE  14  35.132  18.219   5.276
  117    HE2  PHE  14           HE2      PHE  14  38.484  20.781   4.371
  118    HZ   PHE  14           HZ       PHE  14  36.115  20.500   5.089
  119    H    ILE  15           HN       ILE  15  40.159  15.136   0.597
  120    HA   ILE  15           HA       ILE  15  39.054  17.186  -1.194
  121    HB   ILE  15           HB       ILE  15  41.295  18.387  -1.399
  122   HG12  ILE  15          HG12      ILE  15  41.782  16.916   1.233
  123   HG13  ILE  15          HG11      ILE  15  42.698  16.707  -0.277
  124   HG21  ILE  15          HG21      ILE  15  40.809  19.935   0.358
  125   HG22  ILE  15          HG22      ILE  15  40.080  18.673   1.378
  126   HG23  ILE  15          HG23      ILE  15  39.242  19.230  -0.089
  127   HD11  ILE  15           HD1      ILE  15  42.644  19.101   1.587
  128   HD12  ILE  15           HD2      ILE  15  43.172  19.267  -0.106
  129   HD13  ILE  15           HD3      ILE  15  44.047  18.181   0.999
  130    H    ILE  16           HN       ILE  16  39.017  14.625  -1.719
  131    HA   ILE  16           HA       ILE  16  41.089  14.365  -3.850
  132    HB   ILE  16           HB       ILE  16  41.861  13.089  -1.790
  133   HG12  ILE  16          HG12      ILE  16  42.213  10.902  -3.088
  134   HG13  ILE  16          HG11      ILE  16  41.178  11.580  -4.360
  135   HG21  ILE  16          HG21      ILE  16  39.572  11.201  -2.446
  136   HG22  ILE  16          HG22      ILE  16  39.457  12.439  -1.170
  137   HG23  ILE  16          HG23      ILE  16  40.678  11.151  -1.055
  138   HD11  ILE  16           HD1      ILE  16  43.550  13.201  -3.376
  139   HD12  ILE  16           HD2      ILE  16  42.765  13.205  -4.973
  140   HD13  ILE  16           HD3      ILE  16  43.818  11.853  -4.506
  141    H    ILE  17           HN       ILE  17  38.097  13.119  -2.321
  142    HA   ILE  17           HA       ILE  17  37.248  11.657  -4.656
  143    HB   ILE  17           HB       ILE  17  35.083  11.476  -3.648
  144   HG12  ILE  17          HG12      ILE  17  34.547  13.764  -3.087
  145   HG13  ILE  17          HG11      ILE  17  34.463  12.829  -1.586
  146   HG21  ILE  17          HG21      ILE  17  37.370  11.427  -1.655
  147   HG22  ILE  17          HG22      ILE  17  36.593  10.075  -2.497
  148   HG23  ILE  17          HG23      ILE  17  35.731  10.920  -1.194
  149   HD11  ILE  17           HD1      ILE  17  35.618  14.870  -1.070
  150   HD12  ILE  17           HD2      ILE  17  36.681  14.714  -2.480
  151   HD13  ILE  17           HD3      ILE  17  36.857  13.601  -1.105
  152    H    GLY  18           HN       GLY  18  37.769  14.895  -4.251
  153    HA2  GLY  18           HA1      GLY  18  36.443  15.559  -6.728
  154    HA3  GLY  18           HA2      GLY  18  35.554  16.213  -5.339
  155    H    GLY  19           HN       GLY  19  38.164  16.413  -3.808
  156    HA2  GLY  19           HA1      GLY  19  38.763  19.143  -4.654
  157    HA3  GLY  19           HA2      GLY  19  39.494  18.256  -3.302
  158    H    ALA  20           HN       ALA  20  39.647  16.318  -6.015
  159    HA   ALA  20           HA       ALA  20  42.533  16.721  -6.237
  160    HB1  ALA  20           HB1      ALA  20  40.677  15.042  -7.959
  161    HB2  ALA  20           HB2      ALA  20  41.405  14.501  -6.426
  162    HB3  ALA  20           HB3      ALA  20  42.444  14.886  -7.820
  163    H    LEU  21           HN       LEU  21  39.709  17.974  -7.807
  164    HA   LEU  21           HA       LEU  21  39.460  19.384  -9.632
  165    HB2  LEU  21           HB2      LEU  21  42.421  20.015  -9.388
  166    HB3  LEU  21           HB1      LEU  21  41.099  21.077  -9.929
  167    HG   LEU  21           HG       LEU  21  41.542  20.009  -7.105
  168   HD11  LEU  21          HD11      LEU  21  41.610  22.827  -8.276
  169   HD12  LEU  21          HD12      LEU  21  43.031  21.871  -7.792
  170   HD13  LEU  21          HD13      LEU  21  41.858  22.403  -6.565
  171   HD21  LEU  21          HD21      LEU  21  39.258  21.581  -8.371
  172   HD22  LEU  21          HD22      LEU  21  39.582  21.631  -6.621
  173   HD23  LEU  21          HD23      LEU  21  39.167  20.089  -7.405
  174    H    ASP  22           HN       ASP  22  40.747  16.543  -9.851
  175    HA   ASP  22           HA       ASP  22  42.327  16.680 -12.292
  176    HB2  ASP  22           HB2      ASP  22  42.429  14.822 -10.586
  177    HB3  ASP  22           HB1      ASP  22  40.825  14.295 -11.149
  178    H    HIS  23           HN       HIS  23  39.057  15.328 -11.622
  179    HA   HIS  23           HA       HIS  23  37.900  16.596 -13.951
  180    HB2  HIS  23           HB2      HIS  23  39.284  14.899 -15.118
  181    HB3  HIS  23           HB1      HIS  23  38.482  13.616 -14.181
  182    HD1  HIS  23           HD1      HIS  23  37.745  16.319 -16.778
  183    HD2  HIS  23           HD2      HIS  23  36.002  12.836 -15.195
  184    HE1  HIS  23           HE1      HIS  23  35.659  15.816 -18.162
  185    H    LEU  24           HN       LEU  24  37.787  15.133 -11.014
  186    HA   LEU  24           HA       LEU  24  35.213  13.793 -11.174
  187    HB2  LEU  24           HB2      LEU  24  36.963  14.795  -8.911
  188    HB3  LEU  24           HB1      LEU  24  35.359  14.109  -8.592
  189    HG   LEU  24           HG       LEU  24  37.342  12.494  -8.430
  190   HD11  LEU  24          HD11      LEU  24  35.373  11.574 -10.560
  191   HD12  LEU  24          HD12      LEU  24  34.853  11.869  -8.887
  192   HD13  LEU  24          HD13      LEU  24  36.098  10.650  -9.229
  193   HD21  LEU  24          HD21      LEU  24  38.483  13.443 -10.493
  194   HD22  LEU  24          HD22      LEU  24  37.259  12.606 -11.477
  195   HD23  LEU  24          HD23      LEU  24  38.367  11.670 -10.448
  Start of MODEL   84
    1    H1   GLY   1           HT1      GLY   1  64.226   1.697   6.048
    2    H2   GLY   1           HT2      GLY   1  64.096   3.332   5.606
    3    H3   GLY   1           HT3      GLY   1  63.029   2.182   4.951
    4    HA2  GLY   1           HA1      GLY   1  62.927   2.042   7.733
    5    HA3  GLY   1           HA2      GLY   1  62.723   3.727   7.214
    6    H    LYS   2           HN       LYS   2  60.585   2.976   8.357
    7    HA   LYS   2           HA       LYS   2  58.757   1.378   6.779
    8    HB2  LYS   2           HB2      LYS   2  58.572   1.855   9.258
    9    HB3  LYS   2           HB1      LYS   2  58.064   3.508   8.836
   10    HG2  LYS   2           HG2      LYS   2  56.178   2.592   7.511
   11    HG3  LYS   2           HG1      LYS   2  56.682   0.939   7.941
   12    HD2  LYS   2           HD2      LYS   2  56.269   1.355  10.298
   13    HD3  LYS   2           HD1      LYS   2  55.962   3.081   9.986
   14    HE2  LYS   2           HE2      LYS   2  53.824   1.913  10.228
   15    HE3  LYS   2           HE1      LYS   2  54.021   2.433   8.537
   16    HZ1  LYS   2           HZ1      LYS   2  53.558  -0.135   9.457
   17    HZ2  LYS   2           HZ2      LYS   2  55.179  -0.130   8.947
   18    HZ3  LYS   2           HZ3      LYS   2  53.946   0.332   7.873
   19    H    GLY   3           HN       GLY   3  59.185   2.358   4.662
   20    HA2  GLY   3           HA1      GLY   3  58.748   4.954   3.769
   21    HA3  GLY   3           HA2      GLY   3  58.037   3.531   2.876
   22    H    ARG   4           HN       ARG   4  56.743   2.371   3.844
   23    HA   ARG   4           HA       ARG   4  55.243   3.696   2.477
   24    HB2  ARG   4           HB2      ARG   4  54.301   1.343   4.182
   25    HB3  ARG   4           HB1      ARG   4  53.352   2.008   2.828
   26    HG2  ARG   4           HG2      ARG   4  55.208   1.578   1.273
   27    HG3  ARG   4           HG1      ARG   4  56.228   1.003   2.615
   28    HD2  ARG   4           HD2      ARG   4  54.416  -0.756   3.066
   29    HD3  ARG   4           HD1      ARG   4  53.701  -0.282   1.507
   30    HE   ARG   4           HE       ARG   4  56.538  -0.908   1.273
   31   HH11  ARG   4          HH11      ARG   4  54.628  -3.081   2.642
   32   HH12  ARG   4          HH12      ARG   4  54.435  -4.141   1.285
   33   HH21  ARG   4          HH21      ARG   4  55.741  -1.883  -1.000
   34   HH22  ARG   4          HH22      ARG   4  55.066  -3.463  -0.776
   35    H    TRP   5           HN       TRP   5  55.649   4.110   5.612
   36    HA   TRP   5           HA       TRP   5  53.326   4.660   7.030
   37    HB2  TRP   5           HB2      TRP   5  55.644   5.073   7.854
   38    HB3  TRP   5           HB1      TRP   5  55.706   6.548   6.858
   39    HD1  TRP   5           HD1      TRP   5  53.246   5.046   9.468
   40    HE1  TRP   5           HE1      TRP   5  52.411   6.952  11.026
   41    HE3  TRP   5           HE3      TRP   5  55.754   8.974   7.350
   42    HZ2  TRP   5           HZ2      TRP   5  52.800   9.794  11.289
   43    HZ3  TRP   5           HZ3      TRP   5  55.507  11.274   8.270
   44    HH2  TRP   5           HH2      TRP   5  54.034  11.687  10.236
   45    H    LEU   6           HN       LEU   6  54.345   6.164   4.096
   46    HA   LEU   6           HA       LEU   6  52.229   8.287   4.383
   47    HB2  LEU   6           HB2      LEU   6  54.470   9.226   4.121
   48    HB3  LEU   6           HB1      LEU   6  54.770   8.201   2.704
   49    HG   LEU   6           HG       LEU   6  53.015   9.367   1.437
   50   HD11  LEU   6          HD11      LEU   6  52.510  10.716   4.117
   51   HD12  LEU   6          HD12      LEU   6  51.339   9.960   3.011
   52   HD13  LEU   6          HD13      LEU   6  52.068  11.525   2.595
   53   HD21  LEU   6          HD21      LEU   6  54.085  11.584   1.305
   54   HD22  LEU   6          HD22      LEU   6  55.315  10.311   1.492
   55   HD23  LEU   6          HD23      LEU   6  54.857  11.320   2.885
   56    H    GLU   7           HN       GLU   7  53.269   5.408   2.643
   57    HA   GLU   7           HA       GLU   7  51.596   6.063   0.282
   58    HB2  GLU   7           HB2      GLU   7  53.752   4.767   0.137
   59    HB3  GLU   7           HB1      GLU   7  52.954   3.444   1.015
   60    HG2  GLU   7           HG2      GLU   7  51.327   3.143  -0.743
   61    HG3  GLU   7           HG1      GLU   7  51.853   4.631  -1.566
   62    H    ARG   8           HN       ARG   8  51.167   4.713   3.405
   63    HA   ARG   8           HA       ARG   8  49.039   2.849   2.708
   64    HB2  ARG   8           HB2      ARG   8  50.373   2.634   4.780
   65    HB3  ARG   8           HB1      ARG   8  49.695   4.170   5.368
   66    HG2  ARG   8           HG2      ARG   8  47.463   3.260   5.436
   67    HG3  ARG   8           HG1      ARG   8  47.969   1.794   4.562
   68    HD2  ARG   8           HD2      ARG   8  47.712   1.490   7.069
   69    HD3  ARG   8           HD1      ARG   8  49.315   1.054   6.431
   70    HE   ARG   8           HE       ARG   8  50.134   2.684   7.914
   71   HH11  ARG   8          HH11      ARG   8  46.915   3.090   8.289
   72   HH12  ARG   8          HH12      ARG   8  46.922   4.817   8.412
   73   HH21  ARG   8          HH21      ARG   8  50.217   5.140   7.383
   74   HH22  ARG   8          HH22      ARG   8  48.792   5.977   7.901
   75    H    ILE   9           HN       ILE   9  48.646   5.573   4.985
   76    HA   ILE   9           HA       ILE   9  45.894   5.894   4.283
   77    HB   ILE   9           HB       ILE   9  46.729   6.603   6.467
   78   HG12  ILE   9          HG12      ILE   9  45.701   8.836   6.630
   79   HG13  ILE   9          HG11      ILE   9  45.797   9.041   4.872
   80   HG21  ILE   9          HG21      ILE   9  48.155   8.995   5.266
   81   HG22  ILE   9          HG22      ILE   9  48.996   7.430   5.370
   82   HG23  ILE   9          HG23      ILE   9  48.386   8.214   6.845
   83   HD11  ILE   9           HD1      ILE   9  44.352   6.641   6.042
   84   HD12  ILE   9           HD2      ILE   9  44.123   7.426   4.460
   85   HD13  ILE   9           HD3      ILE   9  43.537   8.218   5.939
   86    H    GLY  10           HN       GLY  10  46.015   5.918   1.977
   87    HA2  GLY  10           HA1      GLY  10  47.238   8.243   0.654
   88    HA3  GLY  10           HA2      GLY  10  46.306   6.941  -0.110
   89    H    LYS  11           HN       LYS  11  44.188   7.455   2.088
   90    HA   LYS  11           HA       LYS  11  42.594   9.265   0.447
   91    HB2  LYS  11           HB2      LYS  11  42.100   7.983   3.158
   92    HB3  LYS  11           HB1      LYS  11  40.893   8.934   2.260
   93    HG2  LYS  11           HG2      LYS  11  41.202   7.356   0.308
   94    HG3  LYS  11           HG1      LYS  11  42.241   6.352   1.342
   95    HD2  LYS  11           HD2      LYS  11  39.421   7.108   2.217
   96    HD3  LYS  11           HD1      LYS  11  39.707   5.723   1.142
   97    HE2  LYS  11           HE2      LYS  11  40.911   6.119   3.920
   98    HE3  LYS  11           HE1      LYS  11  39.630   4.970   3.478
   99    HZ1  LYS  11           HZ1      LYS  11  41.181   3.529   2.880
  100    HZ2  LYS  11           HZ2      LYS  11  42.407   4.626   3.303
  101    HZ3  LYS  11           HZ3      LYS  11  41.785   4.610   1.722
  102    H    ALA  12           HN       ALA  12  43.316  11.336   0.410
  103    HA   ALA  12           HA       ALA  12  44.352  12.695   2.736
  104    HB1  ALA  12           HB1      ALA  12  44.848  13.376   0.409
  105    HB2  ALA  12           HB2      ALA  12  44.163  14.716   1.361
  106    HB3  ALA  12           HB3      ALA  12  43.144  13.841   0.192
  107    H    GLY  13           HN       GLY  13  41.318  11.548   2.135
  108    HA2  GLY  13           HA1      GLY  13  39.212  12.061   2.948
  109    HA3  GLY  13           HA2      GLY  13  40.084  12.737   4.337
  110    H    PHE  14           HN       PHE  14  39.886  13.781   0.908
  111    HA   PHE  14           HA       PHE  14  38.145  16.010   1.516
  112    HB2  PHE  14           HB2      PHE  14  40.297  16.749   2.623
  113    HB3  PHE  14           HB1      PHE  14  41.054  16.742   1.013
  114    HD1  PHE  14           HD1      PHE  14  41.002  18.756  -0.228
  115    HD2  PHE  14           HD2      PHE  14  37.946  18.028   2.736
  116    HE1  PHE  14           HE1      PHE  14  40.042  21.013  -0.661
  117    HE2  PHE  14           HE2      PHE  14  36.989  20.285   2.300
  118    HZ   PHE  14           HZ       PHE  14  38.071  21.799   0.643
  119    H    ILE  15           HN       ILE  15  40.716  14.681  -0.580
  120    HA   ILE  15           HA       ILE  15  38.942  15.033  -2.914
  121    HB   ILE  15           HB       ILE  15  40.851  16.181  -4.223
  122   HG12  ILE  15          HG12      ILE  15  41.743  16.809  -1.367
  123   HG13  ILE  15          HG11      ILE  15  42.612  15.759  -2.508
  124   HG21  ILE  15          HG21      ILE  15  40.094  18.385  -3.623
  125   HG22  ILE  15          HG22      ILE  15  39.666  17.864  -1.977
  126   HG23  ILE  15          HG23      ILE  15  38.710  17.301  -3.369
  127   HD11  ILE  15           HD1      ILE  15  43.713  17.839  -2.741
  128   HD12  ILE  15           HD2      ILE  15  42.197  18.761  -2.633
  129   HD13  ILE  15           HD3      ILE  15  42.572  17.834  -4.107
  130    H    ILE  16           HN       ILE  16  39.346  12.677  -2.110
  131    HA   ILE  16           HA       ILE  16  41.266  11.511  -4.050
  132    HB   ILE  16           HB       ILE  16  41.387  11.093  -1.038
  133   HG12  ILE  16          HG12      ILE  16  42.877  12.826  -1.961
  134   HG13  ILE  16          HG11      ILE  16  43.810  11.449  -1.347
  135   HG21  ILE  16          HG21      ILE  16  42.031   9.123  -3.233
  136   HG22  ILE  16          HG22      ILE  16  41.447   8.833  -1.582
  137   HG23  ILE  16          HG23      ILE  16  43.163   9.214  -1.861
  138   HD11  ILE  16           HD1      ILE  16  43.640  10.643  -3.918
  139   HD12  ILE  16           HD2      ILE  16  44.890  11.781  -3.389
  140   HD13  ILE  16           HD3      ILE  16  43.429  12.384  -4.196
  141    H    ILE  17           HN       ILE  17  38.940  10.917  -1.393
  142    HA   ILE  17           HA       ILE  17  38.090   8.366  -2.524
  143    HB   ILE  17           HB       ILE  17  36.079   8.803  -0.837
  144   HG12  ILE  17          HG12      ILE  17  36.583  10.400   0.931
  145   HG13  ILE  17          HG11      ILE  17  38.138  10.816   0.183
  146   HG21  ILE  17          HG21      ILE  17  38.970   8.502   0.094
  147   HG22  ILE  17          HG22      ILE  17  37.890   7.188  -0.436
  148   HG23  ILE  17          HG23      ILE  17  37.530   8.090   1.057
  149   HD11  ILE  17           HD1      ILE  17  35.487  11.199  -1.260
  150   HD12  ILE  17           HD2      ILE  17  37.072  11.906  -1.664
  151   HD13  ILE  17           HD3      ILE  17  36.195  12.454  -0.218
  152    H    GLY  18           HN       GLY  18  37.870  11.238  -3.872
  153    HA2  GLY  18           HA1      GLY  18  35.623  10.523  -5.524
  154    HA3  GLY  18           HA2      GLY  18  35.162  11.794  -4.376
  155    H    GLY  19           HN       GLY  19  37.678  13.127  -4.234
  156    HA2  GLY  19           HA1      GLY  19  37.410  14.979  -6.337
  157    HA3  GLY  19           HA2      GLY  19  38.867  14.769  -5.345
  158    H    ALA  20           HN       ALA  20  39.377  12.034  -6.130
  159    HA   ALA  20           HA       ALA  20  40.619  10.935  -7.747
  160    HB1  ALA  20           HB1      ALA  20  38.356  11.069  -8.879
  161    HB2  ALA  20           HB2      ALA  20  39.749  10.900  -9.975
  162    HB3  ALA  20           HB3      ALA  20  38.969  12.486  -9.765
  163    H    LEU  21           HN       LEU  21  40.960  14.065  -7.068
  164    HA   LEU  21           HA       LEU  21  42.485  15.713  -7.647
  165    HB2  LEU  21           HB2      LEU  21  43.915  13.594  -7.052
  166    HB3  LEU  21           HB1      LEU  21  44.235  13.516  -8.797
  167    HG   LEU  21           HG       LEU  21  44.848  16.103  -8.503
  168   HD11  LEU  21          HD11      LEU  21  45.931  16.513  -6.281
  169   HD12  LEU  21          HD12      LEU  21  45.252  14.980  -5.691
  170   HD13  LEU  21          HD13      LEU  21  44.169  16.314  -6.149
  171   HD21  LEU  21          HD21      LEU  21  47.210  15.440  -7.983
  172   HD22  LEU  21          HD22      LEU  21  46.459  14.401  -9.218
  173   HD23  LEU  21          HD23      LEU  21  46.628  13.816  -7.546
  174    H    ASP  22           HN       ASP  22  40.500  14.713  -9.700
  175    HA   ASP  22           HA       ASP  22  41.825  14.943 -12.278
  176    HB2  ASP  22           HB2      ASP  22  39.641  13.753 -11.862
  177    HB3  ASP  22           HB1      ASP  22  38.881  15.346 -11.628
  178    H    HIS  23           HN       HIS  23  39.629  17.115 -10.427
  179    HA   HIS  23           HA       HIS  23  41.148  19.459 -11.235
  180    HB2  HIS  23           HB2      HIS  23  39.288  20.519 -12.545
  181    HB3  HIS  23           HB1      HIS  23  40.034  19.128 -13.367
  182    HD1  HIS  23           HD1      HIS  23  38.558  17.162 -13.946
  183    HD2  HIS  23           HD2      HIS  23  36.686  19.908 -11.372
  184    HE1  HIS  23           HE1      HIS  23  36.125  16.425 -13.687
  185    H    LEU  24           HN       LEU  24  38.827  17.782  -9.428
  186    HA   LEU  24           HA       LEU  24  37.391  20.068  -8.349
  187    HB2  LEU  24           HB2      LEU  24  36.616  17.633  -8.348
  188    HB3  LEU  24           HB1      LEU  24  37.796  17.350  -7.051
  189    HG   LEU  24           HG       LEU  24  36.617  19.399  -5.861
  190   HD11  LEU  24          HD11      LEU  24  35.177  20.162  -7.665
  191   HD12  LEU  24          HD12      LEU  24  34.139  19.444  -6.416
  192   HD13  LEU  24          HD13      LEU  24  34.509  18.529  -7.894
  193   HD21  LEU  24          HD21      LEU  24  36.543  17.069  -5.039
  194   HD22  LEU  24          HD22      LEU  24  35.215  16.703  -6.168
  195   HD23  LEU  24          HD23      LEU  24  34.962  17.859  -4.837
  Start of MODEL   85
    1    H1   GLY   1           HT1      GLY   1  62.001  -3.340   7.077
    2    H2   GLY   1           HT2      GLY   1  61.527  -2.373   5.762
    3    H3   GLY   1           HT3      GLY   1  61.243  -4.048   5.735
    4    HA2  GLY   1           HA1      GLY   1  59.257  -3.655   6.492
    5    HA3  GLY   1           HA2      GLY   1  60.057  -3.235   8.020
    6    H    LYS   2           HN       LYS   2  58.367  -2.085   5.217
    7    HA   LYS   2           HA       LYS   2  57.791   0.433   6.530
    8    HB2  LYS   2           HB2      LYS   2  60.184   0.719   5.574
    9    HB3  LYS   2           HB1      LYS   2  59.412   0.694   3.974
   10    HG2  LYS   2           HG2      LYS   2  59.397   2.998   4.414
   11    HG3  LYS   2           HG1      LYS   2  57.805   2.544   5.058
   12    HD2  LYS   2           HD2      LYS   2  58.740   2.418   7.339
   13    HD3  LYS   2           HD1      LYS   2  60.363   2.784   6.711
   14    HE2  LYS   2           HE2      LYS   2  59.412   4.845   7.570
   15    HE3  LYS   2           HE1      LYS   2  59.440   4.949   5.793
   16    HZ1  LYS   2           HZ1      LYS   2  57.286   5.455   6.022
   17    HZ2  LYS   2           HZ2      LYS   2  57.190   4.848   7.605
   18    HZ3  LYS   2           HZ3      LYS   2  57.049   3.796   6.279
   19    H    GLY   3           HN       GLY   3  57.814   1.423   3.463
   20    HA2  GLY   3           HA1      GLY   3  56.324   0.863   1.560
   21    HA3  GLY   3           HA2      GLY   3  55.189   0.016   2.706
   22    H    ARG   4           HN       ARG   4  54.845   0.818   4.484
   23    HA   ARG   4           HA       ARG   4  52.862   1.519   3.278
   24    HB2  ARG   4           HB2      ARG   4  53.103   2.084   6.275
   25    HB3  ARG   4           HB1      ARG   4  51.578   1.851   5.382
   26    HG2  ARG   4           HG2      ARG   4  52.467  -0.402   4.627
   27    HG3  ARG   4           HG1      ARG   4  53.832  -0.171   5.747
   28    HD2  ARG   4           HD2      ARG   4  50.874  -0.237   6.491
   29    HD3  ARG   4           HD1      ARG   4  52.081  -1.496   6.846
   30    HE   ARG   4           HE       ARG   4  53.077   0.896   7.963
   31   HH11  ARG   4          HH11      ARG   4  49.849   0.479   8.175
   32   HH12  ARG   4          HH12      ARG   4  49.782   0.109   9.865
   33   HH21  ARG   4          HH21      ARG   4  53.212  -0.289  10.186
   34   HH22  ARG   4          HH22      ARG   4  51.685  -0.326  11.005
   35    H    TRP   5           HN       TRP   5  55.286   3.449   4.000
   36    HA   TRP   5           HA       TRP   5  54.557   5.996   4.827
   37    HB2  TRP   5           HB2      TRP   5  56.826   5.432   4.059
   38    HB3  TRP   5           HB1      TRP   5  56.250   5.359   2.375
   39    HD1  TRP   5           HD1      TRP   5  55.830   7.971   5.227
   40    HE1  TRP   5           HE1      TRP   5  56.336  10.337   4.276
   41    HE3  TRP   5           HE3      TRP   5  56.979   6.673   0.412
   42    HZ2  TRP   5           HZ2      TRP   5  57.130  11.479   1.753
   43    HZ3  TRP   5           HZ3      TRP   5  57.607   8.415  -1.251
   44    HH2  TRP   5           HH2      TRP   5  57.684  10.816  -0.586
   45    H    LEU   6           HN       LEU   6  53.377   4.316   2.039
   46    HA   LEU   6           HA       LEU   6  52.047   6.811   1.000
   47    HB2  LEU   6           HB2      LEU   6  52.294   4.128  -0.407
   48    HB3  LEU   6           HB1      LEU   6  51.857   5.703  -1.109
   49    HG   LEU   6           HG       LEU   6  54.570   5.001   0.108
   50   HD11  LEU   6          HD11      LEU   6  55.386   4.982  -2.182
   51   HD12  LEU   6          HD12      LEU   6  53.794   5.483  -2.801
   52   HD13  LEU   6          HD13      LEU   6  54.000   3.869  -2.079
   53   HD21  LEU   6          HD21      LEU   6  53.413   7.513  -1.173
   54   HD22  LEU   6          HD22      LEU   6  55.168   7.211  -1.124
   55   HD23  LEU   6          HD23      LEU   6  54.250   7.353   0.390
   56    H    GLU   7           HN       GLU   7  51.560   3.630   2.465
   57    HA   GLU   7           HA       GLU   7  48.627   3.743   1.894
   58    HB2  GLU   7           HB2      GLU   7  50.458   1.680   3.180
   59    HB3  GLU   7           HB1      GLU   7  48.685   1.522   3.154
   60    HG2  GLU   7           HG2      GLU   7  49.665   0.311   1.248
   61    HG3  GLU   7           HG1      GLU   7  48.728   1.708   0.664
   62    H    ARG   8           HN       ARG   8  50.669   5.206   3.992
   63    HA   ARG   8           HA       ARG   8  49.674   4.687   6.582
   64    HB2  ARG   8           HB2      ARG   8  51.615   6.198   5.899
   65    HB3  ARG   8           HB1      ARG   8  50.401   7.447   5.536
   66    HG2  ARG   8           HG2      ARG   8  49.528   7.192   7.891
   67    HG3  ARG   8           HG1      ARG   8  50.886   6.091   8.224
   68    HD2  ARG   8           HD2      ARG   8  52.505   7.840   7.744
   69    HD3  ARG   8           HD1      ARG   8  51.219   8.941   7.195
   70    HE   ARG   8           HE       ARG   8  50.519   8.277   9.816
   71   HH11  ARG   8          HH11      ARG   8  51.296  11.048   8.884
   72   HH12  ARG   8          HH12      ARG   8  52.651  11.392   9.906
   73   HH21  ARG   8          HH21      ARG   8  53.116   8.087  10.849
   74   HH22  ARG   8          HH22      ARG   8  53.681   9.716  11.021
   75    H    ILE   9           HN       ILE   9  48.756   7.586   4.673
   76    HA   ILE   9           HA       ILE   9  45.935   7.088   4.881
   77    HB   ILE   9           HB       ILE   9  46.199   7.532   7.262
   78   HG12  ILE   9          HG12      ILE   9  44.696   9.455   7.541
   79   HG13  ILE   9          HG11      ILE   9  45.069  10.031   5.904
   80   HG21  ILE   9          HG21      ILE   9  48.391   8.954   6.787
   81   HG22  ILE   9          HG22      ILE   9  47.388   9.317   8.207
   82   HG23  ILE   9          HG23      ILE   9  47.262  10.328   6.754
   83   HD11  ILE   9           HD1      ILE   9  43.975   7.228   6.328
   84   HD12  ILE   9           HD2      ILE   9  43.892   8.255   4.875
   85   HD13  ILE   9           HD3      ILE   9  42.879   8.630   6.289
   86    H    GLY  10           HN       GLY  10  46.142   7.629   2.693
   87    HA2  GLY  10           HA1      GLY  10  47.143  10.288   1.941
   88    HA3  GLY  10           HA2      GLY  10  46.443   9.061   0.867
   89    H    LYS  11           HN       LYS  11  43.976   8.597   1.763
   90    HA   LYS  11           HA       LYS  11  42.494  10.819   0.817
   91    HB2  LYS  11           HB2      LYS  11  41.597   8.565   2.654
   92    HB3  LYS  11           HB1      LYS  11  40.519   9.652   1.745
   93    HG2  LYS  11           HG2      LYS  11  41.419   8.864  -0.378
   94    HG3  LYS  11           HG1      LYS  11  42.652   7.890   0.461
   95    HD2  LYS  11           HD2      LYS  11  40.775   6.611   1.576
   96    HD3  LYS  11           HD1      LYS  11  39.631   7.489   0.532
   97    HE2  LYS  11           HE2      LYS  11  40.169   5.330  -0.496
   98    HE3  LYS  11           HE1      LYS  11  40.872   6.641  -1.474
   99    HZ1  LYS  11           HZ1      LYS  11  42.260   4.533  -0.660
  100    HZ2  LYS  11           HZ2      LYS  11  42.544   5.563   0.662
  101    HZ3  LYS  11           HZ3      LYS  11  42.964   6.055  -0.908
  102    H    ALA  12           HN       ALA  12  42.788  12.782   1.745
  103    HA   ALA  12           HA       ALA  12  43.077  13.198   4.573
  104    HB1  ALA  12           HB1      ALA  12  41.990  15.168   2.535
  105    HB2  ALA  12           HB2      ALA  12  43.721  14.800   2.729
  106    HB3  ALA  12           HB3      ALA  12  42.811  15.534   4.070
  107    H    GLY  13           HN       GLY  13  40.495  12.000   2.906
  108    HA2  GLY  13           HA1      GLY  13  38.252  11.777   3.385
  109    HA3  GLY  13           HA2      GLY  13  38.698  12.096   5.075
  110    H    PHE  14           HN       PHE  14  39.684  14.628   3.112
  111    HA   PHE  14           HA       PHE  14  37.123  16.165   3.564
  112    HB2  PHE  14           HB2      PHE  14  38.972  16.722   5.223
  113    HB3  PHE  14           HB1      PHE  14  39.946  17.278   3.842
  114    HD1  PHE  14           HD1      PHE  14  36.506  17.688   5.337
  115    HD2  PHE  14           HD2      PHE  14  39.745  19.539   3.164
  116    HE1  PHE  14           HE1      PHE  14  35.303  19.870   5.399
  117    HE2  PHE  14           HE2      PHE  14  38.542  21.719   3.227
  118    HZ   PHE  14           HZ       PHE  14  36.361  21.901   4.418
  119    H    ILE  15           HN       ILE  15  39.763  15.196   1.593
  120    HA   ILE  15           HA       ILE  15  38.582  16.622  -0.731
  121    HB   ILE  15           HB       ILE  15  41.601  16.771  -0.326
  122   HG12  ILE  15          HG12      ILE  15  39.508  18.780   0.625
  123   HG13  ILE  15          HG11      ILE  15  40.642  17.867   1.648
  124   HG21  ILE  15          HG21      ILE  15  39.755  18.686  -1.809
  125   HG22  ILE  15          HG22      ILE  15  40.344  17.191  -2.571
  126   HG23  ILE  15          HG23      ILE  15  41.502  18.429  -2.032
  127   HD11  ILE  15           HD1      ILE  15  42.523  18.966   0.252
  128   HD12  ILE  15           HD2      ILE  15  41.645  20.012   1.392
  129   HD13  ILE  15           HD3      ILE  15  41.265  20.074  -0.344
  130    H    ILE  16           HN       ILE  16  41.416  15.849  -1.934
  131    HA   ILE  16           HA       ILE  16  42.129  14.066  -3.235
  132    HB   ILE  16           HB       ILE  16  41.197  12.373  -0.869
  133   HG12  ILE  16          HG12      ILE  16  42.559  14.108   0.068
  134   HG13  ILE  16          HG11      ILE  16  43.617  12.694  -0.081
  135   HG21  ILE  16          HG21      ILE  16  43.309  11.033  -1.667
  136   HG22  ILE  16          HG22      ILE  16  43.110  11.927  -3.192
  137   HG23  ILE  16          HG23      ILE  16  41.803  10.885  -2.595
  138   HD11  ILE  16           HD1      ILE  16  43.570  15.217  -1.770
  139   HD12  ILE  16           HD2      ILE  16  44.319  13.723  -2.378
  140   HD13  ILE  16           HD3      ILE  16  44.935  14.486  -0.897
  141    H    ILE  17           HN       ILE  17  39.588  12.167  -1.574
  142    HA   ILE  17           HA       ILE  17  38.622  11.234  -4.156
  143    HB   ILE  17           HB       ILE  17  38.496   9.737  -2.216
  144   HG12  ILE  17          HG12      ILE  17  36.173   9.018  -2.363
  145   HG13  ILE  17          HG11      ILE  17  35.657  10.620  -2.929
  146   HG21  ILE  17          HG21      ILE  17  36.537  11.739  -1.016
  147   HG22  ILE  17          HG22      ILE  17  38.240  11.586  -0.522
  148   HG23  ILE  17          HG23      ILE  17  37.116  10.230  -0.275
  149   HD11  ILE  17           HD1      ILE  17  36.000   8.711  -4.697
  150   HD12  ILE  17           HD2      ILE  17  37.735   9.036  -4.480
