*HEADER    ANTIMICROBIAL PROTEIN                   16-NOV-11   2LLR              
*TITLE     NMR STRUCTURE OF ALVINELLACIN                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ALVINELLACIN;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    ANTIMICROBIAL PROTEIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    S.JUNG, A.TASIEMSKI, M.LEIPPE, J.GROETZINGER                          
*REVDAT   1   19-DEC-12 2LLR    0                                                


 10 VAL  H      10 VAL  HB      2.82            #peak     2
  9 LYS  HA     10 VAL  H       2.54            #peak     5
 14 GLY  H      14 GLY  HA2     2.44            #peak     6
 10 VAL  H      15 ARG  HA      2.88            #peak     8
  7 CYSS HA      8 TRP  HE3     3.22            #peak    15
 13 ASN  H      13 ASN  HB2     3.30            #peak    17
  3 CYSS HA     22 THR  H       3.48            #peak    18
 13 ASN  H      13 ASN  HA      2.86            #peak    20
 14 GLY  HA2    15 ARG  H       2.41            #peak    21
 22 THR  H      22 THR  QG2     3.65            #peak    24
 16 VAL  QG2    17 CYSS H       3.54            #peak    25
 16 VAL  QG1    17 CYSS H       3.54            #peak    26
 13 ASN  HA     14 GLY  H       3.16            #peak    27
 21 CYSS HA     22 THR  H       2.41            #peak    29
 16 VAL  HA     17 CYSS H       2.53            #peak    31
  6 ARG  H      18 MET  H       3.56            #peak    33
  8 TRP  H      16 VAL  H       3.30            #peak    36
  8 TRP  H       8 TRP  HE3     3.32            #peak    40
 10 VAL  HB     11 GLY  H       3.40            #peak    46
 13 ASN  H      14 GLY  H       2.46            #peak    47
  7 CYSS HA     17 CYSS HA      2.32            #peak    52
  3 CYSS HA     21 CYSS HA      2.35            #peak    54
 16 VAL  H      16 VAL  QG2     4.23            #peak    56
 16 VAL  H      16 VAL  QG1     4.23            #peak    57
 13 ASN  H      13 ASN  HB3     3.30            #peak    59
  8 TRP  H       8 TRP  HB3     4.18            #peak    60
  5 THR  QG2     6 ARG  H       2.92            #peak    65
  5 THR  HA      6 ARG  H       2.55            #peak    66
  4 TYR  H       4 TYR  HA      2.94            #peak    67
  4 TYR  HA      5 THR  H       2.21            #peak    70
 20 VAL  HA     21 CYSS H       2.37            #peak    74
  5 THR  H       5 THR  HB      2.44            #peak    75
  8 TRP  H       8 TRP  HB2     4.18            #peak    79
  7 CYSS HA      8 TRP  H       2.73            #peak    80
  7 CYSS HA     18 MET  H       2.87            #peak    82
 17 CYSS HA     18 MET  H       2.29            #peak    83
 18 MET  H      18 MET  HA      2.86            #peak    84
  8 TRP  H      17 CYSS HA      3.65            #peak    85
  3 CYSS HA      4 TYR  H       2.55            #peak    87
  4 TYR  H      21 CYSS HA      3.23            #peak    88
 20 VAL  H      20 VAL  HB      2.60            #peak    89
 19 ARG  HA     20 VAL  H       2.25            #peak    91
  6 ARG  HA      7 CYSS H       2.41            #peak    93
 15 ARG  HA     16 VAL  H       2.55            #peak    94
 16 VAL  H      16 VAL  HB      2.89            #peak    95
  9 LYS  H       9 LYS  HA      2.88            #peak    96
  2 GLY  HA3     3 CYSS H       2.40            #peak    99
 14 GLY  HA3    15 ARG  H       2.24            #peak   103
 12 ARG  HA     13 ASN  H       3.00            #peak   104
 11 GLY  H      11 GLY  HA2     2.56            #peak   109
 18 MET  HA     19 ARG  H       2.22            #peak   111
 11 GLY  H      11 GLY  HA3     2.75            #peak   112
 10 VAL  HA     11 GLY  H       2.20            #peak   115
  2 GLY  HA2     3 CYSS H       2.46            #peak   119
 11 GLY  HA3    12 ARG  H       2.47            #peak   121
 11 GLY  HA2    12 ARG  H       2.80            #peak   122
  1 ARG  HA      2 GLY  H       2.67            #peak   123
  3 CYSS SG     21 CYSS SG      2.10 
  3 CYSS SG     21 CYSS CB      3.10 
  3 CYSS CB     21 CYSS SG      3.10 
  7 CYSS SG     17 CYSS SG      2.10 
  7 CYSS SG     17 CYSS CB      3.10 
  7 CYSS CB     17 CYSS SG      3.10 
  1 ARG  QB      2 GLY  H       2.94            #peak   120
  1 ARG  QG      2 GLY  H       3.29            #peak   117
  3 CYSS H       3 CYSS QB      2.75            #peak    98
  3 CYSS QB      4 TYR  H       2.95            #peak    69
  4 TYR  QB      5 THR  H       2.46            #peak    76
  4 TYR  HD2    20 VAL  QQG     3.14            #peak    32
  6 ARG  H       6 ARG  QB      2.58            #peak    64
  6 ARG  QB      7 CYSS H       2.84            #peak   114
  7 CYSS H       7 CYSS QB      2.80            #peak   113
  7 CYSS HA      7 CYSS QB      2.52            #peak    53
  7 CYSS QB      8 TRP  H       2.96            #peak    90
  8 TRP  H       8 TRP  QB      3.57            #peak    60
  8 TRP  QB      8 TRP  HE3     2.79            #peak    16
  8 TRP  QB      9 LYS  H       2.83            #peak   106
  8 TRP  HZ3    18 MET  QB      2.92            #peak    12
  8 TRP  HZ2    16 VAL  QQG     3.09            #peak    14
  8 TRP  HH2    18 MET  QB      2.79            #peak    11
  9 LYS  H       9 LYS  QB      2.42            #peak   108
  9 LYS  H       9 LYS  QD      4.66            #peak   105
 10 VAL  H      10 VAL  QQG     2.88            #peak     3
 10 VAL  H      15 ARG  QG      3.70            #peak     9
 10 VAL  QQG    11 GLY  H       2.68            #peak   110
 13 ASN  H      13 ASN  QB      2.87            #peak    17
 15 ARG  H      15 ARG  QB      2.61            #peak    22
 15 ARG  H      15 ARG  QG      3.33            #peak    23
 16 VAL  H      16 VAL  QQG     3.29            #peak    56
 16 VAL  QQG    17 CYSS H       2.84            #peak    26
 17 CYSS H      17 CYSS QB      2.84            #peak    28
 17 CYSS HA     17 CYSS QB      2.46            #peak    49
 18 MET  H      18 MET  QB      2.95            #peak    81
 18 MET  H      18 MET  QG      2.72            #peak    78
 18 MET  QB     19 ARG  H       2.78            #peak   116
 20 VAL  H      20 VAL  QQG     3.77            #peak    86
 21 CYSS H      21 CYSS QB      2.56            #peak    72
 21 CYSS QB     22 THR  H       3.60            #peak    19


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1   1.807   0.001   0.855
    2    HA   ARG   1           HA       ARG   1   1.566   0.615  -1.956
    3    HB2  ARG   1           2HB      ARG   1   3.584   0.848   0.035
    4    HB3  ARG   1           3HB      ARG   1   4.225  -0.156  -1.259
    5    HG2  ARG   1           2HG      ARG   1   3.735   1.574  -2.883
    6    HG3  ARG   1           3HG      ARG   1   3.007   2.573  -1.624
    7    HD2  ARG   1           2HD      ARG   1   5.820   1.611  -1.324
    8    HD3  ARG   1           3HD      ARG   1   5.472   2.990  -2.365
    9    HE   ARG   1           HE       ARG   1   4.218   3.634  -0.062
   10   HH11  ARG   1          1HH1      ARG   1   7.457   2.594  -0.801
   11   HH12  ARG   1          2HH1      ARG   1   8.175   3.459   0.516
   12   HH21  ARG   1          1HH2      ARG   1   5.152   4.778   1.676
   13   HH22  ARG   1          2HH2      ARG   1   6.863   4.701   1.926
   14    H    GLY   2           H        GLY   2   2.654  -0.688  -3.619
   15    HA2  GLY   2           2HA      GLY   2   3.685  -3.132  -3.631
   16    HA3  GLY   2           3HA      GLY   2   2.015  -3.508  -3.233
   17    H    CYS   3           H        CYS   3   2.617  -4.734  -5.367
   18    HA   CYS   3           HA       CYS   3   1.394  -3.190  -7.526
   19    HB2  CYS   3           2HB      CYS   3   4.149  -3.744  -7.461
   20    HB3  CYS   3           3HB      CYS   3   3.463  -4.889  -8.610
   21    H    TYR   4           H        TYR   4   0.536  -4.536  -9.249
   22    HA   TYR   4           HA       TYR   4   0.349  -7.389  -8.750
   23    HB2  TYR   4           2HB      TYR   4  -2.098  -5.609  -8.727
   24    HB3  TYR   4           3HB      TYR   4  -2.131  -7.369  -8.773
   25    HD1  TYR   4           HD1      TYR   4  -1.201  -8.652  -6.814
   26    HD2  TYR   4           HD2      TYR   4  -1.853  -4.449  -6.686
   27    HE1  TYR   4           HE1      TYR   4  -1.129  -8.722  -4.356
   28    HE2  TYR   4           HE2      TYR   4  -1.782  -4.507  -4.228
   29    HH   TYR   4           HH       TYR   4  -0.500  -6.715  -2.476
   30    H    THR   5           H        THR   5  -0.669  -8.550 -10.516
   31    HA   THR   5           HA       THR   5  -0.146  -7.240 -13.061
   32    HB   THR   5           HB       THR   5  -0.801 -10.122 -12.422
   33    HG1  THR   5           HG1      THR   5   1.651  -9.173 -13.445
   34   HG21  THR   5          3HG2      THR   5  -1.560  -9.772 -14.631
   35   HG22  THR   5          1HG2      THR   5   0.051 -10.470 -14.797
   36   HG23  THR   5          2HG2      THR   5  -0.188  -8.737 -15.023
   37    H    ARG   6           H        ARG   6  -1.640  -6.912 -14.668
   38    HA   ARG   6           HA       ARG   6  -4.419  -7.682 -14.158
   39    HB2  ARG   6           2HB      ARG   6  -3.339  -4.922 -14.330
   40    HB3  ARG   6           3HB      ARG   6  -4.856  -5.232 -15.162
   41    HG2  ARG   6           2HG      ARG   6  -5.845  -6.033 -13.083
   42    HG3  ARG   6           3HG      ARG   6  -4.319  -5.747 -12.244
   43    HD2  ARG   6           2HD      ARG   6  -5.600  -3.859 -11.751
   44    HD3  ARG   6           3HD      ARG   6  -4.543  -3.330 -13.059
   45    HE   ARG   6           HE       ARG   6  -6.381  -3.093 -14.415
   46   HH11  ARG   6          1HH1      ARG   6  -7.266  -4.855 -11.546
   47   HH12  ARG   6          2HH1      ARG   6  -8.967  -4.787 -11.872
   48   HH21  ARG   6          1HH2      ARG   6  -8.617  -2.996 -14.855
   49   HH22  ARG   6          2HH2      ARG   6  -9.734  -3.730 -13.754
   50    H    CYS   7           H        CYS   7  -5.714  -7.857 -16.012
   51    HA   CYS   7           HA       CYS   7  -4.538  -7.324 -18.612
   52    HB2  CYS   7           2HB      CYS   7  -4.310  -9.887 -17.455
   53    HB3  CYS   7           3HB      CYS   7  -5.567 -10.012 -18.681
   54    H    TRP   8           H        TRP   8  -6.064  -7.486 -20.351
   55    HA   TRP   8           HA       TRP   8  -8.781  -8.178 -19.945
   56    HB2  TRP   8           2HB      TRP   8  -9.842  -6.069 -19.825
   57    HB3  TRP   8           3HB      TRP   8  -8.546  -5.997 -18.634
   58    HD1  TRP   8           HD1      TRP   8  -9.927  -4.147 -21.528
   59    HE1  TRP   8           HE1      TRP   8  -8.343  -2.236 -22.212
   60    HE3  TRP   8           HE3      TRP   8  -5.803  -5.503 -18.826
   61    HZ2  TRP   8           HZ2      TRP   8  -5.697  -1.413 -21.678
   62    HZ3  TRP   8           HZ3      TRP   8  -3.787  -4.100 -18.969
   63    HH2  TRP   8           HH2      TRP   8  -3.736  -2.099 -20.366
   64    H    LYS   9           H        LYS   9  -9.966  -8.151 -21.855
   65    HA   LYS   9           HA       LYS   9  -8.450  -8.209 -24.253
   66    HB2  LYS   9           2HB      LYS   9 -10.491  -8.797 -25.347
   67    HB3  LYS   9           3HB      LYS   9 -10.493  -9.590 -23.778
   68    HG2  LYS   9           2HG      LYS   9 -11.876  -7.630 -22.953
   69    HG3  LYS   9           3HG      LYS   9 -12.069  -7.191 -24.652
   70    HD2  LYS   9           2HD      LYS   9 -12.741  -9.926 -23.592
   71    HD3  LYS   9           3HD      LYS   9 -13.912  -8.606 -23.632
   72    HE2  LYS   9           2HE      LYS   9 -13.543  -8.406 -26.068
   73    HE3  LYS   9           3HE      LYS   9 -12.457  -9.793 -25.993
   74    HZ1  LYS   9           3HZ      LYS   9 -14.326 -10.915 -26.471
   75    HZ2  LYS   9           1HZ      LYS   9 -15.353  -9.702 -25.890
   76    HZ3  LYS   9           2HZ      LYS   9 -14.628 -10.784 -24.811
   77    H    VAL  10           H        VAL  10  -8.120  -6.702 -25.779
   78    HA   VAL  10           HA       VAL  10  -9.660  -4.198 -25.628
   79    HB   VAL  10           HB       VAL  10  -6.732  -4.214 -26.312
   80   HG11  VAL  10          1HG1      VAL  10  -6.997  -1.823 -25.500
   81   HG12  VAL  10          2HG1      VAL  10  -7.802  -2.234 -27.016
   82   HG13  VAL  10          3HG1      VAL  10  -8.736  -2.115 -25.524
   83   HG21  VAL  10          3HG2      VAL  10  -6.636  -3.229 -23.855
   84   HG22  VAL  10          1HG2      VAL  10  -8.019  -4.301 -23.636
   85   HG23  VAL  10          2HG2      VAL  10  -6.471  -4.956 -24.169
   86    H    GLY  11           H        GLY  11  -9.739  -2.978 -27.615
   87    HA2  GLY  11           2HA      GLY  11 -10.232  -2.881 -29.860
   88    HA3  GLY  11           3HA      GLY  11  -8.661  -3.644 -30.055
   89    H    ARG  12           H        ARG  12  -9.506  -4.717 -31.919
   90    HA   ARG  12           HA       ARG  12 -11.118  -7.076 -31.214
   91    HB2  ARG  12           2HB      ARG  12 -12.351  -5.274 -32.553
   92    HB3  ARG  12           3HB      ARG  12 -11.297  -5.710 -33.892
   93    HG2  ARG  12           2HG      ARG  12 -13.072  -7.042 -34.364
   94    HG3  ARG  12           3HG      ARG  12 -12.165  -8.138 -33.319
   95    HD2  ARG  12           2HD      ARG  12 -13.536  -7.557 -31.432
   96    HD3  ARG  12           3HD      ARG  12 -14.358  -6.305 -32.362
   97    HE   ARG  12           HE       ARG  12 -14.630  -8.869 -33.572
   98   HH11  ARG  12          1HH1      ARG  12 -15.838  -6.849 -31.006
   99   HH12  ARG  12          2HH1      ARG  12 -17.390  -7.617 -30.955
  100   HH21  ARG  12          1HH2      ARG  12 -16.670  -9.888 -33.515
  101   HH22  ARG  12          2HH2      ARG  12 -17.862  -9.346 -32.382
  102    H    ASN  13           H        ASN  13  -8.340  -7.043 -31.189
  103    HA   ASN  13           HA       ASN  13  -7.766  -9.166 -33.004
  104    HB2  ASN  13           2HB      ASN  13  -7.492  -6.897 -34.308
  105    HB3  ASN  13           3HB      ASN  13  -5.970  -6.807 -33.426
  106   HD21  ASN  13          1HD2      ASN  13  -7.879  -9.023 -35.422
  107   HD22  ASN  13          2HD2      ASN  13  -6.528  -9.734 -36.229
  108    H    GLY  14           H        GLY  14  -7.696  -9.281 -30.352
  109    HA2  GLY  14           2HA      GLY  14  -5.803 -10.498 -29.257
  110    HA3  GLY  14           3HA      GLY  14  -4.827  -9.094 -29.665
  111    H    ARG  15           H        ARG  15  -4.518  -9.442 -27.214
  112    HA   ARG  15           HA       ARG  15  -6.448  -7.699 -25.835
  113    HB2  ARG  15           2HB      ARG  15  -5.068 -10.129 -24.677
  114    HB3  ARG  15           3HB      ARG  15  -6.084  -9.011 -23.776
  115    HG2  ARG  15           2HG      ARG  15  -7.782 -10.359 -24.241
  116    HG3  ARG  15           3HG      ARG  15  -7.670  -9.786 -25.907
  117    HD2  ARG  15           2HD      ARG  15  -6.483 -11.646 -26.604
  118    HD3  ARG  15           3HD      ARG  15  -5.914 -12.017 -24.977
  119    HE   ARG  15           HE       ARG  15  -8.716 -12.280 -25.080
  120   HH11  ARG  15          1HH1      ARG  15  -5.811 -13.835 -26.204
  121   HH12  ARG  15          2HH1      ARG  15  -6.521 -15.414 -26.258
  122   HH21  ARG  15          1HH2      ARG  15  -9.663 -14.354 -25.148
  123   HH22  ARG  15          2HH2      ARG  15  -8.713 -15.708 -25.659
  124    H    VAL  16           H        VAL  16  -5.353  -7.074 -23.580
  125    HA   VAL  16           HA       VAL  16  -2.521  -6.445 -23.991
  126    HB   VAL  16           HB       VAL  16  -4.685  -4.415 -23.457
  127   HG11  VAL  16          1HG1      VAL  16  -2.969  -3.941 -21.866
  128   HG12  VAL  16          2HG1      VAL  16  -1.706  -4.160 -23.079
  129   HG13  VAL  16          3HG1      VAL  16  -2.807  -2.786 -23.188
  130   HG21  VAL  16          3HG2      VAL  16  -2.566  -4.693 -25.583
  131   HG22  VAL  16          1HG2      VAL  16  -4.314  -4.799 -25.789
  132   HG23  VAL  16          2HG2      VAL  16  -3.567  -3.257 -25.369
  133    H    CYS  17           H        CYS  17  -1.326  -6.252 -22.127
  134    HA   CYS  17           HA       CYS  17  -2.767  -6.800 -19.614
  135    HB2  CYS  17           2HB      CYS  17  -0.741  -8.308 -20.879
  136    HB3  CYS  17           3HB      CYS  17   0.006  -7.554 -19.474
  137    H    MET  18           H        MET  18  -2.359  -5.535 -17.882
  138    HA   MET  18           HA       MET  18  -0.188  -3.560 -18.106
  139    HB2  MET  18           2HB      MET  18  -1.591  -1.833 -17.228
  140    HB3  MET  18           3HB      MET  18  -2.444  -2.571 -18.577
  141    HG2  MET  18           2HG      MET  18  -3.725  -3.933 -16.940
  142    HG3  MET  18           3HG      MET  18  -2.950  -3.020 -15.648
  143    HE1  MET  18           3HE      MET  18  -4.317  -1.829 -14.458
  144    HE2  MET  18           1HE      MET  18  -3.828  -0.253 -15.080
  145    HE3  MET  18           2HE      MET  18  -5.540  -0.650 -14.934
  146    H    ARG  19           H        ARG  19   0.810  -2.936 -16.177
  147    HA   ARG  19           HA       ARG  19   0.308  -4.760 -13.923
  148    HB2  ARG  19           2HB      ARG  19   2.668  -4.103 -13.249