  151   HD13  ILE  17           HD3      ILE  17  36.652  10.325  -5.058
  152    H    GLY  18           HN       GLY  18  37.577  13.579  -1.698
  153    HA2  GLY  18           HA1      GLY  18  35.020  14.138  -2.900
  154    HA3  GLY  18           HA2      GLY  18  35.895  15.171  -1.749
  155    H    GLY  19           HN       GLY  19  38.184  15.820  -3.031
  156    HA2  GLY  19           HA1      GLY  19  37.198  17.723  -5.025
  157    HA3  GLY  19           HA2      GLY  19  38.860  17.564  -4.424
  158    H    ALA  20           HN       ALA  20  39.486  14.960  -5.000
  159    HA   ALA  20           HA       ALA  20  40.445  13.805  -6.777
  160    HB1  ALA  20           HB1      ALA  20  38.868  12.890  -8.334
  161    HB2  ALA  20           HB2      ALA  20  37.740  14.244  -8.077
  162    HB3  ALA  20           HB3      ALA  20  38.032  13.067  -6.774
  163    H    LEU  21           HN       LEU  21  41.258  16.418  -6.858
  164    HA   LEU  21           HA       LEU  21  40.714  17.699  -9.393
  165    HB2  LEU  21           HB2      LEU  21  43.225  18.012  -7.708
  166    HB3  LEU  21           HB1      LEU  21  42.493  19.196  -8.816
  167    HG   LEU  21           HG       LEU  21  41.231  18.155  -6.239
  168   HD11  LEU  21          HD11      LEU  21  41.622  20.469  -5.431
  169   HD12  LEU  21          HD12      LEU  21  42.438  20.863  -6.962
  170   HD13  LEU  21          HD13      LEU  21  43.151  19.665  -5.855
  171   HD21  LEU  21          HD21      LEU  21  39.426  18.691  -7.701
  172   HD22  LEU  21          HD22      LEU  21  40.296  20.072  -8.415
  173   HD23  LEU  21          HD23      LEU  21  39.663  20.177  -6.755
  174    H    ASP  22           HN       ASP  22  42.679  15.018  -8.448
  175    HA   ASP  22           HA       ASP  22  44.809  15.148 -10.287
  176    HB2  ASP  22           HB2      ASP  22  43.202  12.760  -9.303
  177    HB3  ASP  22           HB1      ASP  22  44.714  12.623 -10.233
  178    H    HIS  23           HN       HIS  23  42.466  12.627 -10.983
  179    HA   HIS  23           HA       HIS  23  42.647  13.243 -13.853
  180    HB2  HIS  23           HB2      HIS  23  42.630  10.911 -12.968
  181    HB3  HIS  23           HB1      HIS  23  40.964  11.168 -12.396
  182    HD1  HIS  23           HD1      HIS  23  41.802  12.886 -15.580
  183    HD2  HIS  23           HD2      HIS  23  40.270   9.142 -14.433
  184    HE1  HIS  23           HE1      HIS  23  40.734  11.835 -17.648
  185    H    LEU  24           HN       LEU  24  41.072  14.861 -11.599
  186    HA   LEU  24           HA       LEU  24  39.022  15.782 -13.443
  187    HB2  LEU  24           HB2      LEU  24  37.806  13.821 -12.739
  188    HB3  LEU  24           HB1      LEU  24  38.205  14.111 -11.033
  189    HG   LEU  24           HG       LEU  24  36.791  16.079 -10.955
  190   HD11  LEU  24          HD11      LEU  24  37.150  17.156 -13.054
  191   HD12  LEU  24          HD12      LEU  24  35.443  16.663 -13.096
  192   HD13  LEU  24          HD13      LEU  24  36.666  15.712 -13.975
  193   HD21  LEU  24          HD21      LEU  24  35.660  13.883 -10.751
  194   HD22  LEU  24          HD22      LEU  24  35.399  13.853 -12.512
  195   HD23  LEU  24          HD23      LEU  24  34.593  15.087 -11.512
  Start of MODEL   86
    1    H1   GLY   1           HT1      GLY   1  62.475  -2.894   6.536
    2    H2   GLY   1           HT2      GLY   1  63.892  -2.272   7.239
    3    H3   GLY   1           HT3      GLY   1  63.575  -2.020   5.588
    4    HA2  GLY   1           HA1      GLY   1  62.132  -0.907   7.898
    5    HA3  GLY   1           HA2      GLY   1  63.129  -0.031   6.720
    6    H    LYS   2           HN       LYS   2  60.194   0.066   7.571
    7    HA   LYS   2           HA       LYS   2  59.166   0.598   4.904
    8    HB2  LYS   2           HB2      LYS   2  57.326  -1.043   4.940
    9    HB3  LYS   2           HB1      LYS   2  58.910  -1.859   4.911
   10    HG2  LYS   2           HG2      LYS   2  58.751  -1.972   7.469
   11    HG3  LYS   2           HG1      LYS   2  57.054  -1.464   7.293
   12    HD2  LYS   2           HD2      LYS   2  58.341  -3.952   6.083
   13    HD3  LYS   2           HD1      LYS   2  57.163  -3.909   7.414
   14    HE2  LYS   2           HE2      LYS   2  55.815  -4.405   5.540
   15    HE3  LYS   2           HE1      LYS   2  55.629  -2.642   5.690
   16    HZ1  LYS   2           HZ1      LYS   2  56.511  -2.400   3.684
   17    HZ2  LYS   2           HZ2      LYS   2  56.599  -4.087   3.513
   18    HZ3  LYS   2           HZ3      LYS   2  57.919  -3.226   4.145
   19    H    GLY   3           HN       GLY   3  59.556   1.971   7.437
   20    HA2  GLY   3           HA1      GLY   3  57.373   2.311   9.136
   21    HA3  GLY   3           HA2      GLY   3  58.267   3.749   8.463
   22    H    ARG   4           HN       ARG   4  58.296   4.027   6.500
   23    HA   ARG   4           HA       ARG   4  56.572   5.603   7.160
   24    HB2  ARG   4           HB2      ARG   4  57.622   5.475   4.294
   25    HB3  ARG   4           HB1      ARG   4  56.817   6.897   5.004
   26    HG2  ARG   4           HG2      ARG   4  58.519   7.000   6.785
   27    HG3  ARG   4           HG1      ARG   4  59.310   5.544   6.134
   28    HD2  ARG   4           HD2      ARG   4  60.549   7.432   5.298
   29    HD3  ARG   4           HD1      ARG   4  59.587   6.811   3.936
   30    HE   ARG   4           HE       ARG   4  58.400   8.853   3.945
   31   HH11  ARG   4          HH11      ARG   4  60.939   9.697   5.634
   32   HH12  ARG   4          HH12      ARG   4  60.156  10.650   6.848
   33   HH21  ARG   4          HH21      ARG   4  56.977   9.500   6.078
   34   HH22  ARG   4          HH22      ARG   4  57.912  10.540   7.100
   35    H    TRP   5           HN       TRP   5  55.988   2.818   5.753
   36    HA   TRP   5           HA       TRP   5  54.009   2.868   3.808
   37    HB2  TRP   5           HB2      TRP   5  54.759   0.781   4.809
   38    HB3  TRP   5           HB1      TRP   5  54.043   1.234   6.374
   39    HD1  TRP   5           HD1      TRP   5  52.412   1.449   2.853
   40    HE1  TRP   5           HE1      TRP   5  50.207   0.078   2.866
   41    HE3  TRP   5           HE3      TRP   5  52.695  -0.495   7.582
   42    HZ2  TRP   5           HZ2      TRP   5  48.784  -1.629   4.696
   43    HZ3  TRP   5           HZ3      TRP   5  50.902  -1.994   8.440
   44    HH2  TRP   5           HH2      TRP   5  48.949  -2.562   7.002
   45    H    LEU   6           HN       LEU   6  53.811   4.105   7.052
   46    HA   LEU   6           HA       LEU   6  50.860   4.545   6.870
   47    HB2  LEU   6           HB2      LEU   6  52.928   4.758   9.078
   48    HB3  LEU   6           HB1      LEU   6  51.331   5.510   9.256
   49    HG   LEU   6           HG       LEU   6  51.608   3.148  10.224
   50   HD11  LEU   6          HD11      LEU   6  49.415   3.250   8.117
   51   HD12  LEU   6          HD12      LEU   6  49.382   4.295   9.554
   52   HD13  LEU   6          HD13      LEU   6  49.372   2.529   9.738
   53   HD21  LEU   6          HD21      LEU   6  51.599   1.257   8.746
   54   HD22  LEU   6          HD22      LEU   6  52.922   2.318   8.208
   55   HD23  LEU   6          HD23      LEU   6  51.386   2.285   7.311
   56    H    GLU   7           HN       GLU   7  53.999   6.217   6.791
   57    HA   GLU   7           HA       GLU   7  52.652   8.882   6.810
   58    HB2  GLU   7           HB2      GLU   7  55.556   7.979   6.697
   59    HB3  GLU   7           HB1      GLU   7  55.056   9.683   6.564
   60    HG2  GLU   7           HG2      GLU   7  54.213   7.885   8.877
   61    HG3  GLU   7           HG1      GLU   7  55.683   8.888   8.918
   62    H    ARG   8           HN       ARG   8  51.821   7.253   4.690
   63    HA   ARG   8           HA       ARG   8  52.851   8.856   2.388
   64    HB2  ARG   8           HB2      ARG   8  52.842   5.817   2.535
   65    HB3  ARG   8           HB1      ARG   8  52.924   6.724   1.005
   66    HG2  ARG   8           HG2      ARG   8  54.962   7.905   1.857
   67    HG3  ARG   8           HG1      ARG   8  54.906   6.891   3.318
   68    HD2  ARG   8           HD2      ARG   8  56.483   6.004   1.582
   69    HD3  ARG   8           HD1      ARG   8  55.175   4.863   1.977
   70    HE   ARG   8           HE       ARG   8  54.297   6.424  -0.225
   71   HH11  ARG   8          HH11      ARG   8  55.718   6.323  -2.218
   72   HH12  ARG   8          HH12      ARG   8  56.320   4.741  -2.580
   73   HH21  ARG   8          HH21      ARG   8  55.522   3.436   0.532
   74   HH22  ARG   8          HH22      ARG   8  56.209   3.105  -1.023
   75    H    ILE   9           HN       ILE   9  50.355   8.529   4.125
   76    HA   ILE   9           HA       ILE   9  48.289   7.229   2.727
   77    HB   ILE   9           HB       ILE   9  46.805   9.164   3.660
   78   HG12  ILE   9          HG12      ILE   9  49.260   9.844   5.331
   79   HG13  ILE   9          HG11      ILE   9  49.035  10.655   3.769
   80   HG21  ILE   9          HG21      ILE   9  47.124   6.965   4.767
   81   HG22  ILE   9          HG22      ILE   9  47.019   8.277   5.962
   82   HG23  ILE   9          HG23      ILE   9  48.599   7.572   5.552
   83   HD11  ILE   9           HD1      ILE   9  46.758  11.376   4.488
   84   HD12  ILE   9           HD2      ILE   9  48.035  12.002   5.556
   85   HD13  ILE   9           HD3      ILE   9  47.039  10.624   6.074
   86    H    GLY  10           HN       GLY  10  47.524   7.392   0.758
   87    HA2  GLY  10           HA1      GLY  10  48.338   9.573  -0.991
   88    HA3  GLY  10           HA2      GLY  10  47.257   8.225  -1.399
   89    H    LYS  11           HN       LYS  11  45.715   9.006   1.169
   90    HA   LYS  11           HA       LYS  11  43.801  10.735  -0.228
   91    HB2  LYS  11           HB2      LYS  11  43.798   9.756   2.653
   92    HB3  LYS  11           HB1      LYS  11  42.412  10.400   1.739
   93    HG2  LYS  11           HG2      LYS  11  42.609   8.516   0.129
   94    HG3  LYS  11           HG1      LYS  11  43.973   7.865   1.070
   95    HD2  LYS  11           HD2      LYS  11  42.477   7.706   3.069
   96    HD3  LYS  11           HD1      LYS  11  41.116   8.262   2.064
   97    HE2  LYS  11           HE2      LYS  11  41.057   5.826   2.170
   98    HE3  LYS  11           HE1      LYS  11  41.532   6.313   0.525
   99    HZ1  LYS  11           HZ1      LYS  11  43.549   5.415   0.774
  100    HZ2  LYS  11           HZ2      LYS  11  42.888   4.576   2.096
  101    HZ3  LYS  11           HZ3      LYS  11  43.750   6.019   2.346
  102    H    ALA  12           HN       ALA  12  44.244  12.854  -0.411
  103    HA   ALA  12           HA       ALA  12  45.787  14.239   1.696
  104    HB1  ALA  12           HB1      ALA  12  44.371  15.381  -0.736
  105    HB2  ALA  12           HB2      ALA  12  46.029  14.736  -0.753
  106    HB3  ALA  12           HB3      ALA  12  45.637  16.162   0.238
  107    H    GLY  13           HN       GLY  13  42.841  13.054   1.770
  108    HA2  GLY  13           HA1      GLY  13  40.814  13.675   2.710
  109    HA3  GLY  13           HA2      GLY  13  41.833  14.560   3.864
  110    H    PHE  14           HN       PHE  14  41.494  15.200   0.388
  111    HA   PHE  14           HA       PHE  14  39.668  17.461   0.831
  112    HB2  PHE  14           HB2      PHE  14  41.969  18.319   1.519
  113    HB3  PHE  14           HB1      PHE  14  42.479  18.065  -0.166
  114    HD1  PHE  14           HD1      PHE  14  41.659  19.491  -1.965
  115    HD2  PHE  14           HD2      PHE  14  40.226  19.993   2.076
  116    HE1  PHE  14           HE1      PHE  14  40.639  21.675  -2.597
  117    HE2  PHE  14           HE2      PHE  14  39.207  22.176   1.444
  118    HZ   PHE  14           HZ       PHE  14  39.437  23.031  -0.886
  119    H    ILE  15           HN       ILE  15  42.302  16.701  -1.499
  120    HA   ILE  15           HA       ILE  15  40.301  16.862  -3.703
  121    HB   ILE  15           HB       ILE  15  42.547  18.098  -3.740
  122   HG12  ILE  15          HG12      ILE  15  41.859  16.197  -6.030
  123   HG13  ILE  15          HG11      ILE  15  41.168  17.811  -5.748
  124   HG21  ILE  15          HG21      ILE  15  43.720  15.802  -2.968
  125   HG22  ILE  15          HG22      ILE  15  44.572  16.977  -3.994
  126   HG23  ILE  15          HG23      ILE  15  43.827  15.540  -4.724
  127   HD11  ILE  15           HD1      ILE  15  44.033  17.104  -6.484
  128   HD12  ILE  15           HD2      ILE  15  43.575  18.705  -5.853
  129   HD13  ILE  15           HD3      ILE  15  42.885  18.121  -7.386
  130    H    ILE  16           HN       ILE  16  39.904  14.727  -2.041
  131    HA   ILE  16           HA       ILE  16  40.454  12.495  -3.932
  132    HB   ILE  16           HB       ILE  16  42.263  12.521  -2.174
  133   HG12  ILE  16          HG12      ILE  16  41.909  10.086  -1.503
  134   HG13  ILE  16          HG11      ILE  16  40.288  10.186  -2.219
  135   HG21  ILE  16          HG21      ILE  16  40.046  11.733  -0.258
  136   HG22  ILE  16          HG22      ILE  16  40.690  13.387  -0.368
  137   HG23  ILE  16          HG23      ILE  16  41.754  12.045   0.115
  138   HD11  ILE  16           HD1      ILE  16  41.117  10.315  -4.414
  139   HD12  ILE  16           HD2      ILE  16  42.347   9.281  -3.658
  140   HD13  ILE  16           HD3      ILE  16  42.673  11.011  -3.904
  141    H    ILE  17           HN       ILE  17  38.843  13.611  -0.923
  142    HA   ILE  17           HA       ILE  17  36.676  11.601  -1.335
  143    HB   ILE  17           HB       ILE  17  35.706  12.992   0.744
  144   HG12  ILE  17          HG12      ILE  17  37.475  14.000   2.114
  145   HG13  ILE  17          HG11      ILE  17  38.693  13.612   0.879
  146   HG21  ILE  17          HG21      ILE  17  36.348  10.692   1.000
  147   HG22  ILE  17          HG22      ILE  17  37.190  11.598   2.280
  148   HG23  ILE  17          HG23      ILE  17  38.072  11.081   0.826
  149   HD11  ILE  17           HD1      ILE  17  37.776  15.176  -0.672
  150   HD12  ILE  17           HD2      ILE  17  37.757  16.023   0.891
  151   HD13  ILE  17           HD3      ILE  17  36.257  15.319   0.244
  152    H    GLY  18           HN       GLY  18  37.451  14.131  -3.010
  153    HA2  GLY  18           HA1      GLY  18  34.669  14.816  -3.644
  154    HA3  GLY  18           HA2      GLY  18  35.608  16.153  -2.946
  155    H    GLY  19           HN       GLY  19  38.104  15.818  -4.024
  156    HA2  GLY  19           HA1      GLY  19  37.705  16.876  -6.669
  157    HA3  GLY  19           HA2      GLY  19  39.257  16.438  -5.930
  158    H    ALA  20           HN       ALA  20  37.857  13.663  -5.477
  159    HA   ALA  20           HA       ALA  20  39.045  12.454  -7.845
  160    HB1  ALA  20           HB1      ALA  20  37.343  11.309  -5.606
  161    HB2  ALA  20           HB2      ALA  20  39.120  11.301  -5.713
  162    HB3  ALA  20           HB3      ALA  20  38.153  10.342  -6.860
  163    H    LEU  21           HN       LEU  21  35.827  13.454  -6.859
  164    HA   LEU  21           HA       LEU  21  34.260  11.863  -8.606
  165    HB2  LEU  21           HB2      LEU  21  33.942  14.657  -7.464
  166    HB3  LEU  21           HB1      LEU  21  32.730  13.997  -8.588
  167    HG   LEU  21           HG       LEU  21  32.337  12.085  -7.109
  168   HD11  LEU  21          HD11      LEU  21  34.614  13.313  -5.503
  169   HD12  LEU  21          HD12      LEU  21  34.498  11.663  -6.163
  170   HD13  LEU  21          HD13      LEU  21  33.468  12.149  -4.798
  171   HD21  LEU  21          HD21      LEU  21  31.299  13.266  -5.251
  172   HD22  LEU  21          HD22      LEU  21  31.166  14.290  -6.701
  173   HD23  LEU  21          HD23      LEU  21  32.393  14.654  -5.463
  174    H    ASP  22           HN       ASP  22  34.419  11.597 -10.721
  175    HA   ASP  22           HA       ASP  22  34.880  12.047 -12.951
  176    HB2  ASP  22           HB2      ASP  22  34.006  14.880 -12.273
  177    HB3  ASP  22           HB1      ASP  22  33.923  14.065 -13.854
  178    H    HIS  23           HN       HIS  23  36.988  12.542 -10.866
  179    HA   HIS  23           HA       HIS  23  39.132  13.424 -10.764
  180    HB2  HIS  23           HB2      HIS  23  39.223  12.144 -12.934
  181    HB3  HIS  23           HB1      HIS  23  38.855  13.663 -13.785
  182    HD1  HIS  23           HD1      HIS  23  41.084  13.482 -10.709
  183    HD2  HIS  23           HD2      HIS  23  41.466  13.923 -14.873
  184    HE1  HIS  23           HE1      HIS  23  43.497  14.180 -11.182
  185    H    LEU  24           HN       LEU  24  37.356  15.293 -10.033
  186    HA   LEU  24           HA       LEU  24  37.588  17.718 -11.657
  187    HB2  LEU  24           HB2      LEU  24  35.726  16.969  -9.929
  188    HB3  LEU  24           HB1      LEU  24  36.803  17.709  -8.725
  189    HG   LEU  24           HG       LEU  24  35.638  19.072 -11.199
  190   HD11  LEU  24          HD11      LEU  24  35.163  19.524  -8.219
  191   HD12  LEU  24          HD12      LEU  24  34.042  18.691  -9.323
  192   HD13  LEU  24          HD13      LEU  24  34.399  20.420  -9.554
  193   HD21  LEU  24          HD21      LEU  24  37.774  20.076 -10.876
  194   HD22  LEU  24          HD22      LEU  24  37.655  19.970  -9.102
  195   HD23  LEU  24          HD23      LEU  24  36.659  21.145  -9.996
  Start of MODEL   87
    1    H1   GLY   1           HT1      GLY   1  58.029  -0.910   2.421
    2    H2   GLY   1           HT2      GLY   1  58.399  -2.446   1.793
    3    H3   GLY   1           HT3      GLY   1  57.059  -1.582   1.205
    4    HA2  GLY   1           HA1      GLY   1  59.917  -1.023   0.833
    5    HA3  GLY   1           HA2      GLY   1  58.693  -1.378  -0.402
    6    H    LYS   2           HN       LYS   2  56.769   0.185  -0.397
    7    HA   LYS   2           HA       LYS   2  57.236   2.868   0.608
    8    HB2  LYS   2           HB2      LYS   2  57.466   3.924  -1.682
    9    HB3  LYS   2           HB1      LYS   2  58.900   3.027  -1.128
   10    HG2  LYS   2           HG2      LYS   2  58.282   1.093  -2.477
   11    HG3  LYS   2           HG1      LYS   2  56.737   1.854  -2.930
   12    HD2  LYS   2           HD2      LYS   2  58.058   3.740  -3.977
   13    HD3  LYS   2           HD1      LYS   2  59.538   2.797  -3.675
   14    HE2  LYS   2           HE2      LYS   2  58.661   0.943  -5.038
   15    HE3  LYS   2           HE1      LYS   2  57.145   1.835  -5.305
   16    HZ1  LYS   2           HZ1      LYS   2  59.792   2.961  -6.037
   17    HZ2  LYS   2           HZ2      LYS   2  58.251   3.459  -6.556
   18    HZ3  LYS   2           HZ3      LYS   2  58.902   1.989  -7.106
   19    H    GLY   3           HN       GLY   3  55.695   4.458  -0.645
   20    HA2  GLY   3           HA1      GLY   3  53.521   4.268  -2.084
   21    HA3  GLY   3           HA2      GLY   3  53.015   3.002  -0.872
   22    H    ARG   4           HN       ARG   4  53.607   3.182   1.005
   23    HA   ARG   4           HA       ARG   4  51.337   4.008   1.170
   24    HB2  ARG   4           HB2      ARG   4  53.108   3.573   3.620
   25    HB3  ARG   4           HB1      ARG   4  51.331   3.684   3.698
   26    HG2  ARG   4           HG2      ARG   4  51.074   1.770   2.233
   27    HG3  ARG   4           HG1      ARG   4  52.820   1.735   1.886
   28    HD2  ARG   4           HD2      ARG   4  52.239   0.006   3.548
   29    HD3  ARG   4           HD1      ARG   4  53.277   1.251   4.283
   30    HE   ARG   4           HE       ARG   4  50.636   2.080   4.767
   31   HH11  ARG   4          HH11      ARG   4  51.881  -1.065   4.995
   32   HH12  ARG   4          HH12      ARG   4  51.425  -1.298   6.650
   33   HH21  ARG   4          HH21      ARG   4  50.363   1.974   7.093
   34   HH22  ARG   4          HH22      ARG   4  50.566   0.423   7.838
   35    H    TRP   5           HN       TRP   5  53.933   5.862   1.249
   36    HA   TRP   5           HA       TRP   5  53.774   7.970   3.068
   37    HB2  TRP   5           HB2      TRP   5  54.213   8.196   0.063
   38    HB3  TRP   5           HB1      TRP   5  54.621   9.456   1.253
   39    HD1  TRP   5           HD1      TRP   5  55.932   6.338  -0.313
   40    HE1  TRP   5           HE1      TRP   5  58.190   5.630   0.768
   41    HE3  TRP   5           HE3      TRP   5  55.900   9.465   3.741
   42    HZ2  TRP   5           HZ2      TRP   5  59.744   6.348   3.084
   43    HZ3  TRP   5           HZ3      TRP   5  57.780   9.436   5.372
   44    HH2  TRP   5           HH2      TRP   5  59.701   7.882   5.048
   45    H    LEU   6           HN       LEU   6  51.407   7.039   0.748
   46    HA   LEU   6           HA       LEU   6  49.866   9.590   1.189
   47    HB2  LEU   6           HB2      LEU   6  49.407   7.556  -1.020
   48    HB3  LEU   6           HB1      LEU   6  48.803   9.226  -0.909
   49    HG   LEU   6           HG       LEU   6  51.729   8.404  -1.214
   50   HD11  LEU   6          HD11      LEU   6  50.314   8.059  -3.244
   51   HD12  LEU   6          HD12      LEU   6  51.515   9.353  -3.471
   52   HD13  LEU   6          HD13      LEU   6  49.811   9.764  -3.158
   53   HD21  LEU   6          HD21      LEU   6  51.704  10.462   0.006
   54   HD22  LEU   6          HD22      LEU   6  50.324  11.093  -0.923
   55   HD23  LEU   6          HD23      LEU   6  51.925  10.949  -1.688
   56    H    GLU   7           HN       GLU   7  49.982   6.107   1.719
   57    HA   GLU   7           HA       GLU   7  47.058   5.932   2.152
   58    HB2  GLU   7           HB2      GLU   7  48.723   4.066   1.326
   59    HB3  GLU   7           HB1      GLU   7  49.079   3.854   3.053
   60    HG2  GLU   7           HG2      GLU   7  46.636   3.532   3.491
   61    HG3  GLU   7           HG1      GLU   7  46.328   3.670   1.744
   62    H    ARG   8           HN       ARG   8  48.814   7.844   3.692
   63    HA   ARG   8           HA       ARG   8  49.068   6.872   6.387
   64    HB2  ARG   8           HB2      ARG   8  48.824   9.678   5.241
   65    HB3  ARG   8           HB1      ARG   8  49.170   9.332   6.953
   66    HG2  ARG   8           HG2      ARG   8  51.171   8.019   6.272
   67    HG3  ARG   8           HG1      ARG   8  50.837   8.415   4.569
   68    HD2  ARG   8           HD2      ARG   8  52.536   9.948   5.510
   69    HD3  ARG   8           HD1      ARG   8  51.049  10.831   5.090
   70    HE   ARG   8           HE       ARG   8  50.944   9.984   7.841
   71   HH11  ARG   8          HH11      ARG   8  53.100  11.848   5.970
   72   HH12  ARG   8          HH12      ARG   8  53.088  13.210   7.040
   73   HH21  ARG   8          HH21      ARG   8  50.644  11.893   9.118
   74   HH22  ARG   8          HH22      ARG   8  51.700  13.236   8.823
   75    H    ILE   9           HN       ILE   9  47.140   9.760   6.006
   76    HA   ILE   9           HA       ILE   9  45.147   8.709   7.856
   77    HB   ILE   9           HB       ILE   9  44.023  10.908   7.519
   78   HG12  ILE   9          HG12      ILE   9  46.230  11.263   5.437
   79   HG13  ILE   9          HG11      ILE   9  44.478  11.245   5.139
   80   HG21  ILE   9          HG21      ILE   9  46.045  10.539   9.063
   81   HG22  ILE   9          HG22      ILE   9  45.735  12.220   8.575
   82   HG23  ILE   9          HG23      ILE   9  47.034  11.291   7.788
   83   HD11  ILE   9           HD1      ILE   9  46.135  13.363   6.547
   84   HD12  ILE   9           HD2      ILE   9  44.374  13.253   6.796
   85   HD13  ILE   9           HD3      ILE   9  45.028  13.553   5.168
   86    H    GLY  10           HN       GLY  10  45.334   9.274   4.352
   87    HA2  GLY  10           HA1      GLY  10  43.802   8.813   2.669
   88    HA3  GLY  10           HA2      GLY  10  43.476   7.344   3.612
   89    H    LYS  11           HN       LYS  11  42.855  10.314   5.228
   90    HA   LYS  11           HA       LYS  11  40.006   9.701   5.366
   91    HB2  LYS  11           HB2      LYS  11  41.496  10.765   7.184
   92    HB3  LYS  11           HB1      LYS  11  41.355  12.277   6.258
   93    HG2  LYS  11           HG2      LYS  11  38.925  12.253   6.489
   94    HG3  LYS  11           HG1      LYS  11  38.973  10.647   7.256
   95    HD2  LYS  11           HD2      LYS  11  40.350  11.613   9.109
   96    HD3  LYS  11           HD1      LYS  11  40.175  13.221   8.364
   97    HE2  LYS  11           HE2      LYS  11  37.984  11.447   9.510
   98    HE3  LYS  11           HE1      LYS  11  38.466  13.074  10.046
   99    HZ1  LYS  11           HZ1      LYS  11  37.823  13.833   7.748
  100    HZ2  LYS  11           HZ2      LYS  11  36.537  13.338   8.742
  101    HZ3  LYS  11           HZ3      LYS  11  37.110  12.312   7.516
  102    H    ALA  12           HN       ALA  12  41.892  11.149   3.018
  103    HA   ALA  12           HA       ALA  12  41.315  12.283   1.108
  104    HB1  ALA  12           HB1      ALA  12  39.119  12.243   0.334
  105    HB2  ALA  12           HB2      ALA  12  38.426  12.514   1.952
  106    HB3  ALA  12           HB3      ALA  12  39.094  10.922   1.522
  107    H    GLY  13           HN       GLY  13  41.467  13.426   4.084
  108    HA2  GLY  13           HA1      GLY  13  41.296  15.534   5.075
  109    HA3  GLY  13           HA2      GLY  13  42.020  16.054   3.541
  110    H    PHE  14           HN       PHE  14  38.796  14.782   4.384
  111    HA   PHE  14           HA       PHE  14  36.708  15.774   4.263
  112    HB2  PHE  14           HB2      PHE  14  38.029  17.940   4.981
  113    HB3  PHE  14           HB1      PHE  14  37.868  18.404   3.271
  114    HD1  PHE  14           HD1      PHE  14  35.774  19.171   2.384
  115    HD2  PHE  14           HD2      PHE  14  35.942  17.434   6.332
  116    HE1  PHE  14           HE1      PHE  14  33.434  19.910   2.809
  117    HE2  PHE  14           HE2      PHE  14  33.601  18.173   6.756
  118    HZ   PHE  14           HZ       PHE  14  32.321  19.340   4.964
  119    H    ILE  15           HN       ILE  15  37.579  14.163   2.305
  120    HA   ILE  15           HA       ILE  15  37.175  13.561   0.136
  121    HB   ILE  15           HB       ILE  15  35.296  15.970   0.103
  122   HG12  ILE  15          HG12      ILE  15  34.415  13.082   0.465
  123   HG13  ILE  15          HG11      ILE  15  35.035  13.970   1.873
  124   HG21  ILE  15          HG21      ILE  15  35.773  13.641  -1.784
  125   HG22  ILE  15          HG22      ILE  15  35.545  15.368  -2.157
  126   HG23  ILE  15          HG23      ILE  15  34.157  14.374  -1.670
  127   HD11  ILE  15           HD1      ILE  15  32.877  15.178   0.105
  128   HD12  ILE  15           HD2      ILE  15  33.301  15.581   1.784
  129   HD13  ILE  15           HD3      ILE  15  32.474  14.049   1.419
  130    H    ILE  16           HN       ILE  16  39.424  14.137  -0.146
  131    HA   ILE  16           HA       ILE  16  39.669  16.323  -2.212
  132    HB   ILE  16           HB       ILE  16  41.736  15.607  -0.103
  133   HG12  ILE  16          HG12      ILE  16  39.613  16.897   0.696
  134   HG13  ILE  16          HG11      ILE  16  41.198  17.578   1.096
  135   HG21  ILE  16          HG21      ILE  16  42.796  16.363  -2.140
  136   HG22  ILE  16          HG22      ILE  16  42.825  17.734  -1.009
  137   HG23  ILE  16          HG23      ILE  16  41.632  17.689  -2.329
  138   HD11  ILE  16           HD1      ILE  16  39.474  19.245   0.231
  139   HD12  ILE  16           HD2      ILE  16  39.601  18.451  -1.350
  140   HD13  ILE  16           HD3      ILE  16  41.023  19.241  -0.637
  141    H    ILE  17           HN       ILE  17  41.456  13.540  -0.725
  142    HA   ILE  17           HA       ILE  17  42.806  12.957  -3.240
  143    HB   ILE  17           HB       ILE  17  42.423  11.309  -0.692
  144   HG12  ILE  17          HG12      ILE  17  44.798  11.735  -0.359
  145   HG13  ILE  17          HG11      ILE  17  44.932  12.490  -1.963
  146   HG21  ILE  17          HG21      ILE  17  44.228   9.810  -1.762
  147   HG22  ILE  17          HG22      ILE  17  43.799  10.588  -3.305
  148   HG23  ILE  17          HG23      ILE  17  42.580   9.650  -2.411
  149   HD11  ILE  17           HD1      ILE  17  44.751  14.061   0.099
  150   HD12  ILE  17           HD2      ILE  17  43.037  13.588   0.143
  151   HD13  ILE  17           HD3      ILE  17  43.702  14.401  -1.293
  152    H    GLY  18           HN       GLY  18  40.124  11.444  -1.406
  153    HA2  GLY  18           HA1      GLY  18  39.431   9.593  -3.498
  154    HA3  GLY  18           HA2      GLY  18  38.402  10.077  -2.131
  155    H    GLY  19           HN       GLY  19  38.121  12.770  -2.469
  156    HA2  GLY  19           HA1      GLY  19  36.047  12.970  -4.365
  157    HA3  GLY  19           HA2      GLY  19  36.958  14.344  -3.707
  158    H    ALA  20           HN       ALA  20  39.384  14.276  -4.669
  159    HA   ALA  20           HA       ALA  20  39.086  15.106  -7.381
  160    HB1  ALA  20           HB1      ALA  20  41.481  15.291  -7.408
  161    HB2  ALA  20           HB2      ALA  20  41.641  14.142  -6.058
  162    HB3  ALA  20           HB3      ALA  20  40.925  15.749  -5.782
  163    H    LEU  21           HN       LEU  21  41.029  12.307  -6.237
  164    HA   LEU  21           HA       LEU  21  41.428  10.260  -7.229
  165    HB2  LEU  21           HB2      LEU  21  38.778  10.386  -7.154
  166    HB3  LEU  21           HB1      LEU  21  38.922  10.521  -8.918
  167    HG   LEU  21           HG       LEU  21  40.034   8.278  -7.168
  168   HD11  LEU  21          HD11      LEU  21  38.369   6.892  -8.257
  169   HD12  LEU  21          HD12      LEU  21  37.912   8.215  -9.357
  170   HD13  LEU  21          HD13      LEU  21  37.539   8.331  -7.620
  171   HD21  LEU  21          HD21      LEU  21  40.493   7.252  -9.510
  172   HD22  LEU  21          HD22      LEU  21  41.597   8.530  -8.956
  173   HD23  LEU  21          HD23      LEU  21  40.318   8.910 -10.136
  174    H    ASP  22           HN       ASP  22  43.263  11.093  -8.300
  175    HA   ASP  22           HA       ASP  22  43.180  10.743 -11.170
  176    HB2  ASP  22           HB2      ASP  22  42.183  13.047 -10.971
  177    HB3  ASP  22           HB1      ASP  22  43.701  13.584 -10.210
  178    H    HIS  23           HN       HIS  23  44.634   9.436  -9.320
  179    HA   HIS  23           HA       HIS  23  46.805   8.872  -8.738
  180    HB2  HIS  23           HB2      HIS  23  47.017   8.995 -11.260
  181    HB3  HIS  23           HB1      HIS  23  47.635  10.652 -11.061
  182    HD1  HIS  23           HD1      HIS  23  48.373   7.197  -9.512
  183    HD2  HIS  23           HD2      HIS  23  50.382  10.611 -10.924
  184    HE1  HIS  23           HE1      HIS  23  50.877   6.784  -9.217
  185    H    LEU  24           HN       LEU  24  45.516  11.388  -7.712
  186    HA   LEU  24           HA       LEU  24  47.865  12.375  -6.292
  187    HB2  LEU  24           HB2      LEU  24  48.207  13.715  -8.265
  188    HB3  LEU  24           HB1      LEU  24  46.483  14.137  -8.354
  189    HG   LEU  24           HG       LEU  24  46.632  15.504  -6.359
  190   HD11  LEU  24          HD11      LEU  24  48.963  15.757  -5.252
  191   HD12  LEU  24          HD12      LEU  24  49.389  14.243  -6.087
  192   HD13  LEU  24          HD13      LEU  24  48.061  14.266  -4.901
  193   HD21  LEU  24          HD21      LEU  24  47.488  16.452  -8.531
  194   HD22  LEU  24          HD22      LEU  24  49.135  16.007  -8.026
  195   HD23  LEU  24          HD23      LEU  24  48.210  17.208  -7.092
  Start of MODEL   88
    1    H1   GLY   1           HT1      GLY   1  54.284  -1.537  -0.901
    2    H2   GLY   1           HT2      GLY   1  55.175  -2.503  -1.979
    3    H3   GLY   1           HT3      GLY   1  54.908  -0.861  -2.324
    4    HA2  GLY   1           HA1      GLY   1  56.510  -1.969  -0.115
    5    HA3  GLY   1           HA2      GLY   1  57.128  -1.183  -1.582
    6    H    LYS   2           HN       LYS   2  58.211   0.414  -0.400
    7    HA   LYS   2           HA       LYS   2  57.023   2.027   1.618
    8    HB2  LYS   2           HB2      LYS   2  59.455   1.966   1.096
    9    HB3  LYS   2           HB1      LYS   2  59.132   2.831  -0.427
   10    HG2  LYS   2           HG2      LYS   2  58.344   4.782   0.741
   11    HG3  LYS   2           HG1      LYS   2  58.302   3.915   2.295
   12    HD2  LYS   2           HD2      LYS   2  60.759   3.662   2.236
   13    HD3  LYS   2           HD1      LYS   2  60.815   4.499   0.666
   14    HE2  LYS   2           HE2      LYS   2  59.938   6.544   1.663
   15    HE3  LYS   2           HE1      LYS   2  59.688   5.722   3.222
   16    HZ1  LYS   2           HZ1      LYS   2  61.854   7.118   2.707
   17    HZ2  LYS   2           HZ2      LYS   2  62.374   5.639   2.052
   18    HZ3  LYS   2           HZ3      LYS   2  61.899   5.730   3.681
   19    H    GLY   3           HN       GLY   3  56.288   4.229   1.537
   20    HA2  GLY   3           HA1      GLY   3  55.628   5.928  -0.495
   21    HA3  GLY   3           HA2      GLY   3  54.356   4.638  -0.718
   22    H    ARG   4           HN       ARG   4  53.808   3.596   0.895
   23    HA   ARG   4           HA       ARG   4  51.941   5.127   0.667
   24    HB2  ARG   4           HB2      ARG   4  52.031   2.803   2.640
   25    HB3  ARG   4           HB1      ARG   4  50.512   3.649   2.249
   26    HG2  ARG   4           HG2      ARG   4  50.873   3.173  -0.164
   27    HG3  ARG   4           HG1      ARG   4  52.379   2.314   0.235
   28    HD2  ARG   4           HD2      ARG   4  51.039   0.759   1.694
   29    HD3  ARG   4           HD1      ARG   4  49.559   1.563   1.117
   30    HE   ARG   4           HE       ARG   4  51.230   0.623  -1.077
   31   HH11  ARG   4          HH11      ARG   4  50.346  -1.434   1.238
   32   HH12  ARG   4          HH12      ARG   4  49.080  -2.242   0.375
   33   HH21  ARG   4          HH21      ARG   4  48.965   0.098  -2.180
   34   HH22  ARG   4          HH22      ARG   4  48.298  -1.375  -1.559
   35    H    TRP   5           HN       TRP   5  54.223   5.403   2.874
   36    HA   TRP   5           HA       TRP   5  53.321   6.174   5.387
   37    HB2  TRP   5           HB2      TRP   5  55.693   6.283   4.602
   38    HB3  TRP   5           HB1      TRP   5  55.303   7.786   3.732
   39    HD1  TRP   5           HD1      TRP   5  54.861   9.961   5.155
   40    HE1  TRP   5           HE1      TRP   5  55.355  10.614   7.623
   41    HE3  TRP   5           HE3      TRP   5  55.826   5.302   7.046
   42    HZ2  TRP   5           HZ2      TRP   5  56.073   9.270  10.066
   43    HZ3  TRP   5           HZ3      TRP   5  56.413   5.011   9.449
   44    HH2  TRP   5           HH2      TRP   5  56.537   6.989  10.959
   45    H    LEU   6           HN       LEU   6  52.484   7.621   2.372
   46    HA   LEU   6           HA       LEU   6  51.173   9.933   3.796
   47    HB2  LEU   6           HB2      LEU   6  52.064   9.772   0.885
   48    HB3  LEU   6           HB1      LEU   6  51.327  11.167   1.703
   49    HG   LEU   6           HG       LEU   6  53.428  10.757   3.406
   50   HD11  LEU   6          HD11      LEU   6  54.193   8.810   1.901
   51   HD12  LEU   6          HD12      LEU   6  55.416  10.043   2.279
   52   HD13  LEU   6          HD13      LEU   6  54.613  10.041   0.691
   53   HD21  LEU   6          HD21      LEU   6  54.663  12.502   2.106
   54   HD22  LEU   6          HD22      LEU   6  52.935  12.886   2.283
   55   HD23  LEU   6          HD23      LEU   6  53.551  12.245   0.741
   56    H    GLU   7           HN       GLU   7  50.729   7.026   1.894
   57    HA   GLU   7           HA       GLU   7  48.119   7.894   0.823
   58    HB2  GLU   7           HB2      GLU   7  49.821   6.157  -0.175
   59    HB3  GLU   7           HB1      GLU   7  49.087   5.020   0.974
   60    HG2  GLU   7           HG2      GLU   7  47.847   4.768  -1.058
   61    HG3  GLU   7           HG1      GLU   7  46.810   5.737   0.013
   62    H    ARG   8           HN       ARG   8  49.263   6.996   3.834
   63    HA   ARG   8           HA       ARG   8  47.326   5.185   4.823
   64    HB2  ARG   8           HB2      ARG   8  49.412   6.044   5.997
   65    HB3  ARG   8           HB1      ARG   8  48.496   7.522   6.376
   66    HG2  ARG   8           HG2      ARG   8  46.794   6.196   7.560
   67    HG3  ARG   8           HG1      ARG   8  47.645   4.691   7.133
   68    HD2  ARG   8           HD2      ARG   8  49.574   5.319   8.452
   69    HD3  ARG   8           HD1      ARG   8  48.925   6.955   8.720
   70    HE   ARG   8           HE       ARG   8  47.064   4.987   9.703
   71   HH11  ARG   8          HH11      ARG   8  50.114   4.516  10.544
   72   HH12  ARG   8          HH12      ARG   8  50.035   5.152  12.154
   73   HH21  ARG   8          HH21      ARG   8  46.947   6.658  11.691
   74   HH22  ARG   8          HH22      ARG   8  48.243   6.364  12.802
   75    H    ILE   9           HN       ILE   9  47.012   8.502   3.853
   76    HA   ILE   9           HA       ILE   9  44.704   9.145   5.488
   77    HB   ILE   9           HB       ILE   9  45.509  10.305   2.785
   78   HG12  ILE   9          HG12      ILE   9  47.398  10.476   4.310
   79   HG13  ILE   9          HG11      ILE   9  46.652  12.080   4.156
   80   HG21  ILE   9          HG21      ILE   9  44.328  12.379   4.017
   81   HG22  ILE   9          HG22      ILE   9  43.490  11.083   4.903
   82   HG23  ILE   9          HG23      ILE   9  43.373  11.169   3.135
   83   HD11  ILE   9           HD1      ILE   9  47.000  11.875   6.483
   84   HD12  ILE   9           HD2      ILE   9  46.562  10.152   6.499
   85   HD13  ILE   9           HD3      ILE   9  45.300  11.390   6.307
   86    H    GLY  10           HN       GLY  10  43.631   7.002   5.141
   87    HA2  GLY  10           HA1      GLY  10  42.397   6.545   2.525
   88    HA3  GLY  10           HA2      GLY  10  42.099   5.640   4.023
   89    H    LYS  11           HN       LYS  11  41.777   8.626   5.115
   90    HA   LYS  11           HA       LYS  11  38.863   8.515   5.043
   91    HB2  LYS  11           HB2      LYS  11  40.558  10.847   5.996
   92    HB3  LYS  11           HB1      LYS  11  38.934  10.362   6.541
   93    HG2  LYS  11           HG2      LYS  11  41.526   8.807   6.964
   94    HG3  LYS  11           HG1      LYS  11  40.607   9.690   8.207
   95    HD2  LYS  11           HD2      LYS  11  38.607   8.162   7.548
   96    HD3  LYS  11           HD1      LYS  11  39.818   7.159   6.713
   97    HE2  LYS  11           HE2      LYS  11  41.120   7.080   8.892
   98    HE3  LYS  11           HE1      LYS  11  39.726   7.862   9.675
   99    HZ1  LYS  11           HZ1      LYS  11  38.553   5.978   9.616
  100    HZ2  LYS  11           HZ2      LYS  11  40.035   5.195   9.338
  101    HZ3  LYS  11           HZ3      LYS  11  39.025   5.596   8.032
  102    H    ALA  12           HN       ALA  12  40.851   9.232   2.621
  103    HA   ALA  12           HA       ALA  12  40.494  10.355   0.638
  104    HB1  ALA  12           HB1      ALA  12  38.340  10.974   0.031
  105    HB2  ALA  12           HB2      ALA  12  37.960  11.654   1.632
  106    HB3  ALA  12           HB3      ALA  12  37.990   9.892   1.396
  107    H    GLY  13           HN       GLY  13  40.675  11.804   3.704
  108    HA2  GLY  13           HA1      GLY  13  41.193  13.970   4.405
  109    HA3  GLY  13           HA2      GLY  13  42.393  13.845   3.104
  110    H    PHE  14           HN       PHE  14  38.834  14.259   3.245
  111    HA   PHE  14           HA       PHE  14  37.496  15.958   2.414
  112    HB2  PHE  14           HB2      PHE  14  39.891  17.582   1.508
  113    HB3  PHE  14           HB1      PHE  14  38.312  18.136   2.105
  114    HD1  PHE  14           HD1      PHE  14  41.638  18.080   3.022
  115    HD2  PHE  14           HD2      PHE  14  37.783  16.903   4.573
  116    HE1  PHE  14           HE1      PHE  14  42.525  18.229   5.343
  117    HE2  PHE  14           HE2      PHE  14  38.674  17.053   6.894
  118    HZ   PHE  14           HZ       PHE  14  41.058  17.669   7.277
  119    H    ILE  15           HN       ILE  15  38.047  13.723   0.929
  120    HA   ILE  15           HA       ILE  15  37.869  12.907  -1.206
  121    HB   ILE  15           HB       ILE  15  37.158  15.756  -2.015
  122   HG12  ILE  15          HG12      ILE  15  35.330  13.464  -1.150
  123   HG13  ILE  15          HG11      ILE  15  35.792  14.819  -0.098
  124   HG21  ILE  15          HG21      ILE  15  35.878  14.530  -3.812
  125   HG22  ILE  15          HG22      ILE  15  36.651  13.025  -3.265
  126   HG23  ILE  15          HG23      ILE  15  37.640  14.349  -3.929
  127   HD11  ILE  15           HD1      ILE  15  34.878  16.291  -2.152
  128   HD12  ILE  15           HD2      ILE  15  33.762  15.621  -0.941
  129   HD13  ILE  15           HD3      ILE  15  33.963  14.806  -2.507
  130    H    ILE  16           HN       ILE  16  40.107  12.507  -1.085
  131    HA   ILE  16           HA       ILE  16  41.581  14.013  -3.228
  132    HB   ILE  16           HB       ILE  16  42.839  13.040  -0.639
  133   HG12  ILE  16          HG12      ILE  16  41.233  15.036  -0.344
  134   HG13  ILE  16          HG11      ILE  16  42.893  15.255   0.224
  135   HG21  ILE  16          HG21      ILE  16  43.838  14.688  -3.005
  136   HG22  ILE  16          HG22      ILE  16  44.417  13.095  -2.478
  137   HG23  ILE  16          HG23      ILE  16  44.737  14.531  -1.478
  138   HD11  ILE  16           HD1      ILE  16  43.474  16.599  -1.679
  139   HD12  ILE  16           HD2      ILE  16  41.907  17.205  -1.100
  140   HD13  ILE  16           HD3      ILE  16  41.978  16.166  -2.537
  141    H    ILE  17           HN       ILE  17  41.959  11.220  -0.957
  142    HA   ILE  17           HA       ILE  17  43.258   9.622  -3.027
  143    HB   ILE  17           HB       ILE  17  42.089   8.892  -0.296
  144   HG12  ILE  17          HG12      ILE  17  44.472   8.564   0.294
  145   HG13  ILE  17          HG11      ILE  17  44.950   9.014  -1.359
  146   HG21  ILE  17          HG21      ILE  17  43.388   6.695  -0.692
  147   HG22  ILE  17          HG22      ILE  17  43.407   7.146  -2.414
  148   HG23  ILE  17          HG23      ILE  17  41.858   6.880  -1.580
  149   HD11  ILE  17           HD1      ILE  17  45.019  10.845   0.526
  150   HD12  ILE  17           HD2      ILE  17  43.254  10.905   0.305
  151   HD13  ILE  17           HD3      ILE  17  44.339  11.266  -1.056
  152    H    GLY  18           HN       GLY  18  40.047   9.659  -1.446
  153    HA2  GLY  18           HA1      GLY  18  38.913   7.557  -3.008
  154    HA3  GLY  18           HA2      GLY  18  38.012   8.826  -2.154
  155    H    GLY  19           HN       GLY  19  38.538  11.130  -3.320
  156    HA2  GLY  19           HA1      GLY  19  37.137  10.925  -5.825
  157    HA3  GLY  19           HA2      GLY  19  37.910  12.378  -5.168
  158    H    ALA  20           HN       ALA  20  40.559  11.699  -5.036
  159    HA   ALA  20           HA       ALA  20  42.419  11.776  -6.431
  160    HB1  ALA  20           HB1      ALA  20  42.682   9.856  -7.930
  161    HB2  ALA  20           HB2      ALA  20  40.940   9.506  -7.807
  162    HB3  ALA  20           HB3      ALA  20  41.986   9.345  -6.374
  163    H    LEU  21           HN       LEU  21  40.309  13.596  -7.101
  164    HA   LEU  21           HA       LEU  21  39.849  13.563  -9.964
  165    HB2  LEU  21           HB2      LEU  21  39.788  16.005  -8.157
  166    HB3  LEU  21           HB1      LEU  21  38.875  15.724  -9.657
  167    HG   LEU  21           HG       LEU  21  38.544  14.140  -7.067
  168   HD11  LEU  21          HD11      LEU  21  36.742  16.217  -8.391
  169   HD12  LEU  21          HD12      LEU  21  37.727  16.488  -6.933
  170   HD13  LEU  21          HD13      LEU  21  36.387  15.317  -6.897
  171   HD21  LEU  21          HD21      LEU  21  37.960  12.691  -8.880
  172   HD22  LEU  21          HD22      LEU  21  37.216  14.015  -9.808
  173   HD23  LEU  21          HD23      LEU  21  36.414  13.388  -8.347
  174    H    ASP  22           HN       ASP  22  41.459  13.672 -11.385
  175    HA   ASP  22           HA       ASP  22  43.388  14.409 -12.437
  176    HB2  ASP  22           HB2      ASP  22  41.997  16.532 -12.401
  177    HB3  ASP  22           HB1      ASP  22  42.917  17.022 -10.958
  178    H    HIS  23           HN       HIS  23  43.619  13.114  -9.815
  179    HA   HIS  23           HA       HIS  23  45.214  12.751  -8.164
  180    HB2  HIS  23           HB2      HIS  23  47.125  14.048 -10.143
  181    HB3  HIS  23           HB1      HIS  23  47.512  12.850  -8.885
  182    HD1  HIS  23           HD1      HIS  23  47.954  12.455 -12.046
  183    HD2  HIS  23           HD2      HIS  23  44.714  10.981  -9.809
  184    HE1  HIS  23           HE1      HIS  23  47.021  10.435 -13.300
  185    H    LEU  24           HN       LEU  24  43.750  14.972  -7.600
  186    HA   LEU  24           HA       LEU  24  45.626  16.476  -5.958
  187    HB2  LEU  24           HB2      LEU  24  45.687  17.485  -8.400
  188    HB3  LEU  24           HB1      LEU  24  44.120  18.195  -7.956
  189    HG   LEU  24           HG       LEU  24  46.754  18.547  -6.447
  190   HD11  LEU  24          HD11      LEU  24  45.062  20.510  -8.060
  191   HD12  LEU  24          HD12      LEU  24  46.589  19.777  -8.608
  192   HD13  LEU  24          HD13      LEU  24  46.583  20.883  -7.213
  193   HD21  LEU  24          HD21      LEU  24  45.059  18.651  -4.782
  194   HD22  LEU  24          HD22      LEU  24  43.897  19.436  -5.879
  195   HD23  LEU  24          HD23      LEU  24  45.288  20.350  -5.249
  Start of MODEL   89
    1    H1   GLY   1           HT1      GLY   1  59.561   4.815  -0.087
    2    H2   GLY   1           HT2      GLY   1  60.577   4.181  -1.293
    3    H3   GLY   1           HT3      GLY   1  61.220   5.159  -0.061
    4    HA2  GLY   1           HA1      GLY   1  61.001   2.423  -0.123
    5    HA3  GLY   1           HA2      GLY   1  61.571   3.453   1.206
    6    H    LYS   2           HN       LYS   2  60.677   2.656   2.999
    7    HA   LYS   2           HA       LYS   2  57.975   1.535   2.995
    8    HB2  LYS   2           HB2      LYS   2  59.905   2.213   5.250
    9    HB3  LYS   2           HB1      LYS   2  58.363   1.348   5.459
   10    HG2  LYS   2           HG2      LYS   2  59.149  -0.395   3.852
   11    HG3  LYS   2           HG1      LYS   2  60.712   0.449   3.731
   12    HD2  LYS   2           HD2      LYS   2  60.987   0.195   6.216
   13    HD3  LYS   2           HD1      LYS   2  59.493  -0.772   6.246
   14    HE2  LYS   2           HE2      LYS   2  60.509  -2.388   4.661
   15    HE3  LYS   2           HE1      LYS   2  62.006  -1.428   4.647
   16    HZ1  LYS   2           HZ1      LYS   2  61.586  -1.772   7.280
   17    HZ2  LYS   2           HZ2      LYS   2  62.580  -2.770   6.329
   18    HZ3  LYS   2           HZ3      LYS   2  60.981  -3.233   6.667
   19    H    GLY   3           HN       GLY   3  58.103   4.258   2.059
   20    HA2  GLY   3           HA1      GLY   3  57.484   6.329   3.831
   21    HA3  GLY   3           HA2      GLY   3  56.552   6.093   2.281
   22    H    ARG   4           HN       ARG   4  55.552   4.380   2.034
   23    HA   ARG   4           HA       ARG   4  53.757   5.890   2.650
   24    HB2  ARG   4           HB2      ARG   4  53.200   3.014   1.767
   25    HB3  ARG   4           HB1      ARG   4  52.007   4.334   1.685
   26    HG2  ARG   4           HG2      ARG   4  53.471   5.628   0.214
   27    HG3  ARG   4           HG1      ARG   4  54.761   4.411   0.372
   28    HD2  ARG   4           HD2      ARG   4  53.232   2.706  -0.636
   29    HD3  ARG   4           HD1      ARG   4  52.009   3.977  -0.871
   30    HE   ARG   4           HE       ARG   4  54.417   4.875  -2.085
   31   HH11  ARG   4          HH11      ARG   4  52.190   2.254  -2.319
   32   HH12  ARG   4          HH12      ARG   4  52.323   2.120  -4.041
   33   HH21  ARG   4          HH21      ARG   4  54.545   4.763  -4.343
   34   HH22  ARG   4          HH22      ARG   4  53.655   3.541  -5.187
   35    H    TRP   5           HN       TRP   5  54.998   3.707   4.602
   36    HA   TRP   5           HA       TRP   5  53.160   2.361   6.187
   37    HB2  TRP   5           HB2      TRP   5  55.611   2.465   6.628
   38    HB3  TRP   5           HB1      TRP   5  55.397   4.099   7.301
   39    HD1  TRP   5           HD1      TRP   5  53.735   0.626   7.840
   40    HE1  TRP   5           HE1      TRP   5  53.347   0.269  10.386
   41    HE3  TRP   5           HE3      TRP   5  55.576   5.078   9.569
   42    HZ2  TRP   5           HZ2      TRP   5  53.790   1.740  12.821
   43    HZ3  TRP   5           HZ3      TRP   5  55.584   5.580  12.007
   44    HH2  TRP   5           HH2      TRP   5  54.694   3.917  13.633
   45    H    LEU   6           HN       LEU   6  53.340   5.777   5.710
   46    HA   LEU   6           HA       LEU   6  51.322   6.244   7.905
   47    HB2  LEU   6           HB2      LEU   6  53.139   8.290   6.574
   48    HB3  LEU   6           HB1      LEU   6  52.097   8.530   7.995
   49    HG   LEU   6           HG       LEU   6  54.448   6.585   7.864
   50   HD11  LEU   6          HD11      LEU   6  55.101   9.003   7.760
   51   HD12  LEU   6          HD12      LEU   6  55.633   8.207   9.261
   52   HD13  LEU   6          HD13      LEU   6  54.211   9.278   9.276
   53   HD21  LEU   6          HD21      LEU   6  54.077   6.756  10.450
   54   HD22  LEU   6          HD22      LEU   6  52.948   5.754   9.514
   55   HD23  LEU   6          HD23      LEU   6  52.464   7.387  10.032
   56    H    GLU   7           HN       GLU   7  51.999   6.314   4.463
   57    HA   GLU   7           HA       GLU   7  49.649   8.071   3.924
   58    HB2  GLU   7           HB2      GLU   7  51.543   6.640   2.015
   59    HB3  GLU   7           HB1      GLU   7  50.337   7.874   1.584
   60    HG2  GLU   7           HG2      GLU   7  52.636   8.332   3.534
   61    HG3  GLU   7           HG1      GLU   7  52.676   8.790   1.815
   62    H    ARG   8           HN       ARG   8  49.704   5.194   5.107
   63    HA   ARG   8           HA       ARG   8  48.586   3.389   3.227
   64    HB2  ARG   8           HB2      ARG   8  49.363   2.818   5.537
   65    HB3  ARG   8           HB1      ARG   8  47.911   3.619   6.185
   66    HG2  ARG   8           HG2      ARG   8  46.457   2.061   4.995
   67    HG3  ARG   8           HG1      ARG   8  47.860   1.315   4.188
   68    HD2  ARG   8           HD2      ARG   8  47.333   1.343   7.193
   69    HD3  ARG   8           HD1      ARG   8  47.135  -0.057   6.112
   70    HE   ARG   8           HE       ARG   8  49.760   0.680   5.690
   71   HH11  ARG   8          HH11      ARG   8  49.348   1.773   8.569
   72   HH12  ARG   8          HH12      ARG   8  49.994   0.457   9.489
   73   HH21  ARG   8          HH21      ARG   8  49.948  -1.772   6.833
   74   HH22  ARG   8          HH22      ARG   8  50.335  -1.550   8.506
   75    H    ILE   9           HN       ILE   9  46.940   5.649   5.486
   76    HA   ILE   9           HA       ILE   9  44.286   5.003   4.812
   77    HB   ILE   9           HB       ILE   9  45.006   6.594   6.635
   78   HG12  ILE   9          HG12      ILE   9  42.938   7.662   4.656
   79   HG13  ILE   9          HG11      ILE   9  42.643   6.406   5.882
   80   HG21  ILE   9          HG21      ILE   9  46.561   7.886   5.024
   81   HG22  ILE   9          HG22      ILE   9  45.580   8.858   6.145
   82   HG23  ILE   9          HG23      ILE   9  45.090   8.701   4.441
   83   HD11  ILE   9           HD1      ILE   9  41.871   8.417   6.892
   84   HD12  ILE   9           HD2      ILE   9  43.270   9.348   6.307
   85   HD13  ILE   9           HD3      ILE   9  43.477   8.152   7.610
   86    H    GLY  10           HN       GLY  10  46.517   7.305   3.220
   87    HA2  GLY  10           HA1      GLY  10  46.520   7.986   0.991
   88    HA3  GLY  10           HA2      GLY  10  45.128   6.931   0.677
   89    H    LYS  11           HN       LYS  11  43.195   7.848   2.343
   90    HA   LYS  11           HA       LYS  11  42.320  10.227   0.979
   91    HB2  LYS  11           HB2      LYS  11  41.284   8.974   3.554
   92    HB3  LYS  11           HB1      LYS  11  40.422  10.158   2.539
   93    HG2  LYS  11           HG2      LYS  11  40.365   8.597   0.669
   94    HG3  LYS  11           HG1      LYS  11  41.386   7.437   1.556
   95    HD2  LYS  11           HD2      LYS  11  39.624   7.204   3.284
   96    HD3  LYS  11           HD1      LYS  11  38.602   8.360   2.397
   97    HE2  LYS  11           HE2      LYS  11  38.537   6.859   0.453
   98    HE3  LYS  11           HE1      LYS  11  39.633   5.721   1.270
   99    HZ1  LYS  11           HZ1      LYS  11  37.507   4.881   1.659
  100    HZ2  LYS  11           HZ2      LYS  11  36.835   6.412   1.962
  101    HZ3  LYS  11           HZ3      LYS  11  37.877   5.698   3.098
  102    H    ALA  12           HN       ALA  12  43.577  12.010   1.220
  103    HA   ALA  12           HA       ALA  12  44.717  12.760   3.787
  104    HB1  ALA  12           HB1      ALA  12  45.471  14.735   2.657
  105    HB2  ALA  12           HB2      ALA  12  44.259  14.535   1.368
  106    HB3  ALA  12           HB3      ALA  12  45.613  13.388   1.503
  107    H    GLY  13           HN       GLY  13  41.606  12.550   2.958
  108    HA2  GLY  13           HA1      GLY  13  39.661  13.697   3.525
  109    HA3  GLY  13           HA2      GLY  13  40.512  13.961   5.059
  110    H    PHE  14           HN       PHE  14  41.045  15.250   1.753
  111    HA   PHE  14           HA       PHE  14  40.115  17.915   2.533
  112    HB2  PHE  14           HB2      PHE  14  42.331  17.861   3.643
  113    HB3  PHE  14           HB1      PHE  14  43.093  17.479   2.080
  114    HD1  PHE  14           HD1      PHE  14  41.260  20.069   4.020
  115    HD2  PHE  14           HD2      PHE  14  43.335  19.166   0.346
  116    HE1  PHE  14           HE1      PHE  14  41.323  22.495   3.459
  117    HE2  PHE  14           HE2      PHE  14  43.398  21.593  -0.216
  118    HZ   PHE  14           HZ       PHE  14  42.467  23.263   1.383
  119    H    ILE  15           HN       ILE  15  41.761  15.735   0.284
  120    HA   ILE  15           HA       ILE  15  40.286  16.856  -1.937
  121    HB   ILE  15           HB       ILE  15  42.093  18.596  -1.633
  122   HG12  ILE  15          HG12      ILE  15  42.215  17.008  -4.240
  123   HG13  ILE  15          HG11      ILE  15  40.936  18.164  -3.803
  124   HG21  ILE  15          HG21      ILE  15  44.353  18.117  -1.725
  125   HG22  ILE  15          HG22      ILE  15  44.148  16.784  -2.880
  126   HG23  ILE  15          HG23      ILE  15  43.821  16.522  -1.152
  127   HD11  ILE  15           HD1      ILE  15  42.759  19.912  -3.498
  128   HD12  ILE  15           HD2      ILE  15  42.527  19.355  -5.172
  129   HD13  ILE  15           HD3      ILE  15  43.897  18.745  -4.212
  130    H    ILE  16           HN       ILE  16  40.005  14.450  -1.290
  131    HA   ILE  16           HA       ILE  16  41.488  12.887  -3.349
  132    HB   ILE  16           HB       ILE  16  41.334  12.219  -0.384
  133   HG12  ILE  16          HG12      ILE  16  43.306  13.511  -1.116
  134   HG13  ILE  16          HG11      ILE  16  43.765  11.880  -0.590
  135   HG21  ILE  16          HG21      ILE  16  40.764  10.097  -1.131
  136   HG22  ILE  16          HG22      ILE  16  42.521   9.976  -1.371
  137   HG23  ILE  16          HG23      ILE  16  41.458  10.351  -2.748
  138   HD11  ILE  16           HD1      ILE  16  45.003  12.032  -2.564
  139   HD12  ILE  16           HD2      ILE  16  43.818  13.082  -3.363
  140   HD13  ILE  16           HD3      ILE  16  43.508  11.342  -3.223
  141    H    ILE  17           HN       ILE  17  39.166  12.458  -0.634
  142    HA   ILE  17           HA       ILE  17  37.529  10.639  -2.178
  143    HB   ILE  17           HB       ILE  17  35.984  10.649  -0.358
  144   HG12  ILE  17          HG12      ILE  17  35.566  12.991   0.011
  145   HG13  ILE  17          HG11      ILE  17  36.188  12.349   1.539
  146   HG21  ILE  17          HG21      ILE  17  37.922   9.454   0.281
  147   HG22  ILE  17          HG22      ILE  17  37.585  10.501   1.676
  148   HG23  ILE  17          HG23      ILE  17  38.875  10.930   0.533
  149   HD11  ILE  17           HD1      ILE  17  38.491  13.192   0.848
  150   HD12  ILE  17           HD2      ILE  17  37.284  14.458   1.140
  151   HD13  ILE  17           HD3      ILE  17  37.701  14.004  -0.524
  152    H    GLY  18           HN       GLY  18  38.122  13.770  -2.718
  153    HA2  GLY  18           HA1      GLY  18  35.407  14.220  -3.924
  154    HA3  GLY  18           HA2      GLY  18  36.200  15.494  -2.972
  155    H    GLY  19           HN       GLY  19  38.739  15.566  -3.698
  156    HA2  GLY  19           HA1      GLY  19  38.594  16.630  -6.403
  157    HA3  GLY  19           HA2      GLY  19  40.031  16.551  -5.363
  158    H    ALA  20           HN       ALA  20  40.551  14.033  -4.887
  159    HA   ALA  20           HA       ALA  20  41.467  12.116  -5.792
  160    HB1  ALA  20           HB1      ALA  20  39.482  12.376  -8.066
  161    HB2  ALA  20           HB2      ALA  20  39.016  11.817  -6.441
  162    HB3  ALA  20           HB3      ALA  20  40.208  10.898  -7.391
  163    H    LEU  21           HN       LEU  21  41.639  15.086  -7.272
  164    HA   LEU  21           HA       LEU  21  42.990  15.960  -8.948
  165    HB2  LEU  21           HB2      LEU  21  44.594  13.566  -7.985
  166    HB3  LEU  21           HB1      LEU  21  45.223  14.670  -9.230
  167    HG   LEU  21           HG       LEU  21  44.980  16.580  -7.697
  168   HD11  LEU  21          HD11      LEU  21  43.753  14.466  -5.885
  169   HD12  LEU  21          HD12      LEU  21  43.103  16.063  -6.337
  170   HD13  LEU  21          HD13      LEU  21  44.477  15.948  -5.216
  171   HD21  LEU  21          HD21      LEU  21  46.387  14.215  -6.375
  172   HD22  LEU  21          HD22      LEU  21  46.731  15.937  -6.083
  173   HD23  LEU  21          HD23      LEU  21  47.071  15.218  -7.676
  174    H    ASP  22           HN       ASP  22  41.058  13.504  -9.474
  175    HA   ASP  22           HA       ASP  22  42.148  12.209 -11.815
  176    HB2  ASP  22           HB2      ASP  22  40.265  11.316 -10.423
  177    HB3  ASP  22           HB1      ASP  22  39.228  12.617 -11.057
  178    H    HIS  23           HN       HIS  23  39.642  14.764 -11.445
  179    HA   HIS  23           HA       HIS  23  40.657  16.226 -13.739
  180    HB2  HIS  23           HB2      HIS  23  39.542  14.314 -14.900
  181    HB3  HIS  23           HB1      HIS  23  38.013  14.765 -14.109
  182    HD1  HIS  23           HD1      HIS  23  40.516  17.326 -15.380
  183    HD2  HIS  23           HD2      HIS  23  36.756  15.758 -16.432
  184    HE1  HIS  23           HE1      HIS  23  39.590  18.773 -17.273
  185    H    LEU  24           HN       LEU  24  38.497  15.654 -11.120
  186    HA   LEU  24           HA       LEU  24  36.893  18.084 -11.524
  187    HB2  LEU  24           HB2      LEU  24  37.186  16.505  -8.946
  188    HB3  LEU  24           HB1      LEU  24  35.806  17.485  -9.495
  189    HG   LEU  24           HG       LEU  24  36.782  14.875 -10.735
  190   HD11  LEU  24          HD11      LEU  24  34.696  13.952  -9.907
  191   HD12  LEU  24          HD12      LEU  24  34.148  15.554  -9.358
  192   HD13  LEU  24          HD13      LEU  24  35.514  14.753  -8.545
  193   HD21  LEU  24          HD21      LEU  24  34.573  15.179 -12.066
  194   HD22  LEU  24          HD22      LEU  24  35.953  16.188 -12.551
  195   HD23  LEU  24          HD23      LEU  24  34.646  16.885 -11.563
  Start of MODEL   90
    1    H1   GLY   1           HT1      GLY   1  60.988   5.734  -1.510
    2    H2   GLY   1           HT2      GLY   1  60.401   4.201  -1.070
    3    H3   GLY   1           HT3      GLY   1  62.055   4.423  -1.392
    4    HA2  GLY   1           HA1      GLY   1  62.289   4.601   0.764
    5    HA3  GLY   1           HA2      GLY   1  61.650   6.235   0.504
    6    H    LYS   2           HN       LYS   2  61.009   3.002   1.667
    7    HA   LYS   2           HA       LYS   2  58.190   3.283   2.117
    8    HB2  LYS   2           HB2      LYS   2  60.164   1.669   3.777
    9    HB3  LYS   2           HB1      LYS   2  58.419   1.377   3.587
   10    HG2  LYS   2           HG2      LYS   2  58.804   1.056   1.116
   11    HG3  LYS   2           HG1      LYS   2  60.554   1.177   1.420
   12    HD2  LYS   2           HD2      LYS   2  60.386  -0.741   3.009
   13    HD3  LYS   2           HD1      LYS   2  58.656  -0.888   2.619
   14    HE2  LYS   2           HE2      LYS   2  60.042  -2.479   1.293
   15    HE3  LYS   2           HE1      LYS   2  59.202  -1.305   0.252
   16    HZ1  LYS   2           HZ1      LYS   2  61.137  -0.524  -0.467
   17    HZ2  LYS   2           HZ2      LYS   2  61.910  -1.809   0.332
   18    HZ3  LYS   2           HZ3      LYS   2  61.730  -0.307   1.108
   19    H    GLY   3           HN       GLY   3  58.460   2.483   5.046
   20    HA2  GLY   3           HA1      GLY   3  57.813   3.717   7.025
   21    HA3  GLY   3           HA2      GLY   3  59.448   4.511   6.718
   22    H    ARG   4           HN       ARG   4  56.507   3.774   5.934
   23    HA   ARG   4           HA       ARG   4  55.458   5.233   7.248