  149    HB3  ARG  19           3HB      ARG  19   2.517  -5.081 -14.703
  150    HG2  ARG  19           2HG      ARG  19   3.271  -3.438 -16.054
  151    HG3  ARG  19           3HG      ARG  19   2.533  -2.157 -15.090
  152    HD2  ARG  19           2HD      ARG  19   4.306  -2.085 -13.596
  153    HD3  ARG  19           3HD      ARG  19   4.846  -3.712 -14.008
  154    HE   ARG  19           HE       ARG  19   5.204  -2.312 -16.307
  155   HH11  ARG  19          1HH1      ARG  19   6.220  -1.857 -13.008
  156   HH12  ARG  19          2HH1      ARG  19   7.684  -1.035 -13.436
  157   HH21  ARG  19          1HH2      ARG  19   7.128  -1.231 -16.882
  158   HH22  ARG  19          2HH2      ARG  19   8.199  -0.679 -15.639
  159    H    VAL  20           H        VAL  20  -1.278  -3.569 -12.872
  160    HA   VAL  20           HA       VAL  20  -1.010  -0.792 -12.289
  161    HB   VAL  20           HB       VAL  20  -3.197  -1.985 -12.387
  162   HG11  VAL  20          1HG1      VAL  20  -2.527  -4.021 -11.207
  163   HG12  VAL  20          2HG1      VAL  20  -2.348  -3.097  -9.714
  164   HG13  VAL  20          3HG1      VAL  20  -3.938  -3.277 -10.457
  165   HG21  VAL  20          3HG2      VAL  20  -2.540   0.178 -10.968
  166   HG22  VAL  20          1HG2      VAL  20  -4.175  -0.482 -10.994
  167   HG23  VAL  20          2HG2      VAL  20  -3.095  -0.855  -9.651
  168    H    CYS  21           H        CYS  21  -0.389   0.230 -10.415
  169    HA   CYS  21           HA       CYS  21   0.798  -1.451  -8.311
  170    HB2  CYS  21           2HB      CYS  21   2.222   0.174 -10.096
  171    HB3  CYS  21           3HB      CYS  21   2.168   1.084  -8.590
  172    H    THR  22           H        THR  22   0.107  -0.987  -6.330
  173    HA   THR  22           HA       THR  22  -0.637   1.711  -5.586
  174    HB   THR  22           HB       THR  22  -2.735   0.917  -6.546
  175    HG1  THR  22           HG1      THR  22  -3.054   2.226  -4.789
  176   HG21  THR  22          3HG2      THR  22  -2.588  -1.439  -6.393
  177   HG22  THR  22          1HG2      THR  22  -3.918  -0.977  -5.332
  178   HG23  THR  22          2HG2      THR  22  -2.346  -1.387  -4.647
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1  -1.756  -2.047  -1.136
    2    HA   ARG   1           HA       ARG   1  -0.169  -0.315  -2.873
    3    HB2  ARG   1           2HB      ARG   1   0.147  -1.425  -0.133
    4    HB3  ARG   1           3HB      ARG   1   1.615  -1.123  -1.053
    5    HG2  ARG   1           2HG      ARG   1   1.390   1.120  -0.940
    6    HG3  ARG   1           3HG      ARG   1  -0.372   1.057  -1.010
    7    HD2  ARG   1           2HD      ARG   1  -0.512   0.456   1.297
    8    HD3  ARG   1           3HD      ARG   1   1.233   0.225   1.399
    9    HE   ARG   1           HE       ARG   1   0.991   2.819   0.667
   10   HH11  ARG   1          1HH1      ARG   1  -0.389   0.913   3.232
   11   HH12  ARG   1          2HH1      ARG   1  -0.511   2.245   4.333
   12   HH21  ARG   1          1HH2      ARG   1   0.836   4.581   2.107
   13   HH22  ARG   1          2HH2      ARG   1   0.186   4.331   3.692
   14    H    GLY   2           H        GLY   2   2.232  -1.248  -3.065
   15    HA2  GLY   2           2HA      GLY   2   3.632  -2.984  -3.757
   16    HA3  GLY   2           3HA      GLY   2   2.276  -4.095  -3.635
   17    H    CYS   3           H        CYS   3   3.578  -4.662  -5.732
   18    HA   CYS   3           HA       CYS   3   2.285  -3.244  -7.970
   19    HB2  CYS   3           2HB      CYS   3   4.918  -4.721  -8.106
   20    HB3  CYS   3           3HB      CYS   3   4.201  -3.698  -9.347
   21    H    TYR   4           H        TYR   4   1.267  -4.442  -9.514
   22    HA   TYR   4           HA       TYR   4   1.562  -7.317  -9.605
   23    HB2  TYR   4           2HB      TYR   4  -0.940  -7.646  -9.321
   24    HB3  TYR   4           3HB      TYR   4  -0.042  -7.266  -7.855
   25    HD1  TYR   4           HD2      TYR   4  -1.880  -5.486 -10.584
   26    HD2  TYR   4           HD1      TYR   4  -0.944  -5.687  -6.438
   27    HE1  TYR   4           HE2      TYR   4  -3.392  -3.593 -10.156
   28    HE2  TYR   4           HE1      TYR   4  -2.454  -3.796  -5.999
   29    HH   TYR   4           HH       TYR   4  -3.503  -1.983  -7.100
   30    H    THR   5           H        THR   5   0.413  -8.282 -11.408
   31    HA   THR   5           HA       THR   5   0.170  -6.394 -13.624
   32    HB   THR   5           HB       THR   5   0.328  -9.413 -13.615
   33    HG1  THR   5           HG1      THR   5   2.240  -7.702 -14.765
   34   HG21  THR   5          3HG2      THR   5   0.150  -7.447 -15.896
   35   HG22  THR   5          1HG2      THR   5  -0.965  -8.760 -15.521
   36   HG23  THR   5          2HG2      THR   5   0.666  -9.123 -16.083
   37    H    ARG   6           H        ARG   6  -1.666  -6.084 -14.796
   38    HA   ARG   6           HA       ARG   6  -4.034  -7.677 -14.126
   39    HB2  ARG   6           2HB      ARG   6  -3.716  -4.711 -13.870
   40    HB3  ARG   6           3HB      ARG   6  -5.285  -5.379 -14.299
   41    HG2  ARG   6           2HG      ARG   6  -3.937  -6.603 -11.978
   42    HG3  ARG   6           3HG      ARG   6  -4.501  -4.942 -11.779
   43    HD2  ARG   6           2HD      ARG   6  -6.322  -6.221 -11.095
   44    HD3  ARG   6           3HD      ARG   6  -6.717  -5.798 -12.760
   45    HE   ARG   6           HE       ARG   6  -6.613  -8.015 -13.304
   46   HH11  ARG   6          1HH1      ARG   6  -5.021  -7.526 -10.247
   47   HH12  ARG   6          2HH1      ARG   6  -4.804  -9.217  -9.941
   48   HH21  ARG   6          1HH2      ARG   6  -6.334 -10.245 -12.913
   49   HH22  ARG   6          2HH2      ARG   6  -5.550 -10.763 -11.459
   50    H    CYS   7           H        CYS   7  -5.561  -7.862 -15.767
   51    HA   CYS   7           HA       CYS   7  -4.757  -6.749 -18.375
   52    HB2  CYS   7           2HB      CYS   7  -6.171  -9.389 -18.058
   53    HB3  CYS   7           3HB      CYS   7  -5.306  -8.772 -19.462
   54    H    TRP   8           H        TRP   8  -6.658  -6.912 -19.986
   55    HA   TRP   8           HA       TRP   8  -9.279  -6.610 -18.791
   56    HB2  TRP   8           2HB      TRP   8  -9.671  -4.361 -19.505
   57    HB3  TRP   8           3HB      TRP   8  -8.168  -4.358 -18.587
   58    HD1  TRP   8           HD1      TRP   8  -9.564  -3.647 -22.029
   59    HE1  TRP   8           HE1      TRP   8  -7.703  -2.674 -23.516
   60    HE3  TRP   8           HE3      TRP   8  -5.558  -4.481 -18.965
   61    HZ2  TRP   8           HZ2      TRP   8  -4.906  -2.308 -23.405
   62    HZ3  TRP   8           HZ3      TRP   8  -3.324  -3.790 -19.730
   63    HH2  TRP   8           HH2      TRP   8  -3.007  -2.727 -21.905
   64    H    LYS   9           H        LYS   9 -10.968  -6.244 -20.470
   65    HA   LYS   9           HA       LYS   9 -10.449  -7.955 -22.727
   66    HB2  LYS   9           2HB      LYS   9 -12.628  -7.671 -21.262
   67    HB3  LYS   9           3HB      LYS   9 -12.991  -6.410 -22.434
   68    HG2  LYS   9           2HG      LYS   9 -12.143  -8.793 -23.786
   69    HG3  LYS   9           3HG      LYS   9 -13.460  -9.158 -22.669
   70    HD2  LYS   9           2HD      LYS   9 -14.863  -7.500 -23.681
   71    HD3  LYS   9           3HD      LYS   9 -13.529  -6.904 -24.671
   72    HE2  LYS   9           2HE      LYS   9 -14.705  -8.228 -26.161
   73    HE3  LYS   9           3HE      LYS   9 -13.452  -9.326 -25.586
   74    HZ1  LYS   9           3HZ      LYS   9 -15.102 -10.169 -23.953
   75    HZ2  LYS   9           1HZ      LYS   9 -15.514 -10.479 -25.564
   76    HZ3  LYS   9           2HZ      LYS   9 -16.287  -9.235 -24.719
   77    H    VAL  10           H        VAL  10  -9.142  -6.981 -24.205
   78    HA   VAL  10           HA       VAL  10  -9.554  -4.252 -25.033
   79    HB   VAL  10           HB       VAL  10  -7.831  -6.216 -26.511
   80   HG11  VAL  10          1HG1      VAL  10  -7.521  -4.305 -27.648
   81   HG12  VAL  10          2HG1      VAL  10  -8.136  -3.304 -26.331
   82   HG13  VAL  10          3HG1      VAL  10  -6.467  -3.874 -26.303
   83   HG21  VAL  10          3HG2      VAL  10  -6.844  -6.689 -24.538
   84   HG22  VAL  10          1HG2      VAL  10  -6.086  -5.114 -24.769
   85   HG23  VAL  10          2HG2      VAL  10  -7.511  -5.264 -23.742
   86    H    GLY  11           H        GLY  11  -9.834  -3.680 -27.341
   87    HA2  GLY  11           2HA      GLY  11 -12.200  -4.782 -28.384
   88    HA3  GLY  11           3HA      GLY  11 -11.121  -3.690 -29.240
   89    H    ARG  12           H        ARG  12 -11.508  -4.833 -31.185
   90    HA   ARG  12           HA       ARG  12 -10.988  -7.614 -31.450
   91    HB2  ARG  12           2HB      ARG  12 -11.375  -5.346 -33.373
   92    HB3  ARG  12           3HB      ARG  12 -10.818  -6.907 -33.960
   93    HG2  ARG  12           2HG      ARG  12 -12.982  -7.396 -34.159
   94    HG3  ARG  12           3HG      ARG  12 -12.952  -7.610 -32.408
   95    HD2  ARG  12           2HD      ARG  12 -13.808  -5.452 -32.025
   96    HD3  ARG  12           3HD      ARG  12 -13.472  -4.938 -33.677
   97    HE   ARG  12           HE       ARG  12 -15.798  -6.316 -32.742
   98   HH11  ARG  12          1HH1      ARG  12 -13.730  -5.806 -35.496
   99   HH12  ARG  12          2HH1      ARG  12 -14.963  -6.181 -36.655
  100   HH21  ARG  12          1HH2      ARG  12 -17.429  -6.811 -34.257
  101   HH22  ARG  12          2HH2      ARG  12 -17.066  -6.751 -35.949
  102    H    ASN  13           H        ASN  13  -8.917  -7.728 -30.352
  103    HA   ASN  13           HA       ASN  13  -6.750  -7.896 -32.137
  104    HB2  ASN  13           2HB      ASN  13  -7.000  -5.340 -31.658
  105    HB3  ASN  13           3HB      ASN  13  -6.257  -5.738 -30.111
  106   HD21  ASN  13          1HD2      ASN  13  -5.725  -5.007 -33.345
  107   HD22  ASN  13          2HD2      ASN  13  -4.036  -5.362 -33.411
  108    H    GLY  14           H        GLY  14  -8.112  -9.415 -30.072
  109    HA2  GLY  14           2HA      GLY  14  -7.496 -11.007 -28.527
  110    HA3  GLY  14           3HA      GLY  14  -5.825 -10.533 -28.794
  111    H    ARG  15           H        ARG  15  -6.003 -11.096 -26.366
  112    HA   ARG  15           HA       ARG  15  -7.027  -8.887 -24.766
  113    HB2  ARG  15           2HB      ARG  15  -5.973 -11.625 -24.148
  114    HB3  ARG  15           3HB      ARG  15  -6.059 -10.409 -22.880
  115    HG2  ARG  15           2HG      ARG  15  -8.535 -10.171 -23.772
  116    HG3  ARG  15           3HG      ARG  15  -8.239 -11.828 -24.303
  117    HD2  ARG  15           2HD      ARG  15  -7.694 -10.900 -21.495
  118    HD3  ARG  15           3HD      ARG  15  -9.261 -11.533 -21.998
  119    HE   ARG  15           HE       ARG  15  -6.905 -13.037 -21.445
  120   HH11  ARG  15          1HH1      ARG  15  -9.769 -12.954 -23.422
  121   HH12  ARG  15          2HH1      ARG  15  -9.827 -14.672 -23.640
  122   HH21  ARG  15          1HH2      ARG  15  -6.970 -15.300 -21.724
  123   HH22  ARG  15          2HH2      ARG  15  -8.235 -16.006 -22.673
  124    H    VAL  16           H        VAL  16  -5.617  -8.033 -22.997
  125    HA   VAL  16           HA       VAL  16  -2.760  -8.076 -23.521
  126    HB   VAL  16           HB       VAL  16  -4.402  -5.560 -23.793
  127   HG11  VAL  16          1HG1      VAL  16  -2.546  -5.010 -22.380
  128   HG12  VAL  16          2HG1      VAL  16  -1.425  -5.868 -23.439
  129   HG13  VAL  16          3HG1      VAL  16  -2.212  -4.392 -23.997
  130   HG21  VAL  16          3HG2      VAL  16  -2.496  -7.004 -25.627
  131   HG22  VAL  16          1HG2      VAL  16  -4.229  -6.766 -25.850
  132   HG23  VAL  16          2HG2      VAL  16  -3.132  -5.389 -25.939
  133    H    CYS  17           H        CYS  17  -1.523  -7.500 -21.758
  134    HA   CYS  17           HA       CYS  17  -3.014  -6.845 -19.301
  135    HB2  CYS  17           2HB      CYS  17  -0.521  -8.544 -19.534
  136    HB3  CYS  17           3HB      CYS  17  -1.391  -8.178 -18.048
  137    H    MET  18           H        MET  18  -2.355  -5.124 -18.165
  138    HA   MET  18           HA       MET  18   0.070  -3.743 -19.083
  139    HB2  MET  18           2HB      MET  18  -0.923  -1.728 -18.040
  140    HB3  MET  18           3HB      MET  18  -1.940  -2.413 -19.301
  141    HG2  MET  18           2HG      MET  18  -3.400  -3.392 -17.669
  142    HG3  MET  18           3HG      MET  18  -2.330  -2.898 -16.359
  143    HE1  MET  18           3HE      MET  18  -5.732  -0.920 -16.175
  144    HE2  MET  18           1HE      MET  18  -5.033  -2.531 -16.007
  145    HE3  MET  18           2HE      MET  18  -4.454  -1.209 -14.994
  146    H    ARG  19           H        ARG  19   1.598  -2.981 -17.618
  147    HA   ARG  19           HA       ARG  19   1.788  -4.513 -15.175
  148    HB2  ARG  19           2HB      ARG  19   4.011  -3.389 -14.966
  149    HB3  ARG  19           3HB      ARG  19   3.796  -4.283 -16.465
  150    HG2  ARG  19           2HG      ARG  19   4.204  -2.471 -17.669
  151    HG3  ARG  19           3HG      ARG  19   2.955  -1.563 -16.816
  152    HD2  ARG  19           2HD      ARG  19   5.468  -2.011 -15.338
  153    HD3  ARG  19           3HD      ARG  19   5.578  -0.948 -16.741
  154    HE   ARG  19           HE       ARG  19   3.373  -0.155 -15.223
  155   HH11  ARG  19          1HH1      ARG  19   6.843  -0.276 -14.973
  156   HH12  ARG  19          2HH1      ARG  19   6.944   1.090 -13.912
  157   HH21  ARG  19          1HH2      ARG  19   3.493   1.645 -13.827
  158   HH22  ARG  19          2HH2      ARG  19   5.038   2.181 -13.260
  159    H    VAL  20           H        VAL  20   0.824  -3.849 -13.379
  160    HA   VAL  20           HA       VAL  20   0.523  -0.959 -12.911
  161    HB   VAL  20           HB       VAL  20  -0.972  -3.233 -11.597
  162   HG11  VAL  20          1HG1      VAL  20  -0.954  -0.287 -11.239
  163   HG12  VAL  20          2HG1      VAL  20  -2.509  -1.117 -11.142
  164   HG13  VAL  20          3HG1      VAL  20  -1.195  -1.571 -10.055
  165   HG21  VAL  20          3HG2      VAL  20  -2.318  -3.276 -13.363
  166   HG22  VAL  20          1HG2      VAL  20  -2.645  -1.554 -13.167
  167   HG23  VAL  20          2HG2      VAL  20  -1.296  -2.086 -14.170
  168    H    CYS  21           H        CYS  21   2.402  -0.396 -11.905
  169    HA   CYS  21           HA       CYS  21   2.908  -1.673  -9.303
  170    HB2  CYS  21           2HB      CYS  21   4.623  -2.435 -10.862
  171    HB3  CYS  21           3HB      CYS  21   4.988  -0.771 -11.306
  172    H    THR  22           H        THR  22   3.431  -0.323  -7.627
  173    HA   THR  22           HA       THR  22   3.019   2.531  -8.132
  174    HB   THR  22           HB       THR  22   1.596   1.525  -6.417
  175    HG1  THR  22           HG1      THR  22   3.546   3.218  -5.213
  176   HG21  THR  22          3HG2      THR  22   3.062  -0.265  -5.667
  177   HG22  THR  22          1HG2      THR  22   2.579   0.735  -4.298
  178   HG23  THR  22          2HG2      THR  22   4.189   0.913  -4.994
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1   4.740  -1.426  -0.185
    2    HA   ARG   1           HA       ARG   1   2.184  -1.620  -1.639
    3    HB2  ARG   1           2HB      ARG   1   3.768   0.738  -0.856
    4    HB3  ARG   1           3HB      ARG   1   3.235   0.732  -2.532
    5    HG2  ARG   1           2HG      ARG   1   1.325   1.586  -1.794
    6    HG3  ARG   1           3HG      ARG   1   0.976  -0.012  -1.132
    7    HD2  ARG   1           2HD      ARG   1   0.696   1.367   0.707
    8    HD3  ARG   1           3HD      ARG   1   2.354   0.799   0.903
    9    HE   ARG   1           HE       ARG   1   2.160   3.272  -0.540
   10   HH11  ARG   1          1HH1      ARG   1   2.305   1.817   2.619
   11   HH12  ARG   1          2HH1      ARG   1   2.941   3.235   3.386
   12   HH21  ARG   1          1HH2      ARG   1   2.997   5.145   0.458
   13   HH22  ARG   1          2HH2      ARG   1   3.333   5.127   2.156
   14    H    GLY   2           H        GLY   2   2.355  -1.358  -3.980
   15    HA2  GLY   2           2HA      GLY   2   4.732  -1.277  -5.425
   16    HA3  GLY   2           3HA      GLY   2   4.420  -2.969  -5.062
   17    H    CYS   3           H        CYS   3   4.472  -2.695  -7.580
   18    HA   CYS   3           HA       CYS   3   1.704  -2.250  -8.490
   19    HB2  CYS   3           2HB      CYS   3   4.174  -2.143 -10.224
   20    HB3  CYS   3           3HB      CYS   3   2.543  -1.630 -10.644
   21    H    TYR   4           H        TYR   4   0.690  -3.826  -9.644
   22    HA   TYR   4           HA       TYR   4   2.191  -6.328 -10.064
   23    HB2  TYR   4           2HB      TYR   4  -0.046  -7.470  -9.722
   24    HB3  TYR   4           3HB      TYR   4   0.665  -6.740  -8.287
   25    HD1  TYR   4           HD1      TYR   4  -0.249  -4.592  -7.417