   24    HB2  ARG   4           HB2      ARG   4  56.000   7.066   4.951
   25    HB3  ARG   4           HB1      ARG   4  54.331   7.163   5.546
   26    HG2  ARG   4           HG2      ARG   4  56.117   7.276   7.865
   27    HG3  ARG   4           HG1      ARG   4  56.684   8.450   6.665
   28    HD2  ARG   4           HD2      ARG   4  53.769   8.286   7.527
   29    HD3  ARG   4           HD1      ARG   4  54.967   9.314   8.344
   30    HE   ARG   4           HE       ARG   4  55.014   9.778   5.493
   31   HH11  ARG   4          HH11      ARG   4  54.777  11.544   8.145
   32   HH12  ARG   4          HH12      ARG   4  53.396  12.491   7.701
   33   HH21  ARG   4          HH21      ARG   4  52.553  10.478   5.007
   34   HH22  ARG   4          HH22      ARG   4  52.137  11.887   5.924
   35    H    TRP   5           HN       TRP   5  55.610   3.562   4.540
   36    HA   TRP   5           HA       TRP   5  53.247   3.505   3.123
   37    HB2  TRP   5           HB2      TRP   5  55.107   1.918   2.764
   38    HB3  TRP   5           HB1      TRP   5  54.665   1.061   4.260
   39    HD1  TRP   5           HD1      TRP   5  53.075   2.028   0.862
   40    HE1  TRP   5           HE1      TRP   5  51.370   0.188   0.174
   41    HE3  TRP   5           HE3      TRP   5  53.365  -0.937   5.025
   42    HZ2  TRP   5           HZ2      TRP   5  50.300  -2.234   1.305
   43    HZ3  TRP   5           HZ3      TRP   5  51.994  -3.008   5.200
   44    HH2  TRP   5           HH2      TRP   5  50.462  -3.659   3.345
   45    H    LEU   6           HN       LEU   6  53.629   2.965   6.504
   46    HA   LEU   6           HA       LEU   6  50.805   1.953   6.729
   47    HB2  LEU   6           HB2      LEU   6  52.441   0.370   7.619
   48    HB3  LEU   6           HB1      LEU   6  53.199   1.649   8.591
   49    HG   LEU   6           HG       LEU   6  51.166   1.884   9.946
   50   HD11  LEU   6          HD11      LEU   6  50.031  -0.062   7.901
   51   HD12  LEU   6          HD12      LEU   6  49.339   1.470   8.488
   52   HD13  LEU   6          HD13      LEU   6  49.342   0.040   9.540
   53   HD21  LEU   6          HD21      LEU   6  52.826   0.151  10.567
   54   HD22  LEU   6          HD22      LEU   6  51.959  -1.036   9.562
   55   HD23  LEU   6          HD23      LEU   6  51.176  -0.352  11.006
   56    H    GLU   7           HN       GLU   7  53.009   4.615   7.361
   57    HA   GLU   7           HA       GLU   7  51.048   5.774   9.347
   58    HB2  GLU   7           HB2      GLU   7  53.984   6.300   8.765
   59    HB3  GLU   7           HB1      GLU   7  52.988   7.404   9.744
   60    HG2  GLU   7           HG2      GLU   7  52.537   5.679  11.372
   61    HG3  GLU   7           HG1      GLU   7  53.244   4.424  10.326
   62    H    ARG   8           HN       ARG   8  51.145   5.606   6.213
   63    HA   ARG   8           HA       ARG   8  51.546   8.183   5.140
   64    HB2  ARG   8           HB2      ARG   8  49.962   7.507   3.377
   65    HB3  ARG   8           HB1      ARG   8  51.062   6.169   3.786
   66    HG2  ARG   8           HG2      ARG   8  49.272   5.317   5.382
   67    HG3  ARG   8           HG1      ARG   8  48.175   6.535   4.685
   68    HD2  ARG   8           HD2      ARG   8  49.517   4.203   3.265
   69    HD3  ARG   8           HD1      ARG   8  47.774   4.504   3.467
   70    HE   ARG   8           HE       ARG   8  48.869   6.726   2.075
   71   HH11  ARG   8          HH11      ARG   8  49.990   6.165  -0.040
   72   HH12  ARG   8          HH12      ARG   8  49.143   4.992  -0.994
   73   HH21  ARG   8          HH21      ARG   8  47.070   3.988   1.596
   74   HH22  ARG   8          HH22      ARG   8  47.491   3.761  -0.069
   75    H    ILE   9           HN       ILE   9  49.897   9.753   4.402
   76    HA   ILE   9           HA       ILE   9  48.273  10.586   6.685
   77    HB   ILE   9           HB       ILE   9  47.624  12.493   5.228
   78   HG12  ILE   9          HG12      ILE   9  49.174  10.899   3.134
   79   HG13  ILE   9          HG11      ILE   9  47.461  11.372   3.073
   80   HG21  ILE   9          HG21      ILE   9  49.863  12.341   6.487
   81   HG22  ILE   9          HG22      ILE   9  49.800  13.502   5.140
   82   HG23  ILE   9          HG23      ILE   9  50.602  11.929   4.920
   83   HD11  ILE   9           HD1      ILE   9  48.327  13.819   3.220
   84   HD12  ILE   9           HD2      ILE   9  48.550  12.956   1.679
   85   HD13  ILE   9           HD3      ILE   9  49.917  13.136   2.804
   86    H    GLY  10           HN       GLY  10  47.705   9.134   3.493
   87    HA2  GLY  10           HA1      GLY  10  45.828   8.078   2.652
   88    HA3  GLY  10           HA2      GLY  10  45.209   7.992   4.312
   89    H    LYS  11           HN       LYS  11  45.799  11.169   3.953
   90    HA   LYS  11           HA       LYS  11  42.950  11.733   3.349
   91    HB2  LYS  11           HB2      LYS  11  45.264  13.509   4.223
   92    HB3  LYS  11           HB1      LYS  11  43.592  14.067   4.001
   93    HG2  LYS  11           HG2      LYS  11  44.171  11.695   5.818
   94    HG3  LYS  11           HG1      LYS  11  44.421  13.349   6.415
   95    HD2  LYS  11           HD2      LYS  11  42.045  13.891   5.759
   96    HD3  LYS  11           HD1      LYS  11  41.816  12.176   5.341
   97    HE2  LYS  11           HE2      LYS  11  42.329  11.502   7.632
   98    HE3  LYS  11           HE1      LYS  11  42.707  13.184   8.074
   99    HZ1  LYS  11           HZ1      LYS  11  40.272  13.493   7.074
  100    HZ2  LYS  11           HZ2      LYS  11  40.555  13.147   8.712
  101    HZ3  LYS  11           HZ3      LYS  11  40.121  11.902   7.641
  102    H    ALA  12           HN       ALA  12  42.462  11.720   1.235
  103    HA   ALA  12           HA       ALA  12  44.369  12.685  -0.777
  104    HB1  ALA  12           HB1      ALA  12  42.681  10.833  -1.125
  105    HB2  ALA  12           HB2      ALA  12  42.674  12.105  -2.371
  106    HB3  ALA  12           HB3      ALA  12  41.415  12.083  -1.114
  107    H    GLY  13           HN       GLY  13  44.032  14.690   1.068
  108    HA2  GLY  13           HA1      GLY  13  43.663  16.977   1.085
  109    HA3  GLY  13           HA2      GLY  13  43.177  16.865  -0.619
  110    H    PHE  14           HN       PHE  14  41.986  15.995   2.658
  111    HA   PHE  14           HA       PHE  14  39.841  16.102   3.538
  112    HB2  PHE  14           HB2      PHE  14  40.290  18.550   3.033
  113    HB3  PHE  14           HB1      PHE  14  39.391  18.329   1.513
  114    HD1  PHE  14           HD1      PHE  14  39.113  17.942   5.239
  115    HD2  PHE  14           HD2      PHE  14  37.005  18.406   1.501
  116    HE1  PHE  14           HE1      PHE  14  36.973  18.236   6.482
  117    HE2  PHE  14           HE2      PHE  14  34.865  18.699   2.744
  118    HZ   PHE  14           HZ       PHE  14  34.856  18.651   5.235
  119    H    ILE  15           HN       ILE  15  40.429  14.434   1.124
  120    HA   ILE  15           HA       ILE  15  39.258  13.060  -0.294
  121    HB   ILE  15           HB       ILE  15  36.683  13.994   1.046
  122   HG12  ILE  15          HG12      ILE  15  38.737  11.944   2.002
  123   HG13  ILE  15          HG11      ILE  15  38.281  13.452   2.827
  124   HG21  ILE  15          HG21      ILE  15  37.471  11.240   0.008
  125   HG22  ILE  15          HG22      ILE  15  36.697  12.466  -1.023
  126   HG23  ILE  15          HG23      ILE  15  35.844  11.841   0.405
  127   HD11  ILE  15           HD1      ILE  15  37.024  11.782   3.954
  128   HD12  ILE  15           HD2      ILE  15  36.630  10.933   2.440
  129   HD13  ILE  15           HD3      ILE  15  35.857  12.493   2.813
  130    H    ILE  16           HN       ILE  16  40.064  14.979  -1.588
  131    HA   ILE  16           HA       ILE  16  37.755  16.043  -3.200
  132    HB   ILE  16           HB       ILE  16  40.377  17.415  -2.487
  133   HG12  ILE  16          HG12      ILE  16  38.458  17.293  -0.713
  134   HG13  ILE  16          HG11      ILE  16  39.184  18.872  -1.061
  135   HG21  ILE  16          HG21      ILE  16  39.780  18.038  -4.735
  136   HG22  ILE  16          HG22      ILE  16  39.281  19.388  -3.692
  137   HG23  ILE  16          HG23      ILE  16  38.068  18.235  -4.298
  138   HD11  ILE  16           HD1      ILE  16  37.307  19.543  -2.414
  139   HD12  ILE  16           HD2      ILE  16  36.635  18.839  -0.928
  140   HD13  ILE  16           HD3      ILE  16  36.638  17.897  -2.433
  141    H    ILE  17           HN       ILE  17  41.258  15.298  -3.047
  142    HA   ILE  17           HA       ILE  17  41.534  15.193  -5.944
  143    HB   ILE  17           HB       ILE  17  43.278  14.212  -3.636
  144   HG12  ILE  17          HG12      ILE  17  44.760  16.023  -4.372
  145   HG13  ILE  17          HG11      ILE  17  43.703  16.366  -5.759
  146   HG21  ILE  17          HG21      ILE  17  43.673  13.914  -6.642
  147   HG22  ILE  17          HG22      ILE  17  43.767  12.649  -5.393
  148   HG23  ILE  17          HG23      ILE  17  45.037  13.891  -5.498
  149   HD11  ILE  17           HD1      ILE  17  41.983  17.249  -4.388
  150   HD12  ILE  17           HD2      ILE  17  43.471  17.866  -3.635
  151   HD13  ILE  17           HD3      ILE  17  42.626  16.474  -2.919
  152    H    GLY  18           HN       GLY  18  41.195  12.815  -3.301
  153    HA2  GLY  18           HA1      GLY  18  41.029  10.559  -5.163
  154    HA3  GLY  18           HA2      GLY  18  40.768  10.523  -3.405
  155    H    GLY  19           HN       GLY  19  38.823  12.580  -3.236
  156    HA2  GLY  19           HA1      GLY  19  36.450  11.073  -3.697
  157    HA3  GLY  19           HA2      GLY  19  36.523  12.810  -3.344
  158    H    ALA  20           HN       ALA  20  37.729  13.943  -5.443
  159    HA   ALA  20           HA       ALA  20  35.661  13.948  -7.428
  160    HB1  ALA  20           HB1      ALA  20  38.526  14.952  -7.574
  161    HB2  ALA  20           HB2      ALA  20  37.110  15.878  -7.022
  162    HB3  ALA  20           HB3      ALA  20  37.230  15.363  -8.721
  163    H    LEU  21           HN       LEU  21  39.070  12.818  -7.662
  164    HA   LEU  21           HA       LEU  21  40.031  11.288  -9.108
  165    HB2  LEU  21           HB2      LEU  21  38.301   9.907  -7.682
  166    HB3  LEU  21           HB1      LEU  21  37.373   9.827  -9.193
  167    HG   LEU  21           HG       LEU  21  39.706   9.044 -10.240
  168   HD11  LEU  21          HD11      LEU  21  41.001   7.664  -8.598
  169   HD12  LEU  21          HD12      LEU  21  40.014   8.339  -7.283
  170   HD13  LEU  21          HD13      LEU  21  41.081   9.400  -8.231
  171   HD21  LEU  21          HD21      LEU  21  39.120   6.668  -9.653
  172   HD22  LEU  21          HD22      LEU  21  37.720   7.624 -10.196
  173   HD23  LEU  21          HD23      LEU  21  37.952   7.289  -8.462
  174    H    ASP  22           HN       ASP  22  38.013  13.500 -10.103
  175    HA   ASP  22           HA       ASP  22  37.004  12.525 -12.619
  176    HB2  ASP  22           HB2      ASP  22  37.705  15.350 -11.719
  177    HB3  ASP  22           HB1      ASP  22  36.763  14.939 -13.172
  178    H    HIS  23           HN       HIS  23  38.877  15.347 -13.122
  179    HA   HIS  23           HA       HIS  23  40.391  14.080 -15.235
  180    HB2  HIS  23           HB2      HIS  23  40.909  16.765 -13.898
  181    HB3  HIS  23           HB1      HIS  23  41.433  16.252 -15.519
  182    HD1  HIS  23           HD1      HIS  23  38.818  18.116 -13.874
  183    HD2  HIS  23           HD2      HIS  23  39.009  15.576 -17.219
  184    HE1  HIS  23           HE1      HIS  23  36.713  18.524 -15.261
  185    H    LEU  24           HN       LEU  24  40.982  14.796 -11.839
  186    HA   LEU  24           HA       LEU  24  42.839  14.426 -10.496
  187    HB2  LEU  24           HB2      LEU  24  42.028  12.075 -11.393
  188    HB3  LEU  24           HB1      LEU  24  43.561  12.090 -12.291
  189    HG   LEU  24           HG       LEU  24  43.247  12.413  -9.268
  190   HD11  LEU  24          HD11      LEU  24  42.830  10.112 -10.170
  191   HD12  LEU  24          HD12      LEU  24  44.288  10.198  -9.152
  192   HD13  LEU  24          HD13      LEU  24  44.441  10.146 -10.926
  193   HD21  LEU  24          HD21      LEU  24  45.644  12.534 -11.144
  194   HD22  LEU  24          HD22      LEU  24  45.833  12.057  -9.438
  195   HD23  LEU  24          HD23      LEU  24  45.186  13.662  -9.846
  Start of MODEL   91
    1    H1   GLY   1           HT1      GLY   1  59.841  11.378  -0.221
    2    H2   GLY   1           HT2      GLY   1  59.819  10.594  -1.728
    3    H3   GLY   1           HT3      GLY   1  59.932   9.688  -0.294
    4    HA2  GLY   1           HA1      GLY   1  57.718  11.041   0.174
    5    HA3  GLY   1           HA2      GLY   1  57.654  10.868  -1.590
    6    H    LYS   2           HN       LYS   2  55.802   9.522  -1.353
    7    HA   LYS   2           HA       LYS   2  54.722   7.483  -1.085
    8    HB2  LYS   2           HB2      LYS   2  57.518   6.388  -1.578
    9    HB3  LYS   2           HB1      LYS   2  55.984   5.516  -1.814
   10    HG2  LYS   2           HG2      LYS   2  55.330   7.414  -3.434
   11    HG3  LYS   2           HG1      LYS   2  57.034   7.918  -3.362
   12    HD2  LYS   2           HD2      LYS   2  55.980   5.195  -4.250
   13    HD3  LYS   2           HD1      LYS   2  56.699   6.445  -5.293
   14    HE2  LYS   2           HE2      LYS   2  58.052   4.733  -3.183
   15    HE3  LYS   2           HE1      LYS   2  58.484   4.932  -4.897
   16    HZ1  LYS   2           HZ1      LYS   2  60.003   6.299  -3.913
   17    HZ2  LYS   2           HZ2      LYS   2  58.985   6.725  -2.623
   18    HZ3  LYS   2           HZ3      LYS   2  58.751   7.417  -4.157
   19    H    GLY   3           HN       GLY   3  55.099   5.123  -0.009
   20    HA2  GLY   3           HA1      GLY   3  56.064   4.023   2.029
   21    HA3  GLY   3           HA2      GLY   3  56.109   5.650   2.850
   22    H    ARG   4           HN       ARG   4  54.631   6.928   2.533
   23    HA   ARG   4           HA       ARG   4  53.996   6.026   4.693
   24    HB2  ARG   4           HB2      ARG   4  52.426   8.342   3.460
   25    HB3  ARG   4           HB1      ARG   4  52.562   8.002   5.204
   26    HG2  ARG   4           HG2      ARG   4  55.045   8.174   5.024
   27    HG3  ARG   4           HG1      ARG   4  54.877   8.582   3.299
   28    HD2  ARG   4           HD2      ARG   4  53.811  10.175   5.670
   29    HD3  ARG   4           HD1      ARG   4  55.116  10.653   4.558
   30    HE   ARG   4           HE       ARG   4  52.674  10.128   3.099
   31   HH11  ARG   4          HH11      ARG   4  54.202  12.381   2.229
   32   HH12  ARG   4          HH12      ARG   4  53.388  13.754   2.905
   33   HH21  ARG   4          HH21      ARG   4  51.637  11.895   5.251
   34   HH22  ARG   4          HH22      ARG   4  51.936  13.478   4.615
   35    H    TRP   5           HN       TRP   5  52.581   5.248   1.965
   36    HA   TRP   5           HA       TRP   5  49.813   5.016   2.078
   37    HB2  TRP   5           HB2      TRP   5  51.877   2.932   1.311
   38    HB3  TRP   5           HB1      TRP   5  50.138   2.705   1.019
   39    HD1  TRP   5           HD1      TRP   5  51.196   6.284   0.634
   40    HE1  TRP   5           HE1      TRP   5  51.321   6.941  -1.872
   41    HE3  TRP   5           HE3      TRP   5  50.840   1.616  -1.450
   42    HZ2  TRP   5           HZ2      TRP   5  51.271   5.605  -4.419
   43    HZ3  TRP   5           HZ3      TRP   5  50.881   1.335  -3.924
   44    HH2  TRP   5           HH2      TRP   5  51.097   3.324  -5.408
   45    H    LEU   6           HN       LEU   6  52.155   3.527   4.182
   46    HA   LEU   6           HA       LEU   6  50.114   1.731   5.426
   47    HB2  LEU   6           HB2      LEU   6  53.035   2.019   6.204
   48    HB3  LEU   6           HB1      LEU   6  51.939   0.647   6.491
   49    HG   LEU   6           HG       LEU   6  52.977   1.594   3.782
   50   HD11  LEU   6          HD11      LEU   6  54.130  -0.599   3.779
   51   HD12  LEU   6          HD12      LEU   6  53.482  -0.944   5.401
   52   HD13  LEU   6          HD13      LEU   6  54.640   0.389   5.170
   53   HD21  LEU   6          HD21      LEU   6  50.772   0.750   3.394
   54   HD22  LEU   6          HD22      LEU   6  50.966  -0.545   4.600
   55   HD23  LEU   6          HD23      LEU   6  51.847  -0.624   3.055
   56    H    GLU   7           HN       GLU   7  51.921   4.740   5.973
   57    HA   GLU   7           HA       GLU   7  51.747   4.929   8.779
   58    HB2  GLU   7           HB2      GLU   7  52.776   6.592   7.119
   59    HB3  GLU   7           HB1      GLU   7  51.133   7.241   6.903
   60    HG2  GLU   7           HG2      GLU   7  50.983   7.649   9.353
   61    HG3  GLU   7           HG1      GLU   7  52.644   7.036   9.546
   62    H    ARG   8           HN       ARG   8  49.214   4.936   6.404
   63    HA   ARG   8           HA       ARG   8  46.916   5.085   6.606
   64    HB2  ARG   8           HB2      ARG   8  47.421   3.373   8.429
   65    HB3  ARG   8           HB1      ARG   8  47.313   4.711   9.597
   66    HG2  ARG   8           HG2      ARG   8  45.015   5.226   8.729
   67    HG3  ARG   8           HG1      ARG   8  45.127   3.796   7.675
   68    HD2  ARG   8           HD2      ARG   8  45.566   2.409   9.754
   69    HD3  ARG   8           HD1      ARG   8  45.188   3.856  10.720
   70    HE   ARG   8           HE       ARG   8  43.250   2.145   9.426
   71   HH11  ARG   8          HH11      ARG   8  42.183   3.430  11.668
   72   HH12  ARG   8          HH12      ARG   8  41.347   4.824  11.070
   73   HH21  ARG   8          HH21      ARG   8  42.961   4.805   8.001
   74   HH22  ARG   8          HH22      ARG   8  41.787   5.601   8.995
   75    H    ILE   9           HN       ILE   9  47.646   7.443   6.121
   76    HA   ILE   9           HA       ILE   9  47.204   9.341   8.323
   77    HB   ILE   9           HB       ILE   9  47.377  11.070   6.520
   78   HG12  ILE   9          HG12      ILE   9  47.673   8.614   4.727
   79   HG13  ILE   9          HG11      ILE   9  46.340   9.789   4.686
   80   HG21  ILE   9          HG21      ILE   9  49.578   8.988   6.213
   81   HG22  ILE   9          HG22      ILE   9  49.389   9.969   7.686
   82   HG23  ILE   9          HG23      ILE   9  49.722  10.760   6.129
   83   HD11  ILE   9           HD1      ILE   9  47.774  10.495   2.935
   84   HD12  ILE   9           HD2      ILE   9  49.242  10.189   3.891
   85   HD13  ILE   9           HD3      ILE   9  48.195  11.576   4.284
   86    H    GLY  10           HN       GLY  10  45.372   7.918   5.661
   87    HA2  GLY  10           HA1      GLY  10  43.159   8.181   5.027
   88    HA3  GLY  10           HA2      GLY  10  42.851   8.317   6.769
   89    H    LYS  11           HN       LYS  11  44.956  10.704   5.489
   90    HA   LYS  11           HA       LYS  11  42.994  12.795   6.068
   91    HB2  LYS  11           HB2      LYS  11  45.497  12.950   6.478
   92    HB3  LYS  11           HB1      LYS  11  45.701  13.093   4.716
   93    HG2  LYS  11           HG2      LYS  11  44.174  15.068   4.721
   94    HG3  LYS  11           HG1      LYS  11  44.053  14.946   6.493
   95    HD2  LYS  11           HD2      LYS  11  46.536  15.211   6.651
   96    HD3  LYS  11           HD1      LYS  11  46.598  15.433   4.885
   97    HE2  LYS  11           HE2      LYS  11  46.571  17.630   5.951
   98    HE3  LYS  11           HE1      LYS  11  45.013  17.373   5.127
   99    HZ1  LYS  11           HZ1      LYS  11  45.590  17.644   7.944
  100    HZ2  LYS  11           HZ2      LYS  11  44.573  16.332   7.582
  101    HZ3  LYS  11           HZ3      LYS  11  44.142  17.903   7.102
  102    H    ALA  12           HN       ALA  12  44.628  11.543   3.123
  103    HA   ALA  12           HA       ALA  12  44.106  11.809   0.900
  104    HB1  ALA  12           HB1      ALA  12  41.832  11.569   0.304
  105    HB2  ALA  12           HB2      ALA  12  41.265  12.402   1.772
  106    HB3  ALA  12           HB3      ALA  12  41.964  10.769   1.886
  107    H    GLY  13           HN       GLY  13  44.373  14.242   2.942
  108    HA2  GLY  13           HA1      GLY  13  44.220  16.568   2.810
  109    HA3  GLY  13           HA2      GLY  13  44.831  16.287   1.167
  110    H    PHE  14           HN       PHE  14  41.707  15.733   2.824
  111    HA   PHE  14           HA       PHE  14  39.592  16.537   2.347
  112    HB2  PHE  14           HB2      PHE  14  40.931  18.748   1.863
  113    HB3  PHE  14           HB1      PHE  14  40.663  18.347   0.152
  114    HD1  PHE  14           HD1      PHE  14  38.544  18.746  -0.879
  115    HD2  PHE  14           HD2      PHE  14  38.901  18.894   3.420
  116    HE1  PHE  14           HE1      PHE  14  36.226  19.648  -0.717
  117    HE2  PHE  14           HE2      PHE  14  36.584  19.795   3.581
  118    HZ   PHE  14           HZ       PHE  14  35.272  20.233   1.509
  119    H    ILE  15           HN       ILE  15  40.375  14.178   1.335
  120    HA   ILE  15           HA       ILE  15  39.793  12.610  -0.244
  121    HB   ILE  15           HB       ILE  15  37.980  14.711  -1.490
  122   HG12  ILE  15          HG12      ILE  15  37.348  12.739   0.759
  123   HG13  ILE  15          HG11      ILE  15  37.646  14.473   1.010
  124   HG21  ILE  15          HG21      ILE  15  36.678  12.719  -2.177
  125   HG22  ILE  15          HG22      ILE  15  37.878  11.666  -1.392
  126   HG23  ILE  15          HG23      ILE  15  38.338  12.648  -2.802
  127   HD11  ILE  15           HD1      ILE  15  35.731  14.779  -0.808
  128   HD12  ILE  15           HD2      ILE  15  35.301  14.413   0.878
  129   HD13  ILE  15           HD3      ILE  15  35.294  13.117  -0.337
  130    H    ILE  16           HN       ILE  16  42.027  12.882  -0.935
  131    HA   ILE  16           HA       ILE  16  42.101  13.810  -3.804
  132    HB   ILE  16           HB       ILE  16  44.322  14.114  -1.746
  133   HG12  ILE  16          HG12      ILE  16  42.283  15.722  -1.565
  134   HG13  ILE  16          HG11      ILE  16  43.898  16.444  -1.656
  135   HG21  ILE  16          HG21      ILE  16  45.264  13.730  -3.918
  136   HG22  ILE  16          HG22      ILE  16  45.362  15.482  -3.636
  137   HG23  ILE  16          HG23      ILE  16  44.096  14.818  -4.698
  138   HD11  ILE  16           HD1      ILE  16  42.129  17.541  -3.126
  139   HD12  ILE  16           HD2      ILE  16  42.118  16.062  -4.106
  140   HD13  ILE  16           HD3      ILE  16  43.602  17.032  -3.978
  141    H    ILE  17           HN       ILE  17  44.268  12.189  -1.429
  142    HA   ILE  17           HA       ILE  17  45.037  10.210  -3.475
  143    HB   ILE  17           HB       ILE  17  45.636  10.303  -0.483
  144   HG12  ILE  17          HG12      ILE  17  46.539  12.285  -1.579
  145   HG13  ILE  17          HG11      ILE  17  47.876  11.177  -1.212
  146   HG21  ILE  17          HG21      ILE  17  47.672   8.844  -1.465
  147   HG22  ILE  17          HG22      ILE  17  46.480   8.459  -2.730
  148   HG23  ILE  17          HG23      ILE  17  46.122   8.090  -1.031
  149   HD11  ILE  17           HD1      ILE  17  47.507  10.306  -3.668
  150   HD12  ILE  17           HD2      ILE  17  48.336  11.855  -3.428
  151   HD13  ILE  17           HD3      ILE  17  46.626  11.829  -3.901
  152    H    GLY  18           HN       GLY  18  42.863  10.496  -0.734
  153    HA2  GLY  18           HA1      GLY  18  42.281   7.671  -0.524
  154    HA3  GLY  18           HA2      GLY  18  41.306   9.007   0.129
  155    H    GLY  19           HN       GLY  19  40.565  10.460  -2.002
  156    HA2  GLY  19           HA1      GLY  19  38.620   8.673  -3.285
  157    HA3  GLY  19           HA2      GLY  19  38.746  10.431  -3.470
  158    H    ALA  20           HN       ALA  20  41.328  10.791  -4.379
  159    HA   ALA  20           HA       ALA  20  42.386  10.873  -6.451
  160    HB1  ALA  20           HB1      ALA  20  41.943   7.871  -6.350
  161    HB2  ALA  20           HB2      ALA  20  43.231   8.738  -5.478
  162    HB3  ALA  20           HB3      ALA  20  43.204   8.738  -7.259
  163    H    LEU  21           HN       LEU  21  39.672  11.476  -6.657
  164    HA   LEU  21           HA       LEU  21  38.441   9.906  -8.790
  165    HB2  LEU  21           HB2      LEU  21  37.739  12.746  -7.966
  166    HB3  LEU  21           HB1      LEU  21  36.686  11.530  -8.725
  167    HG   LEU  21           HG       LEU  21  37.918  11.297  -5.940
  168   HD11  LEU  21          HD11      LEU  21  35.038  11.836  -6.787
  169   HD12  LEU  21          HD12      LEU  21  36.160  13.071  -6.168
  170   HD13  LEU  21          HD13      LEU  21  35.651  11.724  -5.121
  171   HD21  LEU  21          HD21      LEU  21  36.116   9.428  -5.818
  172   HD22  LEU  21          HD22      LEU  21  37.574   9.081  -6.771
  173   HD23  LEU  21          HD23      LEU  21  36.062   9.533  -7.594
  174    H    ASP  22           HN       ASP  22  39.090   9.894 -10.824
  175    HA   ASP  22           HA       ASP  22  40.112  10.597 -12.793
  176    HB2  ASP  22           HB2      ASP  22  38.724  13.209 -12.076
  177    HB3  ASP  22           HB1      ASP  22  39.247  12.697 -13.700
  178    H    HIS  23           HN       HIS  23  41.758  10.835 -10.435
  179    HA   HIS  23           HA       HIS  23  43.735  11.840  -9.750
  180    HB2  HIS  23           HB2      HIS  23  43.781  12.563 -12.705
  181    HB3  HIS  23           HB1      HIS  23  45.162  12.770 -11.603
  182    HD1  HIS  23           HD1      HIS  23  44.059  10.486 -14.045
  183    HD2  HIS  23           HD2      HIS  23  45.346   9.979 -10.074
  184    HE1  HIS  23           HE1      HIS  23  44.841   8.067 -13.802
  185    H    LEU  24           HN       LEU  24  41.933  13.305  -8.701
  186    HA   LEU  24           HA       LEU  24  42.988  16.003  -8.832
  187    HB2  LEU  24           HB2      LEU  24  41.625  16.238 -10.805
  188    HB3  LEU  24           HB1      LEU  24  40.244  15.440 -10.025
  189    HG   LEU  24           HG       LEU  24  39.906  17.314  -8.526
  190   HD11  LEU  24          HD11      LEU  24  42.587  18.258  -9.616
  191   HD12  LEU  24          HD12      LEU  24  42.113  17.991  -7.921
  192   HD13  LEU  24          HD13      LEU  24  41.452  19.375  -8.820
  193   HD21  LEU  24          HD21      LEU  24  39.120  17.492 -10.935
  194   HD22  LEU  24          HD22      LEU  24  40.568  18.473 -11.266
  195   HD23  LEU  24          HD23      LEU  24  39.344  19.054 -10.111
  Start of MODEL   92
    1    H1   GLY   1           HT1      GLY   1  60.532   2.414  -0.820
    2    H2   GLY   1           HT2      GLY   1  61.191   0.999  -0.149
    3    H3   GLY   1           HT3      GLY   1  62.159   2.382  -0.347
    4    HA2  GLY   1           HA1      GLY   1  61.379   1.914   1.946
    5    HA3  GLY   1           HA2      GLY   1  61.092   3.545   1.309
    6    H    LYS   2           HN       LYS   2  58.976   4.088   0.504
    7    HA   LYS   2           HA       LYS   2  56.669   4.157   0.769
    8    HB2  LYS   2           HB2      LYS   2  56.776   1.128   1.006
    9    HB3  LYS   2           HB1      LYS   2  55.443   2.137   0.396
   10    HG2  LYS   2           HG2      LYS   2  56.973   2.908  -1.463
   11    HG3  LYS   2           HG1      LYS   2  58.166   1.710  -0.903
   12    HD2  LYS   2           HD2      LYS   2  56.403  -0.074  -1.170
   13    HD3  LYS   2           HD1      LYS   2  55.339   1.153  -1.899
   14    HE2  LYS   2           HE2      LYS   2  56.986   1.560  -3.679
   15    HE3  LYS   2           HE1      LYS   2  58.110   0.399  -2.932
   16    HZ1  LYS   2           HZ1      LYS   2  55.556  -0.102  -4.322
   17    HZ2  LYS   2           HZ2      LYS   2  56.091  -1.196  -3.136
   18    HZ3  LYS   2           HZ3      LYS   2  57.052  -0.883  -4.503
   19    H    GLY   3           HN       GLY   3  55.369   1.745   2.311
   20    HA2  GLY   3           HA1      GLY   3  54.306   1.840   4.489
   21    HA3  GLY   3           HA2      GLY   3  56.072   1.675   5.020
   22    H    ARG   4           HN       ARG   4  53.693   3.096   3.630
   23    HA   ARG   4           HA       ARG   4  52.609   3.924   5.301
   24    HB2  ARG   4           HB2      ARG   4  54.711   6.028   5.240
   25    HB3  ARG   4           HB1      ARG   4  53.065   6.683   5.401
   26    HG2  ARG   4           HG2      ARG   4  52.737   5.815   7.538
   27    HG3  ARG   4           HG1      ARG   4  53.752   4.394   7.262
   28    HD2  ARG   4           HD2      ARG   4  55.783   5.765   7.471
   29    HD3  ARG   4           HD1      ARG   4  54.798   7.239   7.614
   30    HE   ARG   4           HE       ARG   4  53.980   5.400   9.644
   31   HH11  ARG   4          HH11      ARG   4  57.037   5.182   9.648
   32   HH12  ARG   4          HH12      ARG   4  57.448   6.383  10.827
   33   HH21  ARG   4          HH21      ARG   4  54.329   7.897  10.760
   34   HH22  ARG   4          HH22      ARG   4  55.914   7.919  11.457
   35    H    TRP   5           HN       TRP   5  53.662   4.284   2.326
   36    HA   TRP   5           HA       TRP   5  52.422   6.350   0.961
   37    HB2  TRP   5           HB2      TRP   5  53.712   4.511  -0.119
   38    HB3  TRP   5           HB1      TRP   5  52.326   3.425   0.154
   39    HD1  TRP   5           HD1      TRP   5  52.542   7.043  -1.272
   40    HE1  TRP   5           HE1      TRP   5  51.221   7.142  -3.506
   41    HE3  TRP   5           HE3      TRP   5  51.118   2.134  -1.593
   42    HZ2  TRP   5           HZ2      TRP   5  49.757   5.321  -5.184
   43    HZ3  TRP   5           HZ3      TRP   5  49.759   1.339  -3.521
   44    HH2  TRP   5           HH2      TRP   5  49.079   2.926  -5.316
   45    H    LEU   6           HN       LEU   6  50.952   3.772   2.739
   46    HA   LEU   6           HA       LEU   6  48.242   4.243   1.605
   47    HB2  LEU   6           HB2      LEU   6  49.427   2.298   3.620
   48    HB3  LEU   6           HB1      LEU   6  47.667   2.478   3.425
   49    HG   LEU   6           HG       LEU   6  47.831   1.893   1.050
   50   HD11  LEU   6          HD11      LEU   6  50.817   1.932   1.632
   51   HD12  LEU   6          HD12      LEU   6  49.922   2.783   0.349
   52   HD13  LEU   6          HD13      LEU   6  50.147   1.022   0.258
   53   HD21  LEU   6          HD21      LEU   6  47.705   0.095   2.825
   54   HD22  LEU   6          HD22      LEU   6  49.474  -0.067   2.712
   55   HD23  LEU   6          HD23      LEU   6  48.454  -0.446   1.304
   56    H    GLU   7           HN       GLU   7  50.269   5.044   4.415
   57    HA   GLU   7           HA       GLU   7  47.969   5.957   6.020
   58    HB2  GLU   7           HB2      GLU   7  50.206   5.129   6.926
   59    HB3  GLU   7           HB1      GLU   7  50.901   6.670   6.370
   60    HG2  GLU   7           HG2      GLU   7  49.335   7.929   7.777
   61    HG3  GLU   7           HG1      GLU   7  48.531   6.421   8.276
   62    H    ARG   8           HN       ARG   8  49.995   7.233   3.507
   63    HA   ARG   8           HA       ARG   8  49.750  10.024   4.183
   64    HB2  ARG   8           HB2      ARG   8  51.394   8.874   2.547
   65    HB3  ARG   8           HB1      ARG   8  50.064   8.919   1.374
   66    HG2  ARG   8           HG2      ARG   8  51.027  10.974   0.859
   67    HG3  ARG   8           HG1      ARG   8  49.958  11.518   2.168
   68    HD2  ARG   8           HD2      ARG   8  52.879  10.691   2.539
   69    HD3  ARG   8           HD1      ARG   8  52.311  12.369   2.384
   70    HE   ARG   8           HE       ARG   8  50.790  11.500   4.470
   71   HH11  ARG   8          HH11      ARG   8  52.293  13.082   5.898
   72   HH12  ARG   8          HH12      ARG   8  53.602  12.191   6.602
   73   HH21  ARG   8          HH21      ARG   8  53.277   9.498   4.441
   74   HH22  ARG   8          HH22      ARG   8  54.160  10.162   5.776
   75    H    ILE   9           HN       ILE   9  48.091   8.087   1.633
   76    HA   ILE   9           HA       ILE   9  46.294  10.055   0.802
   77    HB   ILE   9           HB       ILE   9  46.374   7.984  -0.413
   78   HG12  ILE   9          HG12      ILE   9  44.034   7.414  -0.671
   79   HG13  ILE   9          HG11      ILE   9  43.648   7.988   0.963
   80   HG21  ILE   9          HG21      ILE   9  46.931   6.592   1.671
   81   HG22  ILE   9          HG22      ILE   9  45.882   5.826   0.460
   82   HG23  ILE   9          HG23      ILE   9  45.178   6.489   1.950
   83   HD11  ILE   9           HD1      ILE   9  43.104   9.569  -1.018
   84   HD12  ILE   9           HD2      ILE   9  44.859   9.838  -1.124
   85   HD13  ILE   9           HD3      ILE   9  43.978  10.267   0.363
   86    H    GLY  10           HN       GLY  10  45.567  11.391   2.402
   87    HA2  GLY  10           HA1      GLY  10  43.104  11.093   3.526
   88    HA3  GLY  10           HA2      GLY  10  44.134  10.287   4.728
   89    H    LYS  11           HN       LYS  11  44.980  13.078   2.695
   90    HA   LYS  11           HA       LYS  11  46.220  14.586   4.675
   91    HB2  LYS  11           HB2      LYS  11  46.030  15.070   2.163
   92    HB3  LYS  11           HB1      LYS  11  44.454  15.811   2.524
   93    HG2  LYS  11           HG2      LYS  11  45.854  17.687   2.663
   94    HG3  LYS  11           HG1      LYS  11  45.838  17.167   4.362
   95    HD2  LYS  11           HD2      LYS  11  47.981  15.987   4.046
   96    HD3  LYS  11           HD1      LYS  11  47.976  16.402   2.315
   97    HE2  LYS  11           HE2      LYS  11  47.905  18.845   2.994
   98    HE3  LYS  11           HE1      LYS  11  48.164  18.318   4.674
   99    HZ1  LYS  11           HZ1      LYS  11  50.317  18.443   4.137
  100    HZ2  LYS  11           HZ2      LYS  11  50.023  18.432   2.464
  101    HZ3  LYS  11           HZ3      LYS  11  50.078  16.971   3.329
  102    H    ALA  12           HN       ALA  12  42.783  14.120   4.110
  103    HA   ALA  12           HA       ALA  12  42.162  15.217   6.741
  104    HB1  ALA  12           HB1      ALA  12  40.603  16.976   5.840
  105    HB2  ALA  12           HB2      ALA  12  41.364  16.746   4.247
  106    HB3  ALA  12           HB3      ALA  12  42.331  17.337   5.619
  107    H    GLY  13           HN       GLY  13  41.626  13.287   4.080
  108    HA2  GLY  13           HA1      GLY  13  39.914  11.852   3.479
  109    HA3  GLY  13           HA2      GLY  13  39.496  11.849   5.204
  110    H    PHE  14           HN       PHE  14  39.452  14.800   3.307
  111    HA   PHE  14           HA       PHE  14  36.489  14.622   2.946
  112    HB2  PHE  14           HB2      PHE  14  37.005  15.657   5.224
  113    HB3  PHE  14           HB1      PHE  14  37.786  16.994   4.347
  114    HD1  PHE  14           HD1      PHE  14  34.582  14.995   4.312
  115    HD2  PHE  14           HD2      PHE  14  36.443  18.852   3.752
  116    HE1  PHE  14           HE1      PHE  14  32.345  16.022   3.931
  117    HE2  PHE  14           HE2      PHE  14  34.205  19.875   3.371
  118    HZ   PHE  14           HZ       PHE  14  32.156  18.460   3.450
  119    H    ILE  15           HN       ILE  15  39.610  15.573   2.009
  120    HA   ILE  15           HA       ILE  15  38.553  16.724  -0.487
  121    HB   ILE  15           HB       ILE  15  40.007  18.777  -0.319
  122   HG12  ILE  15          HG12      ILE  15  40.117  17.991   2.633
  123   HG13  ILE  15          HG11      ILE  15  41.486  17.912   1.501
  124   HG21  ILE  15          HG21      ILE  15  37.488  18.704   0.204
  125   HG22  ILE  15          HG22      ILE  15  38.391  20.073   0.889
  126   HG23  ILE  15          HG23      ILE  15  37.947  18.696   1.923
  127   HD11  ILE  15           HD1      ILE  15  40.040  20.365   2.551
  128   HD12  ILE  15           HD2      ILE  15  41.010  20.436   1.059
  129   HD13  ILE  15           HD3      ILE  15  41.778  19.992   2.602
  130    H    ILE  16           HN       ILE  16  39.861  14.341   0.058
  131    HA   ILE  16           HA       ILE  16  42.272  14.718  -1.615
  132    HB   ILE  16           HB       ILE  16  43.059  14.958   0.773
  133   HG12  ILE  16          HG12      ILE  16  44.838  13.167   0.611
  134   HG13  ILE  16          HG11      ILE  16  43.950  12.461  -0.756
  135   HG21  ILE  16          HG21      ILE  16  42.300  12.025   1.047
  136   HG22  ILE  16          HG22      ILE  16  41.276  13.349   1.651
  137   HG23  ILE  16          HG23      ILE  16  42.915  13.121   2.305
  138   HD11  ILE  16           HD1      ILE  16  44.480  14.241  -2.195
  139   HD12  ILE  16           HD2      ILE  16  45.940  14.188  -1.184
  140   HD13  ILE  16           HD3      ILE  16  44.684  15.403  -0.862
  141    H    ILE  17           HN       ILE  17  39.835  12.765  -0.028
  142    HA   ILE  17           HA       ILE  17  40.650  10.284  -1.402
  143    HB   ILE  17           HB       ILE  17  38.261   9.559  -0.487
  144   HG12  ILE  17          HG12      ILE  17  37.479  10.874   1.416
  145   HG13  ILE  17          HG11      ILE  17  38.822  12.021   1.234
  146   HG21  ILE  17          HG21      ILE  17  40.425   8.799   0.442
  147   HG22  ILE  17          HG22      ILE  17  39.252   9.126   1.740
  148   HG23  ILE  17          HG23      ILE  17  40.548  10.296   1.395
  149   HD11  ILE  17           HD1      ILE  17  37.941  12.886  -0.814
  150   HD12  ILE  17           HD2      ILE  17  36.541  12.740   0.271
  151   HD13  ILE  17           HD3      ILE  17  36.813  11.522  -0.995
  152    H    GLY  18           HN       GLY  18  39.597  13.023  -2.622
  153    HA2  GLY  18           HA1      GLY  18  38.559  11.861  -5.009
  154    HA3  GLY  18           HA2      GLY  18  37.199  12.439  -4.026
  155    H    GLY  19           HN       GLY  19  38.877  14.608  -2.838
  156    HA2  GLY  19           HA1      GLY  19  38.131  16.715  -4.538
  157    HA3  GLY  19           HA2      GLY  19  39.399  16.813  -3.300
  158    H    ALA  20           HN       ALA  20  41.262  15.004  -4.317
  159    HA   ALA  20           HA       ALA  20  42.543  16.681  -6.301
  160    HB1  ALA  20           HB1      ALA  20  43.177  13.911  -5.231
  161    HB2  ALA  20           HB2      ALA  20  43.894  15.458  -4.722
  162    HB3  ALA  20           HB3      ALA  20  44.229  14.813  -6.347
  163    H    LEU  21           HN       LEU  21  40.819  13.569  -6.366
  164    HA   LEU  21           HA       LEU  21  39.905  12.400  -8.131
  165    HB2  LEU  21           HB2      LEU  21  39.217  14.883  -8.716
  166    HB3  LEU  21           HB1      LEU  21  40.413  14.724 -10.017
  167    HG   LEU  21           HG       LEU  21  38.035  12.868  -9.537
  168   HD11  LEU  21          HD11      LEU  21  37.399  15.097 -10.397
  169   HD12  LEU  21          HD12      LEU  21  37.189  13.852 -11.652
  170   HD13  LEU  21          HD13      LEU  21  38.596  14.941 -11.705
  171   HD21  LEU  21          HD21      LEU  21  38.766  12.090 -11.922
  172   HD22  LEU  21          HD22      LEU  21  39.717  11.517 -10.536
  173   HD23  LEU  21          HD23      LEU  21  40.328  12.854 -11.540
  174    H    ASP  22           HN       ASP  22  42.210  14.429 -10.002
  175    HA   ASP  22           HA       ASP  22  43.845  13.728 -11.515
  176    HB2  ASP  22           HB2      ASP  22  44.527  12.132  -9.018
  177    HB3  ASP  22           HB1      ASP  22  45.614  12.300 -10.417
  178    H    HIS  23           HN       HIS  23  43.974  10.615  -9.888
  179    HA   HIS  23           HA       HIS  23  42.811   9.301 -12.348
  180    HB2  HIS  23           HB2      HIS  23  45.296   9.061 -12.181
  181    HB3  HIS  23           HB1      HIS  23  45.083   8.284 -10.593
  182    HD1  HIS  23           HD1      HIS  23  44.061   5.898 -10.516
  183    HD2  HIS  23           HD2      HIS  23  44.465   7.463 -14.400
  184    HE1  HIS  23           HE1      HIS  23  43.689   3.974 -12.154
  185    H    LEU  24           HN       LEU  24  42.752   9.749  -8.947
  186    HA   LEU  24           HA       LEU  24  41.642   7.153  -8.241
  187    HB2  LEU  24           HB2      LEU  24  41.278   9.758  -6.720
  188    HB3  LEU  24           HB1      LEU  24  41.269   8.100  -6.078
  189    HG   LEU  24           HG       LEU  24  43.679   9.488  -7.339
  190   HD11  LEU  24          HD11      LEU  24  43.009   8.826  -4.437
  191   HD12  LEU  24          HD12      LEU  24  43.066  10.454  -5.154
  192   HD13  LEU  24          HD13      LEU  24  44.557   9.490  -5.012
  193   HD21  LEU  24          HD21      LEU  24  44.847   7.460  -6.213
  194   HD22  LEU  24          HD22      LEU  24  43.927   7.136  -7.700
  195   HD23  LEU  24          HD23      LEU  24  43.225   6.734  -6.114
  Start of MODEL   93
    1    H1   GLY   1           HT1      GLY   1  58.017   0.844   8.917
    2    H2   GLY   1           HT2      GLY   1  58.333   2.089   7.804
    3    H3   GLY   1           HT3      GLY   1  59.618   1.267   8.555
    4    HA2  GLY   1           HA1      GLY   1  59.694   0.071   6.737
    5    HA3  GLY   1           HA2      GLY   1  58.298  -0.753   7.459
    6    H    LYS   2           HN       LYS   2  58.827  -0.599   4.675
    7    HA   LYS   2           HA       LYS   2  57.520   1.466   3.286
    8    HB2  LYS   2           HB2      LYS   2  58.804  -0.460   2.284
    9    HB3  LYS   2           HB1      LYS   2  57.391  -1.495   2.592
   10    HG2  LYS   2           HG2      LYS   2  55.999  -0.170   1.125
   11    HG3  LYS   2           HG1      LYS   2  57.255   1.083   0.973
   12    HD2  LYS   2           HD2      LYS   2  58.740  -0.485  -0.179
   13    HD3  LYS   2           HD1      LYS   2  57.574  -1.808   0.059
   14    HE2  LYS   2           HE2      LYS   2  55.950  -0.746  -1.377
   15    HE3  LYS   2           HE1      LYS   2  56.905   0.756  -1.443
   16    HZ1  LYS   2           HZ1      LYS   2  57.556  -0.234  -3.374
   17    HZ2  LYS   2           HZ2      LYS   2  57.365  -1.816  -2.785
   18    HZ3  LYS   2           HZ3      LYS   2  58.720  -0.897  -2.335
   19    H    GLY   3           HN       GLY   3  55.407   1.569   2.294
   20    HA2  GLY   3           HA1      GLY   3  53.082   0.237   2.528
   21    HA3  GLY   3           HA2      GLY   3  53.264   0.761   4.269
   22    H    ARG   4           HN       ARG   4  54.285   2.451   4.610
   23    HA   ARG   4           HA       ARG   4  51.996   3.209   4.891
   24    HB2  ARG   4           HB2      ARG   4  54.430   4.945   5.515
   25    HB3  ARG   4           HB1      ARG   4  52.801   5.297   6.146
   26    HG2  ARG   4           HG2      ARG   4  52.699   3.177   7.298
   27    HG3  ARG   4           HG1      ARG   4  54.175   2.599   6.487
   28    HD2  ARG   4           HD2      ARG   4  55.483   4.394   7.608
   29    HD3  ARG   4           HD1      ARG   4  54.007   4.933   8.444
   30    HE   ARG   4           HE       ARG   4  54.235   2.216   9.066
   31   HH11  ARG   4          HH11      ARG   4  56.211   5.033   9.277
   32   HH12  ARG   4          HH12      ARG   4  57.020   4.521  10.720
   33   HH21  ARG   4          HH21      ARG   4  55.262   1.542  10.964
   34   HH22  ARG   4          HH22      ARG   4  56.483   2.544  11.675
   35    H    TRP   5           HN       TRP   5  53.785   3.841   2.336
   36    HA   TRP   5           HA       TRP   5  53.549   6.426   1.346
   37    HB2  TRP   5           HB2      TRP   5  52.949   3.839  -0.146
   38    HB3  TRP   5           HB1      TRP   5  53.228   5.413  -0.929
   39    HD1  TRP   5           HD1      TRP   5  55.016   2.457   0.430
   40    HE1  TRP   5           HE1      TRP   5  57.588   2.840   0.451
   41    HE3  TRP   5           HE3      TRP   5  55.090   7.492  -0.491
   42    HZ2  TRP   5           HZ2      TRP   5  59.402   5.051   0.110
   43    HZ3  TRP   5           HZ3      TRP   5  57.252   8.718  -0.638
   44    HH2  TRP   5           HH2      TRP   5  59.407   7.503  -0.339
   45    H    LEU   6           HN       LEU   6  50.956   4.315   2.206
   46    HA   LEU   6           HA       LEU   6  48.946   6.170   0.935
   47    HB2  LEU   6           HB2      LEU   6  48.440   3.330   1.891
   48    HB3  LEU   6           HB1      LEU   6  47.419   4.340   0.842
   49    HG   LEU   6           HG       LEU   6  50.189   3.266   0.138
   50   HD11  LEU   6          HD11      LEU   6  48.438   1.523   0.173
   51   HD12  LEU   6          HD12      LEU   6  48.929   1.885  -1.500
   52   HD13  LEU   6          HD13      LEU   6  47.399   2.534  -0.861
   53   HD21  LEU   6          HD21      LEU   6  49.938   5.337  -1.027
   54   HD22  LEU   6          HD22      LEU   6  48.204   5.063  -1.317
   55   HD23  LEU   6          HD23      LEU   6  49.418   4.106  -2.200
   56    H    GLU   7           HN       GLU   7  50.260   4.867   3.921
   57    HA   GLU   7           HA       GLU   7  47.848   5.660   5.474
   58    HB2  GLU   7           HB2      GLU   7  50.542   4.654   6.464
   59    HB3  GLU   7           HB1      GLU   7  49.011   4.721   7.370
   60    HG2  GLU   7           HG2      GLU   7  48.007   3.166   5.651
   61    HG3  GLU   7           HG1      GLU   7  49.624   3.005   4.923
   62    H    ARG   8           HN       ARG   8  50.598   7.154   4.196
   63    HA   ARG   8           HA       ARG   8  51.248   8.915   6.403
   64    HB2  ARG   8           HB2      ARG   8  51.745   8.991   3.411
   65    HB3  ARG   8           HB1      ARG   8  52.266  10.317   4.470
   66    HG2  ARG   8           HG2      ARG   8  53.000   7.407   5.010
   67    HG3  ARG   8           HG1      ARG   8  53.995   8.459   3.981
   68    HD2  ARG   8           HD2      ARG   8  55.049   8.822   6.030
   69    HD3  ARG   8           HD1      ARG   8  53.815  10.094   6.142
   70    HE   ARG   8           HE       ARG   8  52.731   7.669   7.206
   71   HH11  ARG   8          HH11      ARG   8  52.066   9.355   9.106
   72   HH12  ARG   8          HH12      ARG   8  53.358   9.487  10.251
   73   HH21  ARG   8          HH21      ARG   8  55.738   8.137   8.121
   74   HH22  ARG   8          HH22      ARG   8  55.438   8.798   9.695
   75    H    ILE   9           HN       ILE   9  50.299  10.316   3.318
   76    HA   ILE   9           HA       ILE   9  48.867  12.436   4.565
   77    HB   ILE   9           HB       ILE   9  49.738  12.762   2.337
   78   HG12  ILE   9          HG12      ILE   9  47.806  13.667   1.161
   79   HG13  ILE   9          HG11      ILE   9  46.694  12.629   2.076
   80   HG21  ILE   9          HG21      ILE   9  49.232  11.457   0.434
   81   HG22  ILE   9          HG22      ILE   9  47.786  10.741   1.177
   82   HG23  ILE   9          HG23      ILE   9  49.403  10.248   1.724
   83   HD11  ILE   9           HD1      ILE   9  48.541  14.577   3.504
   84   HD12  ILE   9           HD2      ILE   9  47.029  13.838   4.089
   85   HD13  ILE   9           HD3      ILE   9  46.975  15.108   2.843
   86    H    GLY  10           HN       GLY  10  47.382  11.673   6.041
   87    HA2  GLY  10           HA1      GLY  10  45.128  10.004   4.977
   88    HA3  GLY  10           HA2      GLY  10  45.550  10.240   6.683
   89    H    LYS  11           HN       LYS  11  45.479  12.906   4.390
   90    HA   LYS  11           HA       LYS  11  42.761  13.732   5.275
   91    HB2  LYS  11           HB2      LYS  11  45.272  15.359   5.847
   92    HB3  LYS  11           HB1      LYS  11  43.609  15.980   5.978
   93    HG2  LYS  11           HG2      LYS  11  43.143  14.046   7.589
   94    HG3  LYS  11           HG1      LYS  11  44.898  13.746   7.597
   95    HD2  LYS  11           HD2      LYS  11  45.266  16.115   8.318
   96    HD3  LYS  11           HD1      LYS  11  43.501  16.334   8.404
   97    HE2  LYS  11           HE2      LYS  11  44.319  15.809  10.639
   98    HE3  LYS  11           HE1      LYS  11  43.405  14.408  10.031
   99    HZ1  LYS  11           HZ1      LYS  11  46.313  14.565   9.567
  100    HZ2  LYS  11           HZ2      LYS  11  45.313  13.197   9.700
  101    HZ3  LYS  11           HZ3      LYS  11  45.740  14.079  11.088
  102    H    ALA  12           HN       ALA  12  42.984  12.990   2.836
  103    HA   ALA  12           HA       ALA  12  44.068  15.073   1.063
  104    HB1  ALA  12           HB1      ALA  12  42.274  12.697   0.452
  105    HB2  ALA  12           HB2      ALA  12  44.054  12.666   0.454
  106    HB3  ALA  12           HB3      ALA  12  43.180  13.673  -0.727
  107    H    GLY  13           HN       GLY  13  42.440  16.408   2.726
  108    HA2  GLY  13           HA1      GLY  13  40.659  17.883   2.710
  109    HA3  GLY  13           HA2      GLY  13  40.575  17.638   0.954
  110    H    PHE  14           HN       PHE  14  39.904  15.737   3.930
  111    HA   PHE  14           HA       PHE  14  38.086  14.409   4.474
  112    HB2  PHE  14           HB2      PHE  14  36.948  16.654   4.263
  113    HB3  PHE  14           HB1      PHE  14  36.516  16.214   2.594
  114    HD1  PHE  14           HD1      PHE  14  34.557  14.932   2.183
  115    HD2  PHE  14           HD2      PHE  14  36.278  14.976   6.143
  116    HE1  PHE  14           HE1      PHE  14  32.606  13.644   3.047
  117    HE2  PHE  14           HE2      PHE  14  34.327  13.689   7.004
  118    HZ   PHE  14           HZ       PHE  14  32.463  13.078   5.469
  119    H    ILE  15           HN       ILE  15  39.763  13.664   2.193
  120    HA   ILE  15           HA       ILE  15  39.782  12.077   0.537
  121    HB   ILE  15           HB       ILE  15  36.979  11.251   1.395
  122   HG12  ILE  15          HG12      ILE  15  39.659  10.569   2.691
  123   HG13  ILE  15          HG11      ILE  15  38.333  11.489   3.437
  124   HG21  ILE  15          HG21      ILE  15  37.616   9.089   0.585
  125   HG22  ILE  15          HG22      ILE  15  39.334   9.549   0.487
  126   HG23  ILE  15          HG23      ILE  15  38.158  10.244  -0.649
  127   HD11  ILE  15           HD1      ILE  15  38.429   8.538   2.731
  128   HD12  ILE  15           HD2      ILE  15  36.874   9.378   2.960
  129   HD13  ILE  15           HD3      ILE  15  38.049   9.297   4.294
  130    H    ILE  16           HN       ILE  16  39.513  14.272  -0.527
  131    HA   ILE  16           HA       ILE  16  37.270  14.046  -2.523
  132    HB   ILE  16           HB       ILE  16  38.462  16.551  -1.273
  133   HG12  ILE  16          HG12      ILE  16  36.733  15.132   0.077
  134   HG13  ILE  16          HG11      ILE  16  36.444  16.873  -0.086
  135   HG21  ILE  16          HG21      ILE  16  36.620  17.700  -2.628
  136   HG22  ILE  16          HG22      ILE  16  36.407  16.156  -3.489
  137   HG23  ILE  16          HG23      ILE  16  37.955  17.022  -3.584
  138   HD11  ILE  16           HD1      ILE  16  35.187  14.816  -1.956
  139   HD12  ILE  16           HD2      ILE  16  34.757  16.529  -1.772
  140   HD13  ILE  16           HD3      ILE  16  34.409  15.379  -0.464
  141    H    ILE  17           HN       ILE  17  40.438  15.554  -1.742
  142    HA   ILE  17           HA       ILE  17  41.154  15.907  -4.535
  143    HB   ILE  17           HB       ILE  17  43.048  15.657  -2.153
  144   HG12  ILE  17          HG12      ILE  17  41.478  17.332  -1.484
  145   HG13  ILE  17          HG11      ILE  17  42.875  18.223  -2.111
  146   HG21  ILE  17          HG21      ILE  17  43.275  16.812  -4.957
  147   HG22  ILE  17          HG22      ILE  17  44.322  15.633  -4.143
  148   HG23  ILE  17          HG23      ILE  17  44.360  17.338  -3.650
  149   HD11  ILE  17           HD1      ILE  17  40.187  17.751  -3.448
  150   HD12  ILE  17           HD2      ILE  17  41.607  18.295  -4.366
  151   HD13  ILE  17           HD3      ILE  17  40.963  19.298  -3.050
  152    H    GLY  18           HN       GLY  18  41.773  13.485  -2.014
  153    HA2  GLY  18           HA1      GLY  18  43.393  11.814  -3.811
  154    HA3  GLY  18           HA2      GLY  18  42.895  11.438  -2.147
  155    H    GLY  19           HN       GLY  19  40.087  11.886  -2.471
  156    HA2  GLY  19           HA1      GLY  19  39.367   9.283  -3.507
  157    HA3  GLY  19           HA2      GLY  19  38.253  10.551  -2.966
  158    H    ALA  20           HN       ALA  20  39.134  12.600  -4.782
  159    HA   ALA  20           HA       ALA  20  37.536  11.772  -7.087
  160    HB1  ALA  20           HB1      ALA  20  37.481  14.058  -6.087
  161    HB2  ALA  20           HB2      ALA  20  37.815  14.054  -7.835
  162    HB3  ALA  20           HB3      ALA  20  39.140  14.315  -6.676
  163    H    LEU  21           HN       LEU  21  40.836  13.208  -6.897
  164    HA   LEU  21           HA       LEU  21  42.636  12.964  -8.340
  165    HB2  LEU  21           HB2      LEU  21  41.493  10.148  -8.377
  166    HB3  LEU  21           HB1      LEU  21  43.013  10.572  -9.193
  167    HG   LEU  21           HG       LEU  21  42.601  11.293  -6.263
  168   HD11  LEU  21          HD11      LEU  21  43.619   9.144  -5.616
  169   HD12  LEU  21          HD12      LEU  21  43.655   8.630  -7.319
  170   HD13  LEU  21          HD13      LEU  21  42.097   8.861  -6.492
  171   HD21  LEU  21          HD21      LEU  21  45.028  10.694  -8.025
  172   HD22  LEU  21          HD22      LEU  21  45.115  10.922  -6.264
  173   HD23  LEU  21          HD23      LEU  21  44.581  12.258  -7.304
  174    H    ASP  22           HN       ASP  22  41.140  10.463 -10.232
  175    HA   ASP  22           HA       ASP  22  40.599  10.441 -12.492
  176    HB2  ASP  22           HB2      ASP  22  39.201  12.985 -11.587
  177    HB3  ASP  22           HB1      ASP  22  38.956  12.236 -13.183
  178    H    HIS  23           HN       HIS  23  40.549  13.976 -12.406
  179    HA   HIS  23           HA       HIS  23  43.221  14.175 -13.668
  180    HB2  HIS  23           HB2      HIS  23  40.661  14.850 -15.174
  181    HB3  HIS  23           HB1      HIS  23  42.297  15.336 -15.684
  182    HD1  HIS  23           HD1      HIS  23  43.800  13.586 -16.774
  183    HD2  HIS  23           HD2      HIS  23  40.196  11.996 -15.300
  184    HE1  HIS  23           HE1      HIS  23  43.631  11.178 -17.614
  185    H    LEU  24           HN       LEU  24  41.248  15.181 -11.412
  186    HA   LEU  24           HA       LEU  24  40.935  17.995 -11.821
  187    HB2  LEU  24           HB2      LEU  24  39.846  16.534 -10.028
  188    HB3  LEU  24           HB1      LEU  24  41.395  16.597  -9.162
  189    HG   LEU  24           HG       LEU  24  41.158  19.225  -9.452
  190   HD11  LEU  24          HD11      LEU  24  39.216  19.277 -10.926
  191   HD12  LEU  24          HD12      LEU  24  38.729  19.916  -9.342
  192   HD13  LEU  24          HD13      LEU  24  38.282  18.260  -9.807
  193   HD21  LEU  24          HD21      LEU  24  39.887  19.340  -7.326
  194   HD22  LEU  24          HD22      LEU  24  41.090  18.029  -7.286
  195   HD23  LEU  24          HD23      LEU  24  39.370  17.651  -7.544
  Start of MODEL   94
    1    H1   GLY   1           HT1      GLY   1  61.927  -1.646   1.998
    2    H2   GLY   1           HT2      GLY   1  63.225  -0.582   2.267
    3    H3   GLY   1           HT3      GLY   1  61.634   0.013   2.182
    4    HA2  GLY   1           HA1      GLY   1  62.280  -2.012   4.168
    5    HA3  GLY   1           HA2      GLY   1  62.813  -0.340   4.437
    6    H    LYS   2           HN       LYS   2  61.498   0.515   5.905
    7    HA   LYS   2           HA       LYS   2  58.584   0.628   5.261
    8    HB2  LYS   2           HB2      LYS   2  59.576  -0.207   8.016
    9    HB3  LYS   2           HB1      LYS   2  57.892  -0.118   7.445
   10    HG2  LYS   2           HG2      LYS   2  58.486  -1.869   5.706
   11    HG3  LYS   2           HG1      LYS   2  60.057  -2.052   6.521
   12    HD2  LYS   2           HD2      LYS   2  58.784  -2.504   8.672
   13    HD3  LYS   2           HD1      LYS   2  57.294  -2.557   7.698
   14    HE2  LYS   2           HE2      LYS   2  58.224  -4.832   8.048
   15    HE3  LYS   2           HE1      LYS   2  58.242  -4.382   6.327
   16    HZ1  LYS   2           HZ1      LYS   2  60.573  -3.983   8.126
   17    HZ2  LYS   2           HZ2      LYS   2  60.537  -3.908   6.429
   18    HZ3  LYS   2           HZ3      LYS   2  60.344  -5.399   7.220
   19    H    GLY   3           HN       GLY   3  58.276   1.548   8.179
   20    HA2  GLY   3           HA1      GLY   3  57.915   3.805   8.987
   21    HA3  GLY   3           HA2      GLY   3  59.755   3.855   8.796
   22    H    ARG   4           HN       ARG   4  56.842   3.571   7.764
   23    HA   ARG   4           HA       ARG   4  56.180   5.632   7.749
   24    HB2  ARG   4           HB2      ARG   4  57.699   5.778   5.193
   25    HB3  ARG   4           HB1      ARG   4  56.078   6.505   5.084
   26    HG2  ARG   4           HG2      ARG   4  56.588   8.279   6.496
   27    HG3  ARG   4           HG1      ARG   4  57.715   7.343   7.486
   28    HD2  ARG   4           HD2      ARG   4  59.444   7.513   5.767
   29    HD3  ARG   4           HD1      ARG   4  58.294   8.258   4.633
   30    HE   ARG   4           HE       ARG   4  58.331   9.889   6.944
   31   HH11  ARG   4          HH11      ARG   4  60.494   8.729   4.519
   32   HH12  ARG   4          HH12      ARG   4  61.480  10.153   4.531
   33   HH21  ARG   4          HH21      ARG   4  59.591  11.765   6.951
   34   HH22  ARG   4          HH22      ARG   4  60.969  11.871   5.907
   35    H    TRP   5           HN       TRP   5  56.189   2.773   6.341
   36    HA   TRP   5           HA       TRP   5  54.178   2.459   4.462
   37    HB2  TRP   5           HB2      TRP   5  55.427   0.571   5.414
   38    HB3  TRP   5           HB1      TRP   5  54.609   0.807   6.977
   39    HD1  TRP   5           HD1      TRP   5  53.233   0.592   3.345
   40    HE1  TRP   5           HE1      TRP   5  51.288  -1.135   3.289
   41    HE3  TRP   5           HE3      TRP   5  53.354  -0.921   8.234
   42    HZ2  TRP   5           HZ2      TRP   5  49.987  -2.918   5.139
   43    HZ3  TRP   5           HZ3      TRP   5  51.754  -2.635   9.067
   44    HH2  TRP   5           HH2      TRP   5  50.071  -3.635   7.526
   45    H    LEU   6           HN       LEU   6  53.913   3.655   7.684
   46    HA   LEU   6           HA       LEU   6  50.922   3.429   7.683
   47    HB2  LEU   6           HB2      LEU   6  52.736   4.373   9.931
   48    HB3  LEU   6           HB1      LEU   6  51.042   3.829  10.036
   49    HG   LEU   6           HG       LEU   6  53.476   2.127   9.332
   50   HD11  LEU   6          HD11      LEU   6  53.139   2.694  11.746
   51   HD12  LEU   6          HD12      LEU   6  52.928   0.958  11.419
   52   HD13  LEU   6          HD13      LEU   6  51.504   1.999  11.657
   53   HD21  LEU   6          HD21      LEU   6  51.719   1.241   7.988
   54   HD22  LEU   6          HD22      LEU   6  50.485   1.557   9.232
   55   HD23  LEU   6          HD23      LEU   6  51.672   0.250   9.462
   56    H    GLU   7           HN       GLU   7  53.595   5.697   7.250
   57    HA   GLU   7           HA       GLU   7  52.116   8.059   8.041
   58    HB2  GLU   7           HB2      GLU   7  54.618   7.874   7.729
   59    HB3  GLU   7           HB1      GLU   7  54.338   7.839   5.973
   60    HG2  GLU   7           HG2      GLU   7  53.236  10.081   7.722
   61    HG3  GLU   7           HG1      GLU   7  54.883  10.138   7.058
   62    H    ARG   8           HN       ARG   8  52.142   6.022   5.207
   63    HA   ARG   8           HA       ARG   8  51.093   7.899   3.310
   64    HB2  ARG   8           HB2      ARG   8  50.520   4.917   3.392
   65    HB3  ARG   8           HB1      ARG   8  50.551   5.984   1.969
   66    HG2  ARG   8           HG2      ARG   8  52.943   5.304   3.740
   67    HG3  ARG   8           HG1      ARG   8  52.633   4.653   2.116
   68    HD2  ARG   8           HD2      ARG   8  52.555   7.163   1.367
   69    HD3  ARG   8           HD1      ARG   8  53.378   7.482   2.914
   70    HE   ARG   8           HE       ARG   8  54.715   5.360   1.491
   71   HH11  ARG   8          HH11      ARG   8  56.229   7.488   2.839
   72   HH12  ARG   8          HH12      ARG   8  56.827   8.443   1.523
   73   HH21  ARG   8          HH21      ARG   8  54.592   7.140  -0.786
   74   HH22  ARG   8          HH22      ARG   8  55.899   8.247  -0.529
   75    H    ILE   9           HN       ILE   9  48.922   7.822   2.340
   76    HA   ILE   9           HA       ILE   9  46.693   6.880   3.982
   77    HB   ILE   9           HB       ILE   9  47.321   8.955   5.224
   78   HG12  ILE   9          HG12      ILE   9  44.744   9.271   3.610
   79   HG13  ILE   9          HG11      ILE   9  44.931   8.166   4.991
   80   HG21  ILE   9          HG21      ILE   9  48.253  10.082   3.114
   81   HG22  ILE   9          HG22      ILE   9  47.268  11.112   4.176
   82   HG23  ILE   9          HG23      ILE   9  46.567  10.451   2.681
   83   HD11  ILE   9           HD1      ILE   9  45.049  11.204   4.980
   84   HD12  ILE   9           HD2      ILE   9  45.691  10.245   6.335
   85   HD13  ILE   9           HD3      ILE   9  43.967  10.144   5.909
   86    H    GLY  10           HN       GLY  10  47.890   9.007   1.391
   87    HA2  GLY  10           HA1      GLY  10  47.205   9.093  -0.829
   88    HA3  GLY  10           HA2      GLY  10  46.042   7.792  -0.507
   89    H    LYS  11           HN       LYS  11  44.487   8.888   1.495
   90    HA   LYS  11           HA       LYS  11  42.847  10.721  -0.090
   91    HB2  LYS  11           HB2      LYS  11  42.571   9.690   2.760
   92    HB3  LYS  11           HB1      LYS  11  41.343  10.646   1.892