   26    HD2  TYR   4           HD2      TYR   4  -2.138  -6.726 -10.576
   27    HE1  TYR   4           HE1      TYR   4  -2.313  -3.309  -7.041
   28    HE2  TYR   4           HE2      TYR   4  -4.207  -5.448 -10.210
   29    HH   TYR   4           HH       TYR   4  -4.709  -3.020  -9.154
   30    H    THR   5           H        THR   5   1.424  -7.689 -11.813
   31    HA   THR   5           HA       THR   5   0.701  -6.100 -14.128
   32    HB   THR   5           HB       THR   5   1.440  -9.023 -13.893
   33    HG1  THR   5           HG1      THR   5   3.424  -8.321 -14.115
   34   HG21  THR   5          3HG2      THR   5   1.859  -8.469 -16.472
   35   HG22  THR   5          1HG2      THR   5   0.517  -7.366 -16.173
   36   HG23  THR   5          2HG2      THR   5   0.321  -9.093 -15.876
   37    H    ARG   6           H        ARG   6  -1.242  -6.034 -15.067
   38    HA   ARG   6           HA       ARG   6  -3.187  -8.149 -14.498
   39    HB2  ARG   6           2HB      ARG   6  -3.387  -5.304 -13.718
   40    HB3  ARG   6           3HB      ARG   6  -4.824  -5.995 -14.460
   41    HG2  ARG   6           2HG      ARG   6  -3.402  -7.146 -12.069
   42    HG3  ARG   6           3HG      ARG   6  -4.839  -6.124 -12.000
   43    HD2  ARG   6           2HD      ARG   6  -5.996  -7.818 -13.441
   44    HD3  ARG   6           3HD      ARG   6  -4.587  -8.858 -13.240
   45    HE   ARG   6           HE       ARG   6  -6.642  -8.319 -11.296
   46   HH11  ARG   6          1HH1      ARG   6  -3.364  -9.376 -11.803
   47   HH12  ARG   6          2HH1      ARG   6  -3.278 -10.254 -10.312
   48   HH21  ARG   6          1HH2      ARG   6  -6.542  -9.472  -9.330
   49   HH22  ARG   6          2HH2      ARG   6  -5.087 -10.309  -8.906
   50    H    CYS   7           H        CYS   7  -4.808  -8.400 -16.074
   51    HA   CYS   7           HA       CYS   7  -4.294  -6.955 -18.591
   52    HB2  CYS   7           2HB      CYS   7  -5.382  -9.761 -18.428
   53    HB3  CYS   7           3HB      CYS   7  -4.714  -8.933 -19.830
   54    H    TRP   8           H        TRP   8  -6.260  -7.239 -20.132
   55    HA   TRP   8           HA       TRP   8  -8.835  -7.377 -18.858
   56    HB2  TRP   8           2HB      TRP   8  -9.517  -5.126 -19.102
   57    HB3  TRP   8           3HB      TRP   8  -7.926  -5.045 -18.351
   58    HD1  TRP   8           HD1      TRP   8  -9.799  -4.067 -21.493
   59    HE1  TRP   8           HE1      TRP   8  -8.269  -2.622 -22.975
   60    HE3  TRP   8           HE3      TRP   8  -5.394  -4.706 -18.978
   61    HZ2  TRP   8           HZ2      TRP   8  -5.553  -1.856 -23.067
   62    HZ3  TRP   8           HZ3      TRP   8  -3.376  -3.584 -19.829
   63    HH2  TRP   8           HH2      TRP   8  -3.457  -2.189 -21.832
   64    H    LYS   9           H        LYS   9 -10.538  -7.533 -20.328
   65    HA   LYS   9           HA       LYS   9  -9.922  -8.610 -22.845
   66    HB2  LYS   9           2HB      LYS   9 -12.320  -8.599 -23.254
   67    HB3  LYS   9           3HB      LYS   9 -11.989  -9.124 -21.608
   68    HG2  LYS   9           2HG      LYS   9 -12.360  -6.578 -21.070
   69    HG3  LYS   9           3HG      LYS   9 -13.267  -6.624 -22.584
   70    HD2  LYS   9           2HD      LYS   9 -13.750  -8.688 -20.470
   71    HD3  LYS   9           3HD      LYS   9 -14.495  -7.093 -20.343
   72    HE2  LYS   9           2HE      LYS   9 -16.122  -8.253 -21.478
   73    HE3  LYS   9           3HE      LYS   9 -15.208  -7.557 -22.815
   74    HZ1  LYS   9           3HZ      LYS   9 -15.675 -10.274 -22.224
   75    HZ2  LYS   9           1HZ      LYS   9 -14.009  -9.980 -22.195
   76    HZ3  LYS   9           2HZ      LYS   9 -14.910  -9.600 -23.574
   77    H    VAL  10           H        VAL  10  -9.438  -7.678 -24.716
   78    HA   VAL  10           HA       VAL  10 -10.006  -4.807 -25.039
   79    HB   VAL  10           HB       VAL  10  -8.043  -6.288 -26.750
   80   HG11  VAL  10          1HG1      VAL  10  -7.993  -4.226 -27.617
   81   HG12  VAL  10          2HG1      VAL  10  -8.803  -3.520 -26.217
   82   HG13  VAL  10          3HG1      VAL  10  -7.060  -3.792 -26.185
   83   HG21  VAL  10          3HG2      VAL  10  -7.764  -5.625 -23.881
   84   HG22  VAL  10          1HG2      VAL  10  -6.983  -6.884 -24.838
   85   HG23  VAL  10          2HG2      VAL  10  -6.399  -5.222 -24.922
   86    H    GLY  11           H        GLY  11 -10.385  -4.091 -27.311
   87    HA2  GLY  11           2HA      GLY  11 -12.599  -5.425 -28.415
   88    HA3  GLY  11           3HA      GLY  11 -11.694  -4.137 -29.196
   89    H    ARG  12           H        ARG  12 -11.964  -5.178 -31.217
   90    HA   ARG  12           HA       ARG  12 -11.073  -7.834 -31.694
   91    HB2  ARG  12           2HB      ARG  12 -11.188  -7.140 -34.112
   92    HB3  ARG  12           3HB      ARG  12 -12.675  -6.914 -33.200
   93    HG2  ARG  12           2HG      ARG  12 -11.169  -4.523 -33.002
   94    HG3  ARG  12           3HG      ARG  12 -11.202  -5.011 -34.697
   95    HD2  ARG  12           2HD      ARG  12 -13.654  -4.855 -32.954
   96    HD3  ARG  12           3HD      ARG  12 -13.093  -3.526 -33.969
   97    HE   ARG  12           HE       ARG  12 -13.402  -5.949 -35.444
   98   HH11  ARG  12          1HH1      ARG  12 -15.129  -3.242 -34.099
   99   HH12  ARG  12          2HH1      ARG  12 -16.430  -3.338 -35.239
  100   HH21  ARG  12          1HH2      ARG  12 -15.109  -6.086 -36.951
  101   HH22  ARG  12          2HH2      ARG  12 -16.418  -4.957 -36.860
  102    H    ASN  13           H        ASN  13  -8.982  -7.715 -30.620
  103    HA   ASN  13           HA       ASN  13  -6.852  -7.472 -32.440
  104    HB2  ASN  13           2HB      ASN  13  -7.451  -5.008 -31.802
  105    HB3  ASN  13           3HB      ASN  13  -6.618  -5.385 -30.297
  106   HD21  ASN  13          1HD2      ASN  13  -4.975  -3.927 -30.712
  107   HD22  ASN  13          2HD2      ASN  13  -3.762  -4.215 -31.907
  108    H    GLY  14           H        GLY  14  -7.937  -9.288 -30.457
  109    HA2  GLY  14           2HA      GLY  14  -7.076 -10.857 -29.011
  110    HA3  GLY  14           3HA      GLY  14  -5.492 -10.146 -29.281
  111    H    ARG  15           H        ARG  15  -5.532 -10.861 -26.885
  112    HA   ARG  15           HA       ARG  15  -6.834  -8.954 -25.124
  113    HB2  ARG  15           2HB      ARG  15  -5.435 -11.545 -24.810
  114    HB3  ARG  15           3HB      ARG  15  -5.297 -10.423 -23.463
  115    HG2  ARG  15           2HG      ARG  15  -7.793 -10.257 -23.457
  116    HG3  ARG  15           3HG      ARG  15  -7.815 -11.562 -24.645
  117    HD2  ARG  15           2HD      ARG  15  -6.212 -12.017 -22.203
  118    HD3  ARG  15           3HD      ARG  15  -7.963 -11.971 -21.998
  119    HE   ARG  15           HE       ARG  15  -7.307 -13.647 -24.165
  120   HH11  ARG  15          1HH1      ARG  15  -7.142 -13.524 -20.690
  121   HH12  ARG  15          2HH1      ARG  15  -7.223 -15.244 -20.495
  122   HH21  ARG  15          1HH2      ARG  15  -7.413 -15.912 -23.922
  123   HH22  ARG  15          2HH2      ARG  15  -7.376 -16.601 -22.334
  124    H    VAL  16           H        VAL  16  -5.417  -8.112 -23.255
  125    HA   VAL  16           HA       VAL  16  -2.701  -7.438 -24.049
  126    HB   VAL  16           HB       VAL  16  -4.845  -5.349 -23.672
  127   HG11  VAL  16          1HG1      VAL  16  -2.950  -4.639 -22.381
  128   HG12  VAL  16          2HG1      VAL  16  -1.848  -5.025 -23.705
  129   HG13  VAL  16          3HG1      VAL  16  -2.998  -3.697 -23.871
  130   HG21  VAL  16          3HG2      VAL  16  -3.969  -4.552 -25.868
  131   HG22  VAL  16          1HG2      VAL  16  -2.960  -5.998 -25.933
  132   HG23  VAL  16          2HG2      VAL  16  -4.717  -6.148 -25.929
  133    H    CYS  17           H        CYS  17  -1.378  -6.879 -22.340
  134    HA   CYS  17           HA       CYS  17  -2.621  -6.866 -19.670
  135    HB2  CYS  17           2HB      CYS  17  -0.070  -8.276 -20.483
  136    HB3  CYS  17           3HB      CYS  17  -0.675  -8.148 -18.834
  137    H    MET  18           H        MET  18  -1.915  -5.341 -18.281
  138    HA   MET  18           HA       MET  18   0.501  -3.825 -18.980
  139    HB2  MET  18           2HB      MET  18  -0.562  -1.729 -18.673
  140    HB3  MET  18           3HB      MET  18  -1.618  -2.656 -19.731
  141    HG2  MET  18           2HG      MET  18  -3.027  -3.215 -17.794
  142    HG3  MET  18           3HG      MET  18  -1.990  -2.215 -16.779
  143    HE1  MET  18           3HE      MET  18  -3.602  -0.311 -15.918
  144    HE2  MET  18           1HE      MET  18  -2.044   0.206 -16.563
  145    HE3  MET  18           2HE      MET  18  -3.504   1.116 -16.950
  146    H    ARG  19           H        ARG  19   1.606  -2.893 -17.236
  147    HA   ARG  19           HA       ARG  19   1.232  -4.268 -14.734
  148    HB2  ARG  19           2HB      ARG  19   3.487  -3.959 -15.471
  149    HB3  ARG  19           3HB      ARG  19   3.246  -2.230 -15.678
  150    HG2  ARG  19           2HG      ARG  19   3.373  -1.801 -13.423
  151    HG3  ARG  19           3HG      ARG  19   2.894  -3.440 -12.978
  152    HD2  ARG  19           2HD      ARG  19   5.463  -2.994 -14.433
  153    HD3  ARG  19           3HD      ARG  19   5.375  -2.665 -12.703
  154    HE   ARG  19           HE       ARG  19   4.318  -5.163 -12.968
  155   HH11  ARG  19          1HH1      ARG  19   7.318  -3.659 -13.894
  156   HH12  ARG  19          2HH1      ARG  19   8.242  -5.118 -13.759
  157   HH21  ARG  19          1HH2      ARG  19   5.524  -7.091 -12.787
  158   HH22  ARG  19          2HH2      ARG  19   7.221  -7.070 -13.130
  159    H    VAL  20           H        VAL  20  -0.710  -3.504 -13.894
  160    HA   VAL  20           HA       VAL  20  -1.150  -0.678 -13.520
  161    HB   VAL  20           HB       VAL  20  -3.013  -2.286 -13.936
  162   HG11  VAL  20          1HG1      VAL  20  -3.776  -3.770 -12.253
  163   HG12  VAL  20          2HG1      VAL  20  -2.045  -4.062 -12.429
  164   HG13  VAL  20          3HG1      VAL  20  -2.648  -3.116 -11.067
  165   HG21  VAL  20          3HG2      VAL  20  -3.058  -0.009 -12.559
  166   HG22  VAL  20          1HG2      VAL  20  -4.501  -0.994 -12.799
  167   HG23  VAL  20          2HG2      VAL  20  -3.604  -1.098 -11.284
  168    H    CYS  21           H        CYS  21  -1.330   0.389 -11.509
  169    HA   CYS  21           HA       CYS  21   0.027  -0.953  -9.265
  170    HB2  CYS  21           2HB      CYS  21   1.246   0.966 -10.677
  171    HB3  CYS  21           3HB      CYS  21   0.334   1.990  -9.572
  172    H    THR  22           H        THR  22  -0.901  -0.747  -7.306
  173    HA   THR  22           HA       THR  22  -2.456  -0.263  -5.715
  174    HB   THR  22           HB       THR  22  -3.279   2.334  -6.820
  175    HG1  THR  22           HG1      THR  22  -0.545   1.751  -6.279
  176   HG21  THR  22          3HG2      THR  22  -2.371   2.995  -4.497
  177   HG22  THR  22          1HG2      THR  22  -2.239   1.259  -4.218
  178   HG23  THR  22          2HG2      THR  22  -3.810   1.978  -4.573
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1   3.245  -4.934  -0.877
    2    HA   ARG   1           HA       ARG   1   2.684  -2.191  -1.560
    3    HB2  ARG   1           2HB      ARG   1   4.964  -1.392  -1.492
    4    HB3  ARG   1           3HB      ARG   1   4.509  -1.971   0.105
    5    HG2  ARG   1           2HG      ARG   1   5.655  -4.137  -0.479
    6    HG3  ARG   1           3HG      ARG   1   6.290  -3.314  -1.906
    7    HD2  ARG   1           2HD      ARG   1   6.629  -2.049   0.772
    8    HD3  ARG   1           3HD      ARG   1   7.668  -3.403   0.328
    9    HE   ARG   1           HE       ARG   1   7.667  -1.530  -1.762
   10   HH11  ARG   1          1HH1      ARG   1   8.788  -1.884   1.515
   11   HH12  ARG   1          2HH1      ARG   1  10.135  -0.814   1.309
   12   HH21  ARG   1          1HH2      ARG   1   9.437  -0.119  -2.046
   13   HH22  ARG   1          2HH2      ARG   1  10.502   0.190  -0.718
   14    H    GLY   2           H        GLY   2   4.025  -1.562  -3.571
   15    HA2  GLY   2           2HA      GLY   2   5.178  -2.307  -5.541
   16    HA3  GLY   2           3HA      GLY   2   4.588  -3.932  -5.223
   17    H    CYS   3           H        CYS   3   4.187  -3.407  -7.669
   18    HA   CYS   3           HA       CYS   3   1.538  -2.168  -7.975
   19    HB2  CYS   3           2HB      CYS   3   3.456  -2.916 -10.184
   20    HB3  CYS   3           3HB      CYS   3   2.046  -1.868 -10.294
   21    H    TYR   4           H        TYR   4  -0.172  -3.290  -8.795
   22    HA   TYR   4           HA       TYR   4   0.126  -6.193  -8.879
   23    HB2  TYR   4           2HB      TYR   4  -2.344  -4.448  -8.836
   24    HB3  TYR   4           3HB      TYR   4  -2.358  -6.208  -8.831
   25    HD1  TYR   4           HD1      TYR   4  -1.137  -7.378  -6.881
   26    HD2  TYR   4           HD2      TYR   4  -2.261  -3.275  -6.824
   27    HE1  TYR   4           HE1      TYR   4  -0.985  -7.377  -4.426
   28    HE2  TYR   4           HE2      TYR   4  -2.112  -3.262  -4.369
   29    HH   TYR   4           HH       TYR   4  -2.311  -5.543  -2.503
   30    H    THR   5           H        THR   5  -0.921  -7.441 -10.564
   31    HA   THR   5           HA       THR   5  -0.577  -6.173 -13.173
   32    HB   THR   5           HB       THR   5  -0.903  -9.084 -12.424
   33    HG1  THR   5           HG1      THR   5   1.135  -8.241 -11.883
   34   HG21  THR   5          3HG2      THR   5  -1.743  -9.056 -14.576
   35   HG22  THR   5          1HG2      THR   5  -0.022  -9.294 -14.879
   36   HG23  THR   5          2HG2      THR   5  -0.737  -7.692 -15.064
   37    H    ARG   6           H        ARG   6  -2.160  -6.088 -14.737
   38    HA   ARG   6           HA       ARG   6  -4.835  -7.057 -14.026
   39    HB2  ARG   6           2HB      ARG   6  -3.992  -4.281 -14.223
   40    HB3  ARG   6           3HB      ARG   6  -5.304  -4.647 -15.336
   41    HG2  ARG   6           2HG      ARG   6  -5.570  -5.585 -12.536
   42    HG3  ARG   6           3HG      ARG   6  -5.741  -3.857 -12.852
   43    HD2  ARG   6           2HD      ARG   6  -7.311  -4.748 -14.792
   44    HD3  ARG   6           3HD      ARG   6  -7.452  -6.132 -13.708
   45    HE   ARG   6           HE       ARG   6  -7.873  -3.637 -12.373
   46   HH11  ARG   6          1HH1      ARG   6  -9.379  -6.078 -14.346
   47   HH12  ARG   6          2HH1      ARG   6 -10.981  -5.726 -13.788
   48   HH21  ARG   6          1HH2      ARG   6  -9.978  -3.164 -11.631
   49   HH22  ARG   6          2HH2      ARG   6 -11.321  -4.068 -12.244
   50    H    CYS   7           H        CYS   7  -6.322  -7.099 -15.887
   51    HA   CYS   7           HA       CYS   7  -5.217  -6.882 -18.535
   52    HB2  CYS   7           2HB      CYS   7  -4.798  -9.297 -17.241
   53    HB3  CYS   7           3HB      CYS   7  -6.238  -9.596 -18.209
   54    H    TRP   8           H        TRP   8  -6.819  -7.365 -20.209
   55    HA   TRP   8           HA       TRP   8  -9.549  -7.822 -19.462
   56    HB2  TRP   8           2HB      TRP   8 -10.470  -5.687 -19.992
   57    HB3  TRP   8           3HB      TRP   8  -9.153  -5.398 -18.858
   58    HD1  TRP   8           HD1      TRP   8 -10.294  -4.599 -22.365
   59    HE1  TRP   8           HE1      TRP   8  -8.619  -2.980 -23.460
   60    HE3  TRP   8           HE3      TRP   8  -6.562  -4.808 -18.876
   61    HZ2  TRP   8           HZ2      TRP   8  -6.056  -1.930 -22.917
   62    HZ3  TRP   8           HZ3      TRP   8  -4.532  -3.466 -19.239
   63    HH2  TRP   8           HH2      TRP   8  -4.286  -2.058 -21.219
   64    H    LYS   9           H        LYS   9 -10.919  -8.141 -21.256
   65    HA   LYS   9           HA       LYS   9  -9.581  -9.075 -23.596
   66    HB2  LYS   9           2HB      LYS   9 -11.745  -9.761 -24.363
   67    HB3  LYS   9           3HB      LYS   9 -11.661 -10.088 -22.637
   68    HG2  LYS   9           2HG      LYS   9 -12.815  -7.813 -22.354
   69    HG3  LYS   9           3HG      LYS   9 -13.194  -7.954 -24.072
   70    HD2  LYS   9           2HD      LYS   9 -14.589  -9.761 -23.753
   71    HD3  LYS   9           3HD      LYS   9 -13.795 -10.242 -22.251
   72    HE2  LYS   9           2HE      LYS   9 -15.250  -9.072 -21.042
   73    HE3  LYS   9           3HE      LYS   9 -14.933  -7.616 -21.984
   74    HZ1  LYS   9           3HZ      LYS   9 -16.649  -9.689 -23.147
   75    HZ2  LYS   9           1HZ      LYS   9 -16.689  -8.011 -23.362
   76    HZ3  LYS   9           2HZ      LYS   9 -17.295  -8.696 -21.939
   77    H    VAL  10           H        VAL  10  -9.198  -8.072 -25.470
   78    HA   VAL  10           HA       VAL  10 -10.377  -5.399 -25.864
   79    HB   VAL  10           HB       VAL  10  -7.885  -6.284 -27.269
   80   HG11  VAL  10          1HG1      VAL  10  -7.599  -3.666 -26.625