   93    HG2  LYS  11           HG2      LYS  11  41.010   8.920   0.259
   94    HG3  LYS  11           HG1      LYS  11  42.468   8.043   0.780
   95    HD2  LYS  11           HD2      LYS  11  40.490   6.907   1.668
   96    HD3  LYS  11           HD1      LYS  11  41.390   7.650   3.011
   97    HE2  LYS  11           HE2      LYS  11  39.818   9.431   3.222
   98    HE3  LYS  11           HE1      LYS  11  39.090   9.090   1.634
   99    HZ1  LYS  11           HZ1      LYS  11  38.347   8.069   4.125
  100    HZ2  LYS  11           HZ2      LYS  11  38.967   6.771   3.222
  101    HZ3  LYS  11           HZ3      LYS  11  37.687   7.703   2.607
  102    H    ALA  12           HN       ALA  12  43.965  12.644  -0.359
  103    HA   ALA  12           HA       ALA  12  45.290  14.046   1.754
  104    HB1  ALA  12           HB1      ALA  12  45.192  15.977   0.271
  105    HB2  ALA  12           HB2      ALA  12  43.927  15.195  -0.707
  106    HB3  ALA  12           HB3      ALA  12  45.573  14.518  -0.672
  107    H    GLY  13           HN       GLY  13  42.075  13.244   1.433
  108    HA2  GLY  13           HA1      GLY  13  40.136  14.007   2.432
  109    HA3  GLY  13           HA2      GLY  13  41.203  14.645   3.699
  110    H    PHE  14           HN       PHE  14  40.657  15.506   0.249
  111    HA   PHE  14           HA       PHE  14  39.332  17.988   0.946
  112    HB2  PHE  14           HB2      PHE  14  41.745  18.448   1.625
  113    HB3  PHE  14           HB1      PHE  14  42.168  18.313  -0.097
  114    HD1  PHE  14           HD1      PHE  14  39.618  20.020   2.116
  115    HD2  PHE  14           HD2      PHE  14  42.138  20.301  -1.380
  116    HE1  PHE  14           HE1      PHE  14  38.881  22.372   1.769
  117    HE2  PHE  14           HE2      PHE  14  41.398  22.652  -1.724
  118    HZ   PHE  14           HZ       PHE  14  39.803  23.702  -0.125
  119    H    ILE  15           HN       ILE  15  41.426  16.353  -1.476
  120    HA   ILE  15           HA       ILE  15  39.293  16.684  -3.483
  121    HB   ILE  15           HB       ILE  15  40.919  17.736  -5.160
  122   HG12  ILE  15          HG12      ILE  15  42.449  18.282  -2.571
  123   HG13  ILE  15          HG11      ILE  15  43.015  17.309  -3.945
  124   HG21  ILE  15          HG21      ILE  15  40.333  19.537  -2.774
  125   HG22  ILE  15          HG22      ILE  15  39.060  18.968  -3.879
  126   HG23  ILE  15          HG23      ILE  15  40.385  19.978  -4.496
  127   HD11  ILE  15           HD1      ILE  15  42.611  20.313  -3.787
  128   HD12  ILE  15           HD2      ILE  15  42.640  19.476  -5.359
  129   HD13  ILE  15           HD3      ILE  15  44.057  19.407  -4.286
  130    H    ILE  16           HN       ILE  16  39.840  14.365  -2.588
  131    HA   ILE  16           HA       ILE  16  41.435  13.078  -4.766
  132    HB   ILE  16           HB       ILE  16  41.758  12.684  -1.768
  133   HG12  ILE  16          HG12      ILE  16  43.228  14.303  -3.205
  134   HG13  ILE  16          HG11      ILE  16  44.039  13.193  -2.090
  135   HG21  ILE  16          HG21      ILE  16  42.410  10.721  -4.000
  136   HG22  ILE  16          HG22      ILE  16  41.490  10.434  -2.505
  137   HG23  ILE  16          HG23      ILE  16  43.247  10.680  -2.430
  138   HD11  ILE  16           HD1      ILE  16  43.617  12.462  -5.018
  139   HD12  ILE  16           HD2      ILE  16  44.760  11.761  -3.853
  140   HD13  ILE  16           HD3      ILE  16  45.020  13.404  -4.473
  141    H    ILE  17           HN       ILE  17  39.648  12.183  -1.774
  142    HA   ILE  17           HA       ILE  17  38.376   9.940  -3.093
  143    HB   ILE  17           HB       ILE  17  38.710   9.912  -0.658
  144   HG12  ILE  17          HG12      ILE  17  36.478   9.251   0.082
  145   HG13  ILE  17          HG11      ILE  17  35.717  10.164  -1.237
  146   HG21  ILE  17          HG21      ILE  17  36.702  12.196  -0.510
  147   HG22  ILE  17          HG22      ILE  17  38.464  12.428  -0.422
  148   HG23  ILE  17          HG23      ILE  17  37.627  11.477   0.827
  149   HD11  ILE  17           HD1      ILE  17  36.031   7.571  -1.510
  150   HD12  ILE  17           HD2      ILE  17  37.731   7.974  -1.850
  151   HD13  ILE  17           HD3      ILE  17  36.435   8.626  -2.885
  152    H    GLY  18           HN       GLY  18  37.455  13.279  -2.301
  153    HA2  GLY  18           HA1      GLY  18  34.731  12.935  -3.352
  154    HA3  GLY  18           HA2      GLY  18  35.476  14.436  -2.768
  155    H    GLY  19           HN       GLY  19  37.775  14.516  -4.359
  156    HA2  GLY  19           HA1      GLY  19  36.642  15.608  -6.785
  157    HA3  GLY  19           HA2      GLY  19  38.367  15.453  -6.397
  158    H    ALA  20           HN       ALA  20  38.395  12.623  -5.966
  159    HA   ALA  20           HA       ALA  20  38.828  10.733  -7.239
  160    HB1  ALA  20           HB1      ALA  20  36.362  11.538  -8.810
  161    HB2  ALA  20           HB2      ALA  20  36.297  10.792  -7.194
  162    HB3  ALA  20           HB3      ALA  20  37.013   9.901  -8.560
  163    H    LEU  21           HN       LEU  21  39.583  13.596  -8.242
  164    HA   LEU  21           HA       LEU  21  40.686  14.485 -10.080
  165    HB2  LEU  21           HB2      LEU  21  41.293  11.520 -10.324
  166    HB3  LEU  21           HB1      LEU  21  41.943  12.691 -11.496
  167    HG   LEU  21           HG       LEU  21  43.066  13.930  -9.723
  168   HD11  LEU  21          HD11      LEU  21  41.563  13.796  -7.873
  169   HD12  LEU  21          HD12      LEU  21  43.003  12.894  -7.352
  170   HD13  LEU  21          HD13      LEU  21  41.554  12.016  -7.901
  171   HD21  LEU  21          HD21      LEU  21  43.470  10.918  -9.428
  172   HD22  LEU  21          HD22      LEU  21  44.635  12.168  -8.927
  173   HD23  LEU  21          HD23      LEU  21  44.236  11.959 -10.649
  174    H    ASP  22           HN       ASP  22  37.825  13.071 -10.309
  175    HA   ASP  22           HA       ASP  22  37.636  12.630 -13.202
  176    HB2  ASP  22           HB2      ASP  22  36.180  11.397 -11.673
  177    HB3  ASP  22           HB1      ASP  22  35.510  12.918 -11.039
  178    H    HIS  23           HN       HIS  23  35.049  14.475 -11.861
  179    HA   HIS  23           HA       HIS  23  35.413  16.551 -13.867
  180    HB2  HIS  23           HB2      HIS  23  33.418  17.572 -12.784
  181    HB3  HIS  23           HB1      HIS  23  33.174  15.850 -13.161
  182    HD1  HIS  23           HD1      HIS  23  35.379  15.574 -10.469
  183    HD2  HIS  23           HD2      HIS  23  31.368  16.819 -10.691
  184    HE1  HIS  23           HE1      HIS  23  34.364  15.289  -8.143
  185    H    LEU  24           HN       LEU  24  37.252  16.008 -11.314
  186    HA   LEU  24           HA       LEU  24  37.248  18.254  -9.650
  187    HB2  LEU  24           HB2      LEU  24  38.747  16.409  -9.235
  188    HB3  LEU  24           HB1      LEU  24  39.566  16.647 -10.793
  189    HG   LEU  24           HG       LEU  24  40.536  18.743 -10.049
  190   HD11  LEU  24          HD11      LEU  24  40.083  19.453  -7.591
  191   HD12  LEU  24          HD12      LEU  24  38.652  18.398  -7.684
  192   HD13  LEU  24          HD13      LEU  24  38.808  19.790  -8.784
  193   HD21  LEU  24          HD21      LEU  24  40.694  16.649  -7.836
  194   HD22  LEU  24          HD22      LEU  24  41.865  17.962  -8.105
  195   HD23  LEU  24          HD23      LEU  24  41.676  16.675  -9.320
  Start of MODEL   95
    1    H1   GLY   1           HT1      GLY   1  58.897   1.852  12.571
    2    H2   GLY   1           HT2      GLY   1  58.182   3.329  12.132
    3    H3   GLY   1           HT3      GLY   1  59.392   3.287  13.325
    4    HA2  GLY   1           HA1      GLY   1  60.666   3.941  11.652
    5    HA3  GLY   1           HA2      GLY   1  60.738   2.186  11.400
    6    H    LYS   2           HN       LYS   2  58.866   5.107  10.522
    7    HA   LYS   2           HA       LYS   2  57.770   5.647   8.561
    8    HB2  LYS   2           HB2      LYS   2  60.211   5.264   7.791
    9    HB3  LYS   2           HB1      LYS   2  59.640   3.710   7.149
   10    HG2  LYS   2           HG2      LYS   2  58.042   4.837   5.686
   11    HG3  LYS   2           HG1      LYS   2  58.393   6.407   6.441
   12    HD2  LYS   2           HD2      LYS   2  59.592   6.238   4.312
   13    HD3  LYS   2           HD1      LYS   2  60.754   6.236   5.658
   14    HE2  LYS   2           HE2      LYS   2  59.728   3.592   4.582
   15    HE3  LYS   2           HE1      LYS   2  61.008   4.463   3.707
   16    HZ1  LYS   2           HZ1      LYS   2  61.663   4.528   6.415
   17    HZ2  LYS   2           HZ2      LYS   2  62.451   3.684   5.168
   18    HZ3  LYS   2           HZ3      LYS   2  61.219   2.929   6.062
   19    H    GLY   3           HN       GLY   3  58.115   3.172   6.413
   20    HA2  GLY   3           HA1      GLY   3  56.868   1.004   6.326
   21    HA3  GLY   3           HA2      GLY   3  55.598   1.722   7.418
   22    H    ARG   4           HN       ARG   4  55.109   3.638   7.165
   23    HA   ARG   4           HA       ARG   4  53.258   2.532   6.051
   24    HB2  ARG   4           HB2      ARG   4  53.288   5.561   6.481
   25    HB3  ARG   4           HB1      ARG   4  51.810   4.593   6.234
   26    HG2  ARG   4           HG2      ARG   4  52.325   3.233   8.208
   27    HG3  ARG   4           HG1      ARG   4  53.867   4.093   8.433
   28    HD2  ARG   4           HD2      ARG   4  52.660   6.207   8.803
   29    HD3  ARG   4           HD1      ARG   4  51.106   5.386   8.524
   30    HE   ARG   4           HE       ARG   4  52.520   5.411  11.010
   31   HH11  ARG   4          HH11      ARG   4  53.062   2.951  11.557
   32   HH12  ARG   4          HH12      ARG   4  51.619   1.993  11.597
   33   HH21  ARG   4          HH21      ARG   4  49.707   4.326   9.887
   34   HH22  ARG   4          HH22      ARG   4  49.720   2.771  10.651
   35    H    TRP   5           HN       TRP   5  55.640   3.981   4.528
   36    HA   TRP   5           HA       TRP   5  54.890   5.461   2.300
   37    HB2  TRP   5           HB2      TRP   5  57.208   4.633   2.810
   38    HB3  TRP   5           HB1      TRP   5  56.742   3.050   2.143
   39    HD1  TRP   5           HD1      TRP   5  57.383   6.681   1.121
   40    HE1  TRP   5           HE1      TRP   5  57.685   6.821  -1.459
   41    HE3  TRP   5           HE3      TRP   5  56.139   1.868  -0.101
   42    HZ2  TRP   5           HZ2      TRP   5  57.414   5.060  -3.720
   43    HZ3  TRP   5           HZ3      TRP   5  56.167   1.120  -2.475
   44    HH2  TRP   5           HH2      TRP   5  56.803   2.710  -4.284
   45    H    LEU   6           HN       LEU   6  53.916   2.232   3.053
   46    HA   LEU   6           HA       LEU   6  52.746   1.855   0.304
   47    HB2  LEU   6           HB2      LEU   6  54.302   0.092   1.098
   48    HB3  LEU   6           HB1      LEU   6  53.273  -0.172   2.519
   49    HG   LEU   6           HG       LEU   6  51.829  -0.288  -0.126
   50   HD11  LEU   6          HD11      LEU   6  52.599  -2.639  -0.547
   51   HD12  LEU   6          HD12      LEU   6  53.864  -2.410   0.684
   52   HD13  LEU   6          HD13      LEU   6  53.878  -1.428  -0.800
   53   HD21  LEU   6          HD21      LEU   6  51.903  -2.092   2.345
   54   HD22  LEU   6          HD22      LEU   6  50.802  -2.293   0.963
   55   HD23  LEU   6          HD23      LEU   6  50.682  -0.848   1.989
   56    H    GLU   7           HN       GLU   7  52.069   2.278   3.747
   57    HA   GLU   7           HA       GLU   7  49.177   1.607   3.297
   58    HB2  GLU   7           HB2      GLU   7  50.781   2.193   5.818
   59    HB3  GLU   7           HB1      GLU   7  49.036   1.842   5.779
   60    HG2  GLU   7           HG2      GLU   7  49.488  -0.356   4.745
   61    HG3  GLU   7           HG1      GLU   7  51.234  -0.006   4.742
   62    H    ARG   8           HN       ARG   8  50.642   4.032   2.235
   63    HA   ARG   8           HA       ARG   8  50.083   6.366   3.681
   64    HB2  ARG   8           HB2      ARG   8  51.263   6.131   1.425
   65    HB3  ARG   8           HB1      ARG   8  49.648   6.074   0.688
   66    HG2  ARG   8           HG2      ARG   8  49.982   8.372   0.555
   67    HG3  ARG   8           HG1      ARG   8  49.304   8.315   2.195
   68    HD2  ARG   8           HD2      ARG   8  52.288   8.252   1.532
   69    HD3  ARG   8           HD1      ARG   8  51.389   9.694   2.049
   70    HE   ARG   8           HE       ARG   8  52.286   7.526   3.780
   71   HH11  ARG   8          HH11      ARG   8  51.111  10.621   3.734
   72   HH12  ARG   8          HH12      ARG   8  50.161  10.495   5.176
   73   HH21  ARG   8          HH21      ARG   8  50.535   7.058   5.439
   74   HH22  ARG   8          HH22      ARG   8  49.835   8.477   6.142
   75    H    ILE   9           HN       ILE   9  48.351   7.678   4.036
   76    HA   ILE   9           HA       ILE   9  45.728   6.431   3.880
   77    HB   ILE   9           HB       ILE   9  46.424   8.021   5.704
   78   HG12  ILE   9          HG12      ILE   9  44.015   8.911   4.048
   79   HG13  ILE   9          HG11      ILE   9  44.028   7.552   5.196
   80   HG21  ILE   9          HG21      ILE   9  45.985  10.215   3.640
   81   HG22  ILE   9          HG22      ILE   9  47.603   9.589   4.037
   82   HG23  ILE   9          HG23      ILE   9  46.620  10.371   5.295
   83   HD11  ILE   9           HD1      ILE   9  44.309  10.520   5.774
   84   HD12  ILE   9           HD2      ILE   9  44.841   9.292   6.950
   85   HD13  ILE   9           HD3      ILE   9  43.136   9.364   6.447
   86    H    GLY  10           HN       GLY  10  47.428   9.026   2.125
   87    HA2  GLY  10           HA1      GLY  10  47.041   9.776  -0.047
   88    HA3  GLY  10           HA2      GLY  10  45.714   8.611  -0.204
   89    H    LYS  11           HN       LYS  11  43.888   9.239   1.601
   90    HA   LYS  11           HA       LYS  11  42.653  11.579   0.531
   91    HB2  LYS  11           HB2      LYS  11  42.146  10.018   3.091
   92    HB3  LYS  11           HB1      LYS  11  41.095  11.330   2.507
   93    HG2  LYS  11           HG2      LYS  11  40.528  10.131   0.513
   94    HG3  LYS  11           HG1      LYS  11  41.830   8.944   0.766
   95    HD2  LYS  11           HD2      LYS  11  39.646   7.974   1.382
   96    HD3  LYS  11           HD1      LYS  11  40.687   8.131   2.816
   97    HE2  LYS  11           HE2      LYS  11  39.483  10.014   3.627
   98    HE3  LYS  11           HE1      LYS  11  38.702  10.306   2.053
   99    HZ1  LYS  11           HZ1      LYS  11  38.109   8.259   4.084
  100    HZ2  LYS  11           HZ2      LYS  11  37.790   7.912   2.451
  101    HZ3  LYS  11           HZ3      LYS  11  37.048   9.243   3.200
  102    H    ALA  12           HN       ALA  12  43.706  13.492   0.663
  103    HA   ALA  12           HA       ALA  12  45.201  14.313   2.996
  104    HB1  ALA  12           HB1      ALA  12  44.001  16.034   0.798
  105    HB2  ALA  12           HB2      ALA  12  45.561  15.185   0.682
  106    HB3  ALA  12           HB3      ALA  12  45.334  16.471   1.890
  107    H    GLY  13           HN       GLY  13  42.003  13.741   2.692
  108    HA2  GLY  13           HA1      GLY  13  40.093  14.538   3.742
  109    HA3  GLY  13           HA2      GLY  13  41.191  14.820   5.107
  110    H    PHE  14           HN       PHE  14  41.236  16.449   1.935
  111    HA   PHE  14           HA       PHE  14  39.856  18.807   2.918
  112    HB2  PHE  14           HB2      PHE  14  42.120  18.892   4.112
  113    HB3  PHE  14           HB1      PHE  14  42.850  19.136   2.509
  114    HD1  PHE  14           HD1      PHE  14  43.137  21.368   1.782
  115    HD2  PHE  14           HD2      PHE  14  39.984  20.462   4.592
  116    HE1  PHE  14           HE1      PHE  14  42.553  23.785   1.909
  117    HE2  PHE  14           HE2      PHE  14  39.404  22.880   4.715
  118    HZ   PHE  14           HZ       PHE  14  40.693  24.542   3.381
  119    H    ILE  15           HN       ILE  15  41.829  17.114   0.557
  120    HA   ILE  15           HA       ILE  15  40.395  18.530  -1.601
  121    HB   ILE  15           HB       ILE  15  42.611  19.021  -2.817
  122   HG12  ILE  15          HG12      ILE  15  43.681  18.778   0.036
  123   HG13  ILE  15          HG11      ILE  15  43.997  17.608  -1.264
  124   HG21  ILE  15          HG21      ILE  15  42.207  20.619  -0.256
  125   HG22  ILE  15          HG22      ILE  15  41.114  20.744  -1.654
  126   HG23  ILE  15          HG23      ILE  15  42.824  21.202  -1.817
  127   HD11  ILE  15           HD1      ILE  15  45.899  19.023  -1.309
  128   HD12  ILE  15           HD2      ILE  15  44.930  20.488  -1.040
  129   HD13  ILE  15           HD3      ILE  15  44.878  19.664  -2.618
  130    H    ILE  16           HN       ILE  16  39.834  16.086  -1.150
  131    HA   ILE  16           HA       ILE  16  41.067  14.626  -3.412
  132    HB   ILE  16           HB       ILE  16  41.188  13.713  -0.515
  133   HG12  ILE  16          HG12      ILE  16  43.193  14.832  -1.382
  134   HG13  ILE  16          HG11      ILE  16  43.524  13.116  -1.089
  135   HG21  ILE  16          HG21      ILE  16  40.294  11.721  -1.318
  136   HG22  ILE  16          HG22      ILE  16  41.995  11.435  -1.749
  137   HG23  ILE  16          HG23      ILE  16  40.846  12.005  -2.983
  138   HD11  ILE  16           HD1      ILE  16  42.847  12.922  -3.704
  139   HD12  ILE  16           HD2      ILE  16  44.497  13.326  -3.195
  140   HD13  ILE  16           HD3      ILE  16  43.387  14.614  -3.704
  141    H    ILE  17           HN       ILE  17  38.836  14.420  -0.607
  142    HA   ILE  17           HA       ILE  17  37.010  12.655  -2.046
  143    HB   ILE  17           HB       ILE  17  35.415  13.423  -0.062
  144   HG12  ILE  17          HG12      ILE  17  36.585  14.317   1.879
  145   HG13  ILE  17          HG11      ILE  17  38.138  14.289   1.020
  146   HG21  ILE  17          HG21      ILE  17  38.010  11.871   0.331
  147   HG22  ILE  17          HG22      ILE  17  36.421  11.214  -0.132
  148   HG23  ILE  17          HG23      ILE  17  36.668  11.883   1.500
  149   HD11  ILE  17           HD1      ILE  17  35.758  15.903   0.026
  150   HD12  ILE  17           HD2      ILE  17  37.468  16.055  -0.453
  151   HD13  ILE  17           HD3      ILE  17  36.948  16.563   1.169
  152    H    GLY  18           HN       GLY  18  37.833  15.604  -2.862
  153    HA2  GLY  18           HA1      GLY  18  35.387  16.127  -4.286
  154    HA3  GLY  18           HA2      GLY  18  35.527  17.215  -2.891
  155    H    GLY  19           HN       GLY  19  38.578  16.954  -3.213
  156    HA2  GLY  19           HA1      GLY  19  38.830  19.314  -4.936
  157    HA3  GLY  19           HA2      GLY  19  40.118  18.516  -4.015
  158    H    ALA  20           HN       ALA  20  39.433  15.857  -5.170
  159    HA   ALA  20           HA       ALA  20  41.246  15.976  -7.404
  160    HB1  ALA  20           HB1      ALA  20  41.038  13.976  -6.041
  161    HB2  ALA  20           HB2      ALA  20  40.600  13.596  -7.724
  162    HB3  ALA  20           HB3      ALA  20  39.327  13.805  -6.496
  163    H    LEU  21           HN       LEU  21  37.953  14.588  -7.557
  164    HA   LEU  21           HA       LEU  21  36.352  14.707  -9.230
  165    HB2  LEU  21           HB2      LEU  21  37.528  17.404  -9.985
  166    HB3  LEU  21           HB1      LEU  21  35.852  16.839 -10.172
  167    HG   LEU  21           HG       LEU  21  37.302  17.370  -7.542
  168   HD11  LEU  21          HD11      LEU  21  34.866  18.723  -8.780
  169   HD12  LEU  21          HD12      LEU  21  36.522  19.362  -8.897
  170   HD13  LEU  21          HD13      LEU  21  35.735  19.213  -7.307
  171   HD21  LEU  21          HD21      LEU  21  34.890  16.977  -6.641
  172   HD22  LEU  21          HD22      LEU  21  35.834  15.543  -7.097
  173   HD23  LEU  21          HD23      LEU  21  34.580  16.167  -8.196
  174    H    ASP  22           HN       ASP  22  39.539  14.348  -9.776
  175    HA   ASP  22           HA       ASP  22  39.612  14.671 -12.684
  176    HB2  ASP  22           HB2      ASP  22  41.809  13.606 -12.513
  177    HB3  ASP  22           HB1      ASP  22  41.639  14.840 -11.241
  178    H    HIS  23           HN       HIS  23  41.151  11.893 -12.540
  179    HA   HIS  23           HA       HIS  23  38.940  10.397 -13.737
  180    HB2  HIS  23           HB2      HIS  23  41.680   9.335 -12.963
  181    HB3  HIS  23           HB1      HIS  23  40.580   8.723 -14.220
  182    HD1  HIS  23           HD1      HIS  23  40.271  12.248 -14.499
  183    HD2  HIS  23           HD2      HIS  23  43.314   9.546 -15.555
  184    HE1  HIS  23           HE1      HIS  23  41.709  13.381 -16.281
  185    H    LEU  24           HN       LEU  24  38.483  11.164 -10.989
  186    HA   LEU  24           HA       LEU  24  37.618   8.598  -9.975
  187    HB2  LEU  24           HB2      LEU  24  39.910   8.273  -9.311
  188    HB3  LEU  24           HB1      LEU  24  40.029   9.928  -8.679
  189    HG   LEU  24           HG       LEU  24  38.531   9.420  -6.843
  190   HD11  LEU  24          HD11      LEU  24  38.055   6.829  -8.369
  191   HD12  LEU  24          HD12      LEU  24  36.856   8.027  -7.820
  192   HD13  LEU  24          HD13      LEU  24  37.676   6.983  -6.637
  193   HD21  LEU  24          HD21      LEU  24  40.916   8.679  -6.648
  194   HD22  LEU  24          HD22      LEU  24  40.435   7.068  -7.236
  195   HD23  LEU  24          HD23      LEU  24  39.806   7.675  -5.684
  Start of MODEL   96
    1    H1   GLY   1           HT1      GLY   1  56.386   3.037  -4.645
    2    H2   GLY   1           HT2      GLY   1  54.843   2.994  -3.934
    3    H3   GLY   1           HT3      GLY   1  56.161   2.247  -3.164
    4    HA2  GLY   1           HA1      GLY   1  57.226   4.478  -3.079
    5    HA3  GLY   1           HA2      GLY   1  55.633   5.110  -3.540
    6    H    LYS   2           HN       LYS   2  56.984   2.685  -1.253
    7    HA   LYS   2           HA       LYS   2  54.861   3.126   0.674
    8    HB2  LYS   2           HB2      LYS   2  57.608   1.977   1.274
    9    HB3  LYS   2           HB1      LYS   2  56.061   1.621   2.080
   10    HG2  LYS   2           HG2      LYS   2  56.795   0.919  -0.799
   11    HG3  LYS   2           HG1      LYS   2  56.678  -0.220   0.564
   12    HD2  LYS   2           HD2      LYS   2  54.233   0.639   0.822
   13    HD3  LYS   2           HD1      LYS   2  54.446   1.334  -0.802
   14    HE2  LYS   2           HE2      LYS   2  54.759  -1.601  -0.037
   15    HE3  LYS   2           HE1      LYS   2  53.436  -0.891  -0.993
   16    HZ1  LYS   2           HZ1      LYS   2  56.079  -0.279  -1.986
   17    HZ2  LYS   2           HZ2      LYS   2  54.701  -0.822  -2.818
   18    HZ3  LYS   2           HZ3      LYS   2  55.708  -1.933  -2.017
   19    H    GLY   3           HN       GLY   3  57.179   3.115   2.827
   20    HA2  GLY   3           HA1      GLY   3  57.686   4.836   4.458
   21    HA3  GLY   3           HA2      GLY   3  58.463   5.612   2.974
   22    H    ARG   4           HN       ARG   4  56.061   4.489   4.623
   23    HA   ARG   4           HA       ARG   4  55.758   6.174   6.002
   24    HB2  ARG   4           HB2      ARG   4  54.345   7.363   3.693
   25    HB3  ARG   4           HB1      ARG   4  53.345   7.414   5.156
   26    HG2  ARG   4           HG2      ARG   4  54.753   8.886   6.292
   27    HG3  ARG   4           HG1      ARG   4  56.209   8.372   5.426
   28    HD2  ARG   4           HD2      ARG   4  53.926   9.963   4.175
   29    HD3  ARG   4           HD1      ARG   4  55.425  10.680   4.811
   30    HE   ARG   4           HE       ARG   4  56.675   9.411   3.061
   31   HH11  ARG   4          HH11      ARG   4  54.614  11.288   1.756
   32   HH12  ARG   4          HH12      ARG   4  53.990  10.258   0.510
   33   HH21  ARG   4          HH21      ARG   4  55.283   7.353   1.894
   34   HH22  ARG   4          HH22      ARG   4  54.370   8.031   0.587
   35    H    TRP   5           HN       TRP   5  54.546   3.826   4.279
   36    HA   TRP   5           HA       TRP   5  51.936   3.188   4.820
   37    HB2  TRP   5           HB2      TRP   5  53.455   1.633   3.693
   38    HB3  TRP   5           HB1      TRP   5  54.333   1.364   5.218
   39    HD1  TRP   5           HD1      TRP   5  50.497   1.367   4.557
   40    HE1  TRP   5           HE1      TRP   5  49.500  -0.872   5.412
   41    HE3  TRP   5           HE3      TRP   5  54.829  -0.950   6.005
   42    HZ2  TRP   5           HZ2      TRP   5  50.474  -3.323   6.564
   43    HZ3  TRP   5           HZ3      TRP   5  54.769  -3.240   6.979
   44    HH2  TRP   5           HH2      TRP   5  52.598  -4.428   7.258
   45    H    LEU   6           HN       LEU   6  54.477   3.630   7.150
   46    HA   LEU   6           HA       LEU   6  52.828   2.515   9.386
   47    HB2  LEU   6           HB2      LEU   6  55.722   3.403   9.103
   48    HB3  LEU   6           HB1      LEU   6  54.979   3.168  10.702
   49    HG   LEU   6           HG       LEU   6  54.350   0.830  10.016
   50   HD11  LEU   6          HD11      LEU   6  55.901   1.651   7.527
   51   HD12  LEU   6          HD12      LEU   6  54.282   0.921   7.632
   52   HD13  LEU   6          HD13      LEU   6  55.720  -0.054   8.005
   53   HD21  LEU   6          HD21      LEU   6  57.308   1.555   9.811
   54   HD22  LEU   6          HD22      LEU   6  56.665  -0.061  10.188
   55   HD23  LEU   6          HD23      LEU   6  56.401   1.289  11.319
   56    H    GLU   7           HN       GLU   7  53.951   5.553   7.923
   57    HA   GLU   7           HA       GLU   7  52.602   7.056  10.187
   58    HB2  GLU   7           HB2      GLU   7  54.944   7.821   8.398
   59    HB3  GLU   7           HB1      GLU   7  54.080   8.968   9.448
   60    HG2  GLU   7           HG2      GLU   7  56.033   8.162  10.652
   61    HG3  GLU   7           HG1      GLU   7  54.590   7.438  11.402
   62    H    ARG   8           HN       ARG   8  51.311   5.845   7.878
   63    HA   ARG   8           HA       ARG   8  50.868   7.832   5.836
   64    HB2  ARG   8           HB2      ARG   8  50.381   5.346   5.677
   65    HB3  ARG   8           HB1      ARG   8  48.961   5.631   6.710
   66    HG2  ARG   8           HG2      ARG   8  48.015   7.177   5.078
   67    HG3  ARG   8           HG1      ARG   8  49.484   7.075   4.075
   68    HD2  ARG   8           HD2      ARG   8  47.679   4.711   4.750
   69    HD3  ARG   8           HD1      ARG   8  47.626   5.622   3.221
   70    HE   ARG   8           HE       ARG   8  49.596   3.612   3.929
   71   HH11  ARG   8          HH11      ARG   8  48.998   3.900   1.141
   72   HH12  ARG   8          HH12      ARG   8  50.306   4.840   0.508
   73   HH21  ARG   8          HH21      ARG   8  51.331   5.994   3.613
   74   HH22  ARG   8          HH22      ARG   8  51.628   6.026   1.907
   75    H    ILE   9           HN       ILE   9  49.697   9.636   5.853
   76    HA   ILE   9           HA       ILE   9  48.288  10.424   8.274
   77    HB   ILE   9           HB       ILE   9  47.663  12.452   6.966
   78   HG12  ILE   9          HG12      ILE   9  49.020  10.928   4.692
   79   HG13  ILE   9          HG11      ILE   9  47.311  11.413   4.769
   80   HG21  ILE   9          HG21      ILE   9  49.962  12.091   8.065
   81   HG22  ILE   9          HG22      ILE   9  49.889  13.329   6.790
   82   HG23  ILE   9          HG23      ILE   9  50.573  11.724   6.435
   83   HD11  ILE   9           HD1      ILE   9  48.220  13.845   5.017
   84   HD12  ILE   9           HD2      ILE   9  48.311  13.080   3.412
   85   HD13  ILE   9           HD3      ILE   9  49.763  13.171   4.435
   86    H    GLY  10           HN       GLY  10  47.402   9.028   5.163
   87    HA2  GLY  10           HA1      GLY  10  45.358   8.321   4.342
   88    HA3  GLY  10           HA2      GLY  10  44.930   8.020   6.038
   89    H    LYS  11           HN       LYS  11  45.470  10.925   3.987
   90    HA   LYS  11           HA       LYS  11  42.677  11.729   4.231
   91    HB2  LYS  11           HB2      LYS  11  43.646  12.294   6.511
   92    HB3  LYS  11           HB1      LYS  11  44.718  13.452   5.685
   93    HG2  LYS  11           HG2      LYS  11  42.775  14.650   4.775
   94    HG3  LYS  11           HG1      LYS  11  41.672  13.464   5.515
   95    HD2  LYS  11           HD2      LYS  11  42.407  14.106   7.756
   96    HD3  LYS  11           HD1      LYS  11  43.633  15.202   7.074
   97    HE2  LYS  11           HE2      LYS  11  41.673  16.507   7.744
   98    HE3  LYS  11           HE1      LYS  11  41.796  16.503   5.969
   99    HZ1  LYS  11           HZ1      LYS  11  40.286  14.284   6.990
  100    HZ2  LYS  11           HZ2      LYS  11  39.878  15.414   5.787
  101    HZ3  LYS  11           HZ3      LYS  11  39.608  15.776   7.426
  102    H    ALA  12           HN       ALA  12  43.176  11.611   1.917
  103    HA   ALA  12           HA       ALA  12  45.047  13.574   0.801
  104    HB1  ALA  12           HB1      ALA  12  44.345  12.741  -1.327
  105    HB2  ALA  12           HB2      ALA  12  42.856  12.049  -0.638
  106    HB3  ALA  12           HB3      ALA  12  44.439  11.341  -0.233
  107    H    GLY  13           HN       GLY  13  43.361  14.927   2.506
  108    HA2  GLY  13           HA1      GLY  13  42.089  16.858   2.524
  109    HA3  GLY  13           HA2      GLY  13  42.336  16.966   0.771
  110    H    PHE  14           HN       PHE  14  40.588  14.826   3.067
  111    HA   PHE  14           HA       PHE  14  38.427  14.002   2.990
  112    HB2  PHE  14           HB2      PHE  14  37.944  16.469   3.148
  113    HB3  PHE  14           HB1      PHE  14  37.797  16.501   1.375
  114    HD1  PHE  14           HD1      PHE  14  35.656  16.129   0.435
  115    HD2  PHE  14           HD2      PHE  14  36.551  14.535   4.349
  116    HE1  PHE  14           HE1      PHE  14  33.312  15.309   0.640
  117    HE2  PHE  14           HE2      PHE  14  34.208  13.715   4.549
  118    HZ   PHE  14           HZ       PHE  14  32.602  14.062   2.677
  119    H    ILE  15           HN       ILE  15  40.285  13.174   0.923
  120    HA   ILE  15           HA       ILE  15  40.248  11.941  -1.012
  121    HB   ILE  15           HB       ILE  15  37.206  11.958  -0.876
  122   HG12  ILE  15          HG12      ILE  15  39.163  10.141   0.611
  123   HG13  ILE  15          HG11      ILE  15  38.145  11.386   1.368
  124   HG21  ILE  15          HG21      ILE  15  39.123   9.762  -1.754
  125   HG22  ILE  15          HG22      ILE  15  38.486  10.988  -2.874
  126   HG23  ILE  15          HG23      ILE  15  37.372   9.875  -2.052