   81   HG12  VAL  10          2HG1      VAL  10  -8.317  -4.250 -28.127
   82   HG13  VAL  10          3HG1      VAL  10  -9.352  -3.787 -26.776
   83   HG21  VAL  10          3HG2      VAL  10  -6.602  -5.199 -25.389
   84   HG22  VAL  10          1HG2      VAL  10  -8.082  -5.295 -24.433
   85   HG23  VAL  10          2HG2      VAL  10  -7.312  -6.770 -25.017
   86    H    GLY  11           H        GLY  11 -10.572  -4.739 -28.186
   87    HA2  GLY  11           2HA      GLY  11 -12.211  -6.550 -29.582
   88    HA3  GLY  11           3HA      GLY  11 -11.549  -5.060 -30.237
   89    H    ARG  12           H        ARG  12 -11.173  -5.986 -32.263
   90    HA   ARG  12           HA       ARG  12  -9.669  -8.373 -32.612
   91    HB2  ARG  12           2HB      ARG  12 -10.504  -6.142 -34.446
   92    HB3  ARG  12           3HB      ARG  12  -9.432  -7.420 -35.004
   93    HG2  ARG  12           2HG      ARG  12 -11.208  -9.053 -34.226
   94    HG3  ARG  12           3HG      ARG  12 -12.273  -7.655 -34.066
   95    HD2  ARG  12           2HD      ARG  12 -12.445  -7.358 -36.310
   96    HD3  ARG  12           3HD      ARG  12 -10.806  -7.929 -36.620
   97    HE   ARG  12           HE       ARG  12 -12.198 -10.148 -35.813
   98   HH11  ARG  12          1HH1      ARG  12 -12.518  -7.787 -38.351
   99   HH12  ARG  12          2HH1      ARG  12 -13.269  -8.888 -39.458
  100   HH21  ARG  12          1HH2      ARG  12 -13.187 -11.607 -37.261
  101   HH22  ARG  12          2HH2      ARG  12 -13.650 -11.060 -38.837
  102    H    ASN  13           H        ASN  13  -7.889  -7.849 -31.143
  103    HA   ASN  13           HA       ASN  13  -5.561  -7.100 -32.531
  104    HB2  ASN  13           2HB      ASN  13  -6.776  -4.841 -32.027
  105    HB3  ASN  13           3HB      ASN  13  -6.178  -5.090 -30.390
  106   HD21  ASN  13          1HD2      ASN  13  -4.172  -4.489 -29.931
  107   HD22  ASN  13          2HD2      ASN  13  -2.980  -4.015 -31.088
  108    H    GLY  14           H        GLY  14  -6.587  -9.172 -30.777
  109    HA2  GLY  14           2HA      GLY  14  -5.752 -10.559 -29.147
  110    HA3  GLY  14           3HA      GLY  14  -4.277  -9.605 -29.203
  111    H    ARG  15           H        ARG  15  -4.570 -10.328 -26.820
  112    HA   ARG  15           HA       ARG  15  -6.318  -8.499 -25.351
  113    HB2  ARG  15           2HB      ARG  15  -4.746 -10.940 -24.538
  114    HB3  ARG  15           3HB      ARG  15  -5.504  -9.875 -23.361
  115    HG2  ARG  15           2HG      ARG  15  -7.606 -10.326 -24.957
  116    HG3  ARG  15           3HG      ARG  15  -6.713 -11.827 -25.211
  117    HD2  ARG  15           2HD      ARG  15  -7.448 -10.699 -22.513
  118    HD3  ARG  15           3HD      ARG  15  -8.361 -11.948 -23.359
  119    HE   ARG  15           HE       ARG  15  -5.859 -12.972 -23.253
  120   HH11  ARG  15          1HH1      ARG  15  -8.009 -11.648 -20.856
  121   HH12  ARG  15          2HH1      ARG  15  -7.396 -12.637 -19.572
  122   HH21  ARG  15          1HH2      ARG  15  -5.044 -14.279 -21.571
  123   HH22  ARG  15          2HH2      ARG  15  -5.709 -14.133 -19.980
  124    H    VAL  16           H        VAL  16  -5.308  -7.659 -23.232
  125    HA   VAL  16           HA       VAL  16  -2.488  -7.003 -23.427
  126    HB   VAL  16           HB       VAL  16  -4.643  -4.912 -23.661
  127   HG11  VAL  16          1HG1      VAL  16  -2.782  -3.253 -23.390
  128   HG12  VAL  16          2HG1      VAL  16  -3.231  -4.114 -21.916
  129   HG13  VAL  16          3HG1      VAL  16  -1.776  -4.576 -22.801
  130   HG21  VAL  16          3HG2      VAL  16  -3.139  -4.138 -25.519
  131   HG22  VAL  16          1HG2      VAL  16  -2.208  -5.618 -25.286
  132   HG23  VAL  16          2HG2      VAL  16  -3.899  -5.708 -25.778
  133    H    CYS  17           H        CYS  17  -1.571  -6.541 -21.473
  134    HA   CYS  17           HA       CYS  17  -3.387  -6.518 -19.151
  135    HB2  CYS  17           2HB      CYS  17  -0.639  -7.732 -19.461
  136    HB3  CYS  17           3HB      CYS  17  -1.430  -7.524 -17.902
  137    H    MET  18           H        MET  18  -3.305  -4.800 -17.858
  138    HA   MET  18           HA       MET  18  -1.175  -2.836 -18.296
  139    HB2  MET  18           2HB      MET  18  -2.682  -1.271 -17.096
  140    HB3  MET  18           3HB      MET  18  -3.414  -1.961 -18.539
  141    HG2  MET  18           2HG      MET  18  -4.653  -3.545 -17.160
  142    HG3  MET  18           3HG      MET  18  -3.912  -2.866 -15.713
  143    HE1  MET  18           3HE      MET  18  -5.896  -0.238 -14.578
  144    HE2  MET  18           1HE      MET  18  -6.655  -1.830 -14.546
  145    HE3  MET  18           2HE      MET  18  -4.909  -1.682 -14.349
  146    H    ARG  19           H        ARG  19   0.033  -1.972 -16.607
  147    HA   ARG  19           HA       ARG  19   0.119  -3.655 -14.202
  148    HB2  ARG  19           2HB      ARG  19   2.401  -2.606 -13.902
  149    HB3  ARG  19           3HB      ARG  19   2.220  -3.647 -15.308
  150    HG2  ARG  19           2HG      ARG  19   2.625  -1.981 -16.740
  151    HG3  ARG  19           3HG      ARG  19   1.630  -0.836 -15.839
  152    HD2  ARG  19           2HD      ARG  19   3.383  -0.263 -14.404
  153    HD3  ARG  19           3HD      ARG  19   4.312  -1.702 -14.820
  154    HE   ARG  19           HE       ARG  19   4.120  -0.303 -17.159
  155   HH11  ARG  19          1HH1      ARG  19   5.288   0.387 -13.952
  156   HH12  ARG  19          2HH1      ARG  19   6.483   1.520 -14.490
  157   HH21  ARG  19          1HH2      ARG  19   5.690   1.187 -17.879
  158   HH22  ARG  19          2HH2      ARG  19   6.710   1.975 -16.724
  159    H    VAL  20           H        VAL  20  -1.519  -2.658 -13.015
  160    HA   VAL  20           HA       VAL  20  -1.445   0.186 -12.515
  161    HB   VAL  20           HB       VAL  20  -3.584  -1.099 -12.649
  162   HG11  VAL  20          1HG1      VAL  20  -2.700  -3.076 -11.377
  163   HG12  VAL  20          2HG1      VAL  20  -2.867  -2.115  -9.906
  164   HG13  VAL  20          3HG1      VAL  20  -4.291  -2.510 -10.869
  165   HG21  VAL  20          3HG2      VAL  20  -3.159   1.114 -11.364
  166   HG22  VAL  20          1HG2      VAL  20  -4.677   0.251 -11.116
  167   HG23  VAL  20          2HG2      VAL  20  -3.384   0.122  -9.924
  168    H    CYS  21           H        CYS  21  -0.935   1.200 -10.590
  169    HA   CYS  21           HA       CYS  21   0.363  -0.463  -8.537
  170    HB2  CYS  21           2HB      CYS  21   1.776   1.119 -10.218
  171    HB3  CYS  21           3HB      CYS  21   1.424   2.270  -8.934
  172    H    THR  22           H        THR  22   0.498   0.571  -6.409
  173    HA   THR  22           HA       THR  22  -1.991   1.897  -5.778
  174    HB   THR  22           HB       THR  22  -0.726   1.830  -3.400
  175    HG1  THR  22           HG1      THR  22   0.720   0.185  -3.311
  176   HG21  THR  22          3HG2      THR  22  -2.886   0.728  -4.162
  177   HG22  THR  22          1HG2      THR  22  -1.975  -0.119  -2.913
  178   HG23  THR  22          2HG2      THR  22  -1.905  -0.674  -4.586
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1  -8.071   0.348 -11.577
    2    HA   ARG   1           HA       ARG   1  -5.359  -0.165 -12.381
    3    HB2  ARG   1           2HB      ARG   1  -6.242   2.552 -11.995
    4    HB3  ARG   1           3HB      ARG   1  -5.040   2.129 -10.784
    5    HG2  ARG   1           2HG      ARG   1  -3.404   1.684 -12.396
    6    HG3  ARG   1           3HG      ARG   1  -4.591   1.597 -13.699
    7    HD2  ARG   1           2HD      ARG   1  -5.039   4.101 -12.886
    8    HD3  ARG   1           3HD      ARG   1  -3.350   3.953 -12.405
    9    HE   ARG   1           HE       ARG   1  -4.387   4.099 -15.086
   10   HH11  ARG   1          1HH1      ARG   1  -1.723   3.096 -13.082
   11   HH12  ARG   1          2HH1      ARG   1  -0.563   3.158 -14.367
   12   HH21  ARG   1          1HH2      ARG   1  -2.869   4.185 -16.786
   13   HH22  ARG   1          2HH2      ARG   1  -1.215   3.779 -16.474
   14    H    GLY   2           H        GLY   2  -3.922  -0.475 -10.538
   15    HA2  GLY   2           2HA      GLY   2  -4.535  -0.279  -7.870
   16    HA3  GLY   2           3HA      GLY   2  -5.279  -1.785  -8.384
   17    H    CYS   3           H        CYS   3  -3.598  -2.312  -6.564
   18    HA   CYS   3           HA       CYS   3  -0.874  -2.545  -7.493
   19    HB2  CYS   3           2HB      CYS   3  -1.966  -2.338  -5.015
   20    HB3  CYS   3           3HB      CYS   3  -1.708  -4.077  -5.108
   21    H    TYR   4           H        TYR   4   0.139  -4.846  -6.939
   22    HA   TYR   4           HA       TYR   4   0.401  -7.009  -7.592
   23    HB2  TYR   4           2HB      TYR   4  -2.619  -7.136  -7.638
   24    HB3  TYR   4           3HB      TYR   4  -1.504  -8.493  -7.516
   25    HD1  TYR   4           HD2      TYR   4   0.403  -7.446  -5.493
   26    HD2  TYR   4           HD1      TYR   4  -3.845  -7.254  -5.651
   27    HE1  TYR   4           HE2      TYR   4   0.324  -7.292  -3.039
   28    HE2  TYR   4           HE1      TYR   4  -3.935  -7.099  -3.198
   29    HH   TYR   4           HH       TYR   4  -1.178  -7.661  -1.219
   30    H    THR   5           H        THR   5   0.203  -8.450  -9.442
   31    HA   THR   5           HA       THR   5   0.062  -6.977 -11.895
   32    HB   THR   5           HB       THR   5   0.492  -9.929 -11.398
   33    HG1  THR   5           HG1      THR   5   2.653  -9.410 -11.664
   34   HG21  THR   5          3HG2      THR   5   1.599  -9.239 -13.853
   35   HG22  THR   5          1HG2      THR   5   0.023  -8.448 -13.846
   36   HG23  THR   5          2HG2      THR   5   0.137 -10.189 -13.589
   37    H    ARG   6           H        ARG   6  -1.644  -6.711 -13.172
   38    HA   ARG   6           HA       ARG   6  -3.783  -8.716 -13.147
   39    HB2  ARG   6           2HB      ARG   6  -4.080  -5.762 -12.659
   40    HB3  ARG   6           3HB      ARG   6  -5.406  -6.718 -13.305
   41    HG2  ARG   6           2HG      ARG   6  -4.684  -8.219 -11.169
   42    HG3  ARG   6           3HG      ARG   6  -4.316  -6.594 -10.588
   43    HD2  ARG   6           2HD      ARG   6  -6.924  -7.110 -11.942
   44    HD3  ARG   6           3HD      ARG   6  -6.705  -7.622 -10.269
   45    HE   ARG   6           HE       ARG   6  -5.919  -4.909 -10.679
   46   HH11  ARG   6          1HH1      ARG   6  -8.661  -6.996 -10.186
   47   HH12  ARG   6          2HH1      ARG   6  -9.649  -5.751  -9.494
   48   HH21  ARG   6          1HH2      ARG   6  -7.209  -3.262  -9.769
   49   HH22  ARG   6          2HH2      ARG   6  -8.822  -3.628  -9.258
   50    H    CYS   7           H        CYS   7  -4.844  -8.994 -15.086
   51    HA   CYS   7           HA       CYS   7  -4.084  -7.260 -17.324
   52    HB2  CYS   7           2HB      CYS   7  -4.066 -10.263 -17.592
   53    HB3  CYS   7           3HB      CYS   7  -3.450  -9.067 -18.727
   54    H    TRP   8           H        TRP   8  -5.678  -6.908 -18.784
   55    HA   TRP   8           HA       TRP   8  -8.038  -8.619 -18.789
   56    HB2  TRP   8           2HB      TRP   8  -9.525  -6.585 -18.629
   57    HB3  TRP   8           3HB      TRP   8  -8.691  -7.020 -17.140
   58    HD1  TRP   8           HD1      TRP   8  -9.128  -4.196 -19.568
   59    HE1  TRP   8           HE1      TRP   8  -7.706  -2.183 -18.825
   60    HE3  TRP   8           HE3      TRP   8  -6.329  -6.472 -15.945
   61    HZ2  TRP   8           HZ2      TRP   8  -5.667  -1.633 -16.952
   62    HZ3  TRP   8           HZ3      TRP   8  -4.664  -5.132 -14.725
   63    HH2  TRP   8           HH2      TRP   8  -4.341  -2.764 -15.220
   64    H    LYS   9           H        LYS   9  -9.174  -8.596 -20.709
   65    HA   LYS   9           HA       LYS   9  -7.744  -7.569 -22.987
   66    HB2  LYS   9           2HB      LYS   9  -8.854  -9.799 -22.975
   67    HB3  LYS   9           3HB      LYS   9 -10.413  -8.988 -22.890
   68    HG2  LYS   9           2HG      LYS   9  -8.857  -7.954 -25.077
   69    HG3  LYS   9           3HG      LYS   9  -8.997  -9.710 -25.180
   70    HD2  LYS   9           2HD      LYS   9 -11.530  -9.141 -24.586
   71    HD3  LYS   9           3HD      LYS   9 -11.092  -7.616 -25.359
   72    HE2  LYS   9           2HE      LYS   9 -11.098  -8.539 -27.392
   73    HE3  LYS   9           3HE      LYS   9 -10.147  -9.921 -26.851
   74    HZ1  LYS   9           3HZ      LYS   9 -12.220 -10.869 -25.936
   75    HZ2  LYS   9           1HZ      LYS   9 -12.264 -10.683 -27.617
   76    HZ3  LYS   9           2HZ      LYS   9 -13.088  -9.590 -26.624
   77    H    VAL  10           H        VAL  10  -8.095  -5.709 -24.005
   78    HA   VAL  10           HA       VAL  10 -10.664  -4.331 -23.570
   79    HB   VAL  10           HB       VAL  10  -8.070  -2.858 -23.960
   80   HG11  VAL  10          1HG1      VAL  10  -9.494  -1.131 -22.658
   81   HG12  VAL  10          2HG1      VAL  10  -9.833  -1.408 -24.367
   82   HG13  VAL  10          3HG1      VAL  10 -10.856  -2.145 -23.133
   83   HG21  VAL  10          3HG2      VAL  10  -7.433  -3.626 -21.951
   84   HG22  VAL  10          1HG2      VAL  10  -8.657  -2.527 -21.315
   85   HG23  VAL  10          2HG2      VAL  10  -9.045  -4.229 -21.564
   86    H    GLY  11           H        GLY  11 -11.300  -2.852 -25.276
   87    HA2  GLY  11           2HA      GLY  11 -11.788  -2.475 -27.491
   88    HA3  GLY  11           3HA      GLY  11 -10.043  -2.457 -27.699
   89    H    ARG  12           H        ARG  12 -10.467  -3.341 -29.822
   90    HA   ARG  12           HA       ARG  12 -10.861  -6.257 -29.718
   91    HB2  ARG  12           2HB      ARG  12 -11.760  -4.465 -31.979
   92    HB3  ARG  12           3HB      ARG  12 -12.030  -6.197 -31.830
   93    HG2  ARG  12           2HG      ARG  12 -13.292  -5.583 -29.665
   94    HG3  ARG  12           3HG      ARG  12 -13.323  -3.953 -30.339
   95    HD2  ARG  12           2HD      ARG  12 -14.075  -5.843 -32.354
   96    HD3  ARG  12           3HD      ARG  12 -15.051  -6.103 -30.909
   97    HE   ARG  12           HE       ARG  12 -15.186  -3.876 -32.702
   98   HH11  ARG  12          1HH1      ARG  12 -15.701  -4.900 -29.415
   99   HH12  ARG  12          2HH1      ARG  12 -16.873  -3.669 -29.078
  100   HH21  ARG  12          1HH2      ARG  12 -16.727  -2.251 -32.270
  101   HH22  ARG  12          2HH2      ARG  12 -17.456  -2.163 -30.703
  102    H    ASN  13           H        ASN  13  -8.367  -5.386 -29.459
  103    HA   ASN  13           HA       ASN  13  -7.080  -6.382 -31.811
  104    HB2  ASN  13           2HB      ASN  13  -7.580  -3.772 -32.066
  105    HB3  ASN  13           3HB      ASN  13  -6.100  -3.656 -31.119
  106   HD21  ASN  13          1HD2      ASN  13  -4.401  -3.342 -32.341
  107   HD22  ASN  13          2HD2      ASN  13  -4.121  -4.026 -33.902
  108    H    GLY  14           H        GLY  14  -7.034  -7.462 -29.368
  109    HA2  GLY  14           2HA      GLY  14  -4.956  -8.424 -28.452
  110    HA3  GLY  14           3HA      GLY  14  -4.340  -6.781 -28.359
  111    H    ARG  15           H        ARG  15  -3.978  -7.740 -26.094
  112    HA   ARG  15           HA       ARG  15  -6.293  -6.995 -24.436
  113    HB2  ARG  15           2HB      ARG  15  -4.353  -9.261 -23.944
  114    HB3  ARG  15           3HB      ARG  15  -5.568  -8.716 -22.796
  115    HG2  ARG  15           2HG      ARG  15  -7.022 -10.103 -23.715
  116    HG3  ARG  15           3HG      ARG  15  -6.904  -9.202 -25.228
  117    HD2  ARG  15           2HD      ARG  15  -6.394 -11.443 -25.765
  118    HD3  ARG  15           3HD      ARG  15  -4.853 -10.587 -25.742
  119    HE   ARG  15           HE       ARG  15  -5.491 -11.812 -23.232
  120   HH11  ARG  15          1HH1      ARG  15  -4.131 -12.351 -26.391
  121   HH12  ARG  15          2HH1      ARG  15  -3.154 -13.690 -25.885
  122   HH21  ARG  15          1HH2      ARG  15  -4.210 -13.573 -22.554
  123   HH22  ARG  15          2HH2      ARG  15  -3.201 -14.385 -23.702
  124    H    VAL  16           H        VAL  16  -5.450  -6.742 -22.038
  125    HA   VAL  16           HA       VAL  16  -2.991  -5.116 -22.144
  126    HB   VAL  16           HB       VAL  16  -5.564  -4.595 -20.666
  127   HG11  VAL  16          1HG1      VAL  16  -3.965  -4.173 -19.005
  128   HG12  VAL  16          2HG1      VAL  16  -2.819  -3.487 -20.159
  129   HG13  VAL  16          3HG1      VAL  16  -4.280  -2.596 -19.729
  130   HG21  VAL  16          3HG2      VAL  16  -5.554  -3.710 -22.885
  131   HG22  VAL  16          1HG2      VAL  16  -5.301  -2.365 -21.773
  132   HG23  VAL  16          2HG2      VAL  16  -3.939  -3.036 -22.669
  133    H    CYS  17           H        CYS  17  -1.549  -5.283 -20.465
  134    HA   CYS  17           HA       CYS  17  -2.206  -6.990 -18.192
  135    HB2  CYS  17           2HB      CYS  17  -1.124  -8.289 -20.199
  136    HB3  CYS  17           3HB      CYS  17   0.364  -7.534 -19.635
  137    H    MET  18           H        MET  18  -1.831  -5.591 -16.588
  138    HA   MET  18           HA       MET  18   0.377  -3.716 -16.728
  139    HB2  MET  18           2HB      MET  18  -1.866  -4.167 -14.775
  140    HB3  MET  18           3HB      MET  18  -0.530  -3.087 -14.399
  141    HG2  MET  18           2HG      MET  18  -2.303  -2.824 -16.815
  142    HG3  MET  18           3HG      MET  18  -2.532  -1.947 -15.303
  143    HE1  MET  18           3HE      MET  18  -0.714  -0.243 -18.727
  144    HE2  MET  18           1HE      MET  18  -0.231  -1.940 -18.720
  145    HE3  MET  18           2HE      MET  18  -1.926  -1.505 -18.497
  146    H    ARG  19           H        ARG  19   2.113  -3.634 -15.285
  147    HA   ARG  19           HA       ARG  19   3.077  -6.184 -14.421
  148    HB2  ARG  19           2HB      ARG  19   4.134  -3.381 -14.341
  149    HB3  ARG  19           3HB      ARG  19   4.930  -4.643 -13.410
  150    HG2  ARG  19           2HG      ARG  19   4.881  -5.923 -15.699
  151    HG3  ARG  19           3HG      ARG  19   4.739  -4.292 -16.356
  152    HD2  ARG  19           2HD      ARG  19   7.046  -4.753 -16.313
  153    HD3  ARG  19           3HD      ARG  19   6.750  -3.699 -14.930
  154    HE   ARG  19           HE       ARG  19   6.552  -6.312 -14.019
  155   HH11  ARG  19          1HH1      ARG  19   8.970  -4.231 -15.412
  156   HH12  ARG  19          2HH1      ARG  19  10.292  -5.013 -14.611
  157   HH21  ARG  19          1HH2      ARG  19   8.284  -7.351 -12.959
  158   HH22  ARG  19          2HH2      ARG  19   9.901  -6.788 -13.217
  159    H    VAL  20           H        VAL  20   3.854  -6.626 -12.229
  160    HA   VAL  20           HA       VAL  20   1.891  -6.516 -10.306
  161    HB   VAL  20           HB       VAL  20   3.681  -8.069 -10.038
  162   HG11  VAL  20          1HG1      VAL  20   5.322  -5.781 -10.607
  163   HG12  VAL  20          2HG1      VAL  20   5.876  -6.580  -9.134
  164   HG13  VAL  20          3HG1      VAL  20   5.742  -7.493 -10.638
  165   HG21  VAL  20          3HG2      VAL  20   4.241  -7.783  -7.719
  166   HG22  VAL  20          1HG2      VAL  20   3.940  -6.048  -7.816
  167   HG23  VAL  20          2HG2      VAL  20   2.602  -7.186  -7.978
  168    H    CYS  21           H        CYS  21   0.949  -4.656  -9.695
  169    HA   CYS  21           HA       CYS  21   0.649  -2.607  -8.754
  170    HB2  CYS  21           2HB      CYS  21   2.265  -3.927  -7.068
  171    HB3  CYS  21           3HB      CYS  21   3.343  -2.604  -7.501
  172    H    THR  22           H        THR  22   1.662  -0.356  -8.525
  173    HA   THR  22           HA       THR  22   3.456   0.142 -10.811
  174    HB   THR  22           HB       THR  22   1.238   0.888 -11.421
  175    HG1  THR  22           HG1      THR  22   1.840   2.908 -12.024
  176   HG21  THR  22          3HG2      THR  22   0.362   2.906  -9.980
  177   HG22  THR  22          1HG2      THR  22   1.295   2.123  -8.705
  178   HG23  THR  22          2HG2      THR  22  -0.002   1.245  -9.515
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1  -0.408  -3.758  -0.005
    2    HA   ARG   1           HA       ARG   1  -0.353  -1.627  -2.025
    3    HB2  ARG   1           2HB      ARG   1   0.757  -1.878   0.601
    4    HB3  ARG   1           3HB      ARG   1   2.071  -1.698  -0.553
    5    HG2  ARG   1           2HG      ARG   1   1.665   0.490  -0.129
    6    HG3  ARG   1           3HG      ARG   1   0.517   0.253  -1.449
    7    HD2  ARG   1           2HD      ARG   1  -1.269  -0.135   0.173
    8    HD3  ARG   1           3HD      ARG   1  -0.122   0.085   1.494
    9    HE   ARG   1           HE       ARG   1  -0.261   2.322  -0.306
   10   HH11  ARG   1          1HH1      ARG   1  -1.640   0.827   2.519
   11   HH12  ARG   1          2HH1      ARG   1  -2.278   2.308   3.152
   12   HH21  ARG   1          1HH2      ARG   1  -1.095   4.279   0.517
   13   HH22  ARG   1          2HH2      ARG   1  -1.968   4.271   2.012
   14    H    GLY   2           H        GLY   2   2.040  -1.393  -2.927
   15    HA2  GLY   2           2HA      GLY   2   3.945  -2.511  -3.823
   16    HA3  GLY   2           3HA      GLY   2   3.102  -4.041  -3.625
   17    H    CYS   3           H        CYS   3   4.151  -4.006  -5.931
   18    HA   CYS   3           HA       CYS   3   2.297  -2.801  -7.859
   19    HB2  CYS   3           2HB      CYS   3   4.923  -4.162  -8.468
   20    HB3  CYS   3           3HB      CYS   3   3.996  -3.093  -9.516
   21    H    TYR   4           H        TYR   4   1.104  -4.004  -9.265
   22    HA   TYR   4           HA       TYR   4   1.411  -6.921  -9.205
   23    HB2  TYR   4           2HB      TYR   4  -1.102  -7.112  -9.117
   24    HB3  TYR   4           3HB      TYR   4  -0.347  -6.547  -7.631
   25    HD1  TYR   4           HD1      TYR   4  -0.632  -4.243  -6.887
   26    HD2  TYR   4           HD2      TYR   4  -2.501  -5.645 -10.442
   27    HE1  TYR   4           HE1      TYR   4  -2.095  -2.265  -6.891
   28    HE2  TYR   4           HE2      TYR   4  -3.969  -3.671 -10.456
   29    HH   TYR   4           HH       TYR   4  -4.504  -1.768  -9.455
   30    H    THR   5           H        THR   5   0.390  -8.012 -11.008
   31    HA   THR   5           HA       THR   5   0.385  -6.322 -13.405
   32    HB   THR   5           HB       THR   5   0.659  -9.319 -13.118
   33    HG1  THR   5           HG1      THR   5   2.781  -8.956 -13.528
   34   HG21  THR   5          3HG2      THR   5   1.297  -9.112 -15.591
   35   HG22  THR   5          1HG2      THR   5   0.483  -7.549 -15.542
   36   HG23  THR   5          2HG2      THR   5  -0.417  -9.024 -15.186
   37    H    ARG   6           H        ARG   6  -1.397  -6.002 -14.591
   38    HA   ARG   6           HA       ARG   6  -3.717  -7.750 -14.167
   39    HB2  ARG   6           2HB      ARG   6  -3.621  -4.756 -13.924
   40    HB3  ARG   6           3HB      ARG   6  -5.111  -5.580 -14.362
   41    HG2  ARG   6           2HG      ARG   6  -3.636  -6.501 -11.951
   42    HG3  ARG   6           3HG      ARG   6  -4.555  -4.996 -11.866
   43    HD2  ARG   6           2HD      ARG   6  -6.055  -7.116 -13.153
   44    HD3  ARG   6           3HD      ARG   6  -5.541  -7.567 -11.528
   45    HE   ARG   6           HE       ARG   6  -6.591  -5.014 -11.344
   46   HH11  ARG   6          1HH1      ARG   6  -7.700  -8.188 -12.249
   47   HH12  ARG   6          2HH1      ARG   6  -9.333  -7.904 -11.744
   48   HH21  ARG   6          1HH2      ARG   6  -8.737  -4.628 -10.675
   49   HH22  ARG   6          2HH2      ARG   6  -9.922  -5.878 -10.849
   50    H    CYS   7           H        CYS   7  -5.057  -8.023 -15.940
   51    HA   CYS   7           HA       CYS   7  -4.114  -6.802 -18.452
   52    HB2  CYS   7           2HB      CYS   7  -5.374  -9.533 -18.289
   53    HB3  CYS   7           3HB      CYS   7  -4.442  -8.835 -19.610
   54    H    TRP   8           H        TRP   8  -5.910  -7.235 -20.226
   55    HA   TRP   8           HA       TRP   8  -8.619  -7.185 -19.354
   56    HB2  TRP   8           2HB      TRP   8  -9.181  -4.895 -19.810
   57    HB3  TRP   8           3HB      TRP   8  -7.840  -4.901 -18.667
   58    HD1  TRP   8           HD1      TRP   8  -8.824  -3.668 -22.079
   59    HE1  TRP   8           HE1      TRP   8  -6.876  -2.339 -23.111
   60    HE3  TRP   8           HE3      TRP   8  -5.156  -4.866 -18.725
   61    HZ2  TRP   8           HZ2      TRP   8  -4.146  -1.863 -22.575
   62    HZ3  TRP   8           HZ3      TRP   8  -2.904  -3.932 -19.057
   63    HH2  TRP   8           HH2      TRP   8  -2.411  -2.462 -20.943
   64    H    LYS   9           H        LYS   9 -10.068  -7.354 -21.057
   65    HA   LYS   9           HA       LYS   9  -8.857  -8.009 -23.618
   66    HB2  LYS   9           2HB      LYS   9 -11.711  -8.290 -22.657
   67    HB3  LYS   9           3HB      LYS   9 -11.091  -8.890 -24.190
   68    HG2  LYS   9           2HG      LYS   9 -10.222 -10.717 -23.253
   69    HG3  LYS   9           3HG      LYS   9  -9.563  -9.815 -21.885
   70    HD2  LYS   9           2HD      LYS   9 -12.137  -9.685 -21.233
   71    HD3  LYS   9           3HD      LYS   9 -12.191 -11.167 -22.191
   72    HE2  LYS   9           2HE      LYS   9  -9.954 -11.072 -20.319
   73    HE3  LYS   9           3HE      LYS   9 -11.528 -10.991 -19.529
   74    HZ1  LYS   9           3HZ      LYS   9 -11.768 -13.154 -19.846
   75    HZ2  LYS   9           1HZ      LYS   9 -10.242 -13.236 -20.572
   76    HZ3  LYS   9           2HZ      LYS   9 -11.616 -12.966 -21.520
   77    H    VAL  10           H        VAL  10  -8.328  -6.001 -24.481
   78    HA   VAL  10           HA       VAL  10 -10.411  -3.997 -24.800
   79    HB   VAL  10           HB       VAL  10  -8.240  -3.140 -24.251
   80   HG11  VAL  10          1HG1      VAL  10  -6.581  -4.564 -24.847
   81   HG12  VAL  10          2HG1      VAL  10  -7.352  -5.000 -26.373
   82   HG13  VAL  10          3HG1      VAL  10  -6.476  -3.476 -26.231
   83   HG21  VAL  10          3HG2      VAL  10  -8.642  -2.583 -27.183
   84   HG22  VAL  10          1HG2      VAL  10  -9.673  -1.915 -25.917
   85   HG23  VAL  10          2HG2      VAL  10  -7.956  -1.513 -25.961
   86    H    GLY  11           H        GLY  11 -11.072  -3.170 -26.838
   87    HA2  GLY  11           2HA      GLY  11 -11.915  -3.454 -28.958
   88    HA3  GLY  11           3HA      GLY  11 -10.298  -4.022 -29.346
   89    H    ARG  12           H        ARG  12 -11.381  -5.409 -30.898
   90    HA   ARG  12           HA       ARG  12 -12.307  -7.892 -29.627
   91    HB2  ARG  12           2HB      ARG  12 -13.938  -8.201 -31.448
   92    HB3  ARG  12           3HB      ARG  12 -14.278  -6.763 -30.495
   93    HG2  ARG  12           2HG      ARG  12 -12.621  -6.434 -32.930
   94    HG3  ARG  12           3HG      ARG  12 -14.343  -6.756 -33.139
   95    HD2  ARG  12           2HD      ARG  12 -14.406  -4.851 -31.214
   96    HD3  ARG  12           3HD      ARG  12 -12.970  -4.365 -32.113
   97    HE   ARG  12           HE       ARG  12 -14.957  -4.848 -33.981
   98   HH11  ARG  12          1HH1      ARG  12 -14.396  -2.680 -31.316
   99   HH12  ARG  12          2HH1      ARG  12 -15.342  -1.396 -31.992
  100   HH21  ARG  12          1HH2      ARG  12 -16.206  -3.165 -34.881
  101   HH22  ARG  12          2HH2      ARG  12 -16.373  -1.673 -34.019
  102    H    ASN  13           H        ASN  13  -9.728  -7.686 -30.223
  103    HA   ASN  13           HA       ASN  13  -9.362  -9.690 -32.233
  104    HB2  ASN  13           2HB      ASN  13  -9.462  -7.333 -33.403
  105    HB3  ASN  13           3HB      ASN  13  -7.813  -7.192 -32.800
  106   HD21  ASN  13          1HD2      ASN  13  -9.917  -8.733 -35.047
  107   HD22  ASN  13          2HD2      ASN  13  -8.699  -9.566 -35.946
  108    H    GLY  14           H        GLY  14  -8.822  -9.903 -29.623
  109    HA2  GLY  14           2HA      GLY  14  -6.749 -11.052 -28.887
  110    HA3  GLY  14           3HA      GLY  14  -5.880  -9.646 -29.485
  111    H    ARG  15           H        ARG  15  -5.090  -9.965 -27.146
  112    HA   ARG  15           HA       ARG  15  -6.647  -8.132 -25.465
  113    HB2  ARG  15           2HB      ARG  15  -5.525 -10.809 -24.648
  114    HB3  ARG  15           3HB      ARG  15  -5.929  -9.559 -23.479
  115    HG2  ARG  15           2HG      ARG  15  -8.150  -9.876 -23.701
  116    HG3  ARG  15           3HG      ARG  15  -8.036 -10.243 -25.424
  117    HD2  ARG  15           2HD      ARG  15  -7.033 -12.141 -23.324
  118    HD3  ARG  15           3HD      ARG  15  -8.717 -12.138 -23.847
  119    HE   ARG  15           HE       ARG  15  -6.962 -12.288 -26.071
  120   HH11  ARG  15          1HH1      ARG  15  -8.299 -14.181 -23.472
  121   HH12  ARG  15          2HH1      ARG  15  -8.162 -15.684 -24.322
  122   HH21  ARG  15          1HH2      ARG  15  -6.777 -14.261 -27.200
  123   HH22  ARG  15          2HH2      ARG  15  -7.295 -15.729 -26.443
  124    H    VAL  16           H        VAL  16  -5.233  -7.503 -23.475
  125    HA   VAL  16           HA       VAL  16  -2.388  -7.421 -24.043
  126    HB   VAL  16           HB       VAL  16  -4.098  -4.939 -24.043
  127   HG11  VAL  16          1HG1      VAL  16  -2.306  -4.452 -22.547
  128   HG12  VAL  16          2HG1      VAL  16  -1.125  -5.193 -23.629
  129   HG13  VAL  16          3HG1      VAL  16  -1.928  -3.692 -24.092
  130   HG21  VAL  16          3HG2      VAL  16  -2.788  -4.488 -26.127
  131   HG22  VAL  16          1HG2      VAL  16  -2.111  -6.111 -25.981
  132   HG23  VAL  16          2HG2      VAL  16  -3.846  -5.896 -26.218
  133    H    CYS  17           H        CYS  17  -1.140  -7.070 -22.241
  134    HA   CYS  17           HA       CYS  17  -2.590  -6.643 -19.711
  135    HB2  CYS  17           2HB      CYS  17  -1.611  -9.006 -20.259
  136    HB3  CYS  17           3HB      CYS  17  -0.070  -8.263 -19.841
  137    H    MET  18           H        MET  18  -1.562  -5.432 -18.111
  138    HA   MET  18           HA       MET  18   0.975  -4.151 -18.835
  139    HB2  MET  18           2HB      MET  18   0.186  -1.968 -18.443
  140    HB3  MET  18           3HB      MET  18  -1.054  -2.721 -19.438
  141    HG2  MET  18           2HG      MET  18  -2.259  -3.242 -17.263
  142    HG3  MET  18           3HG      MET  18  -1.129  -2.125 -16.501
  143    HE1  MET  18           3HE      MET  18  -2.905   0.421 -16.019
  144    HE2  MET  18           1HE      MET  18  -4.426  -0.366 -16.442
  145    HE3  MET  18           2HE      MET  18  -3.164  -1.275 -15.610
  146    H    ARG  19           H        ARG  19   2.216  -3.412 -17.079
  147    HA   ARG  19           HA       ARG  19   1.534  -4.713 -14.549
  148    HB2  ARG  19           2HB      ARG  19   3.940  -4.206 -13.982
  149    HB3  ARG  19           3HB      ARG  19   3.701  -5.307 -15.332
  150    HG2  ARG  19           2HG      ARG  19   4.756  -3.957 -16.747
  151    HG3  ARG  19           3HG      ARG  19   3.864  -2.541 -16.186
  152    HD2  ARG  19           2HD      ARG  19   5.541  -1.879 -14.863
  153    HD3  ARG  19           3HD      ARG  19   5.807  -3.508 -14.245
  154    HE   ARG  19           HE       ARG  19   6.776  -3.265 -16.898
  155   HH11  ARG  19          1HH1      ARG  19   7.510  -2.403 -13.606
  156   HH12  ARG  19          2HH1      ARG  19   9.221  -2.341 -13.866
  157   HH21  ARG  19          1HH2      ARG  19   9.028  -3.187 -17.253
  158   HH22  ARG  19          2HH2      ARG  19  10.084  -2.787 -15.941
  159    H    VAL  20           H        VAL  20   0.015  -3.203 -13.780
  160    HA   VAL  20           HA       VAL  20   0.800  -0.438 -13.424
  161    HB   VAL  20           HB       VAL  20  -1.551  -1.105 -13.967
  162   HG11  VAL  20          1HG1      VAL  20  -1.813  -1.886 -11.081
  163   HG12  VAL  20          2HG1      VAL  20  -2.952  -2.140 -12.404
  164   HG13  VAL  20          3HG1      VAL  20  -1.458  -3.075 -12.334
  165   HG21  VAL  20          3HG2      VAL  20  -2.362   0.752 -12.952
  166   HG22  VAL  20          1HG2      VAL  20  -1.757   0.280 -11.363
  167   HG23  VAL  20          2HG2      VAL  20  -0.662   0.990 -12.549
  168    H    CYS  21           H        CYS  21   1.377   0.542 -11.543
  169    HA   CYS  21           HA       CYS  21   1.545  -1.138  -9.131
  170    HB2  CYS  21           2HB      CYS  21   3.769  -0.914 -10.226
  171    HB3  CYS  21           3HB      CYS  21   3.649   0.834 -10.046
  172    H    THR  22           H        THR  22   1.265  -0.093  -7.158
  173    HA   THR  22           HA       THR  22   0.508   2.745  -7.262
  174    HB   THR  22           HB       THR  22  -1.578   1.488  -7.313
  175    HG1  THR  22           HG1      THR  22  -2.183   3.085  -6.069
  176   HG21  THR  22          3HG2      THR  22  -1.024  -0.613  -6.388
  177   HG22  THR  22          1HG2      THR  22  -2.152   0.116  -5.246
  178   HG23  THR  22          2HG2      THR  22  -0.423   0.113  -4.897
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1   4.952  -1.929   0.212
    2    HA   ARG   1           HA       ARG   1   3.206  -3.310  -1.511
    3    HB2  ARG   1           2HB      ARG   1   2.218  -1.126  -1.974
    4    HB3  ARG   1           3HB      ARG   1   2.538  -1.312  -0.255
    5    HG2  ARG   1           2HG      ARG   1   4.841  -0.136  -1.275
    6    HG3  ARG   1           3HG      ARG   1   3.509   0.673  -2.104
    7    HD2  ARG   1           2HD      ARG   1   2.696   1.596  -0.187
    8    HD3  ARG   1           3HD      ARG   1   3.245   0.256   0.819
    9    HE   ARG   1           HE       ARG   1   5.493   1.623  -0.126
   10   HH11  ARG   1          1HH1      ARG   1   2.784   2.130   2.002
   11   HH12  ARG   1          2HH1      ARG   1   3.628   3.248   3.022
   12   HH21  ARG   1          1HH2      ARG   1   6.614   3.093   1.210