  127   HD11  ILE  15           HD1      ILE  15  36.906   9.390   1.672
  128   HD12  ILE  15           HD2      ILE  15  37.291   8.795   0.041
  129   HD13  ILE  15           HD3      ILE  15  36.143  10.140   0.250
  130    H    ILE  16           HN       ILE  16  41.014  14.017  -1.840
  131    HA   ILE  16           HA       ILE  16  39.375  14.770  -4.202
  132    HB   ILE  16           HB       ILE  16  40.464  16.796  -2.201
  133   HG12  ILE  16          HG12      ILE  16  37.662  15.889  -2.997
  134   HG13  ILE  16          HG11      ILE  16  38.402  15.869  -1.381
  135   HG21  ILE  16          HG21      ILE  16  38.885  17.317  -4.769
  136   HG22  ILE  16          HG22      ILE  16  40.656  17.426  -4.701
  137   HG23  ILE  16          HG23      ILE  16  39.668  18.521  -3.723
  138   HD11  ILE  16           HD1      ILE  16  36.953  17.749  -1.353
  139   HD12  ILE  16           HD2      ILE  16  37.440  18.252  -2.988
  140   HD13  ILE  16           HD3      ILE  16  38.569  18.442  -1.625
  141    H    ILE  17           HN       ILE  17  42.349  15.608  -2.343
  142    HA   ILE  17           HA       ILE  17  43.941  16.155  -4.661
  143    HB   ILE  17           HB       ILE  17  44.630  15.284  -1.815
  144   HG12  ILE  17          HG12      ILE  17  45.479  17.568  -1.631
  145   HG13  ILE  17          HG11      ILE  17  45.230  17.843  -3.370
  146   HG21  ILE  17          HG21      ILE  17  46.435  14.329  -3.083
  147   HG22  ILE  17          HG22      ILE  17  47.044  15.892  -2.489
  148   HG23  ILE  17          HG23      ILE  17  46.503  15.730  -4.178
  149   HD11  ILE  17           HD1      ILE  17  42.854  17.804  -3.145
  150   HD12  ILE  17           HD2      ILE  17  43.431  18.778  -1.774
  151   HD13  ILE  17           HD3      ILE  17  42.940  17.088  -1.517
  152    H    GLY  18           HN       GLY  18  42.891  13.268  -3.019
  153    HA2  GLY  18           HA1      GLY  18  44.620  11.515  -4.706
  154    HA3  GLY  18           HA2      GLY  18  43.616  11.018  -3.325
  155    H    GLY  19           HN       GLY  19  41.187  12.182  -3.895
  156    HA2  GLY  19           HA1      GLY  19  40.200  10.347  -5.933
  157    HA3  GLY  19           HA2      GLY  19  39.253  11.535  -5.019
  158    H    ALA  20           HN       ALA  20  39.853  13.924  -5.639
  159    HA   ALA  20           HA       ALA  20  39.671  15.537  -7.291
  160    HB1  ALA  20           HB1      ALA  20  41.179  15.418  -9.142
  161    HB2  ALA  20           HB2      ALA  20  41.272  13.644  -9.036
  162    HB3  ALA  20           HB3      ALA  20  41.997  14.652  -7.760
  163    H    LEU  21           HN       LEU  21  37.705  13.284  -7.131
  164    HA   LEU  21           HA       LEU  21  35.905  12.484  -8.363
  165    HB2  LEU  21           HB2      LEU  21  36.348  14.893 -10.161
  166    HB3  LEU  21           HB1      LEU  21  34.815  14.069  -9.787
  167    HG   LEU  21           HG       LEU  21  36.545  15.657  -7.837
  168   HD11  LEU  21          HD11      LEU  21  33.747  16.168  -8.945
  169   HD12  LEU  21          HD12      LEU  21  35.226  17.001  -9.480
  170   HD13  LEU  21          HD13      LEU  21  34.640  17.211  -7.812
  171   HD21  LEU  21          HD21      LEU  21  35.557  13.918  -6.539
  172   HD22  LEU  21          HD22      LEU  21  34.043  13.958  -7.473
  173   HD23  LEU  21          HD23      LEU  21  34.435  15.285  -6.353
  174    H    ASP  22           HN       ASP  22  36.120  13.640 -11.421
  175    HA   ASP  22           HA       ASP  22  37.106  11.053 -12.441
  176    HB2  ASP  22           HB2      ASP  22  35.130  12.167 -13.445
  177    HB3  ASP  22           HB1      ASP  22  36.154  13.547 -13.910
  178    H    HIS  23           HN       HIS  23  39.254  11.739 -11.279
  179    HA   HIS  23           HA       HIS  23  41.479  12.336 -11.534
  180    HB2  HIS  23           HB2      HIS  23  41.194  10.859 -13.560
  181    HB3  HIS  23           HB1      HIS  23  40.874  12.326 -14.517
  182    HD1  HIS  23           HD1      HIS  23  42.853  13.687 -15.297
  183    HD2  HIS  23           HD2      HIS  23  43.891  10.846 -12.374
  184    HE1  HIS  23           HE1      HIS  23  45.403  13.681 -15.113
  185    H    LEU  24           HN       LEU  24  39.176  14.383 -11.634
  186    HA   LEU  24           HA       LEU  24  40.056  16.588 -13.241
  187    HB2  LEU  24           HB2      LEU  24  37.782  16.273 -12.125
  188    HB3  LEU  24           HB1      LEU  24  38.563  16.744 -10.600
  189    HG   LEU  24           HG       LEU  24  39.382  18.863 -11.940
  190   HD11  LEU  24          HD11      LEU  24  37.088  17.852 -13.687
  191   HD12  LEU  24          HD12      LEU  24  38.748  18.244 -14.195
  192   HD13  LEU  24          HD13      LEU  24  37.647  19.539 -13.683
  193   HD21  LEU  24          HD21      LEU  24  36.438  18.482 -11.226
  194   HD22  LEU  24          HD22      LEU  24  37.272  20.047 -11.386
  195   HD23  LEU  24          HD23      LEU  24  37.738  18.918 -10.090
  Start of MODEL   97
    1    H1   GLY   1           HT1      GLY   1  59.790  -2.387  -1.235
    2    H2   GLY   1           HT2      GLY   1  58.259  -2.013  -0.603
    3    H3   GLY   1           HT3      GLY   1  59.573  -2.281   0.441
    4    HA2  GLY   1           HA1      GLY   1  60.658  -0.344  -0.261
    5    HA3  GLY   1           HA2      GLY   1  59.451  -0.111  -1.541
    6    H    LYS   2           HN       LYS   2  58.376  -1.335   1.525
    7    HA   LYS   2           HA       LYS   2  56.917  -0.411   3.074
    8    HB2  LYS   2           HB2      LYS   2  58.760   1.969   2.618
    9    HB3  LYS   2           HB1      LYS   2  57.560   1.863   3.930
   10    HG2  LYS   2           HG2      LYS   2  58.668  -0.016   4.926
   11    HG3  LYS   2           HG1      LYS   2  59.689  -0.269   3.491
   12    HD2  LYS   2           HD2      LYS   2  60.957   0.832   5.320
   13    HD3  LYS   2           HD1      LYS   2  60.821   1.889   3.895
   14    HE2  LYS   2           HE2      LYS   2  59.182   3.264   4.925
   15    HE3  LYS   2           HE1      LYS   2  58.814   2.048   6.174
   16    HZ1  LYS   2           HZ1      LYS   2  60.274   3.111   7.441
   17    HZ2  LYS   2           HZ2      LYS   2  60.815   4.082   6.157
   18    HZ3  LYS   2           HZ3      LYS   2  61.506   2.552   6.419
   19    H    GLY   3           HN       GLY   3  57.295   2.849   1.958
   20    HA2  GLY   3           HA1      GLY   3  55.887   3.995   0.276
   21    HA3  GLY   3           HA2      GLY   3  54.613   2.707   0.465
   22    H    ARG   4           HN       ARG   4  54.189   2.004   2.247
   23    HA   ARG   4           HA       ARG   4  52.379   3.591   1.961
   24    HB2  ARG   4           HB2      ARG   4  52.484   1.684   4.349
   25    HB3  ARG   4           HB1      ARG   4  50.993   2.459   3.752
   26    HG2  ARG   4           HG2      ARG   4  51.412   1.471   1.496
   27    HG3  ARG   4           HG1      ARG   4  52.844   0.639   2.147
   28    HD2  ARG   4           HD2      ARG   4  49.994   0.293   3.178
   29    HD3  ARG   4           HD1      ARG   4  50.842  -0.848   2.108
   30    HE   ARG   4           HE       ARG   4  52.485  -0.437   4.390
   31   HH11  ARG   4          HH11      ARG   4  51.283  -0.920   6.526
   32   HH12  ARG   4          HH12      ARG   4  50.424  -2.423   6.491
   33   HH21  ARG   4          HH21      ARG   4  50.563  -2.728   3.040
   34   HH22  ARG   4          HH22      ARG   4  50.017  -3.447   4.518
   35    H    TRP   5           HN       TRP   5  54.890   4.077   3.848
   36    HA   TRP   5           HA       TRP   5  54.355   5.249   6.291
   37    HB2  TRP   5           HB2      TRP   5  56.592   5.191   5.226
   38    HB3  TRP   5           HB1      TRP   5  56.090   6.496   4.125
   39    HD1  TRP   5           HD1      TRP   5  55.793   6.044   7.981
   40    HE1  TRP   5           HE1      TRP   5  56.643   8.207   9.143
   41    HE3  TRP   5           HE3      TRP   5  57.141   8.715   3.826
   42    HZ2  TRP   5           HZ2      TRP   5  57.757  10.739   8.347
   43    HZ3  TRP   5           HZ3      TRP   5  58.098  11.003   4.053
   44    HH2  TRP   5           HH2      TRP   5  58.406  12.016   6.307
   45    H    LEU   6           HN       LEU   6  53.193   6.347   3.211
   46    HA   LEU   6           HA       LEU   6  52.196   8.918   4.421
   47    HB2  LEU   6           HB2      LEU   6  52.260   8.145   1.482
   48    HB3  LEU   6           HB1      LEU   6  52.002   9.757   2.186
   49    HG   LEU   6           HG       LEU   6  54.572   8.125   2.424
   50   HD11  LEU   6          HD11      LEU   6  55.509   9.733   0.841
   51   HD12  LEU   6          HD12      LEU   6  53.972  10.630   0.792
   52   HD13  LEU   6          HD13      LEU   6  54.064   8.985   0.120
   53   HD21  LEU   6          HD21      LEU   6  53.701  10.869   3.425
   54   HD22  LEU   6          HD22      LEU   6  55.420  10.473   3.175
   55   HD23  LEU   6          HD23      LEU   6  54.455   9.541   4.340
   56    H    GLU   7           HN       GLU   7  51.253   5.786   3.076
   57    HA   GLU   7           HA       GLU   7  48.430   6.656   2.745
   58    HB2  GLU   7           HB2      GLU   7  49.919   4.037   2.353
   59    HB3  GLU   7           HB1      GLU   7  48.148   4.145   2.241
   60    HG2  GLU   7           HG2      GLU   7  49.239   4.372   0.011
   61    HG3  GLU   7           HG1      GLU   7  48.342   5.841   0.465
   62    H    ARG   8           HN       ARG   8  49.741   6.817   5.409
   63    HA   ARG   8           HA       ARG   8  48.438   4.647   6.963
   64    HB2  ARG   8           HB2      ARG   8  49.838   7.117   8.048
   65    HB3  ARG   8           HB1      ARG   8  49.572   5.554   8.855
   66    HG2  ARG   8           HG2      ARG   8  51.373   6.086   6.454
   67    HG3  ARG   8           HG1      ARG   8  51.894   5.680   8.105
   68    HD2  ARG   8           HD2      ARG   8  50.504   3.909   6.070
   69    HD3  ARG   8           HD1      ARG   8  52.017   3.610   6.957
   70    HE   ARG   8           HE       ARG   8  50.071   3.793   8.944
   71   HH11  ARG   8          HH11      ARG   8  49.506   2.380   5.940
   72   HH12  ARG   8          HH12      ARG   8  49.121   0.809   6.561
   73   HH21  ARG   8          HH21      ARG   8  50.022   1.581   9.818
   74   HH22  ARG   8          HH22      ARG   8  49.412   0.358   8.754
   75    H    ILE   9           HN       ILE   9  48.009   8.077   6.185
   76    HA   ILE   9           HA       ILE   9  45.223   7.958   6.987
   77    HB   ILE   9           HB       ILE   9  46.222   8.170   9.243
   78   HG12  ILE   9          HG12      ILE   9  45.052  10.119  10.044
   79   HG13  ILE   9          HG11      ILE   9  45.138  10.918   8.465
   80   HG21  ILE   9          HG21      ILE   9  47.491  10.728   8.183
   81   HG22  ILE   9          HG22      ILE   9  48.359   9.195   8.445
   82   HG23  ILE   9          HG23      ILE   9  47.644  10.063   9.827
   83   HD11  ILE   9           HD1      ILE   9  42.890   9.781   9.160
   84   HD12  ILE   9           HD2      ILE   9  43.718   8.250   8.792
   85   HD13  ILE   9           HD3      ILE   9  43.500   9.475   7.520
   86    H    GLY  10           HN       GLY  10  47.830   9.150   5.320
   87    HA2  GLY  10           HA1      GLY  10  47.628  11.808   4.817
   88    HA3  GLY  10           HA2      GLY  10  47.806  10.628   3.505
   89    H    LYS  11           HN       LYS  11  45.103   9.469   4.113
   90    HA   LYS  11           HA       LYS  11  43.591  10.923   2.215
   91    HB2  LYS  11           HB2      LYS  11  42.618   9.191   4.525
   92    HB3  LYS  11           HB1      LYS  11  41.627   9.701   3.136
   93    HG2  LYS  11           HG2      LYS  11  43.301   8.602   1.610
   94    HG3  LYS  11           HG1      LYS  11  44.145   7.982   3.050
   95    HD2  LYS  11           HD2      LYS  11  42.171   6.736   3.743
   96    HD3  LYS  11           HD1      LYS  11  41.204   7.461   2.435
   97    HE2  LYS  11           HE2      LYS  11  41.923   5.201   1.785
   98    HE3  LYS  11           HE1      LYS  11  42.728   6.412   0.759
   99    HZ1  LYS  11           HZ1      LYS  11  44.696   5.738   1.489
  100    HZ2  LYS  11           HZ2      LYS  11  43.932   4.462   2.311
  101    HZ3  LYS  11           HZ3      LYS  11  44.241   5.928   3.112
  102    H    ALA  12           HN       ALA  12  43.180  13.050   2.375
  103    HA   ALA  12           HA       ALA  12  42.849  14.395   4.906
  104    HB1  ALA  12           HB1      ALA  12  41.898  15.333   2.182
  105    HB2  ALA  12           HB2      ALA  12  43.590  15.430   2.727
  106    HB3  ALA  12           HB3      ALA  12  42.323  16.333   3.592
  107    H    GLY  13           HN       GLY  13  40.909  12.130   3.605
  108    HA2  GLY  13           HA1      GLY  13  38.644  11.652   3.720
  109    HA3  GLY  13           HA2      GLY  13  38.738  12.476   5.289
  110    H    PHE  14           HN       PHE  14  39.566  14.451   2.634
  111    HA   PHE  14           HA       PHE  14  36.764  15.480   2.322
  112    HB2  PHE  14           HB2      PHE  14  37.942  16.833   4.084
  113    HB3  PHE  14           HB1      PHE  14  39.189  17.241   2.880
  114    HD1  PHE  14           HD1      PHE  14  38.811  18.971   1.268
  115    HD2  PHE  14           HD2      PHE  14  35.511  17.440   3.593
  116    HE1  PHE  14           HE1      PHE  14  37.351  20.790   0.393
  117    HE2  PHE  14           HE2      PHE  14  34.051  19.260   2.717
  118    HZ   PHE  14           HZ       PHE  14  34.962  20.914   1.091
  119    H    ILE  15           HN       ILE  15  39.620  14.361   1.071
  120    HA   ILE  15           HA       ILE  15  38.916  15.349  -1.641
  121    HB   ILE  15           HB       ILE  15  41.836  15.467  -0.787
  122   HG12  ILE  15          HG12      ILE  15  39.751  17.679  -0.493
  123   HG13  ILE  15          HG11      ILE  15  40.677  16.911   0.817
  124   HG21  ILE  15          HG21      ILE  15  40.334  17.161  -2.825
  125   HG22  ILE  15          HG22      ILE  15  40.976  15.555  -3.232
  126   HG23  ILE  15          HG23      ILE  15  42.082  16.847  -2.719
  127   HD11  ILE  15           HD1      ILE  15  41.837  18.942   0.387
  128   HD12  ILE  15           HD2      ILE  15  41.683  18.756  -1.376
  129   HD13  ILE  15           HD3      ILE  15  42.793  17.704  -0.463
  130    H    ILE  16           HN       ILE  16  41.797  14.286  -2.269
  131    HA   ILE  16           HA       ILE  16  42.452  12.266  -3.254
  132    HB   ILE  16           HB       ILE  16  41.684  11.356  -0.454
  133   HG12  ILE  16          HG12      ILE  16  43.233  13.233  -0.372
  134   HG13  ILE  16          HG11      ILE  16  44.105  11.750   0.058
  135   HG21  ILE  16          HG21      ILE  16  43.155   9.998  -2.723
  136   HG22  ILE  16          HG22      ILE  16  42.058   9.309  -1.508
  137   HG23  ILE  16          HG23      ILE  16  43.730   9.711  -1.063
  138   HD11  ILE  16           HD1      ILE  16  44.314  13.432  -2.454
  139   HD12  ILE  16           HD2      ILE  16  44.713  11.701  -2.529
  140   HD13  ILE  16           HD3      ILE  16  45.608  12.770  -1.431
  141    H    ILE  17           HN       ILE  17  40.191  10.606  -1.077
  142    HA   ILE  17           HA       ILE  17  39.242   8.863  -3.080
  143    HB   ILE  17           HB       ILE  17  37.261   8.488  -1.503
  144   HG12  ILE  17          HG12      ILE  17  37.568   9.538   0.788
  145   HG13  ILE  17          HG11      ILE  17  38.777  10.629   0.075
  146   HG21  ILE  17          HG21      ILE  17  40.091   8.441  -0.365
  147   HG22  ILE  17          HG22      ILE  17  39.332   7.173  -1.358
  148   HG23  ILE  17          HG23      ILE  17  38.711   7.517   0.275
  149   HD11  ILE  17           HD1      ILE  17  36.038  10.465  -1.218
  150   HD12  ILE  17           HD2      ILE  17  37.171  11.834  -1.138
  151   HD13  ILE  17           HD3      ILE  17  36.221  11.383   0.292
  152    H    GLY  18           HN       GLY  18  38.764  12.153  -3.069
  153    HA2  GLY  18           HA1      GLY  18  36.247  11.855  -4.694
  154    HA3  GLY  18           HA2      GLY  18  36.426  13.141  -3.485
  155    H    GLY  19           HN       GLY  19  38.399  14.568  -3.763
  156    HA2  GLY  19           HA1      GLY  19  38.245  15.915  -6.205
  157    HA3  GLY  19           HA2      GLY  19  39.619  16.019  -5.093
  158    H    ALA  20           HN       ALA  20  40.100  13.032  -5.439
  159    HA   ALA  20           HA       ALA  20  42.150  13.172  -7.353
  160    HB1  ALA  20           HB1      ALA  20  40.466  10.796  -6.496
  161    HB2  ALA  20           HB2      ALA  20  42.025  11.323  -5.814
  162    HB3  ALA  20           HB3      ALA  20  41.951  10.671  -7.468
  163    H    LEU  21           HN       LEU  21  38.797  13.291  -7.894
  164    HA   LEU  21           HA       LEU  21  38.299  11.902 -10.234
  165    HB2  LEU  21           HB2      LEU  21  36.594  13.250  -9.158
  166    HB3  LEU  21           HB1      LEU  21  37.498  14.743  -9.488
  167    HG   LEU  21           HG       LEU  21  37.133  14.503 -11.891
  168   HD11  LEU  21          HD11      LEU  21  37.248  12.165 -12.316
  169   HD12  LEU  21          HD12      LEU  21  35.545  12.564 -12.620
  170   HD13  LEU  21          HD13      LEU  21  36.016  11.788 -11.089
  171   HD21  LEU  21          HD21      LEU  21  34.729  14.810 -11.950
  172   HD22  LEU  21          HD22      LEU  21  35.320  15.471 -10.407
  173   HD23  LEU  21          HD23      LEU  21  34.522  13.880 -10.446
  174    H    ASP  22           HN       ASP  22  39.194  11.780 -12.182
  175    HA   ASP  22           HA       ASP  22  40.527  12.294 -14.003
  176    HB2  ASP  22           HB2      ASP  22  39.531  15.087 -13.324
  177    HB3  ASP  22           HB1      ASP  22  40.453  14.691 -14.793
  178    H    HIS  23           HN       HIS  23  41.141  15.371 -12.303
  179    HA   HIS  23           HA       HIS  23  43.726  14.479 -11.278
  180    HB2  HIS  23           HB2      HIS  23  44.200  14.728 -13.734
  181    HB3  HIS  23           HB1      HIS  23  43.745  16.443 -13.602
  182    HD1  HIS  23           HD1      HIS  23  45.716  17.929 -13.311
  183    HD2  HIS  23           HD2      HIS  23  46.269  14.208 -11.432
  184    HE1  HIS  23           HE1      HIS  23  48.043  17.947 -12.254
  185    H    LEU  24           HN       LEU  24  41.499  15.615 -10.058
  186    HA   LEU  24           HA       LEU  24  42.468  18.406  -9.416
  187    HB2  LEU  24           HB2      LEU  24  39.649  17.334  -9.030
  188    HB3  LEU  24           HB1      LEU  24  40.207  19.021  -8.923
  189    HG   LEU  24           HG       LEU  24  40.246  17.315 -11.456
  190   HD11  LEU  24          HD11      LEU  24  37.954  17.889 -10.727
  191   HD12  LEU  24          HD12      LEU  24  38.402  18.806 -12.185
  192   HD13  LEU  24          HD13      LEU  24  38.419  19.601 -10.593
  193   HD21  LEU  24          HD21      LEU  24  40.601  19.683 -12.470
  194   HD22  LEU  24          HD22      LEU  24  41.989  18.938 -11.650
  195   HD23  LEU  24          HD23      LEU  24  41.034  20.190 -10.819
  Start of MODEL   98
    1    H1   GLY   1           HT1      GLY   1  55.607   6.926  -3.086
    2    H2   GLY   1           HT2      GLY   1  56.858   6.842  -4.231
    3    H3   GLY   1           HT3      GLY   1  57.215   7.142  -2.597
    4    HA2  GLY   1           HA1      GLY   1  56.583   4.676  -3.963
    5    HA3  GLY   1           HA2      GLY   1  57.704   4.989  -2.623
    6    H    LYS   2           HN       LYS   2  56.010   2.785  -2.635
    7    HA   LYS   2           HA       LYS   2  53.536   3.269  -1.247
    8    HB2  LYS   2           HB2      LYS   2  53.652   0.846  -0.699
    9    HB3  LYS   2           HB1      LYS   2  53.977   1.164  -2.419
   10    HG2  LYS   2           HG2      LYS   2  56.438   1.107  -1.919
   11    HG3  LYS   2           HG1      LYS   2  56.052   0.654  -0.241
   12    HD2  LYS   2           HD2      LYS   2  54.775  -1.330  -1.143
   13    HD3  LYS   2           HD1      LYS   2  55.377  -0.915  -2.767
   14    HE2  LYS   2           HE2      LYS   2  57.051  -1.643  -0.326
   15    HE3  LYS   2           HE1      LYS   2  56.851  -2.603  -1.812
   16    HZ1  LYS   2           HZ1      LYS   2  58.898  -1.422  -1.955
   17    HZ2  LYS   2           HZ2      LYS   2  58.165   0.053  -1.544
   18    HZ3  LYS   2           HZ3      LYS   2  57.819  -0.684  -3.035
   19    H    GLY   3           HN       GLY   3  53.489   1.675   0.959
   20    HA2  GLY   3           HA1      GLY   3  54.615   1.409   3.160
   21    HA3  GLY   3           HA2      GLY   3  55.499   2.979   2.886
   22    H    ARG   4           HN       ARG   4  54.532   4.487   2.038
   23    HA   ARG   4           HA       ARG   4  54.425   5.135   4.372
   24    HB2  ARG   4           HB2      ARG   4  53.438   7.003   2.161
   25    HB3  ARG   4           HB1      ARG   4  53.968   7.539   3.776
   26    HG2  ARG   4           HG2      ARG   4  56.184   6.521   3.413
   27    HG3  ARG   4           HG1      ARG   4  55.664   5.924   1.817
   28    HD2  ARG   4           HD2      ARG   4  55.863   8.846   2.672
   29    HD3  ARG   4           HD1      ARG   4  56.953   8.000   1.548
   30    HE   ARG   4           HE       ARG   4  54.246   7.773   0.612
   31   HH11  ARG   4          HH11      ARG   4  56.594   8.539  -1.089
   32   HH12  ARG   4          HH12      ARG   4  56.233  10.186  -1.484
   33   HH21  ARG   4          HH21      ARG   4  53.866  10.546   1.025
   34   HH22  ARG   4          HH22      ARG   4  54.689  11.323  -0.285
   35    H    TRP   5           HN       TRP   5  51.968   3.956   2.739
   36    HA   TRP   5           HA       TRP   5  49.515   5.139   3.218
   37    HB2  TRP   5           HB2      TRP   5  49.869   2.867   2.230
   38    HB3  TRP   5           HB1      TRP   5  50.116   2.231   3.875
   39    HD1  TRP   5           HD1      TRP   5  48.018   2.050   5.457
   40    HE1  TRP   5           HE1      TRP   5  45.451   2.140   5.050
   41    HE3  TRP   5           HE3      TRP   5  48.020   4.010   0.728
   42    HZ2  TRP   5           HZ2      TRP   5  43.670   2.959   2.941
   43    HZ3  TRP   5           HZ3      TRP   5  45.875   4.436  -0.464
   44    HH2  TRP   5           HH2      TRP   5  43.702   3.913   0.636
   45    H    LEU   6           HN       LEU   6  51.774   4.066   5.621
   46    HA   LEU   6           HA       LEU   6  49.753   4.458   7.810
   47    HB2  LEU   6           HB2      LEU   6  51.096   2.276   7.614
   48    HB3  LEU   6           HB1      LEU   6  52.525   3.240   8.038
   49    HG   LEU   6           HG       LEU   6  51.044   4.063  10.081
   50   HD11  LEU   6          HD11      LEU   6  48.912   3.066   9.459
   51   HD12  LEU   6          HD12      LEU   6  49.526   2.199  10.880
   52   HD13  LEU   6          HD13      LEU   6  49.661   1.464   9.268
   53   HD21  LEU   6          HD21      LEU   6  53.091   2.712  10.308
   54   HD22  LEU   6          HD22      LEU   6  52.175   1.234   9.923
   55   HD23  LEU   6          HD23      LEU   6  51.838   2.125  11.427
   56    H    GLU   7           HN       GLU   7  52.748   5.681   6.358
   57    HA   GLU   7           HA       GLU   7  53.275   7.422   8.718
   58    HB2  GLU   7           HB2      GLU   7  55.071   6.262   7.268
   59    HB3  GLU   7           HB1      GLU   7  54.690   7.474   6.026
   60    HG2  GLU   7           HG2      GLU   7  55.283   9.294   7.539
   61    HG3  GLU   7           HG1      GLU   7  55.498   8.156   8.890
   62    H    ARG   8           HN       ARG   8  51.185   7.415   6.140
   63    HA   ARG   8           HA       ARG   8  51.416  10.273   5.431
   64    HB2  ARG   8           HB2      ARG   8  50.700   8.494   3.802
   65    HB3  ARG   8           HB1      ARG   8  49.215   8.281   4.760
   66    HG2  ARG   8           HG2      ARG   8  48.544  10.578   4.358
   67    HG3  ARG   8           HG1      ARG   8  50.102  10.949   3.583
   68    HD2  ARG   8           HD2      ARG   8  48.190   8.820   2.542
   69    HD3  ARG   8           HD1      ARG   8  48.179  10.505   1.972
   70    HE   ARG   8           HE       ARG   8  50.848   9.553   1.766
   71   HH11  ARG   8          HH11      ARG   8  50.998   7.452   0.417
   72   HH12  ARG   8          HH12      ARG   8  50.135   7.554  -1.082
   73   HH21  ARG   8          HH21      ARG   8  48.308  10.349  -0.144
   74   HH22  ARG   8          HH22      ARG   8  48.612   9.195  -1.399
   75    H    ILE   9           HN       ILE   9  49.806  11.850   5.813
   76    HA   ILE   9           HA       ILE   9  48.851  11.962   8.475
   77    HB   ILE   9           HB       ILE   9  47.319  13.806   7.598
   78   HG12  ILE   9          HG12      ILE   9  48.697  13.110   4.960
   79   HG13  ILE   9          HG11      ILE   9  47.004  12.731   5.339
   80   HG21  ILE   9          HG21      ILE   9  50.187  13.996   6.580
   81   HG22  ILE   9          HG22      ILE   9  49.754  14.113   8.302
   82   HG23  ILE   9          HG23      ILE   9  49.146  15.322   7.150
   83   HD11  ILE   9           HD1      ILE   9  46.868  14.774   4.145
   84   HD12  ILE   9           HD2      ILE   9  48.296  15.451   4.959
   85   HD13  ILE   9           HD3      ILE   9  46.762  15.284   5.846
   86    H    GLY  10           HN       GLY  10  47.738  10.029   5.936
   87    HA2  GLY  10           HA1      GLY  10  45.763   8.857   5.585
   88    HA3  GLY  10           HA2      GLY  10  45.753   8.716   7.353
   89    H    LYS  11           HN       LYS  11  45.500  11.783   5.644
   90    HA   LYS  11           HA       LYS  11  42.552  11.867   5.961
   91    HB2  LYS  11           HB2      LYS  11  44.458  13.667   7.513
   92    HB3  LYS  11           HB1      LYS  11  42.743  14.056   7.245
   93    HG2  LYS  11           HG2      LYS  11  42.166  11.806   8.284
   94    HG3  LYS  11           HG1      LYS  11  43.883  11.652   8.730
   95    HD2  LYS  11           HD2      LYS  11  43.759  13.756  10.011
   96    HD3  LYS  11           HD1      LYS  11  42.052  13.952   9.543
   97    HE2  LYS  11           HE2      LYS  11  43.179  11.597  11.121
   98    HE3  LYS  11           HE1      LYS  11  42.284  12.967  11.821
   99    HZ1  LYS  11           HZ1      LYS  11  40.636  12.201   9.856
  100    HZ2  LYS  11           HZ2      LYS  11  40.526  11.640  11.456
  101    HZ3  LYS  11           HZ3      LYS  11  41.316  10.705  10.277
  102    H    ALA  12           HN       ALA  12  43.173  11.838   3.580
  103    HA   ALA  12           HA       ALA  12  44.332  14.306   2.506
  104    HB1  ALA  12           HB1      ALA  12  44.663  12.264   1.281
  105    HB2  ALA  12           HB2      ALA  12  43.592  13.306   0.314
  106    HB3  ALA  12           HB3      ALA  12  42.914  11.943   1.237
  107    H    GLY  13           HN       GLY  13  42.336  15.110   4.176
  108    HA2  GLY  13           HA1      GLY  13  40.343  16.292   4.263
  109    HA3  GLY  13           HA2      GLY  13  40.818  16.869   2.652
  110    H    PHE  14           HN       PHE  14  39.974  13.560   3.650
  111    HA   PHE  14           HA       PHE  14  38.221  12.192   3.035
  112    HB2  PHE  14           HB2      PHE  14  36.865  14.352   3.641
  113    HB3  PHE  14           HB1      PHE  14  36.693  14.553   1.883
  114    HD1  PHE  14           HD1      PHE  14  35.044  13.318   0.692
  115    HD2  PHE  14           HD2      PHE  14  36.192  12.070   4.662
  116    HE1  PHE  14           HE1      PHE  14  33.207  11.633   0.695
  117    HE2  PHE  14           HE2      PHE  14  34.358  10.384   4.662
  118    HZ   PHE  14           HZ       PHE  14  32.900  10.131   2.658
  119    H    ILE  15           HN       ILE  15  40.286  12.083   1.436
  120    HA   ILE  15           HA       ILE  15  40.954  11.480  -0.675
  121    HB   ILE  15           HB       ILE  15  38.015  11.408  -1.460
  122   HG12  ILE  15          HG12      ILE  15  38.129  10.162   0.589
  123   HG13  ILE  15          HG11      ILE  15  38.138   8.962  -0.717
  124   HG21  ILE  15          HG21      ILE  15  38.991   9.385  -2.831
  125   HG22  ILE  15          HG22      ILE  15  40.563  10.161  -2.545
  126   HG23  ILE  15          HG23      ILE  15  39.283  11.040  -3.403
  127   HD11  ILE  15           HD1      ILE  15  39.837   8.250   0.797
  128   HD12  ILE  15           HD2      ILE  15  40.465   9.900   1.001
  129   HD13  ILE  15           HD3      ILE  15  40.723   9.031  -0.529
  130    H    ILE  16           HN       ILE  16  41.774  13.650  -0.735
  131    HA   ILE  16           HA       ILE  16  40.644  15.123  -3.090
  132    HB   ILE  16           HB       ILE  16  41.696  16.427  -0.548
  133   HG12  ILE  16          HG12      ILE  16  39.340  15.369  -0.392
  134   HG13  ILE  16          HG11      ILE  16  39.491  17.080   0.037
  135   HG21  ILE  16          HG21      ILE  16  40.784  18.517  -1.713
  136   HG22  ILE  16          HG22      ILE  16  40.616  17.517  -3.177
  137   HG23  ILE  16          HG23      ILE  16  42.220  17.782  -2.461
  138   HD11  ILE  16           HD1      ILE  16  38.639  16.148  -2.740
  139   HD12  ILE  16           HD2      ILE  16  38.544  17.787  -2.063
  140   HD13  ILE  16           HD3      ILE  16  37.493  16.501  -1.433
  141    H    ILE  17           HN       ILE  17  43.326  14.895  -0.717
  142    HA   ILE  17           HA       ILE  17  45.289  15.869  -2.649
  143    HB   ILE  17           HB       ILE  17  45.823  14.291  -0.092
  144   HG12  ILE  17          HG12      ILE  17  44.396  16.085   0.604
  145   HG13  ILE  17          HG11      ILE  17  46.046  16.617   0.973
  146   HG21  ILE  17          HG21      ILE  17  47.474  16.123  -1.872
  147   HG22  ILE  17          HG22      ILE  17  47.843  14.487  -1.297
  148   HG23  ILE  17          HG23      ILE  17  47.914  15.857  -0.170
  149   HD11  ILE  17           HD1      ILE  17  46.001  17.814  -1.317
  150   HD12  ILE  17           HD2      ILE  17  44.974  18.497  -0.041
  151   HD13  ILE  17           HD3      ILE  17  44.254  17.495  -1.320
  152    H    GLY  18           HN       GLY  18  44.505  12.707  -1.159
  153    HA2  GLY  18           HA1      GLY  18  46.402  11.256  -2.791
  154    HA3  GLY  18           HA2      GLY  18  45.094  10.562  -1.809
  155    H    GLY  19           HN       GLY  19  42.818  11.563  -2.845
  156    HA2  GLY  19           HA1      GLY  19  42.492  10.001  -5.223
  157    HA3  GLY  19           HA2      GLY  19  41.329  11.175  -4.574
  158    H    ALA  20           HN       ALA  20  42.857  13.515  -4.687
  159    HA   ALA  20           HA       ALA  20  43.529  15.176  -6.148
  160    HB1  ALA  20           HB1      ALA  20  44.901  14.665  -7.977
  161    HB2  ALA  20           HB2      ALA  20  44.047  13.146  -8.330