   13   HH22  ARG   1          2HH2      ARG   1   5.806   3.796   2.570
   14    H    GLY   2           H        GLY   2   2.695  -2.142  -3.760
   15    HA2  GLY   2           2HA      GLY   2   4.597  -1.051  -5.395
   16    HA3  GLY   2           3HA      GLY   2   4.949  -2.772  -5.424
   17    H    CYS   3           H        CYS   3   4.437  -2.027  -7.790
   18    HA   CYS   3           HA       CYS   3   1.636  -1.855  -8.432
   19    HB2  CYS   3           2HB      CYS   3   3.909  -2.390 -10.345
   20    HB3  CYS   3           3HB      CYS   3   2.331  -1.702 -10.714
   21    H    TYR   4           H        TYR   4   0.533  -3.381  -9.836
   22    HA   TYR   4           HA       TYR   4   1.543  -6.135  -9.626
   23    HB2  TYR   4           2HB      TYR   4  -1.362  -5.431  -9.224
   24    HB3  TYR   4           3HB      TYR   4  -0.564  -6.968  -8.908
   25    HD1  TYR   4           HD1      TYR   4   0.959  -7.189  -6.956
   26    HD2  TYR   4           HD2      TYR   4  -1.373  -3.689  -7.598
   27    HE1  TYR   4           HE1      TYR   4   1.316  -6.528  -4.613
   28    HE2  TYR   4           HE2      TYR   4  -1.022  -3.018  -5.258
   29    HH   TYR   4           HH       TYR   4   1.183  -3.863  -3.413
   30    H    THR   5           H        THR   5   0.566  -7.628 -11.163
   31    HA   THR   5           HA       THR   5   0.308  -6.417 -13.756
   32    HB   THR   5           HB       THR   5   0.103  -9.313 -12.910
   33    HG1  THR   5           HG1      THR   5   2.196  -8.797 -12.692
   34   HG21  THR   5          3HG2      THR   5  -0.086  -7.971 -15.572
   35   HG22  THR   5          1HG2      THR   5  -1.000  -9.339 -14.938
   36   HG23  THR   5          2HG2      THR   5   0.671  -9.559 -15.457
   37    H    ARG   6           H        ARG   6  -1.475  -6.320 -15.067
   38    HA   ARG   6           HA       ARG   6  -4.015  -7.353 -14.035
   39    HB2  ARG   6           2HB      ARG   6  -3.257  -4.578 -14.116
   40    HB3  ARG   6           3HB      ARG   6  -4.609  -4.858 -15.206
   41    HG2  ARG   6           2HG      ARG   6  -4.760  -6.011 -12.476
   42    HG3  ARG   6           3HG      ARG   6  -4.967  -4.268 -12.662
   43    HD2  ARG   6           2HD      ARG   6  -6.724  -4.708 -14.355
   44    HD3  ARG   6           3HD      ARG   6  -6.561  -6.433 -14.027
   45    HE   ARG   6           HE       ARG   6  -7.936  -4.493 -12.427
   46   HH11  ARG   6          1HH1      ARG   6  -6.252  -7.540 -12.379
   47   HH12  ARG   6          2HH1      ARG   6  -7.051  -8.107 -10.950
   48   HH21  ARG   6          1HH2      ARG   6  -8.996  -5.229 -10.546
   49   HH22  ARG   6          2HH2      ARG   6  -8.612  -6.793  -9.909
   50    H    CYS   7           H        CYS   7  -5.747  -7.309 -15.691
   51    HA   CYS   7           HA       CYS   7  -4.989  -6.987 -18.447
   52    HB2  CYS   7           2HB      CYS   7  -4.210  -9.350 -17.505
   53    HB3  CYS   7           3HB      CYS   7  -5.895  -9.756 -17.815
   54    H    TRP   8           H        TRP   8  -6.821  -7.647 -19.919
   55    HA   TRP   8           HA       TRP   8  -9.417  -8.064 -18.848
   56    HB2  TRP   8           2HB      TRP   8 -10.410  -5.895 -19.288
   57    HB3  TRP   8           3HB      TRP   8  -9.074  -5.705 -18.156
   58    HD1  TRP   8           HD1      TRP   8 -10.159  -4.789 -21.689
   59    HE1  TRP   8           HE1      TRP   8  -8.525  -3.040 -22.636
   60    HE3  TRP   8           HE3      TRP   8  -6.615  -4.912 -18.007
   61    HZ2  TRP   8           HZ2      TRP   8  -6.060  -1.869 -21.918
   62    HZ3  TRP   8           HZ3      TRP   8  -4.649  -3.447 -18.213
   63    HH2  TRP   8           HH2      TRP   8  -4.379  -1.958 -20.129
   64    H    LYS   9           H        LYS   9 -11.129  -7.706 -20.585
   65    HA   LYS   9           HA       LYS   9 -10.098  -8.802 -23.064
   66    HB2  LYS   9           2HB      LYS   9 -12.906  -8.311 -22.064
   67    HB3  LYS   9           3HB      LYS   9 -12.541  -8.994 -23.644
   68    HG2  LYS   9           2HG      LYS   9 -11.858 -10.994 -22.779
   69    HG3  LYS   9           3HG      LYS   9 -11.361 -10.285 -21.241
   70    HD2  LYS   9           2HD      LYS   9 -13.275 -11.061 -20.397
   71    HD3  LYS   9           3HD      LYS   9 -14.095  -9.824 -21.353
   72    HE2  LYS   9           2HE      LYS   9 -15.070 -12.025 -21.743
   73    HE3  LYS   9           3HE      LYS   9 -14.314 -11.399 -23.208
   74    HZ1  LYS   9           3HZ      LYS   9 -12.904 -13.099 -23.266
   75    HZ2  LYS   9           1HZ      LYS   9 -13.872 -13.845 -22.096
   76    HZ3  LYS   9           2HZ      LYS   9 -12.511 -12.957 -21.626
   77    H    VAL  10           H        VAL  10  -9.840  -7.725 -24.917
   78    HA   VAL  10           HA       VAL  10 -10.842  -4.956 -25.047
   79    HB   VAL  10           HB       VAL  10  -8.599  -5.956 -26.766
   80   HG11  VAL  10          1HG1      VAL  10  -9.175  -3.853 -27.474
   81   HG12  VAL  10          2HG1      VAL  10  -9.675  -3.328 -25.865
   82   HG13  VAL  10          3HG1      VAL  10  -7.960  -3.457 -26.259
   83   HG21  VAL  10          3HG2      VAL  10  -8.354  -4.984 -23.921
   84   HG22  VAL  10          1HG2      VAL  10  -7.908  -6.573 -24.542
   85   HG23  VAL  10          2HG2      VAL  10  -7.006  -5.143 -25.047
   86    H    GLY  11           H        GLY  11 -11.263  -4.152 -27.286
   87    HA2  GLY  11           2HA      GLY  11 -13.179  -5.764 -28.568
   88    HA3  GLY  11           3HA      GLY  11 -12.493  -4.283 -29.218
   89    H    ARG  12           H        ARG  12 -12.419  -5.103 -31.320
   90    HA   ARG  12           HA       ARG  12 -11.145  -7.558 -31.976
   91    HB2  ARG  12           2HB      ARG  12 -12.840  -6.413 -33.407
   92    HB3  ARG  12           3HB      ARG  12 -11.643  -5.177 -33.769
   93    HG2  ARG  12           2HG      ARG  12 -10.426  -7.650 -34.323
   94    HG3  ARG  12           3HG      ARG  12 -12.051  -7.715 -35.010
   95    HD2  ARG  12           2HD      ARG  12  -9.966  -5.594 -35.507
   96    HD3  ARG  12           3HD      ARG  12 -10.492  -6.836 -36.641
   97    HE   ARG  12           HE       ARG  12 -12.717  -5.326 -35.828
   98   HH11  ARG  12          1HH1      ARG  12  -9.820  -5.031 -37.736
   99   HH12  ARG  12          2HH1      ARG  12 -10.485  -3.832 -38.796
  100   HH21  ARG  12          1HH2      ARG  12 -13.604  -3.749 -37.217
  101   HH22  ARG  12          2HH2      ARG  12 -12.636  -3.103 -38.500
  102    H    ASN  13           H        ASN  13  -9.174  -7.261 -30.707
  103    HA   ASN  13           HA       ASN  13  -6.972  -6.576 -32.316
  104    HB2  ASN  13           2HB      ASN  13  -7.947  -4.280 -31.536
  105    HB3  ASN  13           3HB      ASN  13  -7.186  -4.682 -29.999
  106   HD21  ASN  13          1HD2      ASN  13  -6.711  -3.666 -33.240
  107   HD22  ASN  13          2HD2      ASN  13  -5.003  -3.423 -33.147
  108    H    GLY  14           H        GLY  14  -7.943  -8.689 -30.579
  109    HA2  GLY  14           2HA      GLY  14  -7.029 -10.241 -29.153
  110    HA3  GLY  14           3HA      GLY  14  -5.505  -9.380 -29.319
  111    H    ARG  15           H        ARG  15  -5.580 -10.249 -26.969
  112    HA   ARG  15           HA       ARG  15  -7.079  -8.524 -25.168
  113    HB2  ARG  15           2HB      ARG  15  -5.500 -11.037 -24.885
  114    HB3  ARG  15           3HB      ARG  15  -5.665 -10.002 -23.473
  115    HG2  ARG  15           2HG      ARG  15  -8.238 -10.178 -24.473
  116    HG3  ARG  15           3HG      ARG  15  -7.576 -11.800 -24.686
  117    HD2  ARG  15           2HD      ARG  15  -7.550 -10.224 -22.115
  118    HD3  ARG  15           3HD      ARG  15  -8.685 -11.515 -22.507
  119    HE   ARG  15           HE       ARG  15  -5.985 -11.810 -21.610
  120   HH11  ARG  15          1HH1      ARG  15  -8.517 -13.281 -23.492
  121   HH12  ARG  15          2HH1      ARG  15  -7.909 -14.891 -23.292
  122   HH21  ARG  15          1HH2      ARG  15  -5.174 -13.925 -21.339
  123   HH22  ARG  15          2HH2      ARG  15  -6.008 -15.256 -22.067
  124    H    VAL  16           H        VAL  16  -5.783  -7.764 -23.168
  125    HA   VAL  16           HA       VAL  16  -3.063  -6.941 -23.764
  126    HB   VAL  16           HB       VAL  16  -5.350  -5.006 -23.591
  127   HG11  VAL  16          1HG1      VAL  16  -2.508  -4.567 -22.737
  128   HG12  VAL  16          2HG1      VAL  16  -3.501  -3.242 -23.349
  129   HG13  VAL  16          3HG1      VAL  16  -3.997  -4.124 -21.904
  130   HG21  VAL  16          3HG2      VAL  16  -4.746  -5.434 -25.810
  131   HG22  VAL  16          1HG2      VAL  16  -3.909  -3.932 -25.419
  132   HG23  VAL  16          2HG2      VAL  16  -3.023  -5.457 -25.433
  133    H    CYS  17           H        CYS  17  -1.874  -6.984 -21.969
  134    HA   CYS  17           HA       CYS  17  -3.265  -6.824 -19.375
  135    HB2  CYS  17           2HB      CYS  17  -0.779  -8.426 -20.011
  136    HB3  CYS  17           3HB      CYS  17  -1.633  -8.387 -18.472
  137    H    MET  18           H        MET  18  -2.721  -5.113 -18.209
  138    HA   MET  18           HA       MET  18  -0.014  -3.995 -18.527
  139    HB2  MET  18           2HB      MET  18  -2.545  -2.434 -17.983
  140    HB3  MET  18           3HB      MET  18  -0.932  -1.765 -18.186
  141    HG2  MET  18           2HG      MET  18  -2.389  -3.297 -20.323
  142    HG3  MET  18           3HG      MET  18  -2.425  -1.542 -20.167
  143    HE1  MET  18           3HE      MET  18  -0.411  -1.320 -23.085
  144    HE2  MET  18           1HE      MET  18  -1.786  -0.857 -22.083
  145    HE3  MET  18           2HE      MET  18  -0.210  -0.112 -21.814
  146    H    ARG  19           H        ARG  19   1.015  -3.237 -16.680
  147    HA   ARG  19           HA       ARG  19   0.101  -4.432 -14.212
  148    HB2  ARG  19           2HB      ARG  19   2.589  -2.874 -14.922
  149    HB3  ARG  19           3HB      ARG  19   2.270  -3.521 -13.318
  150    HG2  ARG  19           2HG      ARG  19   1.905  -5.653 -15.106
  151    HG3  ARG  19           3HG      ARG  19   3.377  -4.822 -15.612
  152    HD2  ARG  19           2HD      ARG  19   2.766  -5.826 -12.834
  153    HD3  ARG  19           3HD      ARG  19   3.867  -6.576 -13.989
  154    HE   ARG  19           HE       ARG  19   4.392  -4.298 -12.325
  155   HH11  ARG  19          1HH1      ARG  19   5.232  -5.918 -15.290
  156   HH12  ARG  19          2HH1      ARG  19   6.817  -5.225 -15.373
  157   HH21  ARG  19          1HH2      ARG  19   6.477  -3.378 -12.423
  158   HH22  ARG  19          2HH2      ARG  19   7.525  -3.780 -13.741
  159    H    VAL  20           H        VAL  20  -1.466  -3.377 -13.158
  160    HA   VAL  20           HA       VAL  20  -1.641  -0.495 -13.180
  161    HB   VAL  20           HB       VAL  20  -3.660  -1.965 -13.207
  162   HG11  VAL  20          1HG1      VAL  20  -2.902  -3.670 -11.649
  163   HG12  VAL  20          2HG1      VAL  20  -2.889  -2.488 -10.338
  164   HG13  VAL  20          3HG1      VAL  20  -4.414  -2.953 -11.092
  165   HG21  VAL  20          3HG2      VAL  20  -3.508   0.468 -12.329
  166   HG22  VAL  20          1HG2      VAL  20  -4.967  -0.469 -12.009
  167   HG23  VAL  20          2HG2      VAL  20  -3.755  -0.265 -10.744
  168    H    CYS  21           H        CYS  21  -1.165   0.896 -11.548
  169    HA   CYS  21           HA       CYS  21   0.050  -0.260  -9.124
  170    HB2  CYS  21           2HB      CYS  21   1.422   1.140 -10.986
  171    HB3  CYS  21           3HB      CYS  21   0.879   2.459  -9.954
  172    H    THR  22           H        THR  22  -0.625   0.490  -7.192
  173    HA   THR  22           HA       THR  22  -2.994   2.101  -7.108
  174    HB   THR  22           HB       THR  22  -2.640   0.225  -5.538
  175    HG1  THR  22           HG1      THR  22  -4.055   1.493  -4.571
  176   HG21  THR  22          3HG2      THR  22  -0.710   1.959  -4.030
  177   HG22  THR  22          1HG2      THR  22  -0.145   0.828  -5.259
  178   HG23  THR  22          2HG2      THR  22  -1.025   0.233  -3.851
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1   5.046  -2.316  -0.806
    2    HA   ARG   1           HA       ARG   1   6.323  -0.520  -2.748
    3    HB2  ARG   1           2HB      ARG   1   6.139  -2.222  -4.493
    4    HB3  ARG   1           3HB      ARG   1   7.156  -2.785  -3.174
    5    HG2  ARG   1           2HG      ARG   1   4.846  -3.800  -2.343
    6    HG3  ARG   1           3HG      ARG   1   4.507  -3.745  -4.075
    7    HD2  ARG   1           2HD      ARG   1   6.096  -5.303  -4.575
    8    HD3  ARG   1           3HD      ARG   1   7.123  -4.850  -3.216
    9    HE   ARG   1           HE       ARG   1   6.085  -6.449  -1.965
   10   HH11  ARG   1          1HH1      ARG   1   4.068  -5.686  -4.698
   11   HH12  ARG   1          2HH1      ARG   1   2.915  -6.934  -4.362
   12   HH21  ARG   1          1HH2      ARG   1   4.574  -8.097  -1.512
   13   HH22  ARG   1          2HH2      ARG   1   3.203  -8.305  -2.549
   14    H    GLY   2           H        GLY   2   4.868  -0.470  -4.826
   15    HA2  GLY   2           2HA      GLY   2   2.029  -0.504  -4.040
   16    HA3  GLY   2           3HA      GLY   2   2.731   0.958  -4.718
   17    H    CYS   3           H        CYS   3   0.731   0.309  -6.131
   18    HA   CYS   3           HA       CYS   3  -0.055  -0.326  -8.169
   19    HB2  CYS   3           2HB      CYS   3   2.395   0.760  -8.604
   20    HB3  CYS   3           3HB      CYS   3   2.623  -0.838  -9.307
   21    H    TYR   4           H        TYR   4   0.269  -2.107  -9.972
   22    HA   TYR   4           HA       TYR   4   1.463  -4.563  -9.254
   23    HB2  TYR   4           2HB      TYR   4  -0.688  -5.832  -8.866
   24    HB3  TYR   4           3HB      TYR   4  -0.193  -4.772  -7.551
   25    HD1  TYR   4           HD2      TYR   4  -2.407  -4.858 -10.549
   26    HD2  TYR   4           HD1      TYR   4  -1.705  -3.235  -6.679
   27    HE1  TYR   4           HE2      TYR   4  -4.603  -3.754 -10.621
   28    HE2  TYR   4           HE1      TYR   4  -3.901  -2.128  -6.739
   29    HH   TYR   4           HH       TYR   4  -6.029  -2.422  -9.570
   30    H    THR   5           H        THR   5   0.967  -6.282 -10.770
   31    HA   THR   5           HA       THR   5   0.418  -5.226 -13.400
   32    HB   THR   5           HB       THR   5   1.136  -8.026 -12.511
   33    HG1  THR   5           HG1      THR   5   3.175  -7.441 -12.946
   34   HG21  THR   5          3HG2      THR   5   0.859  -6.834 -15.268
   35   HG22  THR   5          1HG2      THR   5  -0.050  -8.184 -14.590
   36   HG23  THR   5          2HG2      THR   5   1.671  -8.362 -14.933
   37    H    ARG   6           H        ARG   6  -1.489  -5.243 -14.381
   38    HA   ARG   6           HA       ARG   6  -3.404  -7.371 -13.807
   39    HB2  ARG   6           2HB      ARG   6  -3.719  -4.545 -13.044
   40    HB3  ARG   6           3HB      ARG   6  -5.087  -5.223 -13.916
   41    HG2  ARG   6           2HG      ARG   6  -3.872  -6.381 -11.417
   42    HG3  ARG   6           3HG      ARG   6  -5.342  -5.407 -11.488
   43    HD2  ARG   6           2HD      ARG   6  -6.549  -7.207 -11.973
   44    HD3  ARG   6           3HD      ARG   6  -5.537  -7.539 -13.379
   45    HE   ARG   6           HE       ARG   6  -4.489  -9.182 -12.185
   46   HH11  ARG   6          1HH1      ARG   6  -6.204  -7.102  -9.983
   47   HH12  ARG   6          2HH1      ARG   6  -5.913  -8.106  -8.602
   48   HH21  ARG   6          1HH2      ARG   6  -4.099 -10.513 -10.374
   49   HH22  ARG   6          2HH2      ARG   6  -4.715 -10.046  -8.825
   50    H    CYS   7           H        CYS   7  -4.966  -7.687 -15.442
   51    HA   CYS   7           HA       CYS   7  -4.418  -6.248 -17.955
   52    HB2  CYS   7           2HB      CYS   7  -5.350  -9.094 -17.969
   53    HB3  CYS   7           3HB      CYS   7  -4.434  -8.214 -19.189
   54    H    TRP   8           H        TRP   8  -6.292  -6.804 -19.588
   55    HA   TRP   8           HA       TRP   8  -8.894  -7.130 -18.425
   56    HB2  TRP   8           2HB      TRP   8  -9.767  -4.927 -18.886
   57    HB3  TRP   8           3HB      TRP   8  -8.355  -4.763 -17.846
   58    HD1  TRP   8           HD1      TRP   8  -9.556  -4.035 -21.403
   59    HE1  TRP   8           HE1      TRP   8  -7.912  -2.391 -22.507
   60    HE3  TRP   8           HE3      TRP   8  -5.923  -3.983 -17.807
   61    HZ2  TRP   8           HZ2      TRP   8  -5.405  -1.228 -21.930
   62    HZ3  TRP   8           HZ3      TRP   8  -3.934  -2.579 -18.160
   63    HH2  TRP   8           HH2      TRP   8  -3.682  -1.231 -20.180
   64    H    LYS   9           H        LYS   9 -10.618  -7.009 -20.056
   65    HA   LYS   9           HA       LYS   9  -9.744  -8.178 -22.526
   66    HB2  LYS   9           2HB      LYS   9 -12.410  -7.558 -21.301
   67    HB3  LYS   9           3HB      LYS   9 -12.306  -8.002 -22.999
   68    HG2  LYS   9           2HG      LYS   9 -11.055 -10.068 -22.242
   69    HG3  LYS   9           3HG      LYS   9 -11.552  -9.645 -20.602
   70    HD2  LYS   9           2HD      LYS   9 -13.933  -9.503 -21.698
   71    HD3  LYS   9           3HD      LYS   9 -13.203 -10.549 -22.918
   72    HE2  LYS   9           2HE      LYS   9 -12.392 -11.733 -20.596
   73    HE3  LYS   9           3HE      LYS   9 -13.989 -11.129 -20.155
   74    HZ1  LYS   9           3HZ      LYS   9 -14.714 -12.217 -22.347
   75    HZ2  LYS   9           1HZ      LYS   9 -14.421 -13.216 -21.014
   76    HZ3  LYS   9           2HZ      LYS   9 -13.265 -13.083 -22.241
   77    H    VAL  10           H        VAL  10  -9.241  -7.132 -24.327
   78    HA   VAL  10           HA       VAL  10 -10.125  -4.343 -24.631
   79    HB   VAL  10           HB       VAL  10  -7.965  -5.603 -26.290
   80   HG11  VAL  10          1HG1      VAL  10  -7.243  -3.038 -25.793
   81   HG12  VAL  10          2HG1      VAL  10  -8.201  -3.551 -27.184
   82   HG13  VAL  10          3HG1      VAL  10  -9.001  -2.906 -25.750
   83   HG21  VAL  10          3HG2      VAL  10  -7.868  -4.935 -23.421
   84   HG22  VAL  10          1HG2      VAL  10  -6.872  -6.042 -24.366
   85   HG23  VAL  10          2HG2      VAL  10  -6.540  -4.310 -24.398
   86    H    GLY  11           H        GLY  11 -10.554  -3.613 -26.875
   87    HA2  GLY  11           2HA      GLY  11 -12.566  -5.165 -28.077
   88    HA3  GLY  11           3HA      GLY  11 -11.811  -3.748 -28.790
   89    H    ARG  12           H        ARG  12 -11.885  -4.714 -30.855
   90    HA   ARG  12           HA       ARG  12 -10.689  -7.231 -31.411
   91    HB2  ARG  12           2HB      ARG  12 -12.419  -6.000 -32.817
   92    HB3  ARG  12           3HB      ARG  12 -11.096  -4.991 -33.389
   93    HG2  ARG  12           2HG      ARG  12 -10.939  -6.504 -35.025
   94    HG3  ARG  12           3HG      ARG  12 -10.090  -7.475 -33.820
   95    HD2  ARG  12           2HD      ARG  12 -12.623  -8.124 -33.218
   96    HD3  ARG  12           3HD      ARG  12 -12.811  -7.774 -34.936
   97    HE   ARG  12           HE       ARG  12 -11.441 -10.013 -33.758
   98   HH11  ARG  12          1HH1      ARG  12 -11.743  -7.990 -36.575
   99   HH12  ARG  12          2HH1      ARG  12 -11.114  -9.185 -37.661
  100   HH21  ARG  12          1HH2      ARG  12 -10.612 -11.595 -35.178
  101   HH22  ARG  12          2HH2      ARG  12 -10.472 -11.235 -36.866
  102    H    ASN  13           H        ASN  13  -8.658  -6.946 -30.263
  103    HA   ASN  13           HA       ASN  13  -6.513  -6.377 -31.989
  104    HB2  ASN  13           2HB      ASN  13  -7.395  -4.030 -31.251
  105    HB3  ASN  13           3HB      ASN  13  -6.576  -4.397 -29.736
  106   HD21  ASN  13          1HD2      ASN  13  -5.827  -2.253 -31.250
  107   HD22  ASN  13          2HD2      ASN  13  -4.265  -2.538 -31.932
  108    H    GLY  14           H        GLY  14  -7.458  -8.402 -30.138
  109    HA2  GLY  14           2HA      GLY  14  -6.464  -9.951 -28.754
  110    HA3  GLY  14           3HA      GLY  14  -4.967  -9.044 -28.910
  111    H    ARG  15           H        ARG  15  -5.012  -9.901 -26.563
  112    HA   ARG  15           HA       ARG  15  -6.600  -8.264 -24.762
  113    HB2  ARG  15           2HB      ARG  15  -4.874 -10.673 -24.496
  114    HB3  ARG  15           3HB      ARG  15  -5.044  -9.640 -23.083
  115    HG2  ARG  15           2HG      ARG  15  -7.615  -9.858 -23.720
  116    HG3  ARG  15           3HG      ARG  15  -7.035 -11.368 -24.424
  117    HD2  ARG  15           2HD      ARG  15  -5.905 -11.802 -22.193
  118    HD3  ARG  15           3HD      ARG  15  -6.854 -10.456 -21.564
  119    HE   ARG  15           HE       ARG  15  -8.682 -12.103 -22.759
  120   HH11  ARG  15          1HH1      ARG  15  -6.277 -12.463 -20.268
  121   HH12  ARG  15          2HH1      ARG  15  -7.153 -13.692 -19.418
  122   HH21  ARG  15          1HH2      ARG  15  -9.846 -13.720 -21.649
  123   HH22  ARG  15          2HH2      ARG  15  -9.183 -14.407 -20.205
  124    H    VAL  16           H        VAL  16  -5.362  -7.393 -22.779
  125    HA   VAL  16           HA       VAL  16  -2.718  -6.357 -23.429
  126    HB   VAL  16           HB       VAL  16  -5.129  -4.601 -23.013
  127   HG11  VAL  16          1HG1      VAL  16  -3.478  -2.709 -22.917
  128   HG12  VAL  16          2HG1      VAL  16  -3.523  -3.739 -21.485
  129   HG13  VAL  16          3HG1      VAL  16  -2.218  -3.916 -22.658
  130   HG21  VAL  16          3HG2      VAL  16  -4.160  -3.458 -25.022
  131   HG22  VAL  16          1HG2      VAL  16  -2.989  -4.772 -25.128
  132   HG23  VAL  16          2HG2      VAL  16  -4.711  -5.109 -25.309
  133    H    CYS  17           H        CYS  17  -1.484  -5.894 -21.652
  134    HA   CYS  17           HA       CYS  17  -2.767  -6.001 -19.016
  135    HB2  CYS  17           2HB      CYS  17  -1.669  -8.233 -19.864
  136    HB3  CYS  17           3HB      CYS  17  -0.166  -7.426 -19.427
  137    H    MET  18           H        MET  18  -2.169  -4.332 -17.811
  138    HA   MET  18           HA       MET  18   0.539  -3.248 -18.105
  139    HB2  MET  18           2HB      MET  18  -1.901  -1.479 -17.941
  140    HB3  MET  18           3HB      MET  18  -0.236  -0.982 -18.209
  141    HG2  MET  18           2HG      MET  18  -1.777  -2.711 -20.122
  142    HG3  MET  18           3HG      MET  18  -1.710  -0.954 -20.228
  143    HE1  MET  18           3HE      MET  18   0.996   0.255 -21.448
  144    HE2  MET  18           1HE      MET  18   0.513  -0.706 -22.846
  145    HE3  MET  18           2HE      MET  18  -0.713  -0.051 -21.761
  146    H    ARG  19           H        ARG  19   1.390  -2.285 -16.253
  147    HA   ARG  19           HA       ARG  19   0.381  -3.284 -13.788
  148    HB2  ARG  19           2HB      ARG  19   2.679  -1.559 -14.607
  149    HB3  ARG  19           3HB      ARG  19   2.219  -1.602 -12.910
  150    HG2  ARG  19           2HG      ARG  19   2.855  -3.783 -12.647
  151    HG3  ARG  19           3HG      ARG  19   2.598  -4.177 -14.348
  152    HD2  ARG  19           2HD      ARG  19   4.571  -2.463 -14.688
  153    HD3  ARG  19           3HD      ARG  19   4.937  -2.900 -13.020
  154    HE   ARG  19           HE       ARG  19   5.715  -4.906 -13.773
  155   HH11  ARG  19          1HH1      ARG  19   3.640  -3.531 -16.208
  156   HH12  ARG  19          2HH1      ARG  19   3.976  -4.765 -17.377
  157   HH21  ARG  19          1HH2      ARG  19   6.165  -6.536 -15.304
  158   HH22  ARG  19          2HH2      ARG  19   5.412  -6.474 -16.861
  159    H    VAL  20           H        VAL  20  -1.715  -2.412 -13.595
  160    HA   VAL  20           HA       VAL  20  -2.061   0.460 -13.463
  161    HB   VAL  20           HB       VAL  20  -3.814  -1.050 -14.409
  162   HG11  VAL  20          1HG1      VAL  20  -3.389  -2.640 -12.299
  163   HG12  VAL  20          2HG1      VAL  20  -4.775  -1.729 -11.697
  164   HG13  VAL  20          3HG1      VAL  20  -4.900  -2.632 -13.207
  165   HG21  VAL  20          3HG2      VAL  20  -4.861   0.459 -12.029
  166   HG22  VAL  20          1HG2      VAL  20  -4.215   1.270 -13.456
  167   HG23  VAL  20          2HG2      VAL  20  -5.626   0.222 -13.600
  168    H    CYS  21           H        CYS  21  -2.226   1.682 -11.666
  169    HA   CYS  21           HA       CYS  21  -1.677   0.366  -9.108
  170    HB2  CYS  21           2HB      CYS  21  -1.632   3.330  -9.685
  171    HB3  CYS  21           3HB      CYS  21  -0.908   2.488  -8.318
  172    H    THR  22           H        THR  22  -2.814   1.043  -7.186
  173    HA   THR  22           HA       THR  22  -5.629   1.107  -7.559
  174    HB   THR  22           HB       THR  22  -4.744  -0.009  -5.617
  175    HG1  THR  22           HG1      THR  22  -6.106   0.914  -4.087
  176   HG21  THR  22          3HG2      THR  22  -3.747   1.404  -3.758
  177   HG22  THR  22          1HG2      THR  22  -3.558   2.680  -4.959
  178   HG23  THR  22          2HG2      THR  22  -2.723   1.141  -5.169
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1   3.811  -4.005  -0.135
    2    HA   ARG   1           HA       ARG   1   1.630  -3.359  -1.342
    3    HB2  ARG   1           2HB      ARG   1   1.411  -0.952  -1.719
    4    HB3  ARG   1           3HB      ARG   1   1.342  -1.328  -0.002
    5    HG2  ARG   1           2HG      ARG   1   4.018  -0.845  -0.434
    6    HG3  ARG   1           3HG      ARG   1   3.213   0.332  -1.474
    7    HD2  ARG   1           2HD      ARG   1   2.431  -0.072   1.400
    8    HD3  ARG   1           3HD      ARG   1   3.715   1.039   0.924
    9    HE   ARG   1           HE       ARG   1   1.510   1.684  -0.614
   10   HH11  ARG   1          1HH1      ARG   1   2.340   1.594   2.766
   11   HH12  ARG   1          2HH1      ARG   1   1.265   2.882   3.198
   12   HH21  ARG   1          1HH2      ARG   1   0.091   3.381  -0.058
   13   HH22  ARG   1          2HH2      ARG   1  -0.015   3.897   1.591
   14    H    GLY   2           H        GLY   2   1.917  -1.838  -3.473
   15    HA2  GLY   2           2HA      GLY   2   4.055  -1.167  -4.822
   16    HA3  GLY   2           3HA      GLY   2   4.353  -2.895  -4.716
   17    H    CYS   3           H        CYS   3   4.308  -2.248  -7.164
   18    HA   CYS   3           HA       CYS   3   1.626  -2.159  -8.269
   19    HB2  CYS   3           2HB      CYS   3   4.225  -2.429  -9.781
   20    HB3  CYS   3           3HB      CYS   3   2.676  -1.864 -10.398
   21    H    TYR   4           H        TYR   4   0.840  -3.721  -9.792
   22    HA   TYR   4           HA       TYR   4   2.095  -6.370  -9.621
   23    HB2  TYR   4           2HB      TYR   4  -0.240  -7.335  -9.401
   24    HB3  TYR   4           3HB      TYR   4   0.385  -6.513  -7.977
   25    HD1  TYR   4           HD2      TYR   4  -1.661  -5.804 -11.022
   26    HD2  TYR   4           HD1      TYR   4  -0.977  -4.985  -6.903
   27    HE1  TYR   4           HE2      TYR   4  -3.657  -4.368 -10.982
   28    HE2  TYR   4           HE1      TYR   4  -2.973  -3.548  -6.852
   29    HH   TYR   4           HH       TYR   4  -5.284  -3.551  -8.498
   30    H    THR   5           H        THR   5   1.405  -7.855 -11.300
   31    HA   THR   5           HA       THR   5   1.036  -6.477 -13.820
   32    HB   THR   5           HB       THR   5   1.483  -9.407 -13.220
   33    HG1  THR   5           HG1      THR   5   3.568  -8.964 -13.531
   34   HG21  THR   5          3HG2      THR   5   0.508  -9.546 -15.293
   35   HG22  THR   5          1HG2      THR   5   2.179  -9.238 -15.764
   36   HG23  THR   5          2HG2      THR   5   1.008  -7.920 -15.758
   37    H    ARG   6           H        ARG   6  -0.793  -6.364 -14.964
   38    HA   ARG   6           HA       ARG   6  -2.963  -8.248 -14.402
   39    HB2  ARG   6           2HB      ARG   6  -3.003  -5.315 -13.951
   40    HB3  ARG   6           3HB      ARG   6  -4.429  -6.016 -14.704
   41    HG2  ARG   6           2HG      ARG   6  -4.330  -7.710 -12.750
   42    HG3  ARG   6           3HG      ARG   6  -3.302  -6.498 -11.982
   43    HD2  ARG   6           2HD      ARG   6  -5.360  -5.840 -11.221
   44    HD3  ARG   6           3HD      ARG   6  -5.237  -4.873 -12.690
   45    HE   ARG   6           HE       ARG   6  -6.462  -7.317 -13.315
   46   HH11  ARG   6          1HH1      ARG   6  -7.093  -4.388 -11.543
   47   HH12  ARG   6          2HH1      ARG   6  -8.810  -4.469 -11.764
   48   HH21  ARG   6          1HH2      ARG   6  -8.720  -7.436 -13.613
   49   HH22  ARG   6          2HH2      ARG   6  -9.734  -6.204 -12.941
   50    H    CYS   7           H        CYS   7  -4.418  -8.554 -16.111
   51    HA   CYS   7           HA       CYS   7  -3.704  -7.253 -18.652
   52    HB2  CYS   7           2HB      CYS   7  -4.508 -10.148 -18.528
   53    HB3  CYS   7           3HB      CYS   7  -3.696  -9.286 -19.830
   54    H    TRP   8           H        TRP   8  -5.422  -7.473 -20.317
   55    HA   TRP   8           HA       TRP   8  -8.064  -8.208 -19.587
   56    HB2  TRP   8           2HB      TRP   8  -9.093  -6.000 -19.505
   57    HB3  TRP   8           3HB      TRP   8  -7.873  -6.145 -18.242
   58    HD1  TRP   8           HD1      TRP   8  -8.674  -4.227 -21.426
   59    HE1  TRP   8           HE1      TRP   8  -7.000  -2.288 -21.678
   60    HE3  TRP   8           HE3      TRP   8  -5.432  -5.460 -17.669
   61    HZ2  TRP   8           HZ2      TRP   8  -4.620  -1.399 -20.447
   62    HZ3  TRP   8           HZ3      TRP   8  -3.482  -4.013 -17.273
   63    HH2  TRP   8           HH2      TRP   8  -3.086  -2.026 -18.634
   64    H    LYS   9           H        LYS   9  -9.426  -8.270 -21.345
   65    HA   LYS   9           HA       LYS   9  -8.217  -8.205 -23.910
   66    HB2  LYS   9           2HB      LYS   9 -10.521  -8.678 -24.738
   67    HB3  LYS   9           3HB      LYS   9  -9.981  -9.781 -23.479
   68    HG2  LYS   9           2HG      LYS   9 -11.259  -7.724 -22.113
   69    HG3  LYS   9           3HG      LYS   9 -12.264  -8.020 -23.534
   70    HD2  LYS   9           2HD      LYS   9 -11.752 -10.557 -22.760
   71    HD3  LYS   9           3HD      LYS   9 -11.721  -9.737 -21.197
   72    HE2  LYS   9           2HE      LYS   9 -13.946 -10.033 -21.245
   73    HE3  LYS   9           3HE      LYS   9 -13.937  -8.645 -22.330
   74    HZ1  LYS   9           3HZ      LYS   9 -13.710 -10.301 -24.185
   75    HZ2  LYS   9           1HZ      LYS   9 -15.199 -10.312 -23.381
   76    HZ3  LYS   9           2HZ      LYS   9 -14.053 -11.514 -23.057
   77    H    VAL  10           H        VAL  10  -7.550  -6.250 -24.626
   78    HA   VAL  10           HA       VAL  10  -9.329  -3.946 -24.426
   79    HB   VAL  10           HB       VAL  10  -7.033  -3.507 -23.865
   80   HG11  VAL  10          1HG1      VAL  10  -5.272  -3.726 -25.677
   81   HG12  VAL  10          2HG1      VAL  10  -5.843  -5.230 -24.952
   82   HG13  VAL  10          3HG1      VAL  10  -6.429  -4.738 -26.541
   83   HG21  VAL  10          3HG2      VAL  10  -6.638  -1.611 -25.204
   84   HG22  VAL  10          1HG2      VAL  10  -7.409  -2.344 -26.611
   85   HG23  VAL  10          2HG2      VAL  10  -8.387  -1.840 -25.232
   86    H    GLY  11           H        GLY  11  -9.941  -2.692 -26.249
   87    HA2  GLY  11           2HA      GLY  11 -10.902  -2.494 -28.329
   88    HA3  GLY  11           3HA      GLY  11  -9.380  -3.157 -28.905
   89    H    ARG  12           H        ARG  12 -10.575  -4.165 -30.612
   90    HA   ARG  12           HA       ARG  12 -11.921  -6.631 -29.729
   91    HB2  ARG  12           2HB      ARG  12 -13.357  -4.718 -30.807
   92    HB3  ARG  12           3HB      ARG  12 -12.664  -5.311 -32.310
   93    HG2  ARG  12           2HG      ARG  12 -13.659  -7.433 -32.048
   94    HG3  ARG  12           3HG      ARG  12 -14.083  -7.106 -30.366
   95    HD2  ARG  12           2HD      ARG  12 -15.898  -5.858 -30.923
   96    HD3  ARG  12           3HD      ARG  12 -15.161  -5.252 -32.405
   97    HE   ARG  12           HE       ARG  12 -15.616  -7.925 -32.850
   98   HH11  ARG  12          1HH1      ARG  12 -17.546  -5.148 -32.025
   99   HH12  ARG  12          2HH1      ARG  12 -18.969  -5.738 -32.818
  100   HH21  ARG  12          1HH2      ARG  12 -17.482  -8.713 -33.898
  101   HH22  ARG  12          2HH2      ARG  12 -18.932  -7.766 -33.883
  102    H    ASN  13           H        ASN  13  -9.290  -6.777 -30.094
  103    HA   ASN  13           HA       ASN  13  -9.041  -8.589 -32.292
  104    HB2  ASN  13           2HB      ASN  13  -8.697  -6.164 -33.214
  105    HB3  ASN  13           3HB      ASN  13  -7.122  -6.290 -32.437
  106   HD21  ASN  13          1HD2      ASN  13  -8.491  -6.492 -35.297
  107   HD22  ASN  13          2HD2      ASN  13  -7.531  -7.717 -36.048
  108    H    GLY  14           H        GLY  14  -8.778  -9.153 -29.692
  109    HA2  GLY  14           2HA      GLY  14  -7.038 -10.670 -28.866
  110    HA3  GLY  14           3HA      GLY  14  -5.859  -9.464 -29.359
  111    H    ARG  15           H        ARG  15  -5.292 -10.028 -26.998
  112    HA   ARG  15           HA       ARG  15  -6.655  -8.075 -25.265
  113    HB2  ARG  15           2HB      ARG  15  -5.465 -10.718 -24.403
  114    HB3  ARG  15           3HB      ARG  15  -6.233  -9.537 -23.350
  115    HG2  ARG  15           2HG      ARG  15  -8.157 -10.577 -23.668
  116    HG3  ARG  15           3HG      ARG  15  -8.097 -10.099 -25.366
  117    HD2  ARG  15           2HD      ARG  15  -8.336 -12.422 -25.434
  118    HD3  ARG  15           3HD      ARG  15  -6.613 -12.157 -25.697
  119    HE   ARG  15           HE       ARG  15  -6.830 -12.498 -23.005
  120   HH11  ARG  15          1HH1      ARG  15  -7.793 -14.352 -25.789
  121   HH12  ARG  15          2HH1      ARG  15  -7.633 -15.881 -24.990
  122   HH21  ARG  15          1HH2      ARG  15  -6.615 -14.504 -21.941
  123   HH22  ARG  15          2HH2      ARG  15  -6.963 -15.966 -22.800