  162    HB3  ALA  20           HB3      ALA  20  45.119  13.256  -6.915
  163    H    LEU  21           HN       LEU  21  41.059  12.924  -6.856
  164    HA   LEU  21           HA       LEU  21  39.091  13.132  -8.046
  165    HB2  LEU  21           HB2      LEU  21  39.267  15.445  -6.805
  166    HB3  LEU  21           HB1      LEU  21  39.651  16.092  -8.413
  167    HG   LEU  21           HG       LEU  21  37.468  14.722  -9.150
  168   HD11  LEU  21          HD11      LEU  21  37.001  15.213  -6.172
  169   HD12  LEU  21          HD12      LEU  21  37.071  13.628  -6.979
  170   HD13  LEU  21          HD13      LEU  21  35.745  14.754  -7.343
  171   HD21  LEU  21          HD21      LEU  21  37.322  17.318  -7.550
  172   HD22  LEU  21          HD22      LEU  21  36.097  16.739  -8.704
  173   HD23  LEU  21          HD23      LEU  21  37.721  17.183  -9.279
  174    H    ASP  22           HN       ASP  22  42.070  13.523  -9.341
  175    HA   ASP  22           HA       ASP  22  41.379  14.480 -12.006
  176    HB2  ASP  22           HB2      ASP  22  43.783  12.907 -10.992
  177    HB3  ASP  22           HB1      ASP  22  43.649  13.663 -12.599
  178    H    HIS  23           HN       HIS  23  39.543  13.194 -12.539
  179    HA   HIS  23           HA       HIS  23  38.501  11.385 -13.538
  180    HB2  HIS  23           HB2      HIS  23  41.346  10.626 -14.321
  181    HB3  HIS  23           HB1      HIS  23  39.852   9.999 -15.057
  182    HD1  HIS  23           HD1      HIS  23  42.273  12.002 -16.244
  183    HD2  HIS  23           HD2      HIS  23  38.235  12.856 -15.434
  184    HE1  HIS  23           HE1      HIS  23  41.638  14.057 -17.622
  185    H    LEU  24           HN       LEU  24  40.246  11.134 -10.825
  186    HA   LEU  24           HA       LEU  24  39.528   8.231 -10.458
  187    HB2  LEU  24           HB2      LEU  24  42.036   9.614  -9.421
  188    HB3  LEU  24           HB1      LEU  24  41.559   7.935  -9.097
  189    HG   LEU  24           HG       LEU  24  41.980   9.003 -11.921
  190   HD11  LEU  24          HD11      LEU  24  43.980   7.586 -10.108
  191   HD12  LEU  24          HD12      LEU  24  44.073   9.283 -10.636
  192   HD13  LEU  24          HD13      LEU  24  44.231   7.971 -11.827
  193   HD21  LEU  24          HD21      LEU  24  40.748   6.945 -11.960
  194   HD22  LEU  24          HD22      LEU  24  41.744   6.232 -10.670
  195   HD23  LEU  24          HD23      LEU  24  42.432   6.486 -12.290
  Start of MODEL   99
    1    H1   GLY   1           HT1      GLY   1  61.429   0.970   7.075
    2    H2   GLY   1           HT2      GLY   1  60.118   0.334   6.201
    3    H3   GLY   1           HT3      GLY   1  60.176   0.173   7.892
    4    HA2  GLY   1           HA1      GLY   1  59.480   2.219   8.288
    5    HA3  GLY   1           HA2      GLY   1  60.333   2.860   6.870
    6    H    LYS   2           HN       LYS   2  58.825   0.225   5.694
    7    HA   LYS   2           HA       LYS   2  56.932   1.664   4.159
    8    HB2  LYS   2           HB2      LYS   2  55.879  -0.631   3.800
    9    HB3  LYS   2           HB1      LYS   2  57.618  -0.519   3.437
   10    HG2  LYS   2           HG2      LYS   2  58.200  -1.520   5.568
   11    HG3  LYS   2           HG1      LYS   2  56.507  -1.457   6.115
   12    HD2  LYS   2           HD2      LYS   2  55.841  -3.044   4.374
   13    HD3  LYS   2           HD1      LYS   2  57.490  -3.044   3.703
   14    HE2  LYS   2           HE2      LYS   2  57.191  -5.025   5.114
   15    HE3  LYS   2           HE1      LYS   2  58.340  -3.913   5.894
   16    HZ1  LYS   2           HZ1      LYS   2  56.984  -3.689   7.621
   17    HZ2  LYS   2           HZ2      LYS   2  56.019  -4.934   6.980
   18    HZ3  LYS   2           HZ3      LYS   2  55.657  -3.309   6.634
   19    H    GLY   3           HN       GLY   3  54.509   1.160   4.160
   20    HA2  GLY   3           HA1      GLY   3  52.528   0.659   5.634
   21    HA3  GLY   3           HA2      GLY   3  53.440   1.390   7.034
   22    H    ARG   4           HN       ARG   4  54.602   2.974   6.671
   23    HA   ARG   4           HA       ARG   4  52.654   4.034   7.650
   24    HB2  ARG   4           HB2      ARG   4  55.192   5.607   6.995
   25    HB3  ARG   4           HB1      ARG   4  53.968   6.135   8.179
   26    HG2  ARG   4           HG2      ARG   4  54.270   4.041   9.451
   27    HG3  ARG   4           HG1      ARG   4  55.458   3.470   8.255
   28    HD2  ARG   4           HD2      ARG   4  56.736   4.377  10.073
   29    HD3  ARG   4           HD1      ARG   4  56.803   5.593   8.774
   30    HE   ARG   4           HE       ARG   4  54.575   6.201  10.450
   31   HH11  ARG   4          HH11      ARG   4  55.359   6.407  12.852
   32   HH12  ARG   4          HH12      ARG   4  56.697   7.495  13.007
   33   HH21  ARG   4          HH21      ARG   4  57.456   7.462   9.623
   34   HH22  ARG   4          HH22      ARG   4  57.884   8.094  11.177
   35    H    TRP   5           HN       TRP   5  53.349   4.095   4.544
   36    HA   TRP   5           HA       TRP   5  52.846   6.537   3.294
   37    HB2  TRP   5           HB2      TRP   5  51.651   3.826   2.606
   38    HB3  TRP   5           HB1      TRP   5  51.624   5.235   1.518
   39    HD1  TRP   5           HD1      TRP   5  54.318   6.398   1.421
   40    HE1  TRP   5           HE1      TRP   5  56.489   5.117   0.781
   41    HE3  TRP   5           HE3      TRP   5  52.757   1.624   2.412
   42    HZ2  TRP   5           HZ2      TRP   5  57.391   2.382   0.718
   43    HZ3  TRP   5           HZ3      TRP   5  54.289  -0.305   2.053
   44    HH2  TRP   5           HH2      TRP   5  56.603   0.068   1.209
   45    H    LEU   6           HN       LEU   6  50.728   4.773   5.373
   46    HA   LEU   6           HA       LEU   6  48.391   6.504   4.622
   47    HB2  LEU   6           HB2      LEU   6  47.935   4.107   4.509
   48    HB3  LEU   6           HB1      LEU   6  48.579   3.872   6.148
   49    HG   LEU   6           HG       LEU   6  46.755   5.219   7.101
   50   HD11  LEU   6          HD11      LEU   6  44.837   5.830   5.415
   51   HD12  LEU   6          HD12      LEU   6  46.104   5.714   4.171
   52   HD13  LEU   6          HD13      LEU   6  46.258   6.894   5.497
   53   HD21  LEU   6          HD21      LEU   6  44.865   3.726   6.520
   54   HD22  LEU   6          HD22      LEU   6  46.376   2.805   6.713
   55   HD23  LEU   6          HD23      LEU   6  45.752   3.162   5.084
   56    H    GLU   7           HN       GLU   7  50.748   5.716   7.145
   57    HA   GLU   7           HA       GLU   7  49.172   7.197   9.200
   58    HB2  GLU   7           HB2      GLU   7  51.926   5.905   9.324
   59    HB3  GLU   7           HB1      GLU   7  51.025   6.581  10.701
   60    HG2  GLU   7           HG2      GLU   7  49.152   4.968  10.171
   61    HG3  GLU   7           HG1      GLU   7  50.210   4.223   8.947
   62    H    ARG   8           HN       ARG   8  49.989   8.632   6.823
   63    HA   ARG   8           HA       ARG   8  51.550  10.790   8.171
   64    HB2  ARG   8           HB2      ARG   8  53.165   9.318   6.873
   65    HB3  ARG   8           HB1      ARG   8  52.283   9.779   5.396
   66    HG2  ARG   8           HG2      ARG   8  52.769  12.145   5.789
   67    HG3  ARG   8           HG1      ARG   8  53.549  11.758   7.342
   68    HD2  ARG   8           HD2      ARG   8  55.134  12.108   5.360
   69    HD3  ARG   8           HD1      ARG   8  55.341  10.586   6.258
   70    HE   ARG   8           HE       ARG   8  53.505  10.253   4.040
   71   HH11  ARG   8          HH11      ARG   8  54.322   8.456   2.813
   72   HH12  ARG   8          HH12      ARG   8  56.003   8.466   2.395
   73   HH21  ARG   8          HH21      ARG   8  56.760  11.176   4.421
   74   HH22  ARG   8          HH22      ARG   8  57.383  10.007   3.307
   75    H    ILE   9           HN       ILE   9  49.636   9.608   5.421
   76    HA   ILE   9           HA       ILE   9  48.237  12.226   5.317
   77    HB   ILE   9           HB       ILE   9  48.488  12.123   2.705
   78   HG12  ILE   9          HG12      ILE   9  51.155  10.800   3.376
   79   HG13  ILE   9          HG11      ILE   9  49.737   9.794   3.017
   80   HG21  ILE   9          HG21      ILE   9  49.439  13.902   4.175
   81   HG22  ILE   9          HG22      ILE   9  50.509  13.532   2.805
   82   HG23  ILE   9          HG23      ILE   9  50.890  12.904   4.424
   83   HD11  ILE   9           HD1      ILE   9  49.457  11.061   0.849
   84   HD12  ILE   9           HD2      ILE   9  50.973  10.139   0.954
   85   HD13  ILE   9           HD3      ILE   9  50.988  11.899   1.197
   86    H    GLY  10           HN       GLY  10  48.064  10.276   2.490
   87    HA2  GLY  10           HA1      GLY  10  46.431   8.838   1.704
   88    HA3  GLY  10           HA2      GLY  10  46.178   8.311   3.380
   89    H    LYS  11           HN       LYS  11  44.065   8.330   3.716
   90    HA   LYS  11           HA       LYS  11  41.974   9.227   4.120
   91    HB2  LYS  11           HB2      LYS  11  43.400  11.324   4.762
   92    HB3  LYS  11           HB1      LYS  11  42.880  11.972   3.190
   93    HG2  LYS  11           HG2      LYS  11  40.492  11.525   3.858
   94    HG3  LYS  11           HG1      LYS  11  41.078  11.056   5.472
   95    HD2  LYS  11           HD2      LYS  11  42.164  13.309   5.684
   96    HD3  LYS  11           HD1      LYS  11  41.434  13.770   4.127
   97    HE2  LYS  11           HE2      LYS  11  40.054  14.555   6.036
   98    HE3  LYS  11           HE1      LYS  11  39.177  13.358   5.052
   99    HZ1  LYS  11           HZ1      LYS  11  40.748  12.606   7.456
  100    HZ2  LYS  11           HZ2      LYS  11  39.585  11.684   6.630
  101    HZ3  LYS  11           HZ3      LYS  11  39.110  13.037   7.542
  102    H    ALA  12           HN       ALA  12  43.627  10.210   1.132
  103    HA   ALA  12           HA       ALA  12  41.385   9.245  -0.454
  104    HB1  ALA  12           HB1      ALA  12  41.131  11.530  -1.613
  105    HB2  ALA  12           HB2      ALA  12  41.921  12.215  -0.175
  106    HB3  ALA  12           HB3      ALA  12  40.375  11.351  -0.013
  107    H    GLY  13           HN       GLY  13  44.479   9.373   0.126
  108    HA2  GLY  13           HA1      GLY  13  46.358   8.992  -1.171
  109    HA3  GLY  13           HA2      GLY  13  45.276   8.722  -2.553
  110    H    PHE  14           HN       PHE  14  46.463  11.395  -0.473
  111    HA   PHE  14           HA       PHE  14  47.117  13.545  -1.021
  112    HB2  PHE  14           HB2      PHE  14  48.817  12.297  -2.366
  113    HB3  PHE  14           HB1      PHE  14  47.719  12.369  -3.765
  114    HD1  PHE  14           HD1      PHE  14  49.328  14.593  -1.181
  115    HD2  PHE  14           HD2      PHE  14  47.829  14.242  -5.216
  116    HE1  PHE  14           HE1      PHE  14  50.154  16.888  -1.691
  117    HE2  PHE  14           HE2      PHE  14  48.654  16.536  -5.722
  118    HZ   PHE  14           HZ       PHE  14  49.761  17.883  -3.941
  119    H    ILE  15           HN       ILE  15  44.341  12.711  -1.384
  120    HA   ILE  15           HA       ILE  15  42.390  13.595  -2.204
  121    HB   ILE  15           HB       ILE  15  44.004  15.931  -3.305
  122   HG12  ILE  15          HG12      ILE  15  43.029  15.428  -0.454
  123   HG13  ILE  15          HG11      ILE  15  44.723  15.546  -0.984
  124   HG21  ILE  15          HG21      ILE  15  41.968  17.168  -3.037
  125   HG22  ILE  15          HG22      ILE  15  41.228  15.881  -2.053
  126   HG23  ILE  15          HG23      ILE  15  41.500  15.631  -3.793
  127   HD11  ILE  15           HD1      ILE  15  44.248  17.700  -0.111
  128   HD12  ILE  15           HD2      ILE  15  42.627  17.737  -0.843
  129   HD13  ILE  15           HD3      ILE  15  44.072  17.910  -1.871
  130    H    ILE  16           HN       ILE  16  42.934  11.667  -3.603
  131    HA   ILE  16           HA       ILE  16  42.720  12.542  -6.480
  132    HB   ILE  16           HB       ILE  16  44.205  10.144  -5.340
  133   HG12  ILE  16          HG12      ILE  16  45.293  12.522  -5.238
  134   HG13  ILE  16          HG11      ILE  16  46.244  11.190  -5.917
  135   HG21  ILE  16          HG21      ILE  16  44.889   9.825  -7.784
  136   HG22  ILE  16          HG22      ILE  16  43.629  11.009  -8.206
  137   HG23  ILE  16          HG23      ILE  16  43.185   9.479  -7.422
  138   HD11  ILE  16           HD1      ILE  16  46.312  13.374  -7.233
  139   HD12  ILE  16           HD2      ILE  16  44.611  13.096  -7.652
  140   HD13  ILE  16           HD3      ILE  16  45.853  11.940  -8.174
  141    H    ILE  17           HN       ILE  17  42.287   9.798  -4.184
  142    HA   ILE  17           HA       ILE  17  40.218   8.566  -5.817
  143    HB   ILE  17           HB       ILE  17  40.681   8.242  -2.816
  144   HG12  ILE  17          HG12      ILE  17  42.804   7.803  -3.849
  145   HG13  ILE  17          HG11      ILE  17  42.077   6.219  -3.529
  146   HG21  ILE  17          HG21      ILE  17  39.158   6.669  -4.923
  147   HG22  ILE  17          HG22      ILE  17  38.633   7.196  -3.312
  148   HG23  ILE  17          HG23      ILE  17  39.785   5.854  -3.472
  149   HD11  ILE  17           HD1      ILE  17  41.187   6.352  -5.973
  150   HD12  ILE  17           HD2      ILE  17  42.923   6.050  -5.744
  151   HD13  ILE  17           HD3      ILE  17  42.353   7.676  -6.178
  152    H    GLY  18           HN       GLY  18  40.291  10.645  -2.932
  153    HA2  GLY  18           HA1      GLY  18  37.391  10.798  -2.737
  154    HA3  GLY  18           HA2      GLY  18  38.575  11.796  -1.865
  155    H    GLY  19           HN       GLY  19  40.008  12.978  -3.868
  156    HA2  GLY  19           HA1      GLY  19  38.302  15.126  -4.638
  157    HA3  GLY  19           HA2      GLY  19  39.907  14.786  -5.313
  158    H    ALA  20           HN       ALA  20  39.476  12.282  -6.451
  159    HA   ALA  20           HA       ALA  20  38.631  11.267  -8.344
  160    HB1  ALA  20           HB1      ALA  20  36.408  11.811  -7.118
  161    HB2  ALA  20           HB2      ALA  20  36.344  11.419  -8.852
  162    HB3  ALA  20           HB3      ALA  20  36.232  13.112  -8.317
  163    H    LEU  21           HN       LEU  21  39.159  14.652  -8.137
  164    HA   LEU  21           HA       LEU  21  39.612  16.263  -9.753
  165    HB2  LEU  21           HB2      LEU  21  40.825  13.729 -10.896
  166    HB3  LEU  21           HB1      LEU  21  41.004  15.285 -11.728
  167    HG   LEU  21           HG       LEU  21  42.906  14.615 -10.150
  168   HD11  LEU  21          HD11      LEU  21  41.646  17.238  -9.259
  169   HD12  LEU  21          HD12      LEU  21  42.278  17.031 -10.906
  170   HD13  LEU  21          HD13      LEU  21  43.359  16.844  -9.510
  171   HD21  LEU  21          HD21      LEU  21  42.600  14.821  -7.769
  172   HD22  LEU  21          HD22      LEU  21  41.324  13.735  -8.365
  173   HD23  LEU  21          HD23      LEU  21  40.937  15.424  -7.965
  174    H    ASP  22           HN       ASP  22  37.246  16.460 -10.090
  175    HA   ASP  22           HA       ASP  22  36.679  16.472 -12.920
  176    HB2  ASP  22           HB2      ASP  22  36.345  14.059 -12.578
  177    HB3  ASP  22           HB1      ASP  22  35.206  14.392 -11.251
  178    H    HIS  23           HN       HIS  23  33.875  15.650 -11.169
  179    HA   HIS  23           HA       HIS  23  32.743  18.256 -11.424
  180    HB2  HIS  23           HB2      HIS  23  31.038  17.324  -9.731
  181    HB3  HIS  23           HB1      HIS  23  31.246  16.414 -11.246
  182    HD1  HIS  23           HD1      HIS  23  31.787  13.986 -11.032
  183    HD2  HIS  23           HD2      HIS  23  32.633  16.122  -7.509
  184    HE1  HIS  23           HE1      HIS  23  32.545  12.290  -9.276
  185    H    LEU  24           HN       LEU  24  34.704  16.755  -8.935
  186    HA   LEU  24           HA       LEU  24  35.447  17.538  -6.882
  187    HB2  LEU  24           HB2      LEU  24  36.756  18.994  -8.287
  188    HB3  LEU  24           HB1      LEU  24  35.376  20.084  -8.547
  189    HG   LEU  24           HG       LEU  24  35.433  20.834  -6.243
  190   HD11  LEU  24          HD11      LEU  24  37.318  19.895  -4.726
  191   HD12  LEU  24          HD12      LEU  24  37.400  18.541  -5.879
  192   HD13  LEU  24          HD13      LEU  24  35.895  18.860  -4.985
  193   HD21  LEU  24          HD21      LEU  24  37.109  21.803  -7.839
  194   HD22  LEU  24          HD22      LEU  24  38.301  20.615  -7.260
  195   HD23  LEU  24          HD23      LEU  24  37.660  21.847  -6.148
  Start of MODEL  100
    1    H1   GLY   1           HT1      GLY   1  60.674   3.869  11.428
    2    H2   GLY   1           HT2      GLY   1  60.992   2.428  12.270
    3    H3   GLY   1           HT3      GLY   1  60.562   3.836  13.119
    4    HA2  GLY   1           HA1      GLY   1  58.834   2.026  12.747
    5    HA3  GLY   1           HA2      GLY   1  58.398   3.733  12.541
    6    H    LYS   2           HN       LYS   2  58.858   4.605  10.248
    7    HA   LYS   2           HA       LYS   2  58.128   4.530   8.045
    8    HB2  LYS   2           HB2      LYS   2  59.181   1.682   7.964
    9    HB3  LYS   2           HB1      LYS   2  59.164   2.899   6.665
   10    HG2  LYS   2           HG2      LYS   2  60.832   3.001   9.219
   11    HG3  LYS   2           HG1      LYS   2  61.432   2.683   7.573
   12    HD2  LYS   2           HD2      LYS   2  60.420   4.978   6.938
   13    HD3  LYS   2           HD1      LYS   2  60.275   5.268   8.689
   14    HE2  LYS   2           HE2      LYS   2  62.832   4.669   7.144
   15    HE3  LYS   2           HE1      LYS   2  62.389   6.206   7.925
   16    HZ1  LYS   2           HZ1      LYS   2  63.923   4.765   9.238
   17    HZ2  LYS   2           HZ2      LYS   2  62.666   3.632   9.390
   18    HZ3  LYS   2           HZ3      LYS   2  62.497   5.188  10.053
   19    H    GLY   3           HN       GLY   3  57.412   2.096   6.558
   20    HA2  GLY   3           HA1      GLY   3  55.604   0.351   6.821
   21    HA3  GLY   3           HA2      GLY   3  54.674   1.534   7.844
   22    H    ARG   4           HN       ARG   4  54.679   3.441   7.399
   23    HA   ARG   4           HA       ARG   4  52.564   2.777   6.428
   24    HB2  ARG   4           HB2      ARG   4  53.434   5.704   6.532
   25    HB3  ARG   4           HB1      ARG   4  51.742   5.173   6.360
   26    HG2  ARG   4           HG2      ARG   4  51.819   3.999   8.481
   27    HG3  ARG   4           HG1      ARG   4  53.575   4.260   8.620
   28    HD2  ARG   4           HD2      ARG   4  51.502   6.495   8.529
   29    HD3  ARG   4           HD1      ARG   4  52.227   5.853  10.022
   30    HE   ARG   4           HE       ARG   4  54.335   6.601   8.248
   31   HH11  ARG   4          HH11      ARG   4  51.598   8.147   9.613
   32   HH12  ARG   4          HH12      ARG   4  52.467   9.561  10.109
   33   HH21  ARG   4          HH21      ARG   4  55.553   8.345   9.100
   34   HH22  ARG   4          HH22      ARG   4  54.705   9.675   9.817
   35    H    TRP   5           HN       TRP   5  55.195   3.434   4.738
   36    HA   TRP   5           HA       TRP   5  54.676   4.814   2.366
   37    HB2  TRP   5           HB2      TRP   5  56.822   3.634   2.956
   38    HB3  TRP   5           HB1      TRP   5  56.060   2.103   2.459
   39    HD1  TRP   5           HD1      TRP   5  56.189   1.520  -0.019
   40    HE1  TRP   5           HE1      TRP   5  56.842   2.754  -2.214
   41    HE3  TRP   5           HE3      TRP   5  56.756   6.253   1.852
   42    HZ2  TRP   5           HZ2      TRP   5  57.515   5.438  -3.014
   43    HZ3  TRP   5           HZ3      TRP   5  57.405   8.134   0.355
   44    HH2  TRP   5           HH2      TRP   5  57.783   7.731  -2.075
   45    H    LEU   6           HN       LEU   6  53.070   2.008   3.521
   46    HA   LEU   6           HA       LEU   6  51.602   1.751   0.908
   47    HB2  LEU   6           HB2      LEU   6  52.320  -0.539   2.778
   48    HB3  LEU   6           HB1      LEU   6  51.481  -0.655   1.217
   49    HG   LEU   6           HG       LEU   6  54.305   0.468   1.520
   50   HD11  LEU   6          HD11      LEU   6  53.438  -2.344   0.718
   51   HD12  LEU   6          HD12      LEU   6  54.197  -1.905   2.266
   52   HD13  LEU   6          HD13      LEU   6  55.107  -1.725   0.746
   53   HD21  LEU   6          HD21      LEU   6  54.329  -0.220  -0.972
   54   HD22  LEU   6          HD22      LEU   6  53.336   1.191  -0.555
   55   HD23  LEU   6          HD23      LEU   6  52.564  -0.388  -0.834
   56    H    GLU   7           HN       GLU   7  51.455   2.519   4.228
   57    HA   GLU   7           HA       GLU   7  48.787   1.299   4.654
   58    HB2  GLU   7           HB2      GLU   7  50.507   1.596   6.484
   59    HB3  GLU   7           HB1      GLU   7  50.254   3.351   6.355
   60    HG2  GLU   7           HG2      GLU   7  47.938   3.153   7.000
   61    HG3  GLU   7           HG1      GLU   7  47.987   1.378   6.860
   62    H    ARG   8           HN       ARG   8  50.068   4.031   3.116
   63    HA   ARG   8           HA       ARG   8  49.076   5.921   2.227
   64    HB2  ARG   8           HB2      ARG   8  47.365   4.096   1.562
   65    HB3  ARG   8           HB1      ARG   8  46.377   4.703   2.909
   66    HG2  ARG   8           HG2      ARG   8  45.538   6.026   1.173
   67    HG3  ARG   8           HG1      ARG   8  46.842   7.084   1.755
   68    HD2  ARG   8           HD2      ARG   8  48.342   5.882   0.003
   69    HD3  ARG   8           HD1      ARG   8  46.818   5.273  -0.686
   70    HE   ARG   8           HE       ARG   8  46.773   8.159  -0.285
   71   HH11  ARG   8          HH11      ARG   8  46.118   9.088  -2.302
   72   HH12  ARG   8          HH12      ARG   8  46.874   8.502  -3.746
   73   HH21  ARG   8          HH21      ARG   8  48.488   5.878  -2.153
   74   HH22  ARG   8          HH22      ARG   8  48.215   6.685  -3.662
   75    H    ILE   9           HN       ILE   9  48.817   7.916   3.002
   76    HA   ILE   9           HA       ILE   9  48.575   8.362   5.814
   77    HB   ILE   9           HB       ILE   9  48.247  10.773   5.174
   78   HG12  ILE   9          HG12      ILE   9  48.214   9.575   2.364
   79   HG13  ILE   9          HG11      ILE   9  46.876  10.434   3.164
   80   HG21  ILE   9          HG21      ILE   9  50.453  11.057   4.271
   81   HG22  ILE   9          HG22      ILE   9  50.409   9.468   3.469
   82   HG23  ILE   9          HG23      ILE   9  50.519   9.570   5.243
   83   HD11  ILE   9           HD1      ILE   9  48.552  12.420   3.383
   84   HD12  ILE   9           HD2      ILE   9  47.863  12.086   1.778
   85   HD13  ILE   9           HD3      ILE   9  49.515  11.553   2.163
   86    H    GLY  10           HN       GLY  10  46.209   7.949   3.290
   87    HA2  GLY  10           HA1      GLY  10  43.898   8.041   3.325
   88    HA3  GLY  10           HA2      GLY  10  44.041   7.592   5.036
   89    H    LYS  11           HN       LYS  11  44.647  10.494   2.999
   90    HA   LYS  11           HA       LYS  11  42.621  12.037   4.372
   91    HB2  LYS  11           HB2      LYS  11  44.502  11.844   6.115
   92    HB3  LYS  11           HB1      LYS  11  45.475  12.858   5.025
   93    HG2  LYS  11           HG2      LYS  11  43.686  14.600   5.084
   94    HG3  LYS  11           HG1      LYS  11  42.768  13.590   6.228
   95    HD2  LYS  11           HD2      LYS  11  44.833  13.627   7.736
   96    HD3  LYS  11           HD1      LYS  11  45.495  14.877   6.655
   97    HE2  LYS  11           HE2      LYS  11  42.979  15.013   8.356
   98    HE3  LYS  11           HE1      LYS  11  44.409  16.069   8.424
   99    HZ1  LYS  11           HZ1      LYS  11  42.123  16.173   6.667
  100    HZ2  LYS  11           HZ2      LYS  11  43.607  16.292   5.847
  101    HZ3  LYS  11           HZ3      LYS  11  43.227  17.391   7.087
  102    H    ALA  12           HN       ALA  12  42.731  11.720   1.787
  103    HA   ALA  12           HA       ALA  12  44.479  13.645   0.444
  104    HB1  ALA  12           HB1      ALA  12  43.297  13.004  -1.558
  105    HB2  ALA  12           HB2      ALA  12  41.978  12.282  -0.607
  106    HB3  ALA  12           HB3      ALA  12  43.594  11.536  -0.598
  107    H    GLY  13           HN       GLY  13  43.658  15.309   2.161
  108    HA2  GLY  13           HA1      GLY  13  42.470  17.256   2.544
  109    HA3  GLY  13           HA2      GLY  13  42.226  17.310   0.788
  110    H    PHE  14           HN       PHE  14  41.056  15.241   3.483
  111    HA   PHE  14           HA       PHE  14  38.904  14.579   4.029
  112    HB2  PHE  14           HB2      PHE  14  37.964  17.122   2.657
  113    HB3  PHE  14           HB1      PHE  14  37.170  16.231   3.976
  114    HD1  PHE  14           HD1      PHE  14  38.577  15.904   6.174
  115    HD2  PHE  14           HD2      PHE  14  39.414  18.922   3.200
  116    HE1  PHE  14           HE1      PHE  14  39.856  17.216   7.863
  117    HE2  PHE  14           HE2      PHE  14  40.691  20.232   4.891
  118    HZ   PHE  14           HZ       PHE  14  40.933  19.367   7.215
  119    H    ILE  15           HN       ILE  15  40.043  13.651   1.561
  120    HA   ILE  15           HA       ILE  15  39.391  12.473  -0.307
  121    HB   ILE  15           HB       ILE  15  36.508  12.735   0.631
  122   HG12  ILE  15          HG12      ILE  15  38.690  10.830   1.599
  123   HG13  ILE  15          HG11      ILE  15  37.846  12.056   2.574
  124   HG21  ILE  15          HG21      ILE  15  36.183  10.672  -0.543
  125   HG22  ILE  15          HG22      ILE  15  37.935  10.402  -0.705
  126   HG23  ILE  15          HG23      ILE  15  37.144  11.698  -1.632
  127   HD11  ILE  15           HD1      ILE  15  36.747   9.475   1.415
  128   HD12  ILE  15           HD2      ILE  15  35.662  10.805   1.891
  129   HD13  ILE  15           HD3      ILE  15  36.717  10.038   3.101
  130    H    ILE  16           HN       ILE  16  40.022  14.769  -1.105
  131    HA   ILE  16           HA       ILE  16  37.794  15.666  -2.910
  132    HB   ILE  16           HB       ILE  16  38.196  17.283  -0.977
  133   HG12  ILE  16          HG12      ILE  16  38.602  19.302  -2.674
  134   HG13  ILE  16          HG11      ILE  16  38.530  18.028  -3.911
  135   HG21  ILE  16          HG21      ILE  16  40.746  16.825  -1.051
  136   HG22  ILE  16          HG22      ILE  16  40.219  18.508  -0.812
  137   HG23  ILE  16          HG23      ILE  16  40.776  17.970  -2.410
  138   HD11  ILE  16           HD1      ILE  16  36.365  18.476  -1.801
  139   HD12  ILE  16           HD2      ILE  16  36.279  17.402  -3.217
  140   HD13  ILE  16           HD3      ILE  16  36.317  19.163  -3.440
  141    H    ILE  17           HN       ILE  17  41.318  15.562  -2.246
  142    HA   ILE  17           HA       ILE  17  41.962  16.072  -5.079
  143    HB   ILE  17           HB       ILE  17  43.696  14.994  -2.802
  144   HG12  ILE  17          HG12      ILE  17  43.002  17.257  -2.279
  145   HG13  ILE  17          HG11      ILE  17  44.685  17.322  -2.823
  146   HG21  ILE  17          HG21      ILE  17  44.262  15.649  -5.706
  147   HG22  ILE  17          HG22      ILE  17  44.861  14.310  -4.707
  148   HG23  ILE  17          HG23      ILE  17  45.535  15.940  -4.497
  149   HD11  ILE  17           HD1      ILE  17  43.635  17.809  -5.195
  150   HD12  ILE  17           HD2      ILE  17  43.701  19.116  -3.995
  151   HD13  ILE  17           HD3      ILE  17  42.181  18.237  -4.270
  152    H    GLY  18           HN       GLY  18  41.886  13.331  -2.808
  153    HA2  GLY  18           HA1      GLY  18  42.619  11.391  -4.849
  154    HA3  GLY  18           HA2      GLY  18  41.983  11.045  -3.226
  155    H    GLY  19           HN       GLY  19  39.606  12.504  -3.287
  156    HA2  GLY  19           HA1      GLY  19  37.874  10.650  -4.604
  157    HA3  GLY  19           HA2      GLY  19  37.401  12.219  -3.921
  158    H    ALA  20           HN       ALA  20  38.959  13.957  -5.483
  159    HA   ALA  20           HA       ALA  20  37.311  14.007  -7.890
  160    HB1  ALA  20           HB1      ALA  20  39.740  15.677  -7.157
  161    HB2  ALA  20           HB2      ALA  20  38.061  16.050  -6.697
  162    HB3  ALA  20           HB3      ALA  20  38.537  16.050  -8.412
  163    H    LEU  21           HN       LEU  21  40.853  13.749  -7.323
  164    HA   LEU  21           HA       LEU  21  42.522  12.911  -8.691
  165    HB2  LEU  21           HB2      LEU  21  41.549  10.784  -8.103
  166    HB3  LEU  21           HB1      LEU  21  40.244  10.985  -9.291
  167    HG   LEU  21           HG       LEU  21  41.788  10.749 -11.145
  168   HD11  LEU  21          HD11      LEU  21  43.916  10.959  -8.978
  169   HD12  LEU  21          HD12      LEU  21  43.737  11.939 -10.455
  170   HD13  LEU  21          HD13      LEU  21  44.270  10.246 -10.571
  171   HD21  LEU  21          HD21      LEU  21  42.679   8.476 -10.712
  172   HD22  LEU  21          HD22      LEU  21  41.034   8.657 -10.056
  173   HD23  LEU  21          HD23      LEU  21  42.441   8.715  -8.966
  174    H    ASP  22           HN       ASP  22  42.937  14.564 -10.109
  175    HA   ASP  22           HA       ASP  22  42.920  15.722 -12.122
  176    HB2  ASP  22           HB2      ASP  22  43.775  13.472 -12.831
  177    HB3  ASP  22           HB1      ASP  22  42.109  13.026 -13.273
  178    H    HIS  23           HN       HIS  23  40.391  15.598 -10.579
  179    HA   HIS  23           HA       HIS  23  38.156  16.169 -10.858
  180    HB2  HIS  23           HB2      HIS  23  39.143  17.316 -13.499
  181    HB3  HIS  23           HB1      HIS  23  37.674  17.790 -12.612
  182    HD1  HIS  23           HD1      HIS  23  38.151  18.712 -10.054
  183    HD2  HIS  23           HD2      HIS  23  41.392  18.742 -12.735
  184    HE1  HIS  23           HE1      HIS  23  39.902  20.320  -9.114
  185    H    LEU  24           HN       LEU  24  38.485  13.557 -11.395
  186    HA   LEU  24           HA       LEU  24  37.755  12.686 -14.005
  187    HB2  LEU  24           HB2      LEU  24  38.609  11.105 -12.398
  188    HB3  LEU  24           HB1      LEU  24  37.305  11.475 -11.249
  189    HG   LEU  24           HG       LEU  24  35.643  10.440 -12.678
  190   HD11  LEU  24          HD11      LEU  24  36.482   9.316 -14.862
  191   HD12  LEU  24          HD12      LEU  24  37.902  10.379 -14.718
  192   HD13  LEU  24          HD13      LEU  24  36.276  11.082 -14.889
  193   HD21  LEU  24          HD21      LEU  24  37.000   8.914 -11.282
  194   HD22  LEU  24          HD22      LEU  24  38.179   8.743 -12.604
  195   HD23  LEU  24          HD23      LEU  24  36.523   8.123 -12.803