  124    H    VAL  16           H        VAL  16  -5.323  -7.092 -23.627
  125    HA   VAL  16           HA       VAL  16  -2.448  -7.145 -24.277
  126    HB   VAL  16           HB       VAL  16  -3.676  -5.052 -25.007
  127   HG11  VAL  16          1HG1      VAL  16  -3.587  -4.090 -22.205
  128   HG12  VAL  16          2HG1      VAL  16  -4.656  -3.627 -23.531
  129   HG13  VAL  16          3HG1      VAL  16  -4.930  -5.138 -22.661
  130   HG21  VAL  16          3HG2      VAL  16  -1.831  -3.716 -24.587
  131   HG22  VAL  16          1HG2      VAL  16  -1.596  -4.373 -22.967
  132   HG23  VAL  16          2HG2      VAL  16  -1.171  -5.338 -24.381
  133    H    CYS  17           H        CYS  17  -1.011  -6.558 -22.521
  134    HA   CYS  17           HA       CYS  17  -2.170  -6.888 -19.842
  135    HB2  CYS  17           2HB      CYS  17  -1.106  -9.024 -20.872
  136    HB3  CYS  17           3HB      CYS  17   0.427  -8.216 -20.562
  137    H    MET  18           H        MET  18  -1.416  -5.485 -18.379
  138    HA   MET  18           HA       MET  18   1.196  -4.245 -18.760
  139    HB2  MET  18           2HB      MET  18  -1.189  -2.496 -18.212
  140    HB3  MET  18           3HB      MET  18   0.426  -2.019 -18.720
  141    HG2  MET  18           2HG      MET  18   0.044  -2.976 -20.915
  142    HG3  MET  18           3HG      MET  18  -1.553  -3.527 -20.413
  143    HE1  MET  18           3HE      MET  18  -0.378   0.356 -22.213
  144    HE2  MET  18           1HE      MET  18   0.480   0.130 -20.689
  145    HE3  MET  18           2HE      MET  18   0.570  -1.107 -21.943
  146    H    ARG  19           H        ARG  19   2.121  -3.437 -16.866
  147    HA   ARG  19           HA       ARG  19   1.031  -4.574 -14.435
  148    HB2  ARG  19           2HB      ARG  19   3.469  -4.701 -15.068
  149    HB3  ARG  19           3HB      ARG  19   3.569  -2.972 -14.762
  150    HG2  ARG  19           2HG      ARG  19   2.546  -3.672 -12.436
  151    HG3  ARG  19           3HG      ARG  19   3.272  -5.225 -12.853
  152    HD2  ARG  19           2HD      ARG  19   5.357  -3.719 -13.416
  153    HD3  ARG  19           3HD      ARG  19   4.570  -2.601 -12.302
  154    HE   ARG  19           HE       ARG  19   4.638  -5.082 -11.058
  155   HH11  ARG  19          1HH1      ARG  19   6.896  -2.705 -12.231
  156   HH12  ARG  19          2HH1      ARG  19   8.116  -3.099 -11.066
  157   HH21  ARG  19          1HH2      ARG  19   6.237  -5.610  -9.519
  158   HH22  ARG  19          2HH2      ARG  19   7.741  -4.752  -9.524
  159    H    VAL  20           H        VAL  20  -0.774  -3.293 -14.001
  160    HA   VAL  20           HA       VAL  20  -0.517  -0.428 -13.761
  161    HB   VAL  20           HB       VAL  20  -2.626  -1.528 -14.521
  162   HG11  VAL  20          1HG1      VAL  20  -3.172  -2.181 -11.648
  163   HG12  VAL  20          2HG1      VAL  20  -4.000  -2.752 -13.098
  164   HG13  VAL  20          3HG1      VAL  20  -2.386  -3.349 -12.710
  165   HG21  VAL  20          3HG2      VAL  20  -3.788   0.261 -13.824
  166   HG22  VAL  20          1HG2      VAL  20  -3.526  -0.114 -12.120
  167   HG23  VAL  20          2HG2      VAL  20  -2.283   0.738 -13.037
  168    H    CYS  21           H        CYS  21  -0.415   0.768 -11.909
  169    HA   CYS  21           HA       CYS  21   0.201  -0.722  -9.455
  170    HB2  CYS  21           2HB      CYS  21   1.655   1.216 -10.666
  171    HB3  CYS  21           3HB      CYS  21   0.699   2.193  -9.557
  172    H    THR  22           H        THR  22  -1.069  -0.600  -7.712
  173    HA   THR  22           HA       THR  22  -2.829  -0.088  -6.362
  174    HB   THR  22           HB       THR  22  -3.275   2.649  -7.269
  175    HG1  THR  22           HG1      THR  22  -1.230   3.047  -7.681
  176   HG21  THR  22          3HG2      THR  22  -3.752   1.426  -5.008
  177   HG22  THR  22          1HG2      THR  22  -3.259   3.118  -5.004
  178   HG23  THR  22          2HG2      THR  22  -2.081   1.855  -4.645
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1  -0.669   5.457 -14.216
    2    HA   ARG   1           HA       ARG   1   0.789   3.061 -14.245
    3    HB2  ARG   1           2HB      ARG   1   1.136   3.415 -11.886
    4    HB3  ARG   1           3HB      ARG   1   1.208   4.969 -12.706
    5    HG2  ARG   1           2HG      ARG   1  -1.342   5.051 -12.062
    6    HG3  ARG   1           3HG      ARG   1  -0.825   3.910 -10.819
    7    HD2  ARG   1           2HD      ARG   1   0.970   6.183 -11.069
    8    HD3  ARG   1           3HD      ARG   1  -0.681   6.665 -10.678
    9    HE   ARG   1           HE       ARG   1   1.175   5.338  -8.959
   10   HH11  ARG   1          1HH1      ARG   1  -2.207   5.726  -9.689
   11   HH12  ARG   1          2HH1      ARG   1  -2.732   5.326  -8.087
   12   HH21  ARG   1          1HH2      ARG   1   0.496   4.811  -6.846
   13   HH22  ARG   1          2HH2      ARG   1  -1.194   4.807  -6.471
   14    H    GLY   2           H        GLY   2   0.439   1.272 -12.591
   15    HA2  GLY   2           2HA      GLY   2  -2.397   0.633 -12.204
   16    HA3  GLY   2           3HA      GLY   2  -1.414  -0.489 -13.132
   17    H    CYS   3           H        CYS   3  -2.431  -1.750 -11.184
   18    HA   CYS   3           HA       CYS   3  -0.252  -2.220  -9.348
   19    HB2  CYS   3           2HB      CYS   3  -2.465  -0.604  -8.544
   20    HB3  CYS   3           3HB      CYS   3  -2.553  -2.133  -7.676
   21    H    TYR   4           H        TYR   4  -0.441  -4.224  -8.218
   22    HA   TYR   4           HA       TYR   4  -0.975  -6.426  -8.020
   23    HB2  TYR   4           2HB      TYR   4  -3.725  -5.602  -8.969
   24    HB3  TYR   4           3HB      TYR   4  -3.310  -7.073  -8.095
   25    HD1  TYR   4           HD2      TYR   4  -1.483  -5.927  -6.026
   26    HD2  TYR   4           HD1      TYR   4  -5.227  -4.551  -7.506
   27    HE1  TYR   4           HE2      TYR   4  -1.898  -4.780  -3.891
   28    HE2  TYR   4           HE1      TYR   4  -5.652  -3.399  -5.375
   29    HH   TYR   4           HH       TYR   4  -3.278  -3.490  -2.732
   30    H    THR   5           H        THR   5  -1.401  -8.370  -9.262
   31    HA   THR   5           HA       THR   5  -0.782  -7.961 -12.083
   32    HB   THR   5           HB       THR   5  -0.758 -10.477 -10.406
   33    HG1  THR   5           HG1      THR   5   1.529 -10.223 -10.674
   34   HG21  THR   5          3HG2      THR   5   0.760 -10.783 -12.762
   35   HG22  THR   5          1HG2      THR   5  -0.806 -10.138 -13.251
   36   HG23  THR   5          2HG2      THR   5  -0.721 -11.628 -12.312
   37    H    ARG   6           H        ARG   6  -2.558  -7.637 -13.288
   38    HA   ARG   6           HA       ARG   6  -4.538  -9.764 -13.387
   39    HB2  ARG   6           2HB      ARG   6  -5.119  -6.961 -12.535
   40    HB3  ARG   6           3HB      ARG   6  -6.310  -7.807 -13.513
   41    HG2  ARG   6           2HG      ARG   6  -6.594  -9.492 -11.872
   42    HG3  ARG   6           3HG      ARG   6  -5.189  -8.932 -10.962
   43    HD2  ARG   6           2HD      ARG   6  -6.811  -7.943  -9.719
   44    HD3  ARG   6           3HD      ARG   6  -6.605  -6.680 -10.932
   45    HE   ARG   6           HE       ARG   6  -8.550  -8.497 -11.824
   46   HH11  ARG   6          1HH1      ARG   6  -8.078  -6.060  -9.383
   47   HH12  ARG   6          2HH1      ARG   6  -9.758  -5.650  -9.282
   48   HH21  ARG   6          1HH2      ARG   6 -10.765  -7.966 -11.700
   49   HH22  ARG   6          2HH2      ARG   6 -11.286  -6.735 -10.600
   50    H    CYS   7           H        CYS   7  -5.545  -9.967 -15.375
   51    HA   CYS   7           HA       CYS   7  -4.872  -8.003 -17.445
   52    HB2  CYS   7           2HB      CYS   7  -4.619 -10.962 -17.958
   53    HB3  CYS   7           3HB      CYS   7  -4.053  -9.629 -18.960
   54    H    TRP   8           H        TRP   8  -6.403  -7.738 -19.019
   55    HA   TRP   8           HA       TRP   8  -8.642  -9.587 -19.182
   56    HB2  TRP   8           2HB      TRP   8 -10.277  -7.669 -18.966
   57    HB3  TRP   8           3HB      TRP   8  -9.475  -8.148 -17.472
   58    HD1  TRP   8           HD1      TRP   8  -9.960  -5.210 -19.770
   59    HE1  TRP   8           HE1      TRP   8  -8.728  -3.160 -18.820
   60    HE3  TRP   8           HE3      TRP   8  -7.270  -7.516 -16.085
   61    HZ2  TRP   8           HZ2      TRP   8  -6.861  -2.595 -16.779
   62    HZ3  TRP   8           HZ3      TRP   8  -5.784  -6.149 -14.678
   63    HH2  TRP   8           HH2      TRP   8  -5.585  -3.740 -15.020
   64    H    LYS   9           H        LYS   9 -10.092  -9.076 -21.002
   65    HA   LYS   9           HA       LYS   9  -8.540  -8.129 -23.263
   66    HB2  LYS   9           2HB      LYS   9  -9.791 -10.217 -23.479
   67    HB3  LYS   9           3HB      LYS   9 -11.292  -9.375 -23.120
   68    HG2  LYS   9           2HG      LYS   9 -10.280  -7.957 -25.248
   69    HG3  LYS   9           3HG      LYS   9  -9.845  -9.626 -25.626
   70    HD2  LYS   9           2HD      LYS   9 -12.614  -8.979 -24.699
   71    HD3  LYS   9           3HD      LYS   9 -12.156  -8.682 -26.377
   72    HE2  LYS   9           2HE      LYS   9 -12.669 -10.819 -26.757
   73    HE3  LYS   9           3HE      LYS   9 -11.195 -11.223 -25.878
   74    HZ1  LYS   9           3HZ      LYS   9 -13.154 -10.765 -23.974
   75    HZ2  LYS   9           1HZ      LYS   9 -12.460 -12.249 -24.399
   76    HZ3  LYS   9           2HZ      LYS   9 -13.878 -11.729 -25.160
   77    H    VAL  10           H        VAL  10  -8.488  -5.885 -22.776
   78    HA   VAL  10           HA       VAL  10 -11.050  -4.467 -22.898
   79    HB   VAL  10           HB       VAL  10  -9.653  -3.756 -21.078
   80   HG11  VAL  10          1HG1      VAL  10  -7.499  -4.491 -21.872
   81   HG12  VAL  10          2HG1      VAL  10  -7.524  -3.286 -23.161
   82   HG13  VAL  10          3HG1      VAL  10  -7.417  -2.775 -21.476
   83   HG21  VAL  10          3HG2      VAL  10 -10.941  -2.037 -22.336
   84   HG22  VAL  10          1HG2      VAL  10  -9.524  -1.395 -21.505
   85   HG23  VAL  10          2HG2      VAL  10  -9.477  -1.667 -23.247
   86    H    GLY  11           H        GLY  11 -11.403  -2.761 -24.375
   87    HA2  GLY  11           2HA      GLY  11 -11.441  -1.931 -26.522
   88    HA3  GLY  11           3HA      GLY  11  -9.711  -1.740 -26.276
   89    H    ARG  12           H        ARG  12  -9.367  -2.147 -28.506
   90    HA   ARG  12           HA       ARG  12  -9.636  -4.991 -29.229
   91    HB2  ARG  12           2HB      ARG  12 -10.827  -2.873 -30.527
   92    HB3  ARG  12           3HB      ARG  12  -9.367  -3.130 -31.473
   93    HG2  ARG  12           2HG      ARG  12 -10.057  -5.142 -32.253
   94    HG3  ARG  12           3HG      ARG  12 -10.960  -5.525 -30.786
   95    HD2  ARG  12           2HD      ARG  12 -12.859  -4.670 -31.604
   96    HD3  ARG  12           3HD      ARG  12 -12.042  -3.242 -32.237
   97    HE   ARG  12           HE       ARG  12 -12.720  -5.629 -33.678
   98   HH11  ARG  12          1HH1      ARG  12 -10.559  -2.903 -33.530
   99   HH12  ARG  12          2HH1      ARG  12 -10.186  -2.941 -35.221
  100   HH21  ARG  12          1HH2      ARG  12 -12.237  -5.689 -35.906
  101   HH22  ARG  12          2HH2      ARG  12 -11.142  -4.526 -36.572
  102    H    ASN  13           H        ASN  13  -8.105  -5.099 -31.459
  103    HA   ASN  13           HA       ASN  13  -5.963  -5.338 -32.183
  104    HB2  ASN  13           2HB      ASN  13  -6.035  -2.852 -32.186
  105    HB3  ASN  13           3HB      ASN  13  -5.420  -2.858 -30.535
  106   HD21  ASN  13          1HD2      ASN  13  -3.444  -2.040 -30.714
  107   HD22  ASN  13          2HD2      ASN  13  -2.205  -2.639 -31.759
  108    H    GLY  14           H        GLY  14  -6.884  -6.473 -29.575
  109    HA2  GLY  14           2HA      GLY  14  -5.352  -8.180 -28.600
  110    HA3  GLY  14           3HA      GLY  14  -4.220  -6.859 -28.352
  111    H    ARG  15           H        ARG  15  -4.444  -7.962 -26.132
  112    HA   ARG  15           HA       ARG  15  -6.627  -6.650 -24.649
  113    HB2  ARG  15           2HB      ARG  15  -5.143  -9.151 -23.829
  114    HB3  ARG  15           3HB      ARG  15  -6.542  -8.442 -23.034
  115    HG2  ARG  15           2HG      ARG  15  -7.918  -8.939 -24.981
  116    HG3  ARG  15           3HG      ARG  15  -6.514  -9.623 -25.804
  117    HD2  ARG  15           2HD      ARG  15  -7.369 -10.660 -23.129
  118    HD3  ARG  15           3HD      ARG  15  -8.177 -11.204 -24.599
  119    HE   ARG  15           HE       ARG  15  -5.556 -11.934 -23.697
  120   HH11  ARG  15          1HH1      ARG  15  -7.594 -11.544 -26.493
  121   HH12  ARG  15          2HH1      ARG  15  -6.703 -12.671 -27.461
  122   HH21  ARG  15          1HH2      ARG  15  -4.375 -13.420 -24.962
  123   HH22  ARG  15          2HH2      ARG  15  -4.873 -13.738 -26.590
  124    H    VAL  16           H        VAL  16  -5.880  -6.658 -22.150
  125    HA   VAL  16           HA       VAL  16  -3.242  -5.340 -22.111
  126    HB   VAL  16           HB       VAL  16  -5.257  -3.855 -21.730
  127   HG11  VAL  16          1HG1      VAL  16  -6.550  -5.467 -20.393
  128   HG12  VAL  16          2HG1      VAL  16  -5.361  -5.325 -19.097
  129   HG13  VAL  16          3HG1      VAL  16  -6.335  -3.928 -19.559
  130   HG21  VAL  16          3HG2      VAL  16  -3.585  -3.797 -19.268
  131   HG22  VAL  16          1HG2      VAL  16  -2.790  -3.617 -20.832
  132   HG23  VAL  16          2HG2      VAL  16  -4.051  -2.483 -20.349
  133    H    CYS  17           H        CYS  17  -2.051  -5.467 -20.098
  134    HA   CYS  17           HA       CYS  17  -2.839  -7.533 -18.212
  135    HB2  CYS  17           2HB      CYS  17  -1.445  -8.459 -20.263
  136    HB3  CYS  17           3HB      CYS  17  -0.090  -7.804 -19.349
  137    H    MET  18           H        MET  18  -2.821  -6.116 -16.528
  138    HA   MET  18           HA       MET  18  -0.698  -4.234 -16.121
  139    HB2  MET  18           2HB      MET  18  -3.095  -5.085 -14.525
  140    HB3  MET  18           3HB      MET  18  -1.867  -4.048 -13.811
  141    HG2  MET  18           2HG      MET  18  -2.257  -2.640 -15.994
  142    HG3  MET  18           3HG      MET  18  -3.809  -3.475 -15.984
  143    HE1  MET  18           3HE      MET  18  -3.808  -0.354 -15.885
  144    HE2  MET  18           1HE      MET  18  -5.249  -1.363 -15.759
  145    HE3  MET  18           2HE      MET  18  -4.972  -0.073 -14.589
  146    H    ARG  19           H        ARG  19   0.868  -4.244 -14.481
  147    HA   ARG  19           HA       ARG  19   1.625  -6.936 -13.598
  148    HB2  ARG  19           2HB      ARG  19   3.091  -4.554 -14.442
  149    HB3  ARG  19           3HB      ARG  19   3.723  -5.255 -12.959
  150    HG2  ARG  19           2HG      ARG  19   4.121  -7.346 -14.023
  151    HG3  ARG  19           3HG      ARG  19   3.247  -6.839 -15.470
  152    HD2  ARG  19           2HD      ARG  19   5.456  -5.073 -14.700
  153    HD3  ARG  19           3HD      ARG  19   5.950  -6.706 -15.144
  154    HE   ARG  19           HE       ARG  19   4.154  -5.733 -17.071
  155   HH11  ARG  19          1HH1      ARG  19   7.399  -5.216 -15.922
  156   HH12  ARG  19          2HH1      ARG  19   7.991  -4.656 -17.451
  157   HH21  ARG  19          1HH2      ARG  19   4.921  -4.998 -19.089
  158   HH22  ARG  19          2HH2      ARG  19   6.580  -4.532 -19.252
  159    H    VAL  20           H        VAL  20   2.582  -7.161 -11.435
  160    HA   VAL  20           HA       VAL  20   0.894  -6.426  -9.397
  161    HB   VAL  20           HB       VAL  20   2.726  -8.169  -9.310
  162   HG11  VAL  20          1HG1      VAL  20   4.421  -6.183  -9.895
  163   HG12  VAL  20          2HG1      VAL  20   4.556  -6.166  -8.135
  164   HG13  VAL  20          3HG1      VAL  20   4.911  -7.642  -9.033
  165   HG21  VAL  20          3HG2      VAL  20   2.487  -8.272  -7.067
  166   HG22  VAL  20          1HG2      VAL  20   3.031  -6.611  -6.828
  167   HG23  VAL  20          2HG2      VAL  20   1.371  -6.932  -7.331
  168    H    CYS  21           H        CYS  21   1.229  -5.000  -7.550
  169    HA   CYS  21           HA       CYS  21   1.463  -2.341  -8.201
  170    HB2  CYS  21           2HB      CYS  21   1.753  -3.821  -5.607
  171    HB3  CYS  21           3HB      CYS  21   2.024  -2.082  -5.663
  172    H    THR  22           H        THR  22   3.167  -1.479  -9.213
  173    HA   THR  22           HA       THR  22   5.869  -2.288  -8.624
  174    HB   THR  22           HB       THR  22   6.378  -0.288 -10.210
  175    HG1  THR  22           HG1      THR  22   4.680   0.750 -10.906
  176   HG21  THR  22          3HG2      THR  22   5.004  -2.018 -11.981
  177   HG22  THR  22          1HG2      THR  22   5.611  -3.002 -10.650
  178   HG23  THR  22          2HG2      THR  22   6.723  -2.003 -11.